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{Dixon:1994:FGO,
author = "Steven L. Dixon and Peter C. Jurs",
title = "Fast geometry optimization using a modified extended
{H{\"u}ckel} method: {Results} for molecules containing
{H}, {C}, {N}, {O}, and {F}",
journal = j-J-COMPUT-CHEM,
volume = "15",
number = "7",
pages = "733--746",
month = jul,
year = "1994",
CODEN = "JCCHDD",
DOI = "https://doi.org/10.1002/jcc.540150706",
ISSN = "0192-8651 (print), 1096-987X (electronic)",
ISSN-L = "0192-8651",
bibdate = "Thu Nov 29 14:54:26 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
- C,
12(1)52,
12(9)1047,
12(9)1129,
12(9)1157,
13(4)423,
13(8)935,
13(8)997,
16(4)478,
17(7)905,
17(12)1387,
17(14)1624,
18(3)330,
19(2)181,
19(2)189,
19(8)858,
20(8)772,
20(8)845,
20(12)1220,
20(12)1304,
20(13)1412,
20(15)1671
- containing,
11(8)952,
12(5)546,
12(6)751,
16(3)311,
18(14)1720,
19(7)695,
19(13)1456,
19(13)1526
- Dixon, Steven L.,
13(4)492,
14(12)1460
- extended,
11(4)518,
13(8)1004,
16(4)441,
17(4)476
- F,
11(2)265,
12(5)565,
13(2)165,
14(8)913,
16(4)465,
17(7)835,
19(11)1205,
20(1)70,
20(2)284,
20(12)1304
- fast,
13(6)675,
13(8)1022,
14(2)246,
14(3)312,
14(7)867,
15(1)28,
15(2)200,
16(4)414,
16(7)898,
17(7)864,
17(8)976,
17(14)1653,
17(16)1857,
18(4)501,
18(4)569,
18(6)744,
18(8)1036,
18(11)1365,
18(12)1546,
18(14)1729,
18(14)1785,
19(13)1494,
20(4)383,
20(6)586
- geometry,
11(2)265,
11(4)468,
11(4)487,
11(5)654,
12(2)167,
12(3)301,
12(3)376,
12(5)606,
12(8)923,
12(9)1129,
13(1)41,
13(2)142,
13(2)240,
13(5)565,
13(6)675,
13(9)1047,
14(4)484,
14(9)1085,
15(0)x--541,
15(8)820,
16(3)263,
16(6)729,
16(9)1170,
16(12)1483,
17(1)49,
17(2)148,
17(5)553,
17(5)587,
17(16)1804,
18(1)45,
18(12)1473,
19(4)404,
19(16)1877,
20(4)396,
20(7)730,
20(12)1292,
20(16)1752
- H,
11(1)1,
11(5)576,
12(1)139,
12(5)565,
12(6)705,
12(9)1047,
12(10)1237,
13(4)423,
13(6)792,
13(9)1037,
14(3)285,
14(11)1326,
14(12)1491,
15(4)377,
16(4)465,
16(6)768,
16(8)1027,
17(7)905,
17(9)1099,
17(9)1163,
18(1)9,
18(9)1124,
18(9)1167,
18(14)1792,
19(15)1698,
20(9)911,
20(11)1138,
20(12)1220,
20(12)1281,
20(13)1412,
20(13)1432,
20(15)1671
- Jurs, Peter C.,
13(4)492,
14(12)1460
- modified,
12(2)147,
14(8)944,
14(12)1482,
15(2)183,
15(2)200,
15(11)1254,
16(6)667,
16(8)1011,
18(7)955,
18(9)1233,
18(13)1656,
18(13)1682,
19(8)893,
19(13)1456,
19(13)1515,
20(7)704,
20(9)928,
20(10)1049
- 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)446,
15(4)466,
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
- N,
12(7)829,
13(9)1066,
15(9)1013,
15(12)1429,
16(1)131,
17(11)1339,
18(9)1211,
18(16)2093,
20(12)1220,
36(30)2270
- 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(4)446,
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
- result,
13(5)640,
13(7)842,
14(7)775,
14(9)1101,
16(9)1067,
17(10)1245,
18(9)1136,
19(7)769,
19(14)1596,
20(7)655,
20(10)1018,
20(12)1220,
20(14)1587,
20(14)1591