Relativistic quantum mechanics of many-electron systems

被引:21
作者
Ishikawa, Y
Vilkas, MJ
机构
[1] Univ Puerto Rico, Dept Chem, San Juan, PR 00931 USA
[2] Univ Puerto Rico, Chem Phys Program, San Juan, PR 00931 USA
来源
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM | 2001年 / 573卷
关键词
Dirac-Fock self-consistent field theory; relativistic many-body perturbation theory; Gaussian spinors;
D O I
10.1016/S0166-1280(01)00540-1
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
The present review surveys the single- and multiconfiguration matrix Dirac-Fock self-consistent field methods and their many-body theoretical refinements developed in our group over the last decade. Implementation with analytic basis sets of Gaussian spinors is discussed in detail. (C) 2001 Elsevier Science B.V. All rights reserved.
引用
收藏
页码:139 / 169
页数:31
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