PNO-CI (PAIR NATURAL ORBITAL CONFIGURATION INTERACTION) AND CEPA-PNO (COUPLED ELECTRON PAIR APPROXIMATION WITH PAIR NATURAL ORBITALS) CALCULATIONS OF MOLECULAR SYSTEMS .1. OUTLINE OF METHOD FOR CLOSED-SHELL STATES

被引：292

作者：

AHLRICHS, R

LISCHKA, H

STAEMMLER, V

KUTZELNIGG, W

机构：

[1] UNIV KARLSRUHE, INST PHYS CHEM, KARLSRUHE, FED REP GER

[2] RUHR UNIV, LEHRSTUH THEORET CHEM, BOCHUM, FED REP GER

来源：

JOURNAL OF CHEMICAL PHYSICS | 1975年 / 62卷 / 04期

关键词：

D O I：

10.1063/1.430637

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：1225 / 1234

页数：10

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