MOLECULAR CALCULATIONS .2. METHODS OF APPROXIMATION OF MOLECULAR INTEGRALS

被引：44

作者：

ELLISON, FO

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1955年 / 23卷 / 12期

关键词：

D O I：

10.1063/1.1741880

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

引用

收藏

页码：2358 / 2365

页数：8

相关论文

共 30 条

[1] APPROXIMATE INTEGRAL EVALUATIONS USED IN THE MOLECULAR QUANTUM MECHANICS OF NONLINEAR MOLECULES
BARKER, RS
EYRING, H
[J]. JOURNAL OF CHEMICAL PHYSICS, 1954, 22 (12) : 2072 - 2077
[2] EVALUATION OF SOME ELECTRON REPULSION INTEGRALS NEEDED IN MOLECULAR QUANTUM MECHANICS .2. USE OF THE NEUMANN EXPANSION IN EVALUATION OF 2 ELECTRON 3-CENTER REPULSION INTEGRALS
BARKER, RS
EYRING, H
[J]. JOURNAL OF CHEMICAL PHYSICS, 1954, 22 (01) : 114 - 119
[3] A STUDY OF 3-CENTER INTEGRALS USEFUL IN MOLECULAR QUANTUM MECHANICS
BARKER, RS
EYRING, H
[J]. JOURNAL OF CHEMICAL PHYSICS, 1953, 21 (05) : 912 - 917
[4] A quantum mechanics treatment of the water molecule
Coolidge, AS
[J]. PHYSICAL REVIEW, 1932, 42 (02): : 189 - 209
[5] Coulson CA, 1937, P CAMB PHILOS SOC, V33, P104
[6] Coulson CA, 1935, P CAMB PHILOS SOC, V31, P244
[7] MOLECULAR CALCULATIONS .1. LCAO MO SELF-CONSISTENT FIELD TREATMENT OF THE GROUND STATE OF H2O
ELLISON, FO
SHULL, H
[J]. JOURNAL OF CHEMICAL PHYSICS, 1955, 23 (12) : 2348 - 2357
[8] HIRSCHFELDER, 1936, J CHEM PHYS, V4, P121
[9] HIRSCHFELDER, 1937, J CHEM PHYS, V5, P695
[10] Integrals required for computing the energy of H-3 and of H-3(+)
Hirschfelder, JO
Weygandt, CN
[J]. JOURNAL OF CHEMICAL PHYSICS, 1938, 6 (12) : 806 - 810