@Preamble{"\input ijqc.sty" #
"\ifx \undefined \booktitle \def \booktitle#1{{{\em #1}}} \fi" #
"\ifx \undefined \ocirc \def \ocirc #1{{\accent'27#1}}\fi"
}
@String{ack-nhfb = "Nelson H. F. Beebe,
University of Utah,
Department of Mathematics, 110 LCB,
155 S 1400 E RM 233,
Salt Lake City, UT 84112-0090, USA,
Tel: +1 801 581 5254,
FAX: +1 801 581 4148,
e-mail: \path|beebe@math.utah.edu|,
\path|beebe@acm.org|,
\path|beebe@computer.org| (Internet),
URL: \path|https://www.math.utah.edu/~beebe/|"}
@String{j-IJQC = "International Journal of Quantum Chemistry"}
@String{pub-ACADEMIC = "Academic Press"}
@String{pub-ACADEMIC:adr = "New York, USA"}
@String{pub-AKADEMIE-VERLAG = "Akademie-Verlag"}
@String{pub-AKADEMIE-VERLAG:adr = "Berlin, Germany"}
@String{pub-BENCUM = "Benjamin\slash Cummings Pub. Co."}
@String{pub-BENCUM:adr = "Menlo Park, CA, USA"}
@String{pub-BENJAMIN = "W. A. {Benjamin, Inc.}"}
@String{pub-BENJAMIN:adr = "New York, NY, USA"}
@String{pub-BUTTERWORTHS = "Butterworths"}
@String{pub-BUTTERWORTHS:adr = "London, UK"}
@String{pub-CLARENDON = "Clarendon Press"}
@String{pub-CLARENDON:adr = "New York, NY, USA"}
@String{pub-DOVER = "Dover Publications, Inc."}
@String{pub-DOVER:adr = "New York, NY, USA"}
@String{pub-ELLIS-HORWOOD = "Ellis Horwood"}
@String{pub-ELLIS-HORWOOD:adr = "New York, NY, USA"}
@String{pub-ELSEVIER = "Elsevier"}
@String{pub-ELSEVIER:adr = "Amsterdam, The Netherlands"}
@String{pub-KLUWER = "Kluwer Academic Publishers"}
@String{pub-KLUWER:adr = "Norwell, MA, USA, and Dordrecht, The
Netherlands"}
@String{pub-MCGRAW-HILL = "Mc{\-}Graw-Hill"}
@String{pub-MCGRAW-HILL:adr = "New York, NY, USA"}
@String{pub-OXFORD = "Oxford University Press"}
@String{pub-OXFORD:adr = "Walton Street, Oxford OX2 6DP, UK"}
@String{pub-PH = "Pren{\-}tice-Hall"}
@String{pub-PH:adr = "Upper Saddle River, NJ 07458, USA"}
@String{pub-PLENUM = "Plenum Press"}
@String{pub-PLENUM:adr = "New York, NY, USA; London, UK"}
@String{pub-R-E-KRIEGER = "Robert E. Krieger Publishing Company"}
@String{pub-R-E-KRIEGER:adr = "Huntington, NY, USA"}
@String{pub-REIDEL = "D. Reidel"}
@String{pub-REIDEL:adr = "Dordrecht, Boston, Lancaster, Tokyo"}
@String{pub-SV = "Springer-Verlag"}
@String{pub-SV:adr = "Berlin, Germany~/ Heidelberg, Germany~/
London, UK~/ etc."}
@String{pub-WILEY = "John Wiley"}
@String{pub-WILEY:adr = "New York, NY, USA"}
@Article{Belinfante:1980:DMF,
author = "Frederik J. Belinfante",
title = "Density matrix formulation of quantum theory and its
physical interpretation",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "1--24",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170102",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Girardeau:1980:SQC,
author = "M. D. Girardeau",
title = "Second quantization for composite particles, reactive
collisions, and unstable particles",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "25--35",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170103",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Recami:1980:ELN,
author = "E. Recami",
title = "Explaining the ``large numbers'' via a unified
(classical) theory of strong and gravitational
interactions",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "37--40",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170104",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jackiw:1980:TDV,
author = "R. Jackiw",
title = "Time-dependent variational principle in quantum field
theory",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "41--46",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170105",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Broyles:1980:CMO,
author = "A. A. Broyles",
title = "Coordinate measurements and operators",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "47--74",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170106",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fusco-Girard:1980:QFT,
author = "M. Fusco-Girard and F. Mancini and M. Marinaro",
title = "Quantum-field theory and electrodynamics of
superconducting systems",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "75--82",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170107",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jasselette:1980:IPD,
author = "P. Jasselette",
title = "Interventions in the panel discussion on measurement
process and interpretation of quantum mechanics",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "83--84",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170108",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chow:1980:FBS,
author = "Yutze Chow",
title = "Fiber bundles, sheaf theory, and generalization of
differentiable manifolds in physics",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "85--97",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170109",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ingolfsson:1980:NAS,
author = "K. Ing{\'o}lfsson",
title = "Notes on asymptotic series by {H$^0$}-strictly
singular perturbations",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "99--106",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170110",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Emch:1980:IDA,
author = "G{\'e}rard G. Emch",
title = "Irreversibility, decay, and asymptotic dynamics",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "107--120",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170111",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Green:1980:SDM,
author = "H. S. Green",
title = "Semigroups and the density matrix formulation of
quantum mechanics",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "121--132",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170112",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hunter:1980:NWF,
author = "Geoffrey Hunter",
title = "Nodeless wave function quantum theory",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "133--137",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170113",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Halpern:1980:CLN,
author = "Francis R. Halpern",
title = "Classical limit of a nonseparable problem with
exchange: {Comparison} of classical and quantum
mechanics",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "139--143",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170114",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Claverie:1980:SRC,
author = "Pierre Claverie",
title = "Some remarks concerning the simulation of stochastic
processes on digital computers",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "145--148",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170115",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Goscinski:1980:BRB,
author = "Osvaldo Goscinski",
title = "Book Review: {{\booktitle{Excited states in quantum
chemistry}}. Edited by Cleantes Nicolaides and D. R.
Beck. D. Reidel Publishing Co., Dordrecht, 1979. 576
pp. Price: \$59.00}",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "149--149",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170116",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Nicolaides:1979:ESQ}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:AS,
author = "Anonymous",
title = "{ACS} symposium",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "151--151",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170117",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Ma,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "17",
number = "1",
pages = "fmi--fmii",
month = jan,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170101",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Duprez-Quesnoit:1980:DIMa,
author = "C. Duprez-Quesnoit and J. Tillieu",
title = "Definition of invariant molecular tensors in an origin
change. {I}. {General} formalism",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "155--167",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170202",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Duprez-Quesnoit:1980:DIMb,
author = "C. Duprez-Quesnoit",
title = "Definition of invariant molecular tensors in an origin
change. {II}. {Refraction} and {Faraday} effect",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "169--179",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170203",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Macias:1980:UMP,
author = "A. Mac{\'\i}as and A. Riera",
title = "Use of molecular properties in the one-dimensional
model of nonadiabatic transitions",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "181--194",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170204",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hubac:1980:CEP,
author = "Ivan Huba{\v{c}}",
title = "Comments on the exclusion-principle-violating diagrams
cancellation in correlations energy calculation by
many-body {Rayleigh--Schr{\"o}dinger} perturbation
theory",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "195--209",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170205",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Douady:1980:PCI,
author = "J. Douady and V. Barone and Y. Ellinger and R.
Subra",
title = "Perturbative configuration interaction using localized
orbitals in the {INDO} hypothesis. {I}. {Theory} and
applications to energetical problems",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "211--233",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170206",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fabian:1980:AIE,
author = "J. Fabian and A. Mehlhorn and F. Fratev",
title = "Approaches for interpreting $\pi$ electronic states
and $\pi$ electronic transitions",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "235--253",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170207",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gyemant:1980:REE,
author = "I. Gyemant and Zs. Varga and M. G. Benedict",
title = "Resonances in the elastic {electron-SF$_6$} molecule
scattering",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "255--263",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170208",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ananchenkov:1980:REB,
author = "V. I. Ananchenkov and V. B. Leontyev",
title = "Realization of the elementary biological function as a
localized electron subsystem interaction process",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "265--272",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170209",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kovarskii:1980:EMN,
author = "V. A. Kovarskii and I. A. Chaikovskii and E. A.
Popov",
title = "Electron mechanism of nonequilibrium molecular
vibration excitation in biological systems",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "273--283",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170210",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Basilevsky:1980:MNM,
author = "M. V. Basilevsky and A. G. Shamov",
title = "Modification of the {NDO} model in semiempirical {MO}
theory",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "285--292",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170211",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Geller:1980:EPA,
author = "M. Geller and B. Lesyng and A. Pohorille",
title = "Energy of planar autoassociation of xanthine and
spatial structure of poly(riboxanthylic acid)",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "293--298",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170212",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Vitkovskaya:1980:QCI,
author = "N. M. Vitkovskaya and V. B. Mantsivoda and T. E.
Moskovskaya and M. G. Voronkov",
title = "Quantum-chemical investigation of the silicon and
carbon coordination bond in their isostructural
compounds",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "299--305",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170213",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Danilov:1980:EAE,
author = "V. I. Danilov and V. I. Pechenaya and N. V.
Zheltovsky",
title = "Electronic absorption and emission spectra of nucleic
acids and their components: {Some} questions of theory
and experiment",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "307--320",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170214",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{IlIcheva:1980:CSD,
author = "I. A. Il'Icheva and V. G. Tumanyan and A. E. Kister
and V. G. Dashevsky",
title = "Conformational studies of double-helical
polynucleotides by the method of pair-wise potential
functions",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "321--326",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170215",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Rossikhin:1980:DPE,
author = "V. V. Rossikhin and E. O. Voronkov and Yu. A.
Kruglyak",
title = "Determination of potential-energy surface of molecules
in an applied field on the basis of virial relations",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "327--338",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170216",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sukhorukov:1980:ISO,
author = "B. I. Sukhorukov and I. Ya. Gukovsky and A. I. Petrov
and A. S. Gukovskaya and A. A. Mayevsky and
N. M. Gusenkova",
title = "Interactions and self-organization of nucleic bases,
nucleotides, and polynucleotides into ordered
structures. {Effect} of ionization and solvent salt
composition",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "339--359",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170217",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yasnikov:1980:HPP,
author = "A. A. Yasnikov and N. V. Volkova and N. P. Kanivets
and L. S. Mushketik and L. I. Vasilenok and
V. P. Kukhar' and A. F. Pavlenko",
title = "Hydrophobic ``pocket'' on photosynthesizing membrane
near photosystem {II}",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "361--366",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170218",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Minaev:1980:ISF,
author = "B. F. Minaev",
title = "Intensities of spin-forbidden transitions in molecular
oxygen and selective heavy-atom effects",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "367--374",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170219",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mb,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "17",
number = "2",
pages = "fmi--fmii",
month = feb,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170201",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Clementi:1980:NIW,
author = "E. Clementi and W. Ko{\l}os and G. C. Lie and G.
Ranghino",
title = "Nonadditivity of interaction in water trimers",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "377--398",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170302",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Basilevsky:1980:VRQ,
author = "M. V. Basilevsky and N. N. Weinberg",
title = "On the validity range of the qualitative theory of
chemical reactivity",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "399--413",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170303",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Klimko:1980:FCF,
author = "G. T. Klimko and M. M. Mestechkin and G. E. Whyman",
title = "{Fock} coordinate function method for separation of
spin variables in transition density matrices",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "415--428",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170304",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kolos:1980:IMM,
author = "W. Ko{\l}os and G. Ranghino and E. Clementi and O.
Novaro",
title = "Interaction of methane molecules",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "429--448",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170305",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dalgaard:1980:VPT,
author = "Esper Dalgaard",
title = "Variation principle for the time dependence of density
operators and its relation to linear decoupling
procedures for propagators",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "449--458",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170306",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{LiberatoDeBrito:1980:TUI,
author = "Adelsindo {Liberato De Brito} and Tomas P. Eggarter",
title = "Two useful identities involving spherical harmonics",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "459--465",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170307",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ransil:1980:HGG,
author = "Bernard J. Ransil",
title = "How good is good agreement: {Evaluating} the
reliability of quantum-mechanically calculated
observables",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "467--478",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170308",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Waltz:1980:CME,
author = "Carl E. Waltz and Hae-Won Kim and Hendrik F. Hameka",
title = "Calculation of molecular electric polarizabilities and
dipole moments. {III}. {BH} molecule",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "479--483",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170309",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Roos:1980:DCM,
author = "Bj{\"o}rn O. Roos and Per E. M. Siegbahn",
title = "A direct {CI} method with a multiconfigurational
reference state",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "485--500",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170310",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Pisani:1980:EEH,
author = "C. Pisani and R. Dovesi",
title = "Exact-exchange {Hartree--Fock} calculations for
periodic systems. {I}. {Illustration} of the method",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "501--516",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170311",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dovesi:1980:EEH,
author = "R. Dovesi and C. Pisani and C. Roetti",
title = "Exact-exchange {Hartree--Fock} calculations for
periodic systems. {II}. {Results} for graphite and
hexagonal boron nitride",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "517--529",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170312",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Smet:1980:EHF,
author = "F. Smet and J. Tillieu and Et. A. {Van Groenendael}",
title = "Equations de {Hartree--Fock} dependant du temps",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "531--547",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170313",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Randic:1980:REV,
author = "Milan Randi{\'c}",
title = "Resonance energy of very large benzenoid
hydrocarbons",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "549--586",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170314",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Rubin:1980:PEP,
author = "A. B. Rubin and A. A. Kononenko and P. S. Venediktov
and Galina P. Borisevitch and P. P. Knox and
E. P. Lukashev",
title = "Polarization effects in photosynthetic membranes",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "587--593",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170315",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Maartensson:1980:BRB,
author = "Olle M{\aa}rtensson",
title = "Book Review: {{\booktitle{Dielectric and electronic
properties of biological materials}}. R. Pethig. John
Wiley \& Sons, New York, 1979. 376 pp. Price: \$15.00
(cloth)}",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "595--595",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170316",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Pethig:1979:DEP}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:BR,
author = "Anonymous",
title = "Books {Received}",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "596--596",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170317",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mc,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "17",
number = "3",
pages = "fmi--fmii",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170301",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{George:1980:OEE,
author = "Philip George and Mendel Trachtman and Charles W.
Bock",
title = "$\pi$-Orbital electron--energy contributions to
chemical reaction heats, {I}. {Reactions} involving
only linear molecules containing up to three first--row
atoms",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "599--608",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170402",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fernandez:1980:FAI,
author = "Francisco M. Fern{\'a}ndez and Eduardo A. Castro",
title = "Further analysis of the iterative hypervirial-scaling
method",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "609--618",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170403",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ho:1980:SPC,
author = "Fat D. Ho and Frank C. Sanders",
title = "Study of pair correlation in three-electron atoms",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "619--629",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170404",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{TenHoor:1980:NHG,
author = "Marten J. {Ten Hoor}",
title = "Notes on hydrogenic {Gaussian} lobe functions",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "631--642",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170405",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yousif:1980:SOD,
author = "F. N. Yousif and G. C. Shukla",
title = "Second-order dispersion energy between interacting
hydrogen pairs by using the {Borel} integral",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "643--650",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170406",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{vanDuijnen:1980:ASH,
author = "P. Th. van Duijnen and B. Th. Thole and Ria Broer and
W. C. Nieuwpoort",
title = "Active-site $\alpha$-helix in papain and the stability
of the ion pair {RS$^-$\dottedbond{}ImH$^+$}. {Ab}
initio molecular orbital study",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "651--671",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170407",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Easa:1980:DMP,
author = "S. I. Easa and G. C. Shukla",
title = "Dynamic multipole polarizabilities of atomic systems",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "673--678",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170408",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Zaitsevskii:1980:PGO,
author = "A. V. Zaitsevskii and A. V. Nemukhin and N. F.
Stepanov",
title = "Possible generalization of the optimized diatomics-in
molecules theory: {Further} studies of the diatomic
state mixing parameter adjustment",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "679--687",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170409",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Harriman:1980:UHS,
author = "John E. Harriman",
title = "Use of the {Hiller--Sucher--Feinberg} identity for
spin-density calculations",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "689--695",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170410",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bulski:1980:DNB,
author = "T. Bulski and S. Olszewski and A. Wierzbicki",
title = "Density of non-{Bloch} electron states in perfect
cubic crystals",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "697--718",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170411",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Larsson:1980:ICE,
author = "S. Larsson and P. Corr{\^e}a de Mello and M.
Hehenberger",
title = "Ab initio calculation of {ESCA} satellite intensities
for a copper--chlorine complex",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "719--724",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170412",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Carbo:1980:STM,
author = "R. Carb{\'o} and Ll. Domingo and J. Gregori",
title = "{SCF} {Theory} of multiplet states",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "725--736",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170413",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Csavinszky:1980:VPO,
author = "P. Csavinszky and C. E. Tarr and F. Vosman",
title = "Variational principle for obtaining approximate
analytical solutions of the temperature-perturbed
{Thomas--Fermi} equation for compressed atoms",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "737--745",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170414",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Graovac:1980:SOM,
author = "Ante Graovac and Kre{\v{s}}imir Kova{\v{c}}evi{\'c}
and Zvonimir B. Maksi and Ahmet Veseli",
title = "Slater-orbital molecular integrals by numerical
{Fourier}-transform methods. {II}. {Four}-center
integrals over is orbitals",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "747--757",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170415",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Cooper:1980:ECE,
author = "Ian L. Cooper and Christopher N. M. Pounder",
title = "Electron correlation effects in {SCF} + {CI} wave
functions---{Fermi} and {Coulomb} correlation holes in
{HCN}",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "759--774",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170416",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kolos:1980:TSS,
author = "W. Ko{\l}os and G. Corongiu and E. Clementi",
title = "Theoretical study of some {van der Waals} molecules",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "775--798",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170417",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Adawi:1980:BED,
author = "I. Adawi",
title = "Behavior of the electron density near an impurity",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "799--801",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170418",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Borodavkin:1980:AUS,
author = "A. V. Borodavkin and V. O. Chekhov and Yu. S. Dolin
and Yu. V. Morozov and F. A. Savin and E. I. Budowsky
and D. Yu. Yakovlev",
title = "Absorption {UV} spectroscopy and electronic structure
of ionic and tautomeric forms of hydroxy and methoxy
derivatives of cytosine and adenine, and of some
5-substituted analogs of pyrimidines",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "803--811",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170419",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Polivtsev:1980:ITS,
author = "O. F. Polivtsev and V. D. Osika and D. Ya. Tsvankin",
title = "Investigation of tertiary structure of a series of
{DNA} compact forms by the small-angle {X}-ray
scattering method",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "813--817",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170420",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Md,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "17",
number = "4",
pages = "fmi--fmii",
month = apr,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170401",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Abdul-Ahad:1980:QSA,
author = "P. G. Abdul-Ahad and T. Blair and G. A. Webb",
title = "Quantitative structure--activity study of some
enzyme-inhibitory quinazolines",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "821--831",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170502",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yusaf:1980:AFA,
author = "M. S. Yusaf and G. P. Lawes and N. H. March",
title = "Asymptotic forms of atomic scattering factors and
momentum densities",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "833--844",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170503",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bonchev:1980:TCC,
author = "D. Bonchev and Ov. Mekenyan and N. Trinajsti{\'c}",
title = "Topological characterization of cyclic structures",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "845--893",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170504",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{McDowell:1980:IBS,
author = "Keith McDowell",
title = "Incomplete basis set problem. {IV}. {Perturbative}
corrections to pair energies",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "895--905",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170505",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bhargava:1980:FSG,
author = "Shobha Bhargava and N. K. Ray",
title = "Floating spherical {Gaussian} orbital model study of
some hydrogen-bridged systems: {LiBeH$_3$}, {LiBH$_4$},
{LiCH$_5$}, and {BeBH$_5$}",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "907--914",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170506",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Story:1980:GAC,
author = "Troy L. Story",
title = "Global analysis of composite particles",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "915--930",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170507",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Requena:1980:ELP,
author = "A. Requena and R. Pe{\~n}a and A. Serna",
title = "Energy levels for perturbed {Morse} oscillators",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "931--942",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170508",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mohammad:1980:HAWa,
author = "S. Noor Mohammad",
title = "High accuracy wave functions and eigenenergies for
vibration--rotation states of diatomic molecules",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "943--954",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170509",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Seger:1980:ATD,
author = "G. Seger and E. Kochanski",
title = "Approximate theoretical determination of molecular
static polarizabilities",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "955--968",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170510",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Trsic:1980:IHF,
author = "M. Trsic and W. G. Laidlaw",
title = "Ab initio {Hartree--Fock--Slater} calculations of
polysulfanes {H$_2$S$_n$} ($n = 1{\rm --}4$) and the
ions {HS} and {S}",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "969--974",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170511",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Nyden:1980:PCG,
author = "Marc R. Nyden and G. A. Petersson",
title = "Pairwise correlated generalized valence bond model of
electronic structure. {VII}. {The} b$^3{\Sigma}$ state
of {H$_2$}",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "975--982",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170512",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hosur:1980:TDF,
author = "Ramakrishna V. Hosur and Anjan S. Joshipura",
title = "Theoretical description of fluidity in biological
membranes: {Rotational} motion in lipid hydrocarbon
chains",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "983--993",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170513",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Suhai:1980:ESC,
author = "S{\'a}ndor Suhai and Johannes Kaspar and J{\'a}nos
Ladik",
title = "Effect of side-chain disorder on the electronic
structure of proteins",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "995--1006",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170514",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Romano:1980:MCS,
author = "Silvano Romano and Enrico Clementi",
title = "{Monte Carlo} simulation of water solvent with
biomolecules: {Serine} and the corresponding
zwitterion",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "1007--1029",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170515",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Osanai:1980:IIA,
author = "You Osanai and Hiroshi Kashiwagi",
title = "Improvement of an integral approximation scheme based
on semiorthogonalized orbitals",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "1031--1037",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170516",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Reid:1980:ZQO,
author = "Charles E. Reid",
title = "Zeroes of the quartic oscillator eigenfunctions",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "1039--1041",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170517",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:AMC,
author = "Anonymous",
title = "Atomic and molecular collision theory",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "1042--1042",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170518",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Me,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "17",
number = "5",
pages = "fmi--fmii",
month = may,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170501",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:33 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ducla-Soares:1980:BEM,
author = "Eduardo Ducla-Soares",
title = "Biological effects of magnetic fields and cooperative
phenomena",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1043--1046",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170602",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Constanciel:1980:PDA,
author = "R. Constanciel and H. Gritli",
title = "Pair density analysis of semiempirical wave functions:
{Study} of water molecule including environmental
effects",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1047--1068",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170603",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Szczesniak:1980:NSI,
author = "Ma{\l}gorzata M. Szcz{\k{e}}{\'s}niak and Henryk
Ratajczak",
title = "Nonadditivity of the {SCF} interaction energy in the
{(LiH)$_3$} complex",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1069--1074",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170604",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Spangler:1980:ICL,
author = "Dale Spangler and Ralph E. Christoffersen",
title = "Ab initio calculations on large molecules using
molecular fragments. {Generalization} of the molecular
fragment basis at the minimum basis set level",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1075--1097",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170605",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{TenHoor:1980:GEH,
author = "Marten J. {Ten Hoor}",
title = "{Gaussian} expansions of hydrogenic functions
involving few variational parameters",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1099--1109",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170606",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Noack:1980:NMAa,
author = "Wolf-Eckart Noack",
title = "New method for approximate {Hartree--Fock}
calculations using density approximations and {Coulomb}
field corrections. {I}",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1111--1123",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170607",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Noack:1980:NMAb,
author = "Wolf-Eckart Noack",
title = "New method for approximate {Hartree--Fock}
calculations using density approximations and {Coulomb}
field corrections. {II}",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1125--1141",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170608",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Morgan:1980:BMP,
author = "John D. {Morgan III} and Barry Simon",
title = "Behavior of molecular potential energy curves for
large nuclear separations",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1143--1166",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170609",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tomasek:1980:PSE,
author = "Mojm{\'\i}r Tom{\'a}{\v{s}}ek and
{\v{S}}t{\v{e}}p{\'a}n Pick",
title = "Projected surface energy bands, {Shockley} surface
states, and bonding in transition-metal monocompounds
with rock-salt structure: {Example} of {NbC}",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1167--1177",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170610",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ganas:1980:OOS,
author = "P. S. Ganas",
title = "Optical oscillator strengths for lithium",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1179--1184",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170611",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Carbo:1980:HSM,
author = "Ramon Carb{\'o} and Luis Leyda and Mariano Arnau",
title = "How similar is a molecule to another? {An} electron
density measure of similarity between two molecular
structures",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1185--1189",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170612",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ibantez-Mengual:1980:QMT,
author = "J. A. Ib{\'a}{\~n}tez-Mengual and A. F.
Tejerina-Garc{\'\i}a",
title = "Quantum model for transport through membranes",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1191--1200",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170613",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Moiseyev:1980:CAR,
author = "Nimrod Moiseyev and Frank Weinhold",
title = "Criteria of accuracy of resonance eigenvalues",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1201--1211",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170614",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bregadze:1980:NDI,
author = "V. G. Bregadze",
title = "Nature of {DNA} interactions with cations: {UV
Spectroscopic} investigations and {Marcus} theory",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1213--1219",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170615",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kuropteva:1980:EIM,
author = "Z. V. Kuropteva and M. K. Pulatova and M. A.
Smotryaeva and K. E. Kruglyakova",
title = "Electronic interactions of {N}-methyl-{N}-nitrosourea
with {DNA} and its chemical modifications",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1221--1227",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170616",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kryachko:1980:NEF,
author = "Eugene S. Kryachko and Yuri A. Kruglyak and Bryan J.
Dalton",
title = "Nonrigidity effects of fragments of membrane-active
complexons",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1229--1235",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170617",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sannigrahi:1980:SVE,
author = "A. B. Sannigrahi and B. R. De",
title = "Selected valence electron split-shell {MO}
calculations on {Cu$_2$}, {Ag$_2$}, and {Au$_2$}",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1237--1239",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170618",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sen:1980:ARI,
author = "K. D. Sen",
title = "Approximate relationship for isoelectronic changes in
atomic average electron density",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "1241--1242",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170619",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mf,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "17",
number = "6",
pages = "fmi--fmii",
month = jun,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560170601",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lowdin:1980:P,
author = "Per-Olov L{\"o}wdin",
title = "Preface",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "1--1",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180102",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kutzelnigg:1980:NDP,
author = "Werner Kutzelnigg",
title = "New derivation and a $k$-particle generalization of
{SCF}-type theories",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "3--9",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180103",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Pucci:1980:TMD,
author = "Renato Pucci and Marcello Baldo and Antonio Grassi and
Pasquale Tomasello",
title = "Toward a microscopic description of molecular
electronic systems",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "11--18",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180104",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mestechkin:1980:OSR,
author = "M. M. Mestechkin",
title = "Open-shell restricted {Hartree--Fock} density matrix
direct calculations",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "19--23",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180105",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Katsuki:1980:MPX,
author = "Shinichi Katsuki and Hiroshi Taketa",
title = "Model potential {X$\alpha$} method for the electronic
structure calculations",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "25--29",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180106",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ogawa:1980:NSC,
author = "Tohru Ogawa",
title = "New self-consistent theory of atoms: {Toward} a
unified theory of atoms and atomic aggregates",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "31--35",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180107",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hiroike:1980:MVO,
author = "Eiko Hiroike",
title = "Modified virtual orbitals of {Hartree--Fock} method in
calculation of second-order perturbation energy",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "37--42",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180108",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chang:1980:PSC,
author = "Tse-Chiang Chang",
title = "Perturbation and {SCF} calculations for excited
states",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "43--48",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180109",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chambaud:1980:PCT,
author = "G. Chambaud and B. Levy and Ph. Milli{\'e}",
title = "Perturbation calculation of transition moments in the
{ArH$^+$} system",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "49--55",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180110",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Au-Chin:1980:CID,
author = "Tang Au-Chin and Sun Chia-Chung",
title = "Conservation of intrinsic dual and single symmetries
of molecular orbitals",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "57--63",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180111",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Roszak:1980:FLM,
author = "Szczepan Roszak and Henryk Chojnacki",
title = "Formulation of the {LCAS MS SCF} method within the
{Gaussian} basis set",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "65--71",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180112",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Uehara:1980:VIP,
author = "Hiroshi Uehara and Takuma Itagaki",
title = "Vertical ionization potential in hydrogen molecule
with many-body {Green}'s function method",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "73--78",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180113",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lee:1980:CBS,
author = "Tieh-Sheng Lee and San-Yan Chu",
title = "Comparison between the symmetry-correlation
examination and the perturbation method",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "79--87",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180114",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lumbroso:1980:IMO,
author = "Henri Lumbroso and Giuseppe Concetto Pappalardo",
title = "Ab initio molecular orbital study of the
hydrogen-bonded pyrrole $\cdot$ acetonitrile complex",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "89--99",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180115",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yamaguchi:1980:IUH,
author = "Kizashi Yamaguchi",
title = "Ab initio unrestricted {Hartree--Fock} ({UHF}) and
{UHF}-natural orbital {CI} studies of ozone",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "101--106",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180116",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Rodwell:1980:ISS,
author = "William R. Rodwell and Willem J. Bouma and Leo
Radom",
title = "Ab initio studies of 1,3-sigmatropic rearrangements:
{Effect} of basis set and electron correlation",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "107--116",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180117",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gayoso:1980:RCS,
author = "J. Gayoso and B. Maouche and O. Ouamerali and A.
Baba-Ahmed",
title = "``Ring currents'' static hypersusceptibilities",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "117--124",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180118",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hartmann:1980:SOC,
author = "Hermann Hartmann and Dieter Schuch",
title = "Spin--orbit coupling for the motion of a particle in a
ring-shaped potential",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "125--141",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180119",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Nomura:1980:PES,
author = "Okio Nomura",
title = "Potential-energy surfaces of low-lying states of
{HNO}",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "143--150",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180120",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Morita:1980:ILM,
author = "Keiko Morita and Hiroshi Sato and Eiichi Ishiguro",
title = "Ab initio {LCAO MO SCF} calculation of potential
surface of the {NO$_2$} molecule",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "151--156",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180121",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tsuda:1980:PES,
author = "Minoru Tsuda and Setsuko Oikawa and Katsuhiko
Kimura",
title = "Potential-energy surfaces in the lower excited states
of benzene $\rightleftharpoons$ {Dewar}--benzene
isomerization process",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "157--164",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180122",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sokalski:1980:BSS,
author = "W. A. Sokalski and P. C. Hariharan and Joyce J.
Kaufman and Carlo Petrongolo",
title = "Basis set superposition effect on difference
electrostatic molecular potential contour maps",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "165--171",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180123",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sokalski:1980:MCN,
author = "W. A. Sokalski and P. C. Hariharan and Herbert E.
Popkie and Joyce J. Kaufman and Carlo Petrongolo",
title = "Molecular calculations with the nonempirical ab initio
{MODPOT}, {VRDDO}, and {MODPOT \slash VRDDO}
procedures. {XI}. {Theoretical} study of the
{[C$_6$H$_5$OH$\cdot$OC$_6$H$_5$]}$^-$ molecular
complex: {Ab} initio {MODPOT \slash VRDDO} calculations
and electrostatic molecular potential contour maps",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "173--184",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180124",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gondo:1980:NSA,
author = "Yasuhiko Gondo and Yoshiya Kanda",
title = "Novel sign-alternation rule for the triplet state in
aromatic systems",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "185--188",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180125",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sokalski:1980:EAS,
author = "W. A. Sokalski and P. C. Hariharan and Herbert E.
Popkie and Joyce J. Kaufman",
title = "Explanation of the artifact structure predictions
within the semiempirical {ZDO SCF} supermolecular
approach",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "189--191",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180126",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Boucekkine:1980:CCD,
author = "A. Boucekkine",
title = "{CNDO} calculation of the diamagnetic susceptibilities
of cyclic conjugated molecules",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "193--197",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180127",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chen:1980:CMC,
author = "Cheng Chen",
title = "{CNDO--MO} calculation of {N$_n$F$_m$} molecules",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "199--204",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180128",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shibuya:1980:PEM,
author = "Tai-Ichi Shibuya and Tadashi Funada",
title = "Parametrization of the equations-of-motion method for
conjugated hydrocarbons",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "205--209",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180129",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Okido:1980:TBP,
author = "Sadao Okido and Osamu Tanimoto",
title = "Theory of the {Bose} particle representation for
geminals",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "211--217",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180130",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Steinborn:1980:EMI,
author = "E. Otto Steinborn and Eckhard Filter",
title = "Evaluation of multicenter integrals over {Slater}-type
atomic orbitals by expansion in terms of complete
sets",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "219--226",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180131",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sasaki:1980:CXS,
author = "Teikichi Sasaki and Hirohiko Adachi",
title = "Calculations of {XPS} spectra for oxyanions and
related compounds by the discrete
variational-{X$\alpha$} method",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "227--235",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180132",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Palma:1980:EPI,
author = "A. Palma and E. Gonz{\'a}lez and O. Goscinski",
title = "{ESCA} peak intensities for small molecules in the
sudden approximation",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "237--241",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180133",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yamabe:1980:TSP,
author = "Shinichi Yamabe and Tsutomu Minato and Yoshihiro
Osamura",
title = "Theoretical study of photochemical reactions:
{Electron} assignment and the state correlation
diagram",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "243--250",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180134",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fujikawa:1980:PCS,
author = "Takashi Fujikawa and Haruo Kuroda",
title = "Photoionization cross section calculated by dynamical
theory",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "251--256",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180135",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hirayama:1980:TEV,
author = "Satoshi Hirayama",
title = "Temperature effect on the vapor-phase exciplexes of
cyano-substituted anthracenes",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "257--261",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180136",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Christov:1980:CTBa,
author = "S. G. Christov",
title = "Collision theory of bimolecular and unimolecular
reactions and its experimental test",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "263--273",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180137",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Suzuki:1980:BED,
author = "I. H. Suzuki and C. E. Brion and E. Weigold and G. R.
J. Williams",
title = "Binding energies at different momenta for the valence
orbitals of {HCl} by the binary (e, 2 e) method",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "275--280",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180138",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shibata:1980:EDW,
author = "S. Shibata and F. Hirota and N. Kakuta and T.
Muramatsu",
title = "Electron distribution in water by high-energy electron
scattering",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "281--285",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180139",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kato:1980:LIF,
author = "Hajime Kat{\^o}",
title = "Laser-induced fluorescence of {Cs$_2$} and role of
kinetic energy in the {Franck--Condon} principle",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "287--291",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180140",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kono:1980:FCE,
author = "H. K{\^o}no and Y. Fujimura and T. Nakajima",
title = "Field correlation effects on the resonant light
scattering",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "293--300",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180141",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Uchida:1980:EME,
author = "Kenji Uchida and Yoshihiro Takahashi",
title = "Excimer and monomer emission of pyrene crystals
associated with the phase transition",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "301--305",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180142",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chu:1980:CBI,
author = "San-Yan Chu and Shyi-Long Lee",
title = "Comparison between intervalence charge transfer and
molecular tautomerism",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "307--310",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180143",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{VanCamp:1980:VSM,
author = "P. E. {Van Camp} and V. E. {Van Doren} and J. T.
Devreese",
title = "Vibrational spectra of molecules in the
{Hartree--Fock} dielectric screening approach",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "311--315",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180144",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Devreese:1980:MEM,
author = "J. T. Devreese and P. E. {Van Camp} and V. E. {Van
Doren}",
title = "Moment expansion method to calculate vibrational
frequencies of molecules and solids",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "317--321",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180145",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shibata:1980:NMV,
author = "Masayuki Shibata and Theresa Julia Zielinski and
Robert Rein",
title = "Normal-mode vibrational frequencies and thermodynamic
properties of uracil and 4-hydroxyuracil",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "323--329",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180146",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yuan-Sun:1980:CDAa,
author = "Kiang Yuan-Sun",
title = "Calculation of the determinant of the adjacency matrix
and the stability of conjugated molecules",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "331--338",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180147",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mladenov:1980:MCC,
author = "Ivailo M. Mladenov and Marin D. Kotarov and Julia G.
Vassileva-Popova",
title = "Method for computing the characteristic polynomial",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "339--341",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180148",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mg,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "1",
pages = "fmi--fmii",
month = jul,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180101",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sabin:1980:EN,
author = "John R. Sabin",
title = "Editorial note",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "345--345",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180202",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lohr:1980:RPE,
author = "L. L. {Lohr, Jr.} and M. Hotokka and P. Pyykk{\"o}",
title = "Relativistically parametrized {extended-H{\"u}ckel}
calculations. {II}. {Orbital} energies of group-{IV}
tetrahalides and tetramethyls",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "347--355",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180203",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shinagawa:1980:ISS,
author = "Yoshiya Shinagawa and Yasuko Shinagawa and Nobuhiro
Uyesaka and Kohji Fukuda",
title = "{INDO} {Studies} on the structure of benzosemiquinone
radicals",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "357--363",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180204",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Spanget-Larsen:1980:AHC,
author = "Jens Spanget-Larsen",
title = "Assignment of the hyperfine constants of the
1,2-benzosemiquinone radical anion: {Comment} on ``
{INDO} studies on the structure of benzosemiquinone
radicals''",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "365--367",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180205",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mekenyan:1980:CGT,
author = "O. Mekenyan and D. Bonchev and N. Trinajsti{\'c}",
title = "Chemical graph theory: {Modeling} the thermodynamic
properties of molecules",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "369--380",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180206",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sinanoglu:1980:STP,
author = "Oktay Sinano{\u{g}}lu",
title = "The solvophobic theory for the prediction of molecular
conformations and biopolymer bindings in solutions with
recent direct experimental tests",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "381--392",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180207",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Osamura:1980:QQC,
author = "Y. Osamura and S. Yamabe and F. Hirota and H. Hosoya
and S. Iwata and H. Kashiwagi and K. Morokuma and
M. Togasi and S. Obara and K. Tanaka and K. Ohno",
title = "{QCLDB} {---Quantum} chemistry literature data
base---a trial",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "393--396",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180208",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Thuraisingham:1980:SMO,
author = "R. A. Thuraisingham and S. H. M. Nilar",
title = "Semiempirical molecular orbital calculations on $\pi$
electron systems",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "397--401",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180209",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kai:1980:EST,
author = "Eiko Kai and Kichisuke Nishimoto",
title = "Electronic structure of transition-metal complexes.
{I}. {Parametrization} for {CNDO/2} method",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "403--408",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180210",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fischer-Hjalmars:1980:MBE,
author = "I. Fischer-Hjalmars and A. Henriksson-Enflo",
title = "Metal bridge effect: {V}. {Quantum} chemical studies
of some metal chelates",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "409--419",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180211",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Langlet:1980:PWI,
author = "J. Langlet and C. Giessner-Prettre and B. Pullman and
P. Claverie and D. Piazzola",
title = "Purine--water interactions in base stacking",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "421--437",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180212",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gumbinger:1980:SCM,
author = "H. G. Gumbinger and P. M. Kaiser",
title = "{SCF CI MO} calculations on the base--base
interactions in dinucleoside monophosphates",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "439--448",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180213",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Teitell:1980:MSF,
author = "Murray F. Teitell and J. Lawrence Fox",
title = "{MO} {Study} of flavin--protein interactions in
flavodoxin catalysis",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "449--456",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180214",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Osamura:1980:MSP,
author = "Yoshihiro Osamura and Shinichi Yamabe and Kichisuke
Nishimoto",
title = "{MO} {Study} of the photochemical behavior of the
imine bond",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "457--462",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180215",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tanaka:1980:MSP,
author = "H. Tanaka and T. Matsushita and Y. Osamura and K.
Nishimoto",
title = "{MO} {Study} on the photochemical isomerization of
isoxazole",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "463--468",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180216",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Boudreaux:1980:QMC,
author = "E. A. Boudreaux and T. P. Carsey",
title = "Quasirelativistic {MO} calculations on platinum
complexes (anticancer drugs) and their interaction with
{DNA}",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "469--479",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180217",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Loew:1980:COS,
author = "Gilda H. Loew and Zelek S. Herman and Michael C.
Zerner",
title = "Calculated optical spectrum of model oxyheme complex",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "481--492",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180218",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Spingarn:1980:MBI,
author = "Neil E. Spingarn and Alan C. Sartorelli",
title = "Mechanism of binding of iron to potential therapeutic
chelating agents",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "493--500",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180219",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Grigoras:1980:HHE,
author = "S. Grigoras and I. Rusu and E. Pausescu and A. Medesan
and S. Moldoveanu",
title = "Hydrophile--hydrophobe equilibrium of some
prostaglandins --- {CNDO\slash SW} study",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "501--508",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180220",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Nagamura:1980:WIP,
author = "Toshihiko Nagamura and Takashi Takayanagi and Taku
Matsuo",
title = "Weak interactions at the photoexcited states of
partially oriented aromatic chromophores in man-made
bilayer membranes",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "509--513",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180221",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ikuta:1980:DEP,
author = "Shigeru Ikuta and Shuichi Hashimoto and Masashi
Imamura",
title = "$\beta^-$-{Decay} effect on the proton movement in the
pyridine--pyrrole hydrogen-bonded system",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "515--519",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180222",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shinagawa:1980:RAE,
author = "Yasuko Shinagawa and Yoshiya Shinagawa",
title = "Regression analysis of enzyme reaction.
{O}-methylation of catechol derivatives by
catechol-{O}-methyltransferase",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "521--526",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180223",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Komiyama:1980:SEC,
author = "Tomoko Komiyama and Makoto Miwa",
title = "Solvent effects on {CD} and {MCD} spectra of
phenylalanine and its related compounds",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "527--531",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180224",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hirokawa:1980:IAN,
author = "Shoji Hirokawa",
title = "Infrared absorption of nonpolar molecules in rattling
motion",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "533--537",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180225",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yoshikawa:1980:PPS,
author = "Kenichi Yoshikawa and Noriyuki Kumazawa and Hiroshi
Terada and Kazuo Akagi",
title = "Physicochemical properties of {SF} 6847, a potent
uncoupler of oxidative phosphorylation in mitochondria
in relation to its activity",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "539--544",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180226",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Au-Chin:1980:ALA,
author = "Tang Au-Chin and Sun Chia-Chung and Li Bei-Foo",
title = "Application of lie algebra to ligand-field theory",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "545--555",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180227",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Au-Chin:1980:CCO,
author = "Tang Au-Chin and Cho Ching-Yu and Sun Chia-Chung",
title = "{$V$}-coupling coefficients from {${\rm SO}(3)$} to
the octahedral group",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "557--573",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180228",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{DeHosson:1980:ESN,
author = "J. Th. M. {De Hosson}",
title = "Electronic states near dislocations in transition
metals: {An} application of quantum chemistry in
technology",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "575--582",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180229",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Petelenz:1980:BEI,
author = "Piotr Petelenz and Vedene H. {Smith, Jr.}",
title = "Binding energies of ionized donor--exciton complexes
in polar crystals",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "583--586",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180230",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Maruyama:1980:FST,
author = "Yusei Maruyama and Keiko Takamiya-Ichikawa",
title = "Fluorescence spectra and their temperature dependence
of amorphous anthracene films doped with naphthacene",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "587--593",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180231",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Garcia-Prieto:1980:NEM,
author = "J. Garc{\'\i}a-Prieto and O. Novaro",
title = "Nonadditive effects in metal clusters and
chemisorption. {Pseudopotential} study of palladium
clusters",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "595--600",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180232",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ruo-Zhuang:1980:LMT,
author = "Liu Ruo-Zhuang and Feng Wen-Lin",
title = "{LCAO--MO} treatment for deep levels produced by ion
implantation of oxygen in gallium arsenide",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "601--605",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180233",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Calais:1980:LD,
author = "Jean-Louis Calais",
title = "On the localization of defects",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "607--613",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180234",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{VanDoren:1980:MTA,
author = "V. E. {Van Doren} and P. E. {Van Camp} and J. T.
Devreese",
title = "Microscopic theory of the average band gap of
semiconductors",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "615--618",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180235",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kojima:1980:ETT,
author = "N. Kojima and T. Ban and I. Tsujikawa",
title = "Exciton transfer in the two-dimensional
antiferromagnet {(C$_2$H$_5$NH$_3$)$_2$MnCl$_4$}",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "619--623",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180236",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Morita:1980:LEL,
author = "Makoto Morita and Yoshiaki Kato",
title = "{N}$_2$ {Laser}-excited luminescence of
antiferromagnetically coupled trinuclear
{chromium(III)} complexes",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "625--631",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180237",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Satoh:1980:LRE,
author = "Mitsuo Satoh and Toshihiko Taki",
title = "Lattice relaxation and electric-field-gradient
calculations in impurity-doped single ionic crystals",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "633--640",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180238",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Nose:1980:RTM,
author = "Shuichi Nos{\'e} and Yoshiaki Ozaki and Kazuo Maki and
Yosuke Kataoka",
title = "Rotational tunneling of methane on the surface of
graphite",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "641--644",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180239",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kertesz:1980:NDE,
author = "M. Kert{\'e}sz and J. Koller and A. A{\v{z}}man",
title = "Nuclear distortion of the equidistant arrangement in
{\em trans\/}-polyacetylene, {(CH)$_x$}",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "645--650",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180240",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Brower:1980:IMO,
author = "A. L. Brower and J. R. Sabin and B. Crist and M. A.
Ratner",
title = "Ab initio molecular orbital studies of polyethylene
deformation",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "651--654",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180241",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mitani:1980:SRS,
author = "T. Mitani and S. Suga and Y. Tokura and K. Koyama and
I. Nakada and T. Koda",
title = "Synchrotron radiation spectroscopy of
quasi-one-dimensional materials",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "655--659",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180242",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mh,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "2",
pages = "fmi--fmii",
month = aug,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180201",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:34 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Pakiari:1980:SDO,
author = "A. H. Pakiari and J. W. Linnett",
title = "Single-determinantal open- and closed-shell {FSGO}
calculations for some diatomic molecules",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "661--673",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180302",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Odiot:1980:DMD,
author = "J. Bridet Et S. Odiot and S. Fliszar",
title = "Dynamique mol{\'e}culaire du cristal ammoniac.
{Calcul} ab initio {SCF} de l'{\'e}nergie electronique.
({French}) [Molecular dynamics of the ammonium crystal.
{SCF} ab initio calculation of the electronic energy]",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "675--688",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180303",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
language = "French",
onlinedate = "19 Oct 2004",
}
@Article{Jolly:1980:VFP,
author = "P. Jolly and R. P. Saxena and P. K. Srivastava and K.
V. Sane",
title = "Variational functions of the {Pad{\'e}}
type---application to the ground state of the helium
atom",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "689--694",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180304",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Niukkanen:1980:GME,
author = "A. W. Niukkanen",
title = "{Gaussian} matrix elements of the operator {X}:
{Reduction} to confluent hypergeometric functions",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "695--708",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180305",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jones:1980:CGF,
author = "Herbert W. Jones",
title = "Computer-generated formulas for overlap integrals of
{Slater}-type orbitals",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "709--713",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180306",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Poirier:1980:UQGa,
author = "R. A. Poirier and R. Daudel and P. G. Mezey and I. G.
Csizmadia",
title = "Uniform quality {Gaussian} basis sets for molecular
calculations, {I}. {C$_1$} hydrocarbons",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "715--725",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180307",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Poirier:1980:UQGb,
author = "R. A. Poirier and R. Daudel and I. G. Csizmadia",
title = "Uniform quality {Gaussian} basis sets for molecular
calculations. {II}. {C$_2$} hydrocarbons",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "727--733",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180308",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fieck:1980:OTP,
author = "Gerhard Fieck and Joachim Wirsich",
title = "One- and two-particle fractional parentage for
arbitrary point groups, configurations, and coupling
schemes",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "735--752",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180309",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fieck:1980:EIA,
author = "Gerhard Fieck and Joachim Wirsich",
title = "Electrostatic interaction for arbitrary point groups,
configurations, and coupling schemes",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "753--773",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180310",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bruggemann:1980:LBH,
author = "R. Br{\"u}ggemann and J. Voitl{\"a}nder",
title = "Local behavior of h{\"u}ckel parameters",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "775--782",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180311",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mayer:1980:EDS,
author = "I. Mayer and S. A. Angelov",
title = "{EHF} {Description} of superexchange: {Relations} to
{Anderson}'s model",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "783--796",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180312",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Defina:1980:EMS,
author = "J. A. Defina and P. R. Andrews",
title = "Evaluation of {MINDO} \slash 3 calculations in simple
amides, ureas, and heterocycles of biological
interest",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "797--810",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180313",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Schweitz:1980:HTO,
author = "Jan-{\AA}ke Schweitz",
title = "Hypevirial theorem for open dynamical assemblies in
the density matrix representation",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "811--817",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180314",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shukla:1980:MPS,
author = "G. C. Shukla and M. R. Issa and M. S. Narayan",
title = "Multipole polarizabilities and shielding factors of
the hydrogen atom from the hydrodynamic analogy to
quantum mechanics. {III}",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "819--825",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180315",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Srivastava:1980:ESN,
author = "S. K. Srivastava and P. C. Mishra",
title = "Electronic spectra of nucleic acid bases: {Variable}
electronegativity calculations and an analysis of
existing results",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "827--840",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180316",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wormer:1980:CIM,
author = "P. E. S. Wormer and J. Paldus",
title = "Configuration interaction matrix elements. {III}.
{Spin} functions relating the unitary and symmetric
group approaches",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "841--866",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180317",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Silverman:1980:VCP,
author = "Jeremiah N. Silverman",
title = "Variational constraints on perturbed eigenvalues and
their perturbation expansions. {II}. {Perturbational}
inequalities",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "867--890",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180318",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kothekar:1980:RCI,
author = "V. Kothekar and S. Dutta",
title = "Role of {CA$^{2+}$} ion in the abortifacient action of
prostaglandins. {II}. {Molecular} orbital and
conformation energy calculations of {PGA$_1$}",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "891--904",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180319",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wilson:1980:FOI,
author = "Stephen Wilson",
title = "Fourth-order invariant in {Rayleigh--Schr{\"o}dinger}
perturbation theory",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "905--906",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180320",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sen:1980:EES,
author = "K. D. Sen",
title = "Energy-eigenvalue sum relationship in molecules",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "907--909",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180321",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Aagren:1980:BRB,
author = "Hans {\AA}gren",
title = "Book Review: {{\booktitle{Atomic energy levels}}.
Serafin Fraga, K. M. S. Saxena, and Jacek Karmowski.
Elsevier Scientific Publishing Company, Amsterdam,
1979}",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "911--911",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180322",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Fraga:1979:AEL}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dunne:1980:BRB,
author = "Lawrence J. Dunne",
title = "Book Review: {{\booktitle{High pressure chemistry}}.
Edited by H. Kelm. NATO Advanced Study Institute
Series, D. Reidel Publishing Company, Dordrccht.
Holland, 1979}",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "911--911",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180323",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Kelm:1978:HPC}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mi,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "3",
pages = "fmi--fmii",
month = sep,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180301",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Blagoy:1980:ESE,
author = "Y. U. P. Blagoy and G. G. Sheina and A. V. Luzanov and
L. K. Silina and V. F. Pedash and Y. U. V. Rubin and
E. A. Leibina",
title = "Effect of substituents on electron energy
redistribution in uracil derivatives and their
ionization in polar solvents",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "913--919",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180402",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Warner:1980:ECH,
author = "J. W. Warner and L. S. Bartell and S. M. Blinder",
title = "Electron correlation and {Hund}'s rule",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "921--935",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180403",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Morton-Blake:1980:ESL,
author = "D. A. Morton-Blake",
title = "Effect of symmetry lowering on the band structure of
polyacetylene",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "937--951",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180404",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Avery:1980:TIDa,
author = "John Avery and Per-Johan {\O}rmen",
title = "Transferable integrals in a deformation density
approach to crystal orbital calculations. {IV}.
{Evaluation} of angular integrals by a vector-pairing
method",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "953--971",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180405",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Boerth:1980:HOM,
author = "Donald W. Boerth and F. A. Van-Catledge",
title = "Hydrogenic orbitals as minimum-basis functions for
{SCF} calculations",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "973--993",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180406",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Datta:1980:SCC,
author = "Dilip Kumar Datta and Sankar Sengupta",
title = "Self-consistent calculation of $1s 2s$ {$^1$S} state
wave function of helium",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "995--1003",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180407",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Randic:1980:GTA,
author = "Milan Randi{\'c} and Charles L. Wilkins",
title = "Graph-theoretical analysis of molecular properties.
{Isomeric} variations in nonanes",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1005--1027",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180408",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kryachko:1980:HKT,
author = "Eugene S. Kryachko",
title = "{Hohenberg--Kohn} theorem",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1029--1035",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180409",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Flurry:1980:PSA,
author = "R. L. {Flurry, Jr.} and T. H. {Siddall III}",
title = "Permutational--symmetry-adapted powers of
representations of the point groups deduced from the
unitary group",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1037--1044",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180410",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mukherjee:1980:SEM,
author = "Nirad Gopal Mukherjee and Pratip Ray",
title = "Simplification of an earlier {MCSCF} procedure for
{CI} expansions involving orbital excitations",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1045--1047",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180411",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Katriel:1980:SVS,
author = "J. Katriel and E. R. Davidson",
title = "Shellwise virial scaling: {Approximation} for atomic
hole states",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1049--1055",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180412",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dugay:1980:TVS,
author = "M. Dugay and J. Roustan",
title = "Toward a very simple picture of disorder effects in
one-dimensional organic conductors",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1057--1069",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180413",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chalasinaski:1980:DSA,
author = "Grezegorz Cha{\l}asi{\'n}aski and Krzysztof
Szalewicz",
title = "Degenerate symmetry-adapted perturbation theory.
{Convergence} properties of perturbation expansions for
excited states of {H$_2^+$} ion",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1071--1089",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180414",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Case:1980:SEA,
author = "David A. Case and Cary Y. Yang",
title = "Stable and efficient algorithms for {X$\alpha$}
multiple scattering calculations",
journal = j-IJQC,
volume = "18",
number = "4",
publisher = pub-REIDEL,
address = pub-REIDEL:adr,
pages = "1091--1099",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180415",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Aiken:1980:LO,
author = "John G. Aiken and John A. Erdos and Jerome A.
Goldstein",
title = "On {L{\"o}wdin} orthogonalization",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1101--1108",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180416",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Weiner:1980:SCA,
author = "Brian Weiner and Osvaldo Goscinski",
title = "Self-consistent approximation to the polarization
propagator",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "1109--1131",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180417",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mj,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "4",
pages = "fmi--fmii",
month = oct,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180401",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mohammad:1980:HAWb,
author = "S. Noor Mohammad",
title = "High accuracy wave functions and eigenenergies for the
vibration--rotation states of diatomic molecules by
factorization method",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1133--1142",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180502",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Otto:1980:CCT,
author = "P. Otto and J. Ladik",
title = "Concept of charge transfer: {Investigation} of charge
transfer in the glyoxal--formamide, water dimer, and
water--lithium cation systems",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1143--1155",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180503",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Takada:1980:ITA,
author = "Toshikazu Takada and Fukashi Sasaki",
title = "Improved transformation algorithm of two-electron
integrals from atomic orbital basis to a symmetry
orbital basis",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1157--1163",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180504",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Pavato:1980:MSM,
author = "A. C. Pav{\~a}to and M. Braga and A. Fazzio and J. R.
Leite",
title = "Multiple scattering mass operator method for molecular
orbital calculations",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1165--1173",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180505",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Facell:1980:IHO,
author = "J. C. Facell and R. H. Contreras",
title = "Inclusion of hydrogen $p$ orbitals in the
semiempirical calculation of {NMR} parameters. {I}.
{Influence} on the {FPT INDO} spin--spin coupling
constants",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1175--1185",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180506",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wolf:1980:NCD,
author = "Andreas Wolf and Hans-Herbert Schmidtke",
title = "Nonempirical calculations on diatomic transition
metals. {II}. {RHF} investigation of lowest
closed-shell states of homonuclear $3d$
transition-metal dimers",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1187--1205",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180507",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Carbo:1980:AFO,
author = "Ramon Carb{\'o} and Lloren{\c{c}}l Domingo and Josep
Gregori",
title = "Average {Fock} operators",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1207--1221",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180508",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jolly:1980:EPM,
author = "Pratibha Jolly and Kamalni Sane and K. V. Sane",
title = "Effective potential model for calculating the energy
shift in the ground state of two-electron atoms",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1223--1228",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180509",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Siegbahn:1980:DCI,
author = "Per E. M. Siegbahn",
title = "Direct configuration interaction with a reference
state composed of many reference configurations",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1229--1242",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180510",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jankowski:1980:ACP,
author = "K. Jankowski and J. Paldus",
title = "Applicability of coupled-pair theories to
quasidegenerate electronic states: a model study",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1243--1269",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180511",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Larsson:1980:IHF,
author = "Sven Larsson and Michael Hehenberger and Paulo
{Corr{\^e}a De Mello}",
title = "Ab initio {Hartree--Fock} and multiple-scattering
{X$\alpha$} calculation of the $g$ factors for
{CuF$_2$}",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1271--1278",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180512",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Coleman:1980:RHO,
author = "A. J. Coleman and I. Absar",
title = "Reduced {Hamiltonian} orbitals. {III}. {Unitarily}
invariant decomposition of {Hermitian} operators",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1279--1307",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180513",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Scharfenberg:1980:BRF,
author = "Peter Scharfenberg and J. Sauer",
title = "Biological response as a function of conformation,
chirality, and electronic characteristics: a
catecholamine study",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "1309--1337",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180514",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Mk,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "5",
pages = "fmi--fmii",
month = nov,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180501",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fanning:1980:CSI,
author = "M. O. Fanning and N. J. Fitzpatrick",
title = "{CNDO \slash INDO} formalism for $f$ block elements",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1339--1359",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180602",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Boca:1980:MPM,
author = "R. Bo{\v{c}}a and P. Pelik{\'a}n",
title = "Modified {PCILO} method. {II}. {Second}-order energy
and geometry of transition-metal halides",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1361--1370",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180603",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hopkinson:1980:TSS,
author = "A. C. Hopkinson and M. H. Lien",
title = "Theoretical study of substituent effects on the
acidity of the methyl group: {Structure} of anions
{CH$_2$X$^-$}",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1371--1391",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180604",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bendazzoli:1980:PAC,
author = "G. L. Bendazzoli and S. Evangelisti and F. Ortolani",
title = "{Pad{\'e}} algorithm for the computation of static and
dynamic second-order properties by large-scale {CI}
expansion",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1393--1404",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180605",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Morton-Blake:1980:MOT,
author = "D. A. Morton-Blake and N. R. Russell",
title = "Molecular-orbital treatment of complex cations of
magnesium and beryllium with acetonitrile",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1405--1413",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180606",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tindimubona:1980:OCE,
author = "Alex R. Tindimubona",
title = "One-center expansion method with model potentials.
{I}. {Formulation} and test calculations",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1415--1429",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180607",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kello:1980:FOD,
author = "Vladimir Kell{\"o} and Miroslav Urban",
title = "Fourth-order diagrammatic {MB--RSPT} calculations of
the correlation energy: {N$_2$}, {CO}, {F$_2$} and the
reaction energy of the process {$\frac{1}{2}$F$_2$ $+$
$\frac{1}{2}$H$_2$ $=$ HF}",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1431--1448",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180608",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Verwoerd:1980:VCS,
author = "W. S. Verwoerd",
title = "Variation of calculated single bond lengths in
saturated hydrocarbon and silicon hydride molecules",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1449--1463",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180609",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Largo-Cabrerizo:1980:OCS,
author = "J. Largo-Cabrerizo and F. M. Duque Calvo",
title = "Orbital contributions to some two-electron
properties",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1465--1472",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180610",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hehenberger:1980:ASM,
author = "Michael Hehenberger and Ulf H{\aa}lenius and Sven
Larsson",
title = "Absorption spectrum of manganian andalusite: {Cluster}
calculation by an ab initio method",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1473--1477",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180611",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Murthy:1980:SMO,
author = "A. S. N. Murthy and Shoba Ranganathan",
title = "Semiempirical molecular-orbital studies on the problem
of nonclassical resonance in the homoallylic cation",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1479--1482",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180612",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Maksic:1980:CQM,
author = "Z. B. Maksi{\'c}",
title = "Comment on quadrupole moments, dipole quadrupole {A}
and quadrupole {C} polarizabilities by means of
perturbation theory",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1483--1484",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180613",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bhattacharjee:1980:VFP,
author = "Ravi Shankar Bhattacharjee",
title = "Variational function of the {Pad{\'e}} type for the
ground state of the x$^4$ anharmonic oscillator",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1485--1487",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180614",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sabin:1980:AE,
author = "John R. Sabin",
title = "Addenda and errata",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1489--1489",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180615",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hartmann:1980:CNF,
author = "Hermann Hartmann and Kyu-Myung Chung",
title = "Classical nonlinear field theory of chemical bonding",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1491--1503",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180616",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Itagaki:1980:MBC,
author = "T. Itagaki and A. Saika",
title = "Many-body calculation of the electric field gradient
in the hydrogen molecule",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1505--1510",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180617",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Maekawa:1980:MLM,
author = "Hiroyuki Maekawa and Masahiko Hosokawa",
title = "Model for the lipid monolayer-phase transitions",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1511--1516",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180618",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hosokawa:1980:TMP,
author = "Masahiko Hosokawa",
title = "Theoretical model for the phase transition of a
membrane as a multicomponent system",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1517--1522",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180619",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Toyoda:1980:AEC,
author = "Kaoru Toyoda",
title = "Analyses of the electronic collective motions by means
of a nonlinear dynamical equation",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1523--1531",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180620",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kubota:1980:ETP,
author = "R. Kubota and H. Kobayashi and I. Tsujikawa and T.
Enoki",
title = "Electrical and thermal properties of the partially
oxidized salt of the {Magnus} green salt with the
formula {Pt$_6$(NH$_3$)$_{10}$Cl$_{10}$(HSO$_4$)$_4$}",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1533--1538",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180621",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yuan-Sun:1980:CDAb,
author = "Kiang Yuan-Sun",
title = "Calculation of the determinant of the adjacency matrix
and the stability of conjugated molecules",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1539--1539",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180622",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Christov:1980:CTBb,
author = "S. G. Christov",
title = "Collision theory of bimolecular and unimolecular
reactions and its experimental test",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "1541--1542",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180623",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1980:Ml,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "6",
pages = "fmi--fmii",
month = dec,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180601",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:35 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sarma:1980:SDL,
author = "M. H. Sarma and C. K. Mitra and Ramaswamy H. Sarma and
Sydney Archer",
title = "Structure of {DNA}-lucanthone intercalated complex",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "1--10",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180702",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Miller:1980:IMN,
author = "Kenneth J. Miller and Michael Lauer and Sydney
Archer",
title = "Interactions of molecules with nucleic acids. {V}.
{Intercalation} of thioxanthenones into {DNA}",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "11--34",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180703",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{VanZandt:1980:MAD,
author = "L. L. {Van Zandt} and E. W. Prohofsky and M. Kohli",
title = "Microwave absorption by double-helical {DNA}",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "35--38",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180704",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mitra:1980:SSD,
author = "C. K. Mitra and Ramaswamy H. Sarma and C.
Giessner-Prettre and Bernard Pullman",
title = "Solution structure of {DNA}: {The} method of nuclear
magnetic resonance spectroscopy",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "39--66",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180705",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Gupta:1980:SMI,
author = "Raj K. Gupta",
title = "On the state of the magnesium ion in intact cells as
observed by noninvasive {$^{31}$P} {NMR} spectroscopy",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "67--73",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180706",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kertesz:1980:ENS,
author = "Judith C. Kertesz and Koloman Laki",
title = "Effect of neutral salts and methylglyoxal on the {\em
cis-trans\/} equilibrium of n-methylacetamide. {A}
13-carbon nuclear magnetic resonance study",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "75--81",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180707",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Moore:1980:EII,
author = "Richard D. Moore and Raj K. Gupta",
title = "Effect of insulin on intracellular {pH} as observed by
{$^{31}$P} {NMR} spectroscopy",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "83--92",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180708",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Gascoyne:1980:ESR,
author = "Peter R. C. Gascoyne",
title = "Electron spin resonance and spectral studies of bovine
serum albumin-methylglyoxal complexes",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "93--100",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180709",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kumar:1980:CFE,
author = "N. Vasanth Kumar and Girjesh Govil",
title = "Conformation and flexibility of the $3^\prime$-end of
{tRNA}",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "101--113",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180710",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Weintraub:1980:CAA,
author = "H. J. R. Weintraub and Paul G. Seybold",
title = "Conformational analysis of anilinonaphthalenesulfonate
derivatives. {I}. 2-anilino-6-naphthalenesulfonate",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "115--122",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180711",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Saran:1980:MOS,
author = "Anil Saran and C. L. Chatterjee",
title = "Molecular orbital studies on nucleoside antibiotics
{III}. {Conformation} of toyocamycin and sangivamycin",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "123--136",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180712",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Herman:1980:CGS,
author = "Zelek S. Herman and Gilda H. Loew and Marie-Madeleine
Rohmer",
title = "Calculated ground-state properties and optical
spectrum of model carbonylheme complexes",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "137--153",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180713",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sapse:1980:ESP,
author = "Anne-Marie Sapse",
title = "Electronic studies of the pyrrolidine molecule with
aziridine ring",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "155--162",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180714",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Thomson:1980:ICE,
author = "Colin Thomson",
title = "Ab-initio calculations of the equilibrium geometry of
$\beta$-propiolactone (2-oxetanone) by the force
method",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "163--169",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180715",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Abdulnur:1980:ISM,
author = "S. F. Abdulnur",
title = "Ab-initio study of the mechanism for the reaction of a
primary amine with an aldehyde group",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "171--176",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180716",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kerteasz:1980:ESP,
author = "Mikl{\'o}as Kert{\'e}asz and Jo{\v{z}}ke Koller and
Andrej A{\v{z}}kman",
title = "On the electronic structure of periodic polyglycine",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "177--179",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180717",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Ladik:1980:IBS,
author = "J{\'a}anos Ladik and S{\'a}andor Suhai",
title = "Ab-initio band structure of polycytidine; internal
charge transfer in {DNA}",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "181--186",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180718",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Randica:1980:GEC,
author = "Milan Randi{\'c}a",
title = "Graphical enumeration of conformations of chains",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "187--197",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180719",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Scheiner:1980:PTP,
author = "Steve Scheiner",
title = "Proton transfer potentials in hydrogen-bonded systems:
{(H$_5$O$_2$)}$^+$",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "199--206",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180720",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pack:1980:MGO,
author = "George R. Pack and Dudley V. Goetschel",
title = "Molecular geometry optimization by semiempirical
methods using an optimized minimization of electronic
and nuclear energies",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "207--216",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180721",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Szent-Gyorgyi:1980:LSC,
author = "A. Szent-Gy{\"o}rgyi",
title = "The living state and cancer",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "217--222",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180722",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Loew:1980:MSA,
author = "Gilda H. Loew and Andrew T. Pudzianowski and Alfredo
Czerwinski and James E. {Ferrell, Jr.}",
title = "Mechanistic studies of addition of nucleophiles to
arene oxides and diol epoxides: {Candidate} ultimate
carcinogens",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "223--244",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180723",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pullman:1980:EEM,
author = "Alberte Pullman and Bernard Pullman",
title = "Electrostatic effect of the macromolecular structure
on the biochemical reactivity of the nucleic acids.
{Significance} for chemical carcinogenesis",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "245--259",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180724",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Seybold:1980:MOS,
author = "Paul G. Seybold and Astrid Gr{\"a}uslund",
title = "A molecular orbital study of the metabolism and
carcinogenicity of the phenols of benzo(a)pyrene",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "261--270",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180725",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Seybold:1980:ARF,
author = "Paul G. Seybold",
title = "Aryloxy radical formation as a deactivating process in
chemical carcinogenesis: {Phenolic} derivatives of
7,12-dimethylbenz[a]anthracene and 5-methylchrysene",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "271--276",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180726",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Findley:1980:GGC,
author = "G. L. Findley and S. P. Mcglynn",
title = "The Generalized Genetic Code. {A} Modification of Code
Universality",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "277--281",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180727",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Broch:1980:QMS,
author = "H. Broch and D. Cabrol and D. Vasilescu",
title = "Quantum Mechanical Simulation of the Interaction
Between the Radioprotector cysteamine and {DNA}",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "283--295",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180728",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Andrews:1980:SES,
author = "P. R. Andrews and J. A. Defina",
title = "Stereochemistry and electronic structure of
anticonvulsant drugs",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "297--313",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180729",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Radhakrishnan:1980:NIM,
author = "R. Radhakrishnan and Subhashini Srinivasan and C. V.
Prasad and S. R. Brinda and R. D. MacElroy and
K. Sundaram",
title = "Nonbonded interactions in membrane active cyclic
biopolymers. {IV}. Cation dependence",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "315--322",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180730",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Lavery:1980:MEP,
author = "Richard Lavery and Didier Cauchy and Olivia {De La Luz
Rojas} and Alberte Pullman",
title = "Molecular electrostatic potential of the {B-DNA}
helix. {VII}. Effect of screening by monovalent
cations",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "323--330",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180731",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Davies:1980:PAC,
author = "R. H. Davies and L. H. Smith",
title = "Partial agonism of cardiac $\beta$-adrenoceptor
blocking agents and competitive conformer-receptor
occupancy",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "331--345",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180732",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Slater:1980:ETR,
author = "Trevor F. Slater and Mustaq Ahmed and Chiara Benedetto
and Kevin Cheeseman and John E. Packer and Robin
L. Willson and Mario U. Dianzani",
title = "Electron transfer reactions in endoplasmic reticulum:
{Free} radical production, lipid peroxidation, covalent
binding and cell division",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "347--356",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180733",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Karle:1980:SDA,
author = "Jerome Karle",
title = "Some developments in anomalous dispersion for the
structural investigation of macromolecular systems in
biology",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "357--367",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180734",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Gupta:1980:MAL,
author = "Raj K. Gupta and John M. Pesando",
title = "Mechanism of activity-linked ionization in carbonic
anhydrase",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "369--373",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180735",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Ducla-Soares:1980:AMC,
author = "Eduardo Ducla-Soares and Maria Margarida Godinho",
title = "An application of microphysical concepts to the
sensory response: {Cooperative} effects",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "375--383",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180736",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Cross:1980:MHE,
author = "Thomas E. Cross and Ronald Pethig",
title = "Microwave {Hall} effect measurements on biopolymers",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "385--395",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180737",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Naaray-Szaboa:1980:EEE,
author = "G. N{\'a}aray-Szab{\'o}a and L. Polg{\'a}r",
title = "Effect of environment on enzymatic action:
{His-64\dottedbond{}asp-32} proton transfer in
subtilisin",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "397--402",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180738",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Klasinc:1980:APS,
author = "L. Klasinc and N. Trinajsti{\'c}a and J. V. Knop",
title = "Application of photoelectron spectroscopy to
biologically active molecules and their constituent
parts. {VIII}. {Thalidomide}",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "403--409",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180739",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pohl:1980:OFA,
author = "Herbert A. Pohl",
title = "Oscillating fields about growing cells",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "411--431",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180740",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1980:A,
author = "Anonymous",
title = "Abstracts",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "433--434",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180741",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1980:Mm,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "fmi--fmi",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180701",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1980:Mo,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "S7",
pages = "fmi--fmi",
day = "5--8",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180701",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:46 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Freidman:1980:I,
author = "Ambassador Bengt Freidman",
title = "Introduction",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "1--4",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180802",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Bryan:1980:NAH,
author = "Robert A. Bryan",
title = "On the nature of {American Higher Education}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "5--7",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180803",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1980:BW,
author = "Anonymous",
title = "{E. Bright Wilson}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "9--16",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180804",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Wilson:1980:SPS,
author = "E. Bright Wilson",
title = "Some personal scientific reminiscences",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "17--29",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180805",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mollmann:1980:THG,
author = "James C. Mollmann and Libero J. Bartolotti",
title = "Third-harmonic generation and intensity-dependent
refractive index of atomic hydrogen",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "31--41",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180806",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Blinder:1980:AFN,
author = "S. M. Blinder",
title = "Asymptotic forms for the nonrelativistic {Coulomb}
propagator",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "43--51",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180807",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Junker:1980:CSM,
author = "B. R. Junker",
title = "The complex stabilization method: {Application} to
atomic resonances",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "53--66",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180808",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Das:1980:REE,
author = "M. P. Das",
title = "Relativistic exchange energies for heavy atoms",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "67--70",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180809",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Green:1980:AME,
author = "A. E. S. Green and P. F. Schippnick and D. E. Rio and
P. S. Ganas",
title = "An analytic model of electron-oxygen elastic
scattering in the {1--500-eV} range",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "71--82",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180810",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Petelenz:1980:ITM,
author = "Piotr Petelenz and Vedene H. {Smith, Jr.}",
title = "An integral transform method for solving a quantum
mechanical three-body problem with exponential-type
potentials",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "83--92",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180811",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Tatewaki:1980:CCG,
author = "Hiroshi Tatewaki and Sigeru Huzinaga",
title = "Compact contracted {Gaussian}-type basis sets from
{Li} to {Ne}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "93--106",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180812",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sakai:1980:CCG,
author = "Yoshiko Sakai and Hiroshi Tatewaki and Sigeru
Huzinaga",
title = "Compact contracted {Gaussian}-type basis sets from
{Na} to {Ar}: {Application} to molecular calculations",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "107--112",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180813",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Simons:1980:CCR,
author = "Jack Simons",
title = "The complex coordinate rotation method and exterior
scaling: {A} simple example",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "113--121",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180814",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Keller:1980:AKS,
author = "Jaime Keller and Walter Baltensperger",
title = "The analysis of the {Knight} shift in the $\mu^+$ {SR}
technique",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "123--129",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180815",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Csavinszky:1980:VST,
author = "P. Csavinszky",
title = "Variational solution of the {Thomas--Fermi} equation
for compressed atoms at high temperatures",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "131--134",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180816",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Golden:1980:GHS,
author = "Sidney Golden",
title = "Generalized {Hartree-Slater} theory: {Lower} bounds to
{Hartree--Fock} energies",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "135--142",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180817",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Cohen:1980:RDM,
author = "L. Cohen and P. Santhanam and C. Frishberg",
title = "Reduced density matrix equations and functionals for
correlation energy",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "143--154",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180818",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Bell:1980:BBD,
author = "J. S. Bell",
title = "{De Broglie--Bohm}, delayed-choice, double-slit
experiment, and density matrix",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "155--159",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180819",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Frishberg:1980:HFD,
author = "C. Frishberg and L. Cohen and P. Blumenau",
title = "{Hartree--Fock} density matrix equation: {Open}-shell
systems",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "161--165",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180820",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Massa:1980:LEM,
author = "L. J. Massa and L. Cohen",
title = "A local energy method based on the reduced density
matrix equations",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "167--173",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180821",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Roos:1980:CAS,
author = "Bj{\"o}rn O. Roos",
title = "The complete active space {SCF} method in a
{Fock}-matrix-based super-{CI} formulation",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "175--189",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180822",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Vela:1980:ESD,
author = "Alberto Vela and Andoni Garritz",
title = "Electronic structure of dichloro-bridged
{ruthenium(II)} dimers",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "191--200",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180823",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Rives:1980:NHO,
author = "A. B. Rives and F. Weinhold",
title = "Natural hybrid orbitals: {Ab} initio {SCF} and {CI}
results for {CO} and {NiCO}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "201--209",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180824",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Shepard:1980:MWO,
author = "Ron Shepard and Jack Simons",
title = "Multiconfigurational wavefunction optimization using
the unitary group method",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "211--228",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180825",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Blomberg:1980:GSP,
author = "Margareta R. A. Blomberg and Per E. M. Siegbahn and
Bj{\"o}rn O. Roos",
title = "The ground-state potential curve of the beryllium
dimer",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "229--247",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180826",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Albertsen:1980:MTD,
author = "Preben Albertsen and Poul J{\o}rgensen and Danny L.
Yeager",
title = "Multiconfigurational time-dependent {Hartree--Fock}
calculation of vertical excitation energies and
transition moments of {O$_2$}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "249--260",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180827",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Wahl:1980:DCE,
author = "Arnold C. Wahl and Edward S. Sachs and John H.
Detrich",
title = "The differential correlation energy method for the
calculation of electron affinities, ionization
potentials, and vertical spectra",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "261--261",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180828",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Detrich:1980:TSA,
author = "John Detrich and Edward S. Sachs and Arnold C. Wahl",
title = "Theoretical studies of atmospheric triatomic
molecules",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "262--262",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180829",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Lim:1980:SSE,
author = "T. K. Lim",
title = "Solving the {Schr{\"o}dinger} equation without
integration",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "263--268",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180830",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Yamaguchi:1980:MMC,
author = "Kizashi Yamaguchi",
title = "Multireference {(MR)} configuration interaction {(CI)}
approach for quasidegenerate systems",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "269--284",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180831",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Langhoff:1980:TSP,
author = "P. W. Langhoff and N. Padial and G. Csanak and T. N.
Rescigno and B. V. Mckoy",
title = "Theoretical studies of photoionization in diatomic and
polyatomic molecules",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "285--304",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180832",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Cvitas:1980:PSS,
author = "T. Cvita{\v{s}} and L. Klasinc and I. Novak and H.
G{\"u}sten",
title = "Photoelectron spectra of some perhalogenated
methanes",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "305--313",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180833",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Nicolaides:1980:FAM,
author = "C. A. Nicolaides and G. Theodorakopoulos",
title = "{FOTOS} applied to molecules: {Oscillator} strengths
in {H$_2$O}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "315--322",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180834",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Beck:1980:TIC,
author = "D. R. Beck and C. A. Nicolaides",
title = "On the theoretical interpretation and calculation of
inner-electron photoemission spectra in atoms and
solids",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "323--333",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180835",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mishra:1980:CTP,
author = "Manoj Mishra and Yngve {\"O}hrn",
title = "Correlated treatment of photoionization cross sections
in the orthogonalized plane wave approximation for the
ejected electron",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "335--348",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180836",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Shepard:1980:ESS,
author = "Ron Shepard and Jack Simons",
title = "The electronic structure of singlet
cyclopentadienylidene",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "349--353",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180837",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Harris:1980:FMM,
author = "Frank E. Harris and A. Trautwein and J. Delhalle",
title = "The {FAKE} method of molecular orbital calculation",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "355--361",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180838",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Newton:1980:FEE,
author = "Marshall D. Newton",
title = "Formalisms for electron-exchange kinetics in aqueous
solution and the role of ab initio techniques in their
implementation",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "363--391",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180839",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Ziegler:1980:REB,
author = "T. Ziegler and J. G. Snijders and E. J. Baerends",
title = "Relativistic effects on bonding",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "393--394",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180840",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Broclawik:1980:ESS,
author = "Ewa Broclawik and Vedene H. {Smith, Jr.}",
title = "Electronic structure of selenium chains by the
{SCF--SW--X$\alpha$} method",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "395--403",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180841",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Piela:1980:LRI,
author = "Lucjan Piela and Jean-Marie Andr{\'e} and Jean-Luc
Br{\'e}das and Joseph Delhalle",
title = "Long-range interactions in periodic helices. {A}
method for accurate calculation at the {Hartree--Fock}
level",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "405--418",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180842",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Andre:1980:ALC,
author = "J.-M. Andr{\'e} and J.-L. Br{\'e}das and J. Delhalle
and Y. Kalenov and L. Piela and J. L. Calais",
title = "{AMO} in linear chains of hydrogen atoms revisited",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "419--429",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180843",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Delhalle:1980:ULT,
author = "Joseph Delhalle and Joseph G. Fripiat and Lucjan
Piela",
title = "On the use of {Laplace} transform to evaluate
one-dimensional lattice summations in quantum
calculations of model polymers",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "431--442",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180844",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kattija-Ari:1980:MSC,
author = "Mano Kattija-Ari and Marlin D. Harmony",
title = "The microwave spectrum and conformation of
hydroxyacetone: {The} influence of hydrogen bonding on
the barrier to internal rotation of the methyl group",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "443--453",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180845",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Brener:1980:EPS,
author = "N. E. Brener and J. L. Fry and T. C. Collins",
title = "Excitations of the {$N$}-particle system in the
generalized random phase approximation",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "455--460",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180846",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Murgich:1980:CBC,
author = "J. Murgich and Y. Aray",
title = "Correlation between the {CN} stretching force constant
and the electric field gradient at the {N} nucleus in
some nitriles",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "461--461",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180847",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kertesz:1980:NEC,
author = "Miklos Kertesz and Joze Koller and Andrej Azman",
title = "Need for electronic correlation calculations in
polymers",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "463--466",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180848",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Bacic:1980:ACR,
author = "Zlatko Ba{\v{c}}i{\'c} and Jack Simons",
title = "Application of the coordinate rotation method to
metastable atom-diatom scattering resonances",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "467--475",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180849",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Flannery:1980:CTT,
author = "M. R. Flannery",
title = "Charge transfer in three-body ion-ion recombination at
low gas densities",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "477--482",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180850",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Nalewajski:1980:UVT,
author = "Roman F. Nalewajski",
title = "Use of the virial theorem in modeling the potential
energy surfaces for triatomic collinear reactions",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "483--492",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180851",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Weatherford:1980:AAE,
author = "C. A. Weatherford and B. L. Jain",
title = "An analytic approach to electron-molecule potentials
using {STOs}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "493--502",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180852",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Knop:1980:CGT,
author = "J. V. Knop and N. Trinajsti{\'c}",
title = "Chemical graph theory. {II}. {On} the graph
theoretical polynomials of conjugated structures",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "503--520",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180853",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Tang:1980:LAM,
author = "Au-Chin Tang and Chia-Chung Sun and Bei-Foo Li",
title = "{Lie} algebra and molecular shell model. {I}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "521--540",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180854",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kiang:1980:DAM,
author = "Yuan-Sun Kiang",
title = "Determinant of adjacency matrix and {Kekul{\'e}}
structures",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "541--547",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180855",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Guo-Sen:1980:GTF,
author = "Yan Guo-Sen",
title = "The graph theoretical formulas for determinant
expansions",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "549--555",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180856",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Randic:1980:SPG,
author = "Milan Randi{\'c}",
title = "Symmetry properties of graphs of interest in
chemistry. {III}. {Homotetrahedryl} rearrangement",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "557--577",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180857",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Satoh:1980:ECG,
author = "Mitsuo Satoh and Toshihiko Taki",
title = "Electric center of gravity of overlap charge
distribution in impurity-doped ionic crystals",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "579--583",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180858",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kunz:1980:TES,
author = "A. Barry Kunz and R. S. Weidman and J. Boettger and G.
Cochran",
title = "Theory of electronic states in narrow-band materials:
{Applications} to solids, argon, {CuCl}, and {CdS}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "585--596",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180859",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Oriade:1980:BQM,
author = "Joseph Oriade",
title = "Biquadratic quasianalytic methods for {Brillouin} zone
integration",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "597--605",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180860",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Allen:1980:TCE,
author = "Roland E. Allen and Harold P. Hjalmarson and Helmut
B{\"u}ttner and Peter Vogl and Donald J. Wolford and
Otto F. Sankey and John D. Dow",
title = "Theory of core exciton binding energies for excitons
near interfaces",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "607--615",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180861",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Gortel:1980:QST,
author = "Z. W. Gortel and H. J. Kreuzer",
title = "Quantum statistical theory of localized
physisorption",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "617--628",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180862",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Avery:1980:TIDb,
author = "John Avery and Per-Johan {\O}rmen",
title = "Transferable integrals in a deformation density
approach to crystal orbital calculations. {V}.
{Coupling} coefficients for crystal symmetry
functions",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "629--636",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180863",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kitagawa:1980:PST,
author = "M. Kitagawa and Y. H. Ohtsuki",
title = "Plasma solitons trailing moving ions",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "637--644",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180864",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Fry:1980:EPS,
author = "J. L. Fry and N. E. Brener and J. D. Mcnutt",
title = "Electron and positron states on the (001) surface of
paramagnetic chromium",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "645--649",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180865",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Callaway:1980:STD,
author = "Joseph Callaway and S. P. Singhal",
title = "Scattering theory of defects in solids: {Theory} and
application to the atomic vacancy",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "651--663",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180866",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Gabbay:1980:MSI,
author = "I. Gabbay and N. H. March",
title = "Metal surfaces in interaction with molecular
adsorbates",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "665--679",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180867",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mccaskill:1980:DAI,
author = "J. S. Mccaskill and N. H. March",
title = "Dynamics of adatoms interacting with metals and metal
surfaces: {The} validity of the description given by
{Kramers}' equation",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "681--693",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180868",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Karo:1980:SRD,
author = "Arnold M. Karo and John R. Hardy",
title = "Shock and reaction dynamics in condensed materials",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "695--695",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180869",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Koutecky:1980:SPS,
author = "J. Kouteck{\'y}",
title = "Some problems of surface quantum chemistry",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "696--696",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180870",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pettitt:1980:TCP,
author = "B. Montgomery Pettitt and Shridhar R. Gadre and Robert
L. Matcha",
title = "Theoretical {Compton} profile anisotropics in
molecules and solids. {VIII}. {Vibrational},
rotational, and temperature-dependent diatomic alkali
halide anisotropics",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "697--706",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180871",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mintmire:1980:LDF,
author = "J. W. Mintmire and J. R. Sabin",
title = "Local density functional methods in two-dimensionally
periodic systems. {I}. {The} atomic hydrogen
monolayer",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "707--713",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180872",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sears:1980:PCC,
author = "V. F. Sears and E. C. Svensson",
title = "Pair correlations and the condensate fraction in
superfluid {$^4$He}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "715--721",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180873",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Enz:1980:WIM,
author = "Charles P. Enz",
title = "Weak itinerant magnetism, new developments:
{TiBe$_2$}",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "723--727",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180874",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Matthias:1980:SE,
author = "Bernd T. Matthias",
title = "Superconductivity and eutectics",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "729--730",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180875",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1980:Mn,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "18",
number = "S14",
pages = "fmi--fmi",
day = "10--20",
month = mar,
year = "1980",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560180801",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 12:51:49 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, Quantum Statistics, and Computational
Methods.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Duprez-Quesnoit:1981:DIM,
author = "C. Duprez-Quesnoit",
title = "Definition of invariant molecular tensors in an origin
change. {III}. {Comparison} of the methods suitable for
the obtainment of invariant tensors for refraction and
the {Faraday} effect",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "191--205",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190202",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Banerjee:1981:CCM,
author = "Ajit Banerjee and Jack Simons",
title = "The coupled-cluster method with a multiconfiguration
reference state",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "207--216",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190203",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gianturco:1981:VIS,
author = "F. A. Gianturco and U. T. Lamanna and F. Battaglia",
title = "Vibrationally inelastic scattering and relaxation
times in gaseous {HF}",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "217--236",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190204",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Linderberg:1981:ARR,
author = "Jan Linderberg",
title = "Algebraic Reductions of the Real Symmetric $4 \times
4$ Secular Problem",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "237--249",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190205",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dyadyusha:1981:ASFa,
author = "G. G. Dyadyusha and E. S. Kryachko",
title = "Algebraic structure of fermion density matrices. {I}",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "251--257",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190206",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hiberty:1981:AMO,
author = "P. C. Hiberty",
title = "Analysis of molecular orbital wave functions in terms
of valence bond functions for molecular fragments. {I}.
{Theory}",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "259--269",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190207",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{McDowell:1981:UNO,
author = "Keith McDowell",
title = "Use of noncanonical orbitals in many-body perturbation
theory",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "271--282",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190208",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dutta:1981:SCC,
author = "Dilip K. Dutta and Sankar Sengupta",
title = "Self-consistent calculation of $1s 2s^3$ {S} state of
helium and heliumlike ions",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "283--291",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190209",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Katriel:1981:MBL,
author = "J. Katriel and C. J. Appellof and E. R. Davidson",
title = "Mapping between local potentials and ground state
densities",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "293--300",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190210",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Cimiraglia:1981:SCH,
author = "Renzo Cimiraglia and Raffaele Resta",
title = "Study of correlation holes. {II}. {CI} calculations on
model polyatomic systems",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "301--318",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190211",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Roeggen:1981:APG,
author = "I. R{\o}eggen",
title = "Antisymmetric product of geminals in the context of
the method of moments",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "319--335",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190212",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ulmer:1981:ESM,
author = "W. Ulmer",
title = "Electronic structure of the metabolites of
cyclophosphamide",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "337--359",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190213",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ischenko:1981:NFD,
author = "S. Ya. Ischenko and V. B. Pavlov-Verevkin",
title = "New finite-difference method for solving the pair
radial equations of the many electron perturbation
theory",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "361--372",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190214",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sen:1981:SDQ,
author = "K. D. Sen and P. C. Schmidt",
title = "Static dipole and quadrupole polarizabilities of
alkaline earth atoms",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "373--376",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190215",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Ma,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "19",
number = "2",
pages = "fmi--fmii",
month = feb,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190201",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gustav:1981:SSS,
author = "Klaus Gustav and Roland Colditz",
title = "Suitability of a square step potential as an
oscillator potential",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "379--381",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190302",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Abu-Eittah:1981:MOT,
author = "Rafie Abu-Eittah and Rifaat Hilal and Maher M.
Hamed",
title = "Molecular orbital treatment of phenylfurans and
bifurans",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "383--399",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190303",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gutowski:1981:AEE,
author = "Maciej Gutowski and Ma{\l}gorzata K{\k{a}}kol and Jan
Andzelm and Lucjan Piela",
title = "Approximate exchange and electrostatic interaction
energies of deformed ions",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "401--411",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190304",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ruttink:1981:GGB,
author = "Paul J. A. Ruttink",
title = "Generation of generalized branching diagram spin
functions by {Schmidt} orthogonalization of spin-paired
functions",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "413--426",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190305",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lieb:1981:ILB,
author = "Elliott H. Lieb and Stephen Oxford",
title = "Improved lower bound on the indirect {Coulomb}
energy",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "427--439",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190306",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Suck:1981:KDT,
author = "Sung Ho Suck",
title = "The kernel of {DWBA} transition amplitude in
atom--diatom reactive scattering",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "441--450",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190307",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Miyoshi:1981:TSE,
author = "Eisaku Miyoshi and Toshikazu Takada and Shigeru Obara
and Hiroshi Kashiwagi and Kimio Ohno",
title = "Theoretical study of excitation energies of some
{CoF$_6^{n-}$} complexes",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "451--461",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190308",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Blake:1981:MCC,
author = "I. Ortega Blake and A. Le{\'s}",
title = "Magnesium and calcium cation--ligand interactions
within the pseudopotential approach. {II}.
{Cation--GABA} interactions",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "463--475",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190309",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Csavinszky:1981:AVP,
author = "P. Csavinszky and C. E. Tarr",
title = "Addendum to {``Variational principle for obtaining
approximate analytical solutions of the
temperature-perturbed Thomas--Fermi equation for
compressed atoms''}",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "477--481",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190310",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Taylor:1981:VTG,
author = "William J. Taylor",
title = "Variational treatment of the ground state of the
hydrogenic atom using the trial function {$\varphi = A
\exp(-\alpha r^\nu)$}",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "483--484",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190311",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{De:1981:CSS,
author = "B. R. De and A. B. Sannigrahi",
title = "Comparative study of the structure and properties of
{ClF$_2$} and {Cl$_3$} radicals by {CNDO/2} and {INDO}
methods",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "485--488",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190312",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Nalewajski:1981:E,
author = "Roman F. Nalewajski",
title = "Erratum",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "489--489",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190313",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mb,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "19",
number = "3",
pages = "fmi--fmii",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190301",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fantucci:1981:DEM,
author = "Piercarlo Fantucci and Stefano Polezzo and Laura
Trombetta",
title = "Direct energy minimization of self-consistent electron
pair by an orthogonal transformation of the basis",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "493--500",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190402",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gaspar:1981:IMF,
author = "R. {G{\'a}sp{\'a}r, Jr.} and R. G{\'a}sp{\'a}ar",
title = "Ab initio molecular fragment calculations with
pseudopotentials. {Some} fragments containing nitrogen
and oxygen",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "501--503",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190403",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dyadyusha:1981:ASFb,
author = "G. G. Dyadyusha and Eugene S. Kryachko",
title = "Algebraic structure of fermion density matrices.
{II}",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "505--514",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190404",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mukhopadhyay:1981:SCM,
author = "A. K. Mukhopadhyay and N. G. Mukherjee",
title = "Self-Consistent methods in {H{\"u}ckel} and extended
{H{\"u}ckel} theories",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "515--519",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190405",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fernandez:1981:HAEa,
author = "Francisco M. Fern{\'a}ndez and Eduardo A. Castro",
title = "Hypervirial analysis of enclosed quantum mechanical
systems. {I}. {Dirichlet} boundary conditions",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "521--532",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190406",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fernandez:1981:HAEb,
author = "Francisco M. Fern{\'a}ndez and Eduardo A. Castro",
title = "Hypervirial analysis of enclosed quantum mechanical
systems. {II}. {von Neumann} boundary conditions and
periodic potentials",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "533--543",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190407",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Adamowicz:1981:BSG,
author = "Ludwik Adamowicz",
title = "Basis set generation for the {SCF} calculation",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "545--551",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190408",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Smeyers:1981:IDN,
author = "Yves G. Smeyers and M. Nieves Bellido",
title = "Internal dynamics of nonrigid molecules. {I}.
{Application} to acetone",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "553--565",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190409",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jones:1981:EFO,
author = "Herbert W. Jones",
title = "Exact formulas for overlap integrals of {Slater}-type
orbitals with equal screening constants",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "567--574",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190410",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Deshmukh:1981:EEM,
author = "Pranawa Deshmukh and Jan Linderberg",
title = "Extension of {EWMO} model to particle-hole
excitations",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "575--584",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190411",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Beran:1981:AGO,
author = "S. Beran and Z. Slanina and D. C. Zidarov",
title = "Automatic geometry optimization for molecules with $d$
orbitals. {III}. {The EHT} method with electrostatic
corrections",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "585--591",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190412",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{El-Basil:1981:ARE,
author = "Sherif El-Basil",
title = "Additivity of resonance energy in benzenoid
hydrocarbons",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "593--609",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190413",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Basilevsky:1981:DCR,
author = "M. V. Basilevsky and V. M. Ryaboy",
title = "Direct calculation of resonant states in reactive
scattering. {Application} to linear triatomic systems",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "611--635",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190414",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Novaro:1981:TBP,
author = "O. Novaro and S. Castillo and W. Ko{\l}os and A.
Le{\'s}",
title = "Three-body potential energy terms for methane
trimers",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "637--648",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190415",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bauschlicher:1981:ICF,
author = "Charles W. {Bauschlicher, Jr.} and Byron H.
{Lengsfield III}",
title = "Improved {CI} formula evaluation: Elimination of the
phase determination at the determinant level for
arbitrarily coupled {CSFs}",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "649--654",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190416",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Varracchio:1981:EPT,
author = "E. Ficocelli Varracchio",
title = "Effective potential theory of atom--diatom scattering
in the presence of ``intermediate'' reactive channels",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "655--671",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190417",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bonchev:1981:ITI,
author = "D. Bonchev",
title = "Information theory interpretation of the {Pauli}
principle and {Hund} rule",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "673--679",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190418",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{DaCunhaLima:1981:SCAa,
author = "I. C. {Da Cunha Lima} and A. Ferreira {Da Silva} and
N. J. Parada",
title = "Self-Consistent {APW}--$k \cdot p$ method. {I}.
{Theory}",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "681--691",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190419",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Poirier:1981:UQGa,
author = "R. A. Poirier and R. Daudel and I. G. Csizmadia",
title = "Uniform quality {Gaussian} basis sets for molecular
calculations. {III}. {Charge} optimized basis sets",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "693--710",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190420",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Poirier:1981:UQGb,
author = "Raymond A. Poirier and Raymond Daudel and Imre G.
Csizmadia",
title = "Uniform quality {Gaussian} basis sets for molecular
calculations. {IV}. {Gradient} and charged optimized
basis sets for {CH$_4$}",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "711--718",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190421",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Les:1981:E,
author = "A. Le{\'s} and I. Ortega Blake",
title = "Erratum",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "719--720",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190422",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mc,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "19",
number = "4",
pages = "fmi--fmii",
month = apr,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190401",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Oriade:1981:FSB,
author = "Joseph Oriade",
title = "The {Fermi} surface of beryllium",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "721--727",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190502",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ganas:1981:OOS,
author = "P. S. Ganas",
title = "Optical oscillator strengths for isoelectronic ions of
nitrogen",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "729--734",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190503",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bhattacharyya:1981:SOE,
author = "Sankar Prasad Bhattacharyya",
title = "A scaled ``one-electron {Hamiltonian}'' model for
open-shell {LCAO--MO--SCF} calculations",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "735--743",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190504",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Heffernan:1981:ESI,
author = "Daniel M. Heffernan and Richard L. Liboff",
title = "Exact solutions for interacting finite potential
wells",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "745--753",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190505",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hunter:1981:NWF,
author = "Geoffrey Hunter",
title = "Nodeless wave functions and spiky potentials",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "755--761",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190506",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Dmitriev:1981:CPT,
author = "Yu. Dmitriev and G. Peinel",
title = "Coupled perturbation theory within the antisymmetrized
product of separated geminals ({APSG}) framework",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "763--769",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190507",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Moffat:1981:SSE,
author = "J. B. Moffat",
title = "Structures, stabilities, and energies of isomerization
of some alkyl cyanides and isocyanides and their
corresponding $\alpha$-cyanocarbonium and
$\alpha$-isocyanocarbonium ions",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "771--779",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190508",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tyrrell:1981:BAA,
author = "J. Tyrrell and R. B. Weinstock and F. Weinhold",
title = "Bond--antibond analysis of internal rotation barriers
in glyoxal and related molecules: {Where INDO} fails",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "781--791",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190509",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Stepanov:1981:UTU,
author = "N. F. Stepanov",
title = "Unitary transformations with the unitary operators
depending on projection operators",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "793--803",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190510",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hilal:1981:TDDa,
author = "Rifaat Hilal",
title = "Thermal dissociation of 1,2-dioxethane. {I}. {Charge}
density distribution along the reaction path and in
different {HF} solutions",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "805--819",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190511",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hilal:1981:TDDb,
author = "Rifaat Hilal",
title = "Thermal dissociation of 1,2-dioxethane. {II}.
{Quantum} topology of the charge distributions",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "821--831",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190512",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hilal:1981:TDDc,
author = "Rifaat Hilal",
title = "Thermal dissociation of 1,2-dioxethane. {III}.
{Localized} molecular-orbital study",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "833--845",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190513",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Grelland:1981:LEA,
author = "Hans H. Grelland",
title = "$n$-{Local} energies as accuracy measures on
approximate wave functions",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "847--857",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190514",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Singh:1981:DNJ,
author = "Jai Singh",
title = "Dynamic nonlinear {Jahn--Teller} effect of the type
{$E\otimes\epsilon$}",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "859--871",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190515",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Grelland:1981:ERA,
author = "Hans H. Grelland",
title = "An {Einstein} relativistic atomic and molecular model
based on the {Horwitz--Piron--Reuse} theory",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "873--883",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190516",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Muller:1981:UIN,
author = "Jiri M{\"u}ller",
title = "Use of iterative natural orbital method for
calculating energy barrier to predissociation of the
first excited states of {NH$_3$ (3s$^{1, 3}$
A$^{\prime\prime}_2$)}",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "885--889",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190517",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lipinski:1981:GOS,
author = "J{\'o}zef Lipi{\'n}ski and Henryk Chojnacki",
title = "Ghost orbitals in semiempirical methods. {Estimation}
of basis set superposition error",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "891--900",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190518",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Atabek:1981:MQS,
author = "O. Atabek and R. Lefebvre",
title = "Multichannel quantization and the static {Stark}
effect",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "901--906",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190519",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Daudey:1981:ACE,
author = "J. P. Daudey and M. Berrondo",
title = "Atomic calculations with an effective one-body
potential",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "907--927",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190520",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mekenyan:1981:ACB,
author = "Ov. Mekenyan and D. Bonchev and N. Trinajsti{\'c}",
title = "Algebraic characterization of bridged polycyclic
compounds",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "929--955",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190521",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Csavinszky:1981:TPD,
author = "P. Csavinszky and R. A. Morrow",
title = "Theory of the potential of a donor ion in silicon",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "957--966",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190522",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Castro:1981:SCA,
author = "Eduardo A. Castro and Francisco M. Fern{\'a}ndez",
title = "Some comments about the effective utilization of
off-diagonal hypervirial relations considering the
diagonal hypervirial relation: {Harmonic} oscillator
case",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "967--968",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190523",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wold:1981:BRB,
author = "Svante Wold",
title = "Book Review: {{\booktitle{Factor analysis in
chemistry}}. E. R. Malinowski and D. G. Howery.
Wiley-Interscience, New York, 1980. 250 pp., Price:
\$26.25}",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "969--969",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190524",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See
\cite{Malinowski:1980:FAC,Malinowski:1989:FAC,Malinowski:1991:FAC,Malinowski:2002:FAC}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Md,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "19",
number = "5",
pages = "fmi--fmii",
month = may,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190501",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:36 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lowdin:1981:P,
author = "Per-Olov L{\"o}wdin",
title = "Preface",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "973--973",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190602",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{DelRe:1981:I,
author = "Giuseppe {Del Re}",
title = "Introduction",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "975--976",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190603",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mangoni:1981:OS,
author = "Lorenzo Mangoni",
title = "Opening statement",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "977--977",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190604",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{DelRe:1981:BUN,
author = "Giuseppe {Del Re}",
title = "Binding: a unifying notion or a pseudoconcept?",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "979--984",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190605",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Berthier:1981:CSC,
author = "G. Berthier",
title = "Comments on the status of the chemical bond in methods
of quantum chemistry",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "985--989",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190606",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lafourcade:1981:ICB,
author = "L. Lafourcade",
title = "Importance of the concept of bond and binding in the
physical chemistry of solids",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "991--1000",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190607",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Cianetti:1981:RTB,
author = "Elvio Cianetti",
title = "Remarks on technology and bonding",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1001--1002",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190608",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ciambelli:1981:BTF,
author = "Paolo Ciambelli",
title = "``Binding'' technology and fundamental research:
{Some} cases in catalysis",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1003--1010",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190609",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wedler:1981:EEC,
author = "G. Wedler",
title = "Experimental evidence on the chemisorption bond with
the chemisorption on metals",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1011--1016",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190610",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kern:1981:EEC,
author = "R. Kern",
title = "Experimental evidence on the chemisorption bond of
two- and one-dimensional boundaries",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1017--1025",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190611",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wedler:1981:IAH,
author = "G. Wedler and W. Draxler",
title = "Influence of the adsorption of hydrogen on the
transport properties of thin nickel films",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1027--1030",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190612",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Laforgue-Kantzer:1981:SIN,
author = "D. Laforgue-Kantzer",
title = "State of ions near a cathode: {Adions} or adatoms?",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1031--1041",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190613",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Iadonisi:1981:PAC,
author = "G. Iadonisi and V. Marigliano Ramaglia and B.
Preziosi",
title = "Physical approach to chemisorption through {Green}'s
function method",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1043--1056",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190614",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Barbier:1981:BPF,
author = "C. Barbier and C. Vincent and G. {Del Re}",
title = "Bond polarization in the {FeCO} system:
{Semiempirical} {MO--SCF} ({BMV}) calculations",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1057--1063",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190615",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Borello:1981:MCS,
author = "E. Borello",
title = "Metal clusters and surfaces",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1065--1081",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190616",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Seel:1981:MCO,
author = "M. Seel",
title = "From molecular crystals and organic polymers to
chemisorption processes: {Importance} of local
interactions",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1083--1098",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190617",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Martin:1981:MIC,
author = "T. P. Martin",
title = "Matrix isolated clusters and microcrystals",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1099--1103",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190618",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Andre:1981:SAB,
author = "J. M. Andr{\'e} and J. L. Br{\'e}das and J.
Delhalle",
title = "Some aspects of bonding and binding in polymeric
chains",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1105--1111",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190619",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Karpfen:1981:HBC,
author = "A. Karpfen and A. Beyer and P. Schuster",
title = "Hydrogen bonding in clusters and molecular crystals",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1113--1119",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190620",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Peters:1981:SRD,
author = "David Peters and Jane Peters",
title = "Some recent developments in the quantum theory of
hydrogen bonding and other effects in proteins",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1121--1132",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190621",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Careri:1981:MAH,
author = "G. Careri and A. Giansanti and E. Gratton",
title = "Molecular aspects of the hydration process in a
globular protein",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1133--1135",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190622",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Barone:1981:RBH,
author = "G. Barone",
title = "Relations between the hydration and the intermolecular
or intramolecular solute--solute interactions",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1137--1138",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190623",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bonapasta:1981:PES,
author = "A. Amore Bonapasta and M. Bossa and A. Lapiccirella",
title = "Potential energy surface of the system {CO} + {O}:
{An} ab initio study on the {O CO} bond formation",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1139--1145",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190624",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sandorfy:1981:RSC,
author = "C. Sandorfy",
title = "{Rydberg} states in chemistry",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1147--1156",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190625",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sbrana:1981:SPT,
author = "G. Sbrana and L. Angeloni and S. Panerai",
title = "Spectroscopic properties of {TCNQ--bifluorenylidene}
1:1 complex",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1157--1160",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190626",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bertoluzza:1981:CBS,
author = "A. Bertoluzza and A. Marinangeli and M. A. Morelli and
R. Simoni",
title = "Correlations between structure and properties of
materials. {X}. {Anomalous} optical properties and
{Raman} spectra of glassy ternary
{B$_2$O$_3$BaTiO$_3$\bond{}Na$_2$O} materials",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1161--1165",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190627",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bertholon:1981:GCB,
author = "G. Bertholon and C. Decoret and M. Perrin and J. Royer
and A. Thozet and B. Tinland",
title = "Geometries of the chemical bonds around the hydroxyl
group in a series of phenolic compounds",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1167--1170",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190628",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Serre:1981:MMB,
author = "Josiane Serre",
title = "Metal--metal bonds",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1171--1183",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190629",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Garbato:1981:BMS,
author = "L. Garbato and P. Manca and G. Mula",
title = "Bond model for semiconducting materials",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1185--1189",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190630",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Garbato:1981:DSB,
author = "L. Garbato and P. Manca and A. Spiga",
title = "Diamagnetism as a structure and bonding related
property in semiconductors",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1191--1196",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190631",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Barone:1981:NAU,
author = "Vincenzo Barone and Francesco Lelj and Nino Russo",
title = "Nonempirical analysis of unusual chemical bonds. {II}.
{AlH$_2$BH$_4$} and {AlH$_2$C$_3$H$_5$}",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1197--1201",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190632",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Aasbrink:1981:CBM,
author = "L. {\AA}sbrink and C. Fridh and E. Lindholm",
title = "Concept of bond in the {MO} method {HAM}",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1203--1206",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190633",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Karpfen:1981:CPI,
author = "Alfred Karpfen",
title = "Convergence problem in ab initio crystal orbital
calculations",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1207--1214",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190634",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mestechkin:1981:E,
author = "M. M. Mestechkin",
title = "Erratum",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "1221--1221",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190635",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Me,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "19",
number = "6",
pages = "fmi--fmii",
month = jun,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560190601",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gupta:1981:DCP,
author = "V. D. Gupta",
title = "Dynamics and conformation of polypeptides",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "9--21",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200102",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hosur:1981:PNA,
author = "Ramakrishna V. Hosur and N. Vasanth Kumar and Girjesh
Govil",
title = "Protein--Nucleic acid interactions: {Investigations}
on the peptide backbone interaction with
polynucleotides",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "23--32",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200103",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hosur:1981:PBI,
author = "Ramakrishna V. Hosur and A. Pohorille",
title = "Protein backbone interaction with nucleic acid base
pairs: a theoretical investigation",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "33--40",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200104",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Montenay-Garestier:1981:CFB,
author = "T. Montenay-Garestier and J. C. Brochon and C.
H{\'e}l{\`e}ne",
title = "Complex formation between tryptophan-containing
peptides and nucleic acids: {Fluorescence} decay
studies using synchrotron radiation",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "41--48",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200105",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lavery:1981:SAR,
author = "Richard Lavery and Alberte Pullman and Bernard
Pullman",
title = "Steric accessibility of reactive centers in {B-DNA}",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "49--62",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200106",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sanyal:1981:SSI,
author = "Nitish K. Sanyal and Mihir Roychoudhury",
title = "Studies in some important aspects of {RNA}
transcription on the basis of intermolecular energy
calculations",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "63--69",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200107",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Durani:1981:PBS,
author = "S. Durani and Nitya Anand",
title = "A possible basis for structure--function relationship
of estrogens",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "71--83",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200108",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Phadke:1981:SFP,
author = "Ratna S. Phadke and N. Vasanth Kumar and R. V. Hosur
and Anil Saran and Girjesh Govil",
title = "Structure and function of propranolol: a
$\beta$-adrenergic blocking drug",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "85--92",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200109",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lala:1981:CPM,
author = "Anil K. Lala",
title = "Cholesterol and phospholipids in membranes: {The}
hydrogen bonding problem",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "93--97",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200110",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Biswas:1981:CAS,
author = "Margaret Biswas and V. S. R. Rao",
title = "Conformational analysis of some mannose-containing and
milk oligosaccharides: {Correlation} of their shape
with inhibitory properties in antigen\slash antibody
interactions",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "99--121",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200111",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kumar:1981:EMS,
author = "Kamal Kumar and Mahesh C. Bindal and Prithvi Singh and
Satya P. Gupta",
title = "Effect of molecular size on carbonic anhydrase
inhibition by sulfonamides",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "123--129",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200112",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Seydel:1981:MAQ,
author = "J. K. Seydel",
title = "Mode of action and quantitative structure--activity
relationship of sulfonamides in biological systems of
different complexity (enzymes, bacteria, rat, and
human)",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "131--150",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200113",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Raghunathan:1981:SAR,
author = "S. Raghunathan and Vasantha Pattabhi",
title = "Structure--Activity relationships in auxins",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "151--158",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200114",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sanyal:1981:BAN,
author = "Nitish K. Sanyal and Mihir Roychoudhury and Rajendra
P. Ojha",
title = "Biological activity of the nucleoside analogs: a
theoretical study",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "159--166",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200115",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kothekar:1981:SMM,
author = "V. Kothekar",
title = "Specificity and molecular mechanism of abortificient
action of prostaglandins",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "167--178",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200116",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sanyal:1981:IES,
author = "Nitish K. Sanyal and Upendra Kumar and Mihir
Roychoudhury",
title = "Interaction energy studies for the specificity of
transcription",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "179--183",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200117",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ghosh:1981:EBS,
author = "Subhendu Ghosh and Anjali Mookerjee",
title = "Estimation of binding sites from the adsorption
profile of complexed {DNA}",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "185--198",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200118",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kannan:1981:SRF,
author = "K. K. Kannan and M. Ramanadham",
title = "Structure, refinement, and function of human carbonic
anhydrase-{B}",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "199--209",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200119",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jayaraman:1981:PPL,
author = "S. Jayaraman and N. Yathindra",
title = "Probing possible left- and right-handed
poly(dinucleotide) helical conformations from (n--h)
plots. models for polysequential nucleotides",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "211--230",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200120",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sokalski:1981:TME,
author = "W. Andrzej Sokalski",
title = "Theoretical model for exploration of catalytic
activity of enzymes and design of new catalysts:
{CO$_2$} hydration reaction",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "231--240",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200121",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Malathi:1981:VBP,
author = "R. Malathi and N. Yathindra",
title = "Virtual bond probe to study ordered and random coil
conformations of nucleic acids",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "241--257",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200122",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lavery:1981:MEP,
author = "Richard Lavery and Bernard Pullman",
title = "Molecular electrostatic potential on the surface
envelopes of macromolecules: {B-DNA}",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "259--272",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200123",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Rao:1981:CME,
author = "Gita Subba Rao and R. S. Tyagi and R. K. Mishra",
title = "Calculation of the minimum energy conformation of
acetylcholine using a global optimization technique",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "273--279",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200124",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mf,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "1",
pages = "fmi--fmii",
month = jul,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200101",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Marchenko:1981:DDR,
author = "T. V. Marchenko and V. M. Lipkin and O. Yu. Chertov
and E. D. Sverdlov and Yu. A. Ovchinnikov",
title = "{DNA}-dependent {RNA} polymerase from {{\em E. coli}}:
{Structure} investigation",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "283--289",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200202",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Grishin:1981:SFB,
author = "E. V. Grishin",
title = "Structure and function of {{\em Buthus eupeus}}
scorpion neurotoxins",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "291--298",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200203",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Langlet:1981:IBN,
author = "J. Langlet and P. Claverie and F. Caron and J. C.
Boeuve",
title = "Interactions between nucleic acid bases in hydrogen
bonded and stacked configurations: {The} role of the
molecular charge distribution",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "299--338",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200204",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chojnacki:1981:PEC,
author = "Henryk Chojnacki and J{\'o}zef Lipi{\'n}ski and W.
Andrzej Sokalski",
title = "Potential energy curves in complementary base pairs
and in model hydrogen bonded systems",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "339--346",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200205",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Balaji:1981:ECH,
author = "V. N. Balaji",
title = "Energy calculations on helical polypeptides:
{Structure} of polyglycine {II}",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "347--356",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200206",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Saran:1981:MOS,
author = "Anil Saran and Lalit N. Patnaik",
title = "Molecular orbital studies on nucleoside antibiotics.
{IV}. conformation of 3'-deoxyadenosine (cordycepin)
and 3'-amino-3'-deoxyadenosine",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "357--367",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200207",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Pedersen:1981:SST,
author = "C. Th. Pedersen and J. Oddershede and J. R. Sabin",
title = "Semiempirical studies on 1,2- and
1,3-tetrathiofulvalenes",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "369--371",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200208",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gupta:1981:SMP,
author = "V. P. Gupta and V. D. Gupta and C. Mehrotra",
title = "Study of molecular polarizabilities of some amino and
polyamino acids",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "373--376",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200209",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mishra:1981:VWF,
author = "R. K. Mishra and K. Bhaumik and A. Srivastava and S.
S. Chaudhary",
title = "{Van der Waals} force between two localized clusters
of bosons",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "377--383",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200210",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Soni:1981:STP,
author = "M. L. Soni and R. C. Kapoor",
title = "Some thermodynamic parameters for hydroxy amino acids:
{Bicine} and tricine",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "385--391",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200211",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Yamaguchi:1981:TSP,
author = "Kizashi Yamaguchi",
title = "Theoretical studies of photo-oxidative cleavage
reactions of nitrogen-activated {C\doublebond{}C}
double bonds of enamines, indoles, and tryptamines",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "393--406",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200212",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bansal:1981:SFC,
author = "Manju Bansal and Goutam Gupta",
title = "Structure factor calculations of various {DNA}
duplexes",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "407--417",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200213",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jain:1981:BLD,
author = "D. V. S. Jain and Vijay Gombar",
title = "Binding of leucomycin and its derivatives to {{\em E.
coli}} ribosomes",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "419--427",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200214",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lukovits:1981:CSD,
author = "I. Lukovits",
title = "Comparative studies on drug-receptor binding of
phenylethylamine derivatives using calculated group
contribution constants",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "429--438",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200215",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Saran:1981:CNA,
author = "Anil Saran",
title = "Conformation of nucleoside antibiotics",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "439--447",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200216",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Chidambaram:1981:NES,
author = "R. Chidambaram",
title = "Neutron elastic scattering studies of biological
molecules and complexes",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "449--459",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200217",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ovchinnikov:1981:IC,
author = "Yu. A. Ovchinnikov",
title = "Ionophores and channels",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "461--478",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200218",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Varma:1981:SLE,
author = "Shambhu D. Varma",
title = "Superoxide and lens of the eye: a new theory of
cataractogenesis",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "479--484",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200219",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Khetrapal:1981:ANO,
author = "C. L. Khetrapal",
title = "Application of {NMR} of oriented systems in
biochemistry and biophysics",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "485--494",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200220",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Das:1981:ECW,
author = "Sudipto Das and Gaurishanker Singhal",
title = "Effect of change of water structure on the phase
transition of liposomes of dipalmitoyl
phosphatidylcholine",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "495--504",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200221",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Seydel:1981:ALM,
author = "U. Seydel and B. Lindner",
title = "Application of the laser microprobe mass analyzer
({LAMMA}) to qualitative and quantitative single cell
analysis",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "505--512",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200222",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Myer:1981:CCA,
author = "Yash P. Myer and A. Pande and J. Pande and K. K.
Thallam and A. F. Saturno and Balbir C. Verma",
title = "Cytochrome c: {Ascorbate} reduction site and possible
electron-transfer path",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "513--521",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200223",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Gurnani:1981:ITL,
author = "S. Gurnani and G. Datta and N. B. Mulchandani and G.
Sen and S. K. Mehta and S. Sengupta",
title = "Interaction of tylophorinidine with lysozyme",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "523--531",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200224",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tatake:1981:SET,
author = "V. G. Tatake",
title = "Significance of the electron trap parameters of glow
curves of photosynthetic membranes",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "533--541",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200225",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Psoda:1981:IMB,
author = "Anna Psoda and B. Kierdaszuk and A. Pohorille and M.
Geller and J. T. Kusmierek and D. Shugar",
title = "Interaction of the mutagenic base analogs
{O$^6$}-methylguanine and {N$^4$}-hydroxycytosine with
potentially complementary bases",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "543--554",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200226",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Talekar:1981:MCB,
author = "Manjubala S. Talekar and Subhash V. Talekar",
title = "Mechanism of chromosome banding: a phenomenological
approach",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "555--566",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200227",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Panda:1981:ATL,
author = "B. C. Panda",
title = "Active transport in the light of thermodynamics of
open systems",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "567--571",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200228",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Shugar:1981:TPP,
author = "David Shugar and Krystyna Szcz{\k{e}}{\'s}niak",
title = "Tautomerism of pyrimidines and purines in the gas
phase and in low-temperature matrices, and some
biological implications",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "573--585",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200229",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Aa,
author = "Anonymous",
title = "Announcements",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "589--590",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200230",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mg,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "2",
pages = "fmi--fmii",
month = aug,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200201",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:37 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Modrak:1981:CDS,
author = "P. Modrak",
title = "Calculation of the density of states of tight-binding
$d$ band for simple cubic lattice",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "591--600",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200302",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Radzio-Andzelm:1981:III,
author = "El{\.z}bieta Radzio-Andzelm",
title = "Investigation of intermolecular interactions based on
the atomic statistical model",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "601--612",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200303",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Prasad:1981:ILP,
author = "C. V. Prasad and K. Sundaram",
title = "Impact of lone pairs on the conformation and
configuration statistics of poly(lactic acid) chains",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "613--621",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200304",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fernandez:1981:HAEc,
author = "Francisco M. Fern{\'a}ndez and Eduardo A. Castro",
title = "Hypervirial analysis of enclosed quantum mechanical
systems. {III}. {Unsymmetrical} boundary conditions",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "623--632",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200305",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kobeissi:1981:EEF,
author = "Hafez Kobeissi and Mounzer Dagher and Mohamad Adel
Alameddine",
title = "Explicit expression of the {Franck--Condon} factors in
terms of the potentials of the two states",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "633--644",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200306",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hariharan:1981:MCN,
author = "P. C. Hariharan and Herbert E. Popkie and Joyce J.
Kaufman",
title = "Molecular calculations with the nonempirical ab initio
{MODPOT}, {VRDDO}, and {MODPOT\slash VRDDO} procedures.
{XII}. {Carcinogenic} 3-methylcholanthrene and its
metabolites using a {MERGE} technique",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "645--653",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200307",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Almlof:1981:TES,
author = "J. Alml{\"o}f and A. V. Nemukhin and A. Heiberg",
title = "Treatment of excited states in the {CASSCF} method:
{Application} to {BO}",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "655--667",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200308",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kluge:1981:CES,
author = "G. Kluge and M. Scholz",
title = "Chemistry of excited states. {XI}. {Interpretation} of
photoelectron spectra by final state single {CI} method
within semiempirical formalisms",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "669--682",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200309",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Beleznay:1981:IBP,
author = "F. Beleznay and S. Suhai and J. Ladik",
title = "Interaction between polymers: {Dispersion} energy of
two infinite linear chains",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "683--692",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200310",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Marini:1981:RTB,
author = "U. Marini and Bettolo Marconi and N. H. March",
title = "Relativistic theory of binding energies of heavy
positive ions",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "693--704",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200311",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tantardini:1981:IVB,
author = "Gian Franco Tantardini and Massimo Simonetta",
title = "Ab initio valence bond calculations. {XI}. {Pyridine}:
{Ground} and ionized states",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "705--715",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200312",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Tatum:1981:CCK,
author = "J. Patrick Tatum",
title = "Calculations concerning {Kato}'s equations",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "717--745",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200313",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sudhindra:1981:IIP,
author = "B. S. Sudhindra and J.-H. Fuhrhop",
title = "Intermolecular interactions in porphin dimers: a
quantum mechanical study",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "747--753",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200314",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Sapse:1981:ISS,
author = "Anne Marie Sapse and Grace Snyder and Angelo V.
Santoro",
title = "Ab initio {SCF} study of guanidine and substituted
guanidines",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "755--762",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200315",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Maric:1981:GRM,
author = "Z. Mari{\'c} and M. Popovi{\'c}-Bo{\v{z}}i{\'c} and Z.
Nikolovski",
title = "Generalized {Racah} method for the evaluation of {CFP}
for mixed electronic configurations",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "763--774",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200316",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lowdin:1981:AQT,
author = "Per-Olov L{\"o}wdin",
title = "Addendum to {``Quantum} theory as a trace algebra''",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "775--776",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200317",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wormer:1981:NMP,
author = "P. E. S. Wormer",
title = "Note on the {Matsen} and {Pauncz} proof of the
{S$_n$-U(n)} duality",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "777--778",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200318",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Simons:1981:SMR,
author = "Jack Simons",
title = "The {Siegert} methods in resonance scattering:
{Relation} to {L$^2$} methods",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "779--780",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200319",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mh,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "3",
pages = "fmi--fmii",
month = sep,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200301",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Thuraisingham:1981:ECC,
author = "R. A. Thuraisingham and G. Bandarage",
title = "Explicitly correlated configuration interaction wave
functions for the {He} atom using correlated
{Gaussians}",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "781--783",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200402",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hofmann:1981:CHS,
author = "Hans-J{\"o}rg Hofmann and Gustav Peinel and Christine
Krebs and Cornelius Weiss",
title = "Construction of hydration shells for the tautomeric
forms of heterocycles based on electrostatic
potentials",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "785--792",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200403",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ang:1981:RCE,
author = "M. H. Ang and K. Yates and I. G. Csizmadia and R.
Daudel",
title = "Relationship of correlation energy and size",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "793--806",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200404",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Raina:1981:EDE,
author = "V. Raina and K. V. Sane and R. P. Saxena and P. K.
Srivastava",
title = "Estimation of dissociation energy of alkali diatomics
using an extended {Linderberg} relation",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "807--816",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200405",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Roeggen:1981:ECD,
author = "I. R{\o}eggen",
title = "Electron correlation described by an extended geminal
model",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "817--833",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200406",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Moiseyev:1981:SPR,
author = "Nimrod Moiseyev",
title = "Study of predissociation resonances by the complex
coordinate method",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "835--842",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200407",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Kashiwagi:1981:IMO,
author = "Hiroshi Kashiwagi and Shigeru Obara",
title = "Ab initio molecular orbital calculation of
{Fe}-porphine with a double zeta basis set",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "843--859",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200408",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Matsen:1981:SFQ,
author = "F. A. Matsen and C. J. Nelin",
title = "Spin-Free quantum chemistry. {XXII}.
{Multiconfiguration} self-consistent field theory",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "861--878",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200409",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Scheire:1981:MSX,
author = "L. Scheire and R. Rotthier and P. Phariseau",
title = "{MSW--SCF--X$\alpha$} studies of some silicon
compounds. {I}. {Iminosilicon (HNSi)}",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "879--885",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200410",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bhattacharyya:1981:LBR,
author = "Kamal Bhattacharyya and Sankar Prasad Bhattacharyya",
title = "Limiting behavior of the ratio of $<r_{12}^{-1}>$ and
$<r_1^{-1}>$ in the helium sequence",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "887--889",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200411",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Oriade:1981:PBS,
author = "Joseph Oladipo Oriade",
title = "Positron band structures for beryllium",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "891--896",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200412",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Matsuoka:1981:MCM,
author = "Osamu Matsuoka",
title = "Methods of composite molecular wave functions. {I}.
{Variational} principle and multiconfiguration {SCF}
theory",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "897--908",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200413",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Facelli:1981:IHO,
author = "J. C. Facelli and R. H. Contreras",
title = "Inclusion of hydrogen $p$ orbitals in the
semiempirical calculation of {NMR} parameters. {III}:
{INDO CHF} calculations of orbital and dipolar
contributions to spin--spin coupling constants
involving protons",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "909--919",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200414",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Romano:1981:MCS,
author = "Silvano Romano",
title = "{Monte-Carlo} simulation of water solvent with
biomolecules: {Serines} with reaction-field
correction",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "921--926",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200415",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Wilson:1981:SLP,
author = "R. G. Wilson and C. S. Sharma",
title = "Studies in {L{\"o}wdin}'s partitioning technique in
quantum theory. {I}. {Invertibility} of the operator
{K}",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "927--932",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200416",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{DaCunhaLima:1981:SCAb,
author = "I. C. {Da Cunha Lima} and A. Ferreira {Da Silva} and
N. J. Parada",
title = "Self-Consistent {APW}--$k \cdot p$ method. {II}.
{Application} to {NaCl}",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "933--949",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200417",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Michels:1981:EAI,
author = "M. A. J. Michels",
title = "Evaluation of angular integrals in rotational
invariants",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "951--952",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200418",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Mukerjee:1981:SEM,
author = "Nirad Gopal Mukerjee and Pratip Ray",
title = "Simplification of an earlier {MCSCF} procedure for
{CI} expansions involving orbital excitations",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "953--953",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200419",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mi,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "4",
pages = "fmi--fmii",
month = oct,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200401",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Fukutome:1981:UHF,
author = "Hideo Fukutome",
title = "Unrestricted {Hartree--Fock} theory and its
applications to molecules and chemical reactions",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "955--1065",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200502",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Raghavachari:1981:COE,
author = "Krishnan Raghavachari and John A. Pople",
title = "Calculation of one-electron properties using limited
configuration interaction techniques",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1067--1071",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200503",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ganas:1981:EIE,
author = "P. S. Ganas",
title = "Electron impact excitation cross sections for {O II}",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1073--1076",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200504",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Ho:1981:IHC,
author = "Y. K. Ho",
title = "Improved {Hylleraas} calculations for ground state
energies of lithium {ISO--electronic} sequence",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1077--1082",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200505",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Hariharan:1981:EMP,
author = "P. C. Hariharan and Joyce J. Kaufman and Carlo
Petrongolo",
title = "Electrostatic molecular potential contour maps
generated from ab initio {MODPOT\slash VRDDO\slash
MERGE} wave functions of carcinogenic
3-methylcholanthrene and its metabolites",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1083--1095",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200506",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lochmann:1981:MEP,
author = "R. Lochmann and G. Peinel and T. Weller",
title = "Molecular electrostatic potentials from {PCILO} wave
functions",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1097--1105",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200507",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Moskowitz:1981:NLC,
author = "Jules W. Moskowitz and M. H. Kalos",
title = "A new look at correlations in atomic and molecular
systems. {I}. {Application} of fermion {Monte Carlo}
variational method",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1107--1119",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200508",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{DalCappello:1981:CPE,
author = "C. {Dal Cappello} and C. Tavard",
title = "{Compton} profiles for ejected electrons:
{Determination} of momentum densities",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1121--1125",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200509",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Oliveira:1981:MXM,
author = "P. Murilo Oliveira and B. Maffeo",
title = "{MS X$_\alpha$} method and transition-state
procedure",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "1127--1139",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200510",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mj,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "5",
pages = "fmi--fmii",
month = nov,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200501",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bozovic:1981:PSA,
author = "I. B. Bo{\v{z}}ovi{\'c} and J. Delhalle and M.
Damnjanovi{\'c}",
title = "A posteriori symmetry analysis of polymer electronic
band structures",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1143--1163",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200602",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{PrasadBhattacharyya:1981:HTO,
author = "Sankar PrasadBhattacharyya and Debashis Mukherjee",
title = "A hybrid technique of orthonormality constrained
orbital optimization in {SCF} calculations",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1165--1177",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200603",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Luzanov:1981:SSP,
author = "A. V. Luzanov and G. E. Whyman",
title = "Structure and spin-purity conditions for reduced
density matrices of arbitrary order",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1179--1199",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200604",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Lowdin:1981:SDC,
author = "Per--olov L{\"o}wdin and Jean--Louis Calais and
Jacques M. Calazans",
title = "Simple derivation of conditions for instability in the
{Hartree--Fock} and projected {Hartree--Fock} schemes",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1201--1215",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200605",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Jones:1981:CGFa,
author = "Herbert W. Jones",
title = "Computer-generated formulas for two-center {Coulomb}
integrals over {Slater}-type orbitals",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1217--1224",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200606",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Solmajer:1981:CIA,
author = "T. {\v{S}}olmajer and D. Kocjan and D. Had{\v{z}}i",
title = "Catecholamine interaction with anionic {sites---A}
model study",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1225--1231",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200607",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Witschel:1981:OPE,
author = "W. Witschel",
title = "Ordered products of exponential operators by
similarity transformations",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1233--1241",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200608",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Westhaus:1981:CBP,
author = "Paul Westhaus",
title = "Connections between perturbation theory and the
unitary transformation methods of deriving effective
{Hamiltonians}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1243--1253",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200609",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Balasubramanian:1981:SSS,
author = "K. Balasubramanian",
title = "Symmetry simplifications of space types in
configuration interaction induced by orbital
degeneracy",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1255--1271",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200610",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bhattacharyya:1981:VRS,
author = "Kamal Bhattacharyya",
title = "Variants of {Rayleigh--Schr{\"o}dinger} perturbation
theory---a new look",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1273--1284",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200611",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Brucenta:1981:ETM,
author = "A. Bruce{\~n}ta and P. Vermeulin and P. Archirel and
G. Berthier",
title = "Exponential transformation of molecular orbitals.
{II}. {General} formulation for {UHF} calculations and
application to diatomics and molecular fragments",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1285--1300",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200612",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Nakatsuji:1981:CEW,
author = "Hiroshi Nakatsuji and Kimihiko Hirao",
title = "Cluster expansion of the wave function. {Electron}
correlations in singlet and triplet excited states,
ionized states, and electron attached states by {SAC}
and {SAC--CI} theories",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1301--1313",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200613",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Bamzai:1981:ISC,
author = "Anjuli S. Bamzai and B. M. Deb",
title = "Internal stresses and chemical binding in the {H}
molecule",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1315--1329",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200614",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Larsson:1981:BRB,
author = "Seven Larsson and Olle M{\aa}rtensson",
title = "Book Review: {{\booktitle{Catalysis in chemistry and
biochemistry. Theory and experiment. Jerusalem symposia
on quantum chemistry and biochemistry}}. Vol. 12.
Edited by B. Pullman. Reidel, Dordrecht, 1979. Price
(cloth): \$85.00. ISBN 90-277-1039-2}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1331--1331",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200615",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Pullman:1979:CCB}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Calais:1981:BRBa,
author = "Jean-Louis Calais",
title = "Book Review: {{\booktitle{Chimie quantique structural
et {\'e}l{\'e}ments de spectroscopie th{\'e}orique}}.
By A. Julg. Office des publications universitaires,
Alger, 1978}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1331--1332",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200616",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Calais:1981:BRBb,
author = "Jeans-Louis Calais",
title = "Book Review: {{\booktitle{Quantum Theory of
Polymers}}. Edited by J.-M. Andr{\'e}, J. Delhalle, and
J. Ladik. NATO advanced study Institutes series C,
Volume 39. Reidle, Dordrecht and Boston, 1978}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1332--1332",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200617",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Andre:1978:QTP}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Calais:1981:BRBc,
author = "Jean-Louis Calais",
title = "Book Review: {{\booktitle{Electrons and Phonons in
Layered Crystal Structures}}. Edited by T. J. Wietling
and M. Schluter. Physics and Chemistry of Materials
with Layered Structures, Volume 3 D. Reidel, Dordrecht
and Boston, 1979}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1332--1333",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200618",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Wieting:1979:EPL}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Siegbahn:1981:BRB,
author = "Hans Siegbahn",
title = "Book Review: {{\booktitle{Reactive Intermediates in
the Gas Phase, Generation and Monitoring}}. Edited by
D. W. Setser. Academic, New York, 1979}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1333--1334",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200619;
https://doi.org/10.1002/qua.560200620",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Setser:1979:RIG}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
xxpages = "1333--1333",
}
@Article{Martensson:1981:BRB,
author = "Olle Martensson",
title = "Book Review: {{\booktitle{Carcinogenesis: Fundamental
Mechanisms and Environmental Effects}}. Edited by B.
Pullman, P. O. P. Ts'o, and H. Gelboin. The Jerusalem
Symposia on Quantum Chemistry and Biochemistry. Vol.
13. Reidel, Dordrecht, 1980. ISBN 90-277-1171-2}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1334--1334",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200621",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Pullman:1980:CFM}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Froelich:1981:BRB,
author = "Piotr Froelich",
title = "Book Review: {{\booktitle{Ab Initio Calculations ---
Methods and Applications in Chemistry}}. By Petr
{\v{C}}{\'a}rsky and Miroslav Urban. Lecture Notes in
Chemistry No. 16. Springer-Verlag, Berlin, 1980. ISBN
3-540-10005-9}",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1334--1335",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200622",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "See \cite{Carsky:1980:ICM}.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Ab,
author = "Anonymous",
title = "Announcement",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "1337--1337",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200623",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Anonymous:1981:Mk,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "6",
pages = "fmi--fmii",
month = dec,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200601",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Mon Oct 3 12:45:38 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Oct 2004",
}
@Article{Oie:1981:DFI,
author = "Tetsuro Oie and Gerald M. Maggiora and Ralph E.
Christoffersen and David J. Duchamp",
title = "Development of a flexible intra- and intermolecular
empirical potential function for large molecular
systems",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "1--47",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200703",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Graf:1981:ESG,
author = "P. Graf and E. L. Mehler",
title = "Evaluation of small {Gaussian} basis sets for
ab-initio calculations on biologically active
molecules",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "49--61",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200704",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Graf:1981:DDI,
author = "P. Graf and E. L. Mehler",
title = "Direct determination of improved contraction
coefficients by a least-squares approach",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "63--71",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200705",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Sapse:1981:SCF,
author = "A. M. Sapse and C. S. Russell and G. Snyder",
title = "Self-consistent field calculations on
2-aminomethyl-3-carboxymethyl pyrrole, a substrate
analog of {PBG} deaminase evidence of intramolecular
hydrogen bonding",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "73--80",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200706",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Laurence:1981:ICC,
author = "Patricia R. Laurence and Colin Thomson",
title = "Ab-initio calculations of charge transfer interactions
involving ascorbic acid and its metabolites",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "81--93",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200707",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Loew:1981:QCS,
author = "Gilda H. Loew and Michael T. Poulsen",
title = "Quantum chemical studies of aflatoxins: {Metabolism}
and carcinogenic activity",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "95--107",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200708",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Gresh:1981:TSS,
author = "N. Gresh and C. Etchebest and O. {de la Luz Rojas} and
A. Pullman",
title = "A theoretical study of the selective alkali and
alkaline-earth cation binding properties of
valinomycin",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "109--116",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200709",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Ramani:1981:IMO,
author = "R. Ramani and Russell J. Boyd",
title = "Ab-initio molecular orbital study of the {\em
cis\slash trans\/} conformations of the peptide bond",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "117--127",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200710",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Chatterjee:1981:MOS,
author = "C. L. Chatterjee and Anil Saran",
title = "Molecular orbital studies on nucleoside antibiotics
{V}. {Conformation} of pyrazofurins",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "129--138",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200711",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Broch:1981:IAC,
author = "H. Broch and D. Cabrol and D. Vasilescu",
title = "Implications of aminoacyladenylate conformations in
the prebiotic polypeptide synthesis",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "139--148",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200712",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Lowrey:1981:MCN,
author = "A. H. Lowrey and P. C. Hariharan and Joyce J.
Kaufman",
title = "Molecular calculations with the nonempirical ab-initio
{MODPOT \slash VRDDO \slash MERGE} procedures. {XIV}.
2,6-dimethyl-{N}-nitroso morpholine and its
{$\alpha$-OH} isomers: {Conformations} and
electrostatic molecular potential contour maps",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "149--160",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200713",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Zakrzewska:1981:EPM,
author = "Krystyna Zakrzewska and Richard Lavery and Bernard
Pullman",
title = "The electrostatic potential of a model phospholipid
monolayer",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "161--170",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200714",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Lavery:1981:EMP,
author = "Richard Lavery and Sylvie Corbin and Alberte
Pullman",
title = "The electrostatic molecular potential of
{tRNA$^{Phe}$}. {V}. {The} influence of counterion
binding on the potential and the steric accessibility",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "171--183",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200715",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Mezey:1981:MTM,
author = "Paul G. Mezey",
title = "Manifold theory of multidimensional potential
surfaces",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "185--196",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200716",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Xiao-Yuan:1981:CEP,
author = "Fu Xiao-Yuan and Su Shu-Jun",
title = "Calculation of energies of protonation and
tautomerization of methyl histamines and their
relationship with {pK$_a$} values and biological
activities",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "197--200",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200717",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Cheney:1981:EPE,
author = "B. Vernon Cheney and Dominic A. Zichi",
title = "Effects of {N}-protonation on the electronic structure
of morphine and naloxone",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "201--219",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200718",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Scheiner:1981:PTH,
author = "Steve Scheiner",
title = "Proton transfers in hydrogen-bonded systems {V}.
{Analysis} of electronic redistributions in
{(N$_2$H$_7$)}$^+$",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "221--229",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200719",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Jeffrey:1981:HBG,
author = "G. A. Jeffrey and H. Maluszynska",
title = "Hydrogen-bonding geometry and patterns in
carbohydrates and amino acids",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "231--239",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200720",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Meshitsuka:1981:PNS,
author = "Shunsuke Meshitsuka and Gary M. Smith and Albert S.
Mildvan",
title = "Proton {NMR} studies of the histidine residues and of
bound {ATP} on rabbit muscle pyruvate kinase",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "241--245",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200721",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Gupta:1981:NPS,
author = "Raj K. Gupta and Jeffrey L. Benovic",
title = "{NMR} probes of the spatial arrangement of substrates
at the active site of creatine kinase",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "247--256",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200722",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Sheridan:1981:NRS,
author = "Robert P. Sheridan and Raj K. Gupta",
title = "{$^1$H} nuclear relaxation study of the
aniline-binding site in human hemoglobin",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "257--264",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200723",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Gascoyne:1981:ESR,
author = "Peter R. C. Gascoyne",
title = "An electron spin resonance investigation of amine
models for the protein--methylglyoxal interaction",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "265--270",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200724",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{vanZandt:1981:DDV,
author = "L. L. van Zandt",
title = "Damping of {DNA} vibration modes by viscous solvents",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "271--276",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200725",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Wagner:1981:SDO,
author = "Belinda J. Wagner and Chanchal K. Mitra and Ramaswamy
H. Sarma",
title = "Structure of {DNA} oligonucleotides",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "277--285",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200726",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Sundaralingam:1981:SMN,
author = "M. Sundaralingam and E. Westhof",
title = "Structural motifs of the nucleotidyl unit and the
handedness of polynucleotide helices",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "287--306",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200727",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Bone:1981:EPP,
author = "Stephen Bone and Joyce Eden and Ronald Pethig",
title = "Electrical properties of proteins as a function of
hydration and {NaCl} content",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "307--316",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200728",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Bennett:1981:MCE,
author = "H. Stanley Bennett",
title = "Muscle contraction and enzymatic action: {Challenges}
to quantum chemistry",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "317--329",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200729",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Sheridan:1981:SSN,
author = "Robert P. Sheridan and Raj K. Gupta",
title = "Spectroscopic studies of neocarzinostatin and its
chromophore: {UV} inactivation and mercaptan
activation",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "331--346",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200730",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Biczo:1981:HSE,
author = "G. Bicz{\'o} and I. Lukovits",
title = "Hunting of strange electronic states and structures in
solids and biopolymers",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "347--357",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200731",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Danilov:1981:EWT,
author = "Victor I. Danilov and J{\'o}zef S. Kwiatkowski and
Bogdan Lesyng and Valery I. Poltev",
title = "Effect of water on the tautomeric equilibrium of
2-oxopyridine. {A Monte Carlo} simulation study",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "359--364",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200732",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Moore:1981:ITS,
author = "Richard D. Moore",
title = "The insulin transduction system: {A} biophysical model
for mitogenesis",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "365--371",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200733",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Reggio:1981:MDB,
author = "Patricia H. Reggio and Harel Weinstein and Roman Osman
and Sid Topiol",
title = "Molecular determinants for binding of
methylenedioxytryptamines at {5-HT\slash LSD}
receptors",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "373--384",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200734",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Urry:1981:CPG,
author = "D. W. Urry and C. M. Venkatachalam and K. U. Prasad
and R. J. Bradley and G. Parenti-Castelli and G. Lenaz",
title = "Conduction processes of the gramicidin channel",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "385--399",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200735",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Seybold:1981:RBC,
author = "Paul G. Seybold and Richard Vestewig and John D.
Scribner",
title = "Relationships between carcinogenicity, mutagenicity,
and theoretical reactivity indices for polycyclic
aromatic hydrocarbons",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "401--408",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200736",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Shibata:1981:CAS,
author = "Masayuki Shibata and Thomas Kieber-Emmons and Shibani
Dutta and Robert Rein",
title = "A comparative analysis of the stability of the
chymotrypsin charge triad",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "409--417",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200737",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Kaufman:1981:SCG,
author = "Joyce J. Kaufman",
title = "Strategy for computer-generated theoretical and
quantum chemical prediction of toxicity and toxicology
(and pharmacology in general)",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "419--439",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200738",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Fox:1981:OPS,
author = "Sidney W. Fox",
title = "Origins of the protein synthesis cycle",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "441--454",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200739",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Findley:1981:GE,
author = "G. L. Findley and S. P. McGlynn",
title = "Geometry and evolution",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "455--461",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200740",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Randic:1981:GTC,
author = "M. Randic",
title = "Graph theoretical characterization of the dendritic
fields",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "463--479",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200741",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Anonymous:1981:Ac,
author = "Anonymous",
title = "Abstracts",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "481--482",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200742",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Anonymous:1981:I,
author = "Anonymous",
title = "Introduction",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "vii--vii",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200702",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Anonymous:1981:Ml,
author = "Anonymous",
title = "Masthead",
journal = j-IJQC,
volume = "20",
number = "S8",
pages = "fmi--fmi",
day = "5--7",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200701",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:06 MDT 2011",
bibsource = "http://www.interscience.wiley.com/jpages/0020-7608;
https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib;
http://www3.interscience.wiley.com/journalfinder.html",
note = "Supplement: Proceedings of the International Symposium
on Quantum Biology and Quantum Pharmacology.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "16 Apr 2008",
}
@Article{Wilson:1981:JHV,
author = "E. Bright Wilson",
title = "{John Hasbrouck Van Vleck} (1899--1980)",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "1--3",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200802",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1981:BM,
author = "Anonymous",
title = "{Bernd T. Matthias}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "5--19",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200803",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sheppard:1981:TOQ,
author = "Maurice G. Sheppard and Karl F. Freed",
title = "Third-order quasidegenerate many-body perturbation
theory calculations for valence state correlation
energies of the nitrogen and oxygen atoms and their
ions",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "21--31",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200804",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Fukutome:1981:CTB,
author = "Hideo Fukutome and Katsufumi Hashimoto",
title = "Characterization of the two-body correlation
structures in a molecular many-electron wave function",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "33--59",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200805",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Cizek:1981:UCQ,
author = "J. {\v{C}}{\^\i}{\v{z}}ek and R. Pauncz and E. R.
Vrscay",
title = "The use of the concept of quasispin for the study of
physical and chemical properties of alternant
conjugated hydrocarbons",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "61--62",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200806",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Born:1981:UGF,
author = "Gregory Born and Isaiah Shavitt",
title = "A unitary group formulation of open-shell electron
propagator theory",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "63--63",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200807",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Davidson:1981:QSE,
author = "Ernest R. Davidson",
title = "Qualitatively significant effects of electron
correlation",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "65--68",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200808",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Hinze:1981:DCE,
author = "Juergen Hinze and Fak. F. Chemie",
title = "Developments in the calculation of electronic
wavefunctions for molecules: {MCSCF}, {CI}, and
numerical {SCF} for molecules",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "69--90",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200809",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Lischka:1981:NIG,
author = "Hans Lischka and Ron Shepard and Franklin B. Brown and
Isaiah Shavitt",
title = "New implementation of the graphical unitary group
approach for multireference direct configuration
interaction calculations",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "91--100",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200810",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pauncz:1981:SCI,
author = "Ruben Pauncz",
title = "Studies in the configuration interaction method. {I}.
{Combinatorial} aspects of the downward-{Robb}
algorithm",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "101--111",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200811",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Ortiz:1981:AWR,
author = "J. V. Ortiz and Brian Weiner and Yngve {\"O}hrn",
title = "The {AGP} wavefunction and its relation to other
descriptions of electronic structure",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "113--128",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200812",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Lozes:1981:ITA,
author = "Richard L. Lozes and Brian Weiner and Yngve
{\"O}hrn",
title = "Invariance transformations and {AGP} optimization",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "129--131",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200813",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sangfelt:1981:AAP,
author = "Erland Sangfelt and Osvaldo Goscinski and Nils Elander
and Henry Kurtz",
title = "An analysis of the {AGP} and projected {AGP}
wavefunctions",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "133--141",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200814",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kurtz:1981:EOA,
author = "Henry A. Kurtz and Nils Elander and Osvaldo Goscinski
and Erland Sangfelt",
title = "On the energy optimization of the {AGP} wavefunction.
{The} ground state of the {Be} atom",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "143--149",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200815",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Yeager:1981:EMM,
author = "Danny L. Yeager and Jeppe Olsen and Poul
J{\o}rgensen",
title = "The evaluation of {MCRPA (MCTDHF)} electronic
excitation energies, oscillator strengths, and
polarizabilities: {Application} to {O$_2$}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "151--162",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200816",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Matsen:1981:PHG,
author = "F. A. Matsen",
title = "Particle-hole {Gel'fand} states and quasidegenerate
perturbation theory",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "163--175",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200817",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mcdowell:1981:AQW,
author = "Keith Mcdowell",
title = "Assessing the quality of a wavefunction using quantum
{Monte Carlo}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "177--181",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200818",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mckeen:1981:SDR,
author = "Leighton E. Mckeen and Everett G. Larson",
title = "Symmetry-decomposed reduced transition operators for
degenerate atomic states --- Their generation and their
utility",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "183--188",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200819",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Curtiss:1981:IMO,
author = "L. A. Curtiss and D. J. Frurip",
title = "Ab initio molecular orbital calculations on hydrogen
bonding in binary water-alcohol mixtures:
{(CH$_3$OH)$_2$(H$_2$O)}, {(CH$_3$OH) (H$_2$O)$_2$},
and {(CF$_3$CH$_2$OH)(H$_2$O)}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "189--197",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200820",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kaufman:1981:ANC,
author = "Joyce J. Kaufman and P. C. Hariharan and Herbert E.
Popkie",
title = "Additional new computational strategies for ab initio
calculations on large molecules",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "199--201",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200821",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Tobin:1981:IMV,
author = "Frank L. Tobin and P. C. Hariharan and Joyce J.
Kaufman and Richard S. Miller",
title = "Ab initio {MODPOT\slash VRDDO\slash MERGE}
calculations on energetic compounds. {I}. {Mechanism}
of initiation of cationic polymerization from
electrostatic molecular potential contour maps",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "203--216",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200822",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Delhalle:1981:PUU,
author = "J. Delhalle and J. M. Andre and L. Piela and L. Z.
Stolarczyk",
title = "Potential use of the unit cell arbitrary concept to
evaluate long-range interactions in quantum mechanical
studies of model polymers",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "217--217",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200823",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Vercauteren:1981:SDO,
author = "D. P. Vercauteren and J. G. Fripiat and J. M.
Andr{\'e}",
title = "Symmetry dilemmas in oxocarbons",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "219--224",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200824",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Simonetta:1981:NPI,
author = "Massimo Simonetta and Mario Raimondi and Gian Franco
Tantardini",
title = "New problems for ab-initio valence bond theory",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "225--229",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200825",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Bredas:1981:NSE,
author = "J. L. Br{\'e}das and R. R. Chance and R. H. Baughman
and R. Silbey",
title = "Nonempirical studies of the electronic properties of
highly conducting polymers",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "231--241",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200826",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Heeger:1981:SMP,
author = "A. J. Heeger and A. G. Macdiarmid",
title = "Semiconducting and metallic polymers: {From} quantum
chemistry to new technology",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "243--249",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200827",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Cederbaum:1981:MVC,
author = "L. S. Cederbaum and H. K{\"o}ppel and W. Domcke",
title = "Multimode vibronic coupling effects in molecules",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "251--267",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200828",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pople:1981:MOS,
author = "J. A. Pople and H. B. Schlegel and R. Krishnan and D.
J. Defrees and J. S. Binkley and M. J. Frisch and
R. A. Whiteside and R. F. Hout and W. J. Hehre",
title = "Molecular orbital studies of vibrational frequencies",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "269--278",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200829",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Mezey:1981:IIE,
author = "Paul G. Mezey",
title = "The isoelectronic and isoprotonic energy hypersurface
and the topology of the nuclear charge space",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "279--285",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200830",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Jones:1981:CGFb,
author = "Herbert W. Jones",
title = "Computer-generated formulas for hybrid integrals over
{Slater}-type orbitals",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "287--291",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200831",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kiang:1981:PTM,
author = "Yuan-Sun Kiang",
title = "Partition technique and molecular graph theory",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "293--304",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200832",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sun:1981:LAM,
author = "Chia-Chung Sun and Bei-Foo Li and Au-Chin Tang",
title = "{Lie} algebra and molecular shell model. {II}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "305--320",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200833",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kim:1981:GTM,
author = "Shoon K. Kim",
title = "A general theory of matrix transformation and its
application to quantum mechanical problems",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "321--329",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200834",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Jordan:1981:RDE,
author = "Kenneth D. Jordan",
title = "Recent developments in electron-molecule scattering",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "331--340",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200835",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Valone:1981:DEA,
author = "Steven M. Valone and Devarajan Thirumalai and Donald
G. Truhlar",
title = "Dispersion-equation approach to obtaining complex
optical potentials for electron scattering",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "341--353",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200836",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Nicolaides:1981:TCR,
author = "C. A. Nicolaides and Y. Komninos and Th. Mercouris",
title = "Theory and calculation of resonances using complex
coordinates",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "355--367",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200837",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Folland:1981:DDM,
author = "N. O. Folland",
title = "Dynamical derivation of microscopic stress tensors",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "369--379",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200838",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Buchler:1981:PCP,
author = "J. Robert Buchler and Manuel Barranco",
title = "Phase-coexistence in partially degenerate nuclear
matter",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "381--384",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200839",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Tai:1981:EOE,
author = "Chin Chui Tai and Geoffrey Hunter",
title = "An exact one-electron model of atomic structure: {The}
helium atom ground state",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "385--385",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200840",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Csavinszky:1981:ISS,
author = "P. Csavinszky",
title = "Introduction of the shell structure with gradient
expansion corrections into the {Thomas--Fermi--Dirac}
energy density functional for neutral atoms",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "387--391",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200841",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Thakkar:1981:EED,
author = "Ajit J. Thakkar and Nancy J. Moore",
title = "Electronic extracule densities",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "393--400",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200842",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Leite:1981:VCM,
author = "Jos{\'e} R. Leite and Adalberto Fazzio and Marco A. P.
Lima and A. M. Dias and Abel Rosato and E. Segre",
title = "The variational cellular method for quantum mechanical
applications: {Calculations} of the ground and excited
states of {F$_2$} and {Ne$_2$} molecules",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "401--408",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200843",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Donnelly:1981:ADM,
author = "Robert A. Donnelly",
title = "An approximate density matrix energy functional",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "409--417",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200844",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{El-Issa:1981:GFM,
author = "B. D. El-Issa",
title = "{Green}'s functions in multiple scattering theory",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "419--428",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200845",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Castro:1981:BMT,
author = "Miguel Castro and Jaime Keller and Pilar Mareca",
title = "Bonding in the {MO$_2$} transition-metal diatomic
molecule",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "429--435",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200846",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Schulman:1981:TKA,
author = "Joel N. Schulman and John D. Dow",
title = "On the theory of the {KVV} {Auger} spectrum of {Li}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "437--443",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200847",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Tsukada:1981:ESV,
author = "Masaru Tsukada and Toshiharu Hoshino",
title = "Electronic structure of vacancy and chemisorptive bond
on {Si(111)} surface by the {DV--X$\alpha$} cluster
calculation",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "445--455",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200848",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Brescansin:1981:MXT,
author = "Luiz M. Brescansin and A. Fazzio",
title = "{MS--X$\alpha$}: {Treatment} for native defects in
{GaSb}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "457--457",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200849",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Brener:1981:MEA,
author = "N. E. Brener and J. L. Fry and R. A. Johnson",
title = "Matrix elements in the analytic tetrahedron method",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "459--468",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200850",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Sankey:1981:EEF,
author = "Otto F. Sankey and Roland E. Allen and John D. Dow",
title = "Effects of the environment on {Frenkel} core-exciton
energies",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "469--476",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200851",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Avery:1981:TID,
author = "John Avery and Per-Johan {\O}rmen and Donald Mullen",
title = "Transferable integrals in a deformation density
approach to crystal orbital calculations. {VII}.
{Crystal} field theory using measured densities and
potentials",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "477--486",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200852",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kunz:1981:PNB,
author = "A. Barry Kunz",
title = "Properties of narrow band insulators",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "487--498",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200853",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Pattnaik:1981:UAE,
author = "P. C. Pattnaik and J. L. Fry and N. E. Brener and G.
Fletcher",
title = "Use of {ATM} in evaluating spin-density",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "499--505",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200854",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Kuivalainen:1981:MPM,
author = "P. Kuivalainen and J. Sinkkonen and T. Stubb",
title = "Magnetic polarons in magnetic semiconductors",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "507--519",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200855",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Beck:1981:ILC,
author = "Donald R. Beck",
title = "On the incorporation of local correlation effects into
ionic solids",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "521--538",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200856",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Fletcher:1981:HTS,
author = "G. Fletcher",
title = "High-temperature superconductivity in {CdS}: {A}
theoretical investigation",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "539--544",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200857",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Little:1981:CDE,
author = "W. A. Little",
title = "Criteria for the design of an excitonic
superconductor",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "545--554",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200858",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Rives:1981:NHO,
author = "A. B. Rives and F. Weinhold",
title = "Natural hybrid orbitals: ab initio {SCF} and {CI}
results for {CO} and {NiCO}",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "555--555",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200859",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Anonymous:1981:SSM,
author = "Anonymous",
title = "Subsymposium on scattering by many-body systems and
related computational methods",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "557--557",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200860",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Linderberg:1981:MSM,
author = "Jan Linderberg",
title = "Multiple surface molecular motion: {A} $t$-matrix
approach",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "559--581",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200861",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Wardlaw:1981:SDT,
author = "David Wardlaw and Paul Brumer",
title = "State densities and time delay in molecular
collisions",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "583--594",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200862",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and Solid-State Theory, Collision
Phenomena, and Computational Quantum Chemistry.",
acknowledgement = ack-nhfb,
ajournal = "Int. J. Quantum Chem.",
fjournal = "International Journal of Quantum Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0020-7608/",
onlinedate = "19 Jun 2009",
}
@Article{Nalewajski:1981:NKF,
author = "Roman F. Nalewajski and Roman Pastewski",
title = "Normalized kinetic field potentials for the
atom-diatom reactions. {Testing} the collinear
surfaces",
journal = j-IJQC,
volume = "20",
number = "S15",
pages = "595--610",
day = "8--14",
month = mar,
year = "1981",
CODEN = "IJQCB2",
DOI = "https://doi.org/10.1002/qua.560200863",
ISSN = "0020-7608 (print), 1097-461X (electronic)",
ISSN-L = "0020-7608",
bibdate = "Tue Oct 11 14:34:09 MDT 2011",
bibsource = "https://www.math.utah.edu/pub/tex/bib/ijqc1980.bib",
note = "Supplement: Proceedings of the International Symposium
on Atomic, Molecular, and So