MANY-BODY PERTURBATION-THEORY APPLIED TO MOLECULES - ANALYSIS AND CORRELATION ENERGY CALCULATION FOR LI-2, N-2, AND H-3

被引：52

作者：

FREEMEN, DL ^{[1
]}

KARPLUS, M ^{[1
]}

机构：

[1] HARVARD UNIV,DEPT CHEM,CAMBRIDGE,MA 02138

来源：

JOURNAL OF CHEMICAL PHYSICS | 1976年 / 64卷 / 06期

关键词：

D O I：

10.1063/1.432518

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

页码：2641 / 2659

页数：19

共 46 条

[1] MANY-BODY PERTURBATION-THEORY APPLIED TO ELECTRON PAIR CORRELATION ENERGIES .1. CLOSED-SHELL FIRST-ROW DIATOMIC HYDRIDES
BARTLETT, RJ
SILVER, DM
[J]. JOURNAL OF CHEMICAL PHYSICS, 1975, 62 (08) : 3258 - 3268
[2] PAIR-CORRELATION ENERGIES IN SODIUM HYDRIDE WITH MANY-BODY PERTURBATION-THEORY
BARTLETT, RJ
SILVER, DM
[J]. PHYSICAL REVIEW A, 1974, 10 (06): : 1927 - 1931
[3] SINGLE PARTICLE ENERGIES IN THE THEORY OF NUCLEAR MATTER
BRUECKNER, KA
GOLDMAN, DT
[J]. PHYSICAL REVIEW, 1960, 117 (01): : 207 - 213
[4] ELECTRONIC STRUCTURE OF DIATOMIC MOLECULES .3. A HARTREE-FOCK WAVEFUNCTIONS AND ENERGY QUANTITIES FOR N2(X1SIGMAG+) AND N2+(X2SIGMAG+A 2PIU B2SIGMAU+) MOLECULAR IONS
CADE, PE
SALES, KD
WAHL, AC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (05) : 1973 - &
[5] CIZEK J, 1966, J CHEM PHYS, V45, P4256
[6] EXTENDED HARTREE-FOCK WAVENFUNCTIONS - OPTIMIZED VALENCE CONFIGURATIONS FOR H2 AND LI2 OPTIMIZED DOUBLE CONFIGURATIONS FOR F2
DAS, G
WAHL, AC
[J]. JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (01) : 87 - &
[7] MANY-BODY GREENS FUNCTIONS FOR FINITE, NONUNIFORM SYSTEMS - APPLICATIONS TO CLOSED SHELL ATOMS
DOLL, JD
REINHARD.WP
[J]. JOURNAL OF CHEMICAL PHYSICS, 1972, 57 (03) : 1169 - &
[8] DOLL JD, 1971, THESIS HARVARD U
[9] MANY-BODY PERTURBATION CALCULATION OF INDIRECT SPIN-SPIN COUPLING CONSTANT IN HD MOLECULE
DUTTA, CM
DUTTA, NC
DAS, TP
[J]. PHYSICAL REVIEW LETTERS, 1970, 25 (25) : 1695 - &
[10] CORRELATION ENERGY CONTRIBUTION TO AMMONIA INVERSION BARRIER
DUTTA, NC
KARPLUS, M
[J]. CHEMICAL PHYSICS LETTERS, 1975, 31 (03) : 455 - 461

← 1 2 3 4 5 →