A QUADRATICALLY CONVERGENT MCSCF METHOD FOR THE SIMULTANEOUS-OPTIMIZATION OF SEVERAL STATES

被引：490

作者：

WERNER, HJ ^{[1
]}

MEYER, W ^{[1
]}

机构：

[1] UNIV KAISERSLAUTERN,FACHBEREICH CHEM,D-6750 KAISERSLAUTERN,FED REP GER

来源：

JOURNAL OF CHEMICAL PHYSICS | 1981年 / 74卷 / 10期

关键词：

D O I：

10.1063/1.440892

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：5794 / 5801

页数：8

共 29 条

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