THE EFFECTS OF BASIS SET QUALITY AND CONFIGURATION MIXING IN ABINITIO CALCULATIONS OF THE IONIZATION-POTENTIALS OF THE NITROGEN MOLECULE

被引：32

作者：

ERMLER, WC ^{[1
]}

MCLEAN, AD ^{[1
]}

机构：

[1] IBM CORP, RES LAB, SAN JOSE, CA 95193 USA

来源：

JOURNAL OF CHEMICAL PHYSICS | 1980年 / 73卷 / 05期

关键词：

D O I：

10.1063/1.440379

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：2297 / 2303

页数：7

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