FORCE CONSTANTS IN HARTREE-FOCK THEORY

被引:16
作者
FREED, KF
机构
关键词
D O I
10.1063/1.1672674
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:253 / &
相关论文
共 27 条
[1]  
Brown WB., 1958, P CAMBRIDGE PHIL SOC, V54, P251
[2]   GEOMETRY OF MOLECULES .3. F2O LI2O FOH LIOH [J].
BUENKER, RJ ;
PEYERIMHOFF, SD .
JOURNAL OF CHEMICAL PHYSICS, 1966, 45 (10) :3682-+
[3]   ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .6A. HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR GROUND STATES OF FIRST-ROW HYDRIDES AH [J].
CADE, PE ;
HUO, WM .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (02) :614-&
[4]   PERTURBED HARTREE-FOCK THEORY .I. DIAGRAMMATIC DOUBLE-PERTURBATION ANALYSIS [J].
CAVES, TC ;
KARPLUS, M .
JOURNAL OF CHEMICAL PHYSICS, 1969, 50 (09) :3649-&
[5]   MANY-BODY CALCULATION OF ATOMIC POLARIZABILITY - RELATION TO HARTREE-FOCK THEORY [J].
CHANG, ES ;
PU, RT ;
DAS, TP .
PHYSICAL REVIEW, 1968, 174 (01) :16-&
[6]   Forces in molecules [J].
Feynman, RP .
PHYSICAL REVIEW, 1939, 56 (04) :340-343
[7]   INTERNAL ROTATION BARRIERS FOR HYDRAZINE AND HYDROXYLAMINE FROM AB INITIO LCAU-MO-SCF WAVEFUNCTIONS [J].
FINK, WH ;
PAN, DC ;
ALLEN, LC .
JOURNAL OF CHEMICAL PHYSICS, 1967, 47 (03) :895-&
[8]   Geometry and barriers to internal rotation in Hartree-Fock theory [J].
Freed, K. F. .
CHEMICAL PHYSICS LETTERS, 1968, 2 (04) :255-256
[9]   GENERALIZED PERTURBATION THEORY AND ITS APPLICATION TO PROBLEM OF DESCRIPTION OF ELECTRON CORRELATION IN ATOMS AND MOLECULES [J].
FREED, KF .
PHYSICAL REVIEW, 1968, 173 (01) :24-&
[10]  
FREED KF, UNPUBLISHED WORK