ANALYTIC ENERGY 2ND DERIVATIVES FOR GENERAL MCSCF WAVE-FUNCTIONS

被引：77

作者：

HOFFMANN, MR ^{[1
]}

FOX, DJ ^{[1
]}

GAW, JF ^{[1
]}

OSAMURA, Y ^{[1
]}

YAMAGUCHI, Y ^{[1
]}

GREV, RS ^{[1
]}

FITZGERALD, G ^{[1
]}

SCHAEFER, HF ^{[1
]}

KNOWLES, PJ ^{[1
]}

HANDY, NC ^{[1
]}

机构：

[1] UNIV CAMBRIDGE,DEPT CHEM,CAMBRIDGE CB2 1EW,ENGLAND

来源：

JOURNAL OF CHEMICAL PHYSICS | 1984年 / 80卷 / 06期

关键词：

D O I：

10.1063/1.447061

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：2660 / 2668

页数：9

共 38 条

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