Last update: Sun Jun 2 02:01:03 MDT 2019
Top |
Symbols |
Math |
A |
B |
C |
D |
E |
F |
G |
H |
I |
J |
K |
L |
M |
N |
O |
P |
Q |
R |
S |
T |
U |
V |
W |
X |
Y |
Z
BibTeX entry
@Article{Bachs:1994:OSC,
author = "M. Bachs and F. J. Luque and Modesto Orozco",
title = "Optimization of solute cavities and {van der Waals}
parameters in ab initio {MST-SCRF} calculations of
neutral molecules",
journal = j-J-COMPUT-CHEM,
volume = "15",
number = "4",
pages = "446--454",
month = apr,
year = "1994",
CODEN = "JCCHDD",
DOI = "https://doi.org/10.1002/jcc.540150408",
ISSN = "0192-8651 (print), 1096-987X (electronic)",
ISSN-L = "0192-8651",
bibdate = "Thu Nov 29 14:54:25 MST 2012",
bibsource = "http://www.interscience.wiley.com/jpages/0192-8651;
http://www.math.utah.edu/pub/tex/bib/jcomputchem1990.bib",
acknowledgement = ack-nhfb,
fjournal = "Journal of Computational Chemistry",
journal-URL = "http://www.interscience.wiley.com/jpages/0192-8651",
onlinedate = "7 Sep 2004",
}
Related entries
- Bachs, M.,
15(8)847,
16(5)563,
17(7)806
- cavity,
12(8)918,
13(2)115,
13(2)229,
14(3)253,
20(8)781,
20(16)1693
- Luque, F. J.,
11(4)416,
11(8)909,
14(5)587,
14(7)799,
14(8)881,
14(12)1498,
15(1)12,
15(8)847,
16(5)563,
17(7)806
- molecule,
11(1)64,
11(1)67,
11(1)82,
11(1)88,
11(3)396,
11(4)440,
11(5)548,
11(5)629,
11(6)680,
11(7)765,
12(1)17,
12(1)91,
12(2)172,
12(3)342,
12(4)469,
12(4)487,
12(5)546,
12(6)690,
12(8)1033,
13(2)229,
13(3)371,
13(5)595,
13(6)675,
13(7)838,
13(7)901,
13(10)1171,
14(1)89,
14(2)138,
14(3)253,
14(4)478,
14(6)691,
14(9)1050,
14(9)1066,
14(10)1172,
14(10)1240,
14(11)1407,
14(12)1440,
14(12)1482,
14(12)1498,
15(1)80,
15(2)144,
15(2)162,
15(4)377,
15(4)424,
15(4)466,
15(7)733,
15(9)937,
15(10)1121,
15(10)1139,
15(12)1437,
16(5)576,
16(6)743,
16(8)923,
16(8)1011,
16(8)1038,
16(11)1405,
16(11)1420,
16(12)1483,
17(1)19,
17(7)864,
17(7)910,
17(9)1171,
17(11)1352,
17(14)1645,
18(1)1,
18(2)277,
18(3)343,
18(5)638,
18(6)826,
18(10)1264,
18(11)1344,
18(11)1407,
18(12)1473,
18(12)1496,
18(13)1609,
18(13)1656,
18(16)2075,
19(1)94,
19(5)524,
19(8)893,
19(11)1205,
19(11)1315,
19(12)1421,
19(13)1526,
19(14)1663,
19(15)1736,
19(16)1834,
19(16)1899,
20(1)155,
20(4)443,
20(6)610,
20(8)760,
20(8)799,
20(10)1028,
20(11)1186
- MST-SCRF,
15(8)847
- neutral,
13(2)229,
14(1)89,
14(12)1498,
17(1)30,
17(7)806,
19(8)820,
20(2)200,
20(8)886
- optimization,
11(1)67,
12(2)167,
12(3)301,
12(3)320,
12(3)376,
12(5)606,
12(8)923,
13(2)240,
13(9)1066,
14(1)37,
14(7)790,
14(9)1085,
14(11)1301,
14(11)1339,
15(1)54,
15(7)733,
16(6)729,
16(8)923,
16(9)1170,
17(4)386,
18(1)45,
18(2)151,
18(7)874,
18(8)1079,
18(9)1222,
18(9)1233,
18(11)1344,
18(12)1473,
18(16)2040,
19(3)334,
19(4)404,
19(6)647,
19(7)797,
19(9)1110,
19(13)1445,
19(13)1505,
19(16)1877,
20(4)396,
20(4)455,
20(7)688,
20(10)1009,
20(13)1354,
20(16)1740,
20(16)1752
- Orozco, Modesto,
12(6)664,
14(5)587,
14(8)881,
14(10)1240,
14(12)1498,
15(1)12,
15(8)847,
16(5)563,
17(7)806,
18(8)980,
19(8)866,
20(7)665,
20(9)937
- parameter,
12(3)320,
12(6)664,
12(8)934,
12(8)970,
12(8)1033,
13(1)57,
13(8)963,
13(8)971,
14(1)37,
14(8)995,
14(9)1077,
14(11)1301,
16(1)56,
16(2)188,
16(3)311,
16(5)586,
16(5)620,
16(8)984,
16(9)1164,
16(10)1210,
17(4)386,
17(4)450,
17(5)520,
17(8)940,
18(2)211,
18(7)849,
18(14)1720,
19(2)215,
19(3)334,
20(4)428,
20(4)455,
20(6)563,
20(12)1220,
20(12)1281
- SCRF, MST-,
15(8)847
- solute,
12(3)301,
13(4)468,
16(6)743,
17(7)806,
18(6)812,
18(10)1320,
18(13)1656
- van,
12(5)611,
12(6)705,
14(9)1077,
15(5)507,
15(7)719,
17(5)520,
18(2)182,
18(2)211,
18(11)1365,
18(13)1682,
19(7)797,
19(8)820,
19(9)1110,
20(1)12,
20(8)857
- Waals,
12(5)611,
12(6)705,
14(9)1077,
15(5)507,
15(7)719,
17(5)520,
18(2)182,
18(2)211,
18(11)1365,
18(13)1682,
19(7)797,
19(8)820,
19(9)1110,
20(1)12,
20(8)857