CALCULATION OF THE 4TH-ORDER TRIPLE-EXCITATION CONTRIBUTION TO MB RSPT BY USING SPATIAL SYMMETRY PROPERTIES OF MOLECULES

被引：65

作者：

NOGA, J

机构：

来源：

COMPUTER PHYSICS COMMUNICATIONS | 1983年 / 29卷 / 02期

关键词：

D O I：

10.1016/0010-4655(83)90067-X

中图分类号：

TP39 [计算机的应用];

学科分类号：

081203 ; 0835 ;

摘要：

引用

收藏

页码：117 / 124

页数：8

相关论文

共 15 条

[11]

URBAN M, UNPUB POLYCOR

[12] DIAGRAMMATIC MANY-BODY PERTURBATION EXPANSION FOR ATOMS AND MOLECULES .3. 3RD-ORDER RING ENERGIES [J].

WILSON, S .

COMPUTER PHYSICS COMMUNICATIONS, 1978, 14 (1-2) :91-98

[13] DIAGRAMMATIC MANY-BODY PERTURBATION EXPANSION FOR ATOMS AND MOLECULES .5. 4TH-ORDER LINKED DIAGRAMS INVOLVING TRIPLY-EXCITED STATES [J].

WILSON, S ;

SAUNDERS, VR .

COMPUTER PHYSICS COMMUNICATIONS, 1980, 19 (03) :293-297

[14] ON THE CONTRIBUTION OF TRIPLY-EXCITED AND QUADRUPLY-EXCITED CONFIGURATIONS TO ELECTRON CORRELATION ENERGIES IN CLOSED-SHELL SYSTEMS [J].

WILSON, S ;

GUEST, MF .

MOLECULAR PHYSICS, 1981, 43 (06) :1331-1345

[15] DIAGRAMMATIC PERTURBATION-THEORY - CONTRIBUTION OF TRIPLY EXCITED-STATES TO CORRELATION ENERGIES [J].

WILSON, S .

JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1979, 12 (22) :L657-L660