CALCULATION OF ELECTROMAGNETIC PROPERTIES OF THE NOBLE-GASES

被引：51

作者：

BISHOP, DM

CYBULSKI, SM

机构：

[1] Department of Chemistry, University of Ottawa, Ottawa

来源：

CHEMICAL PHYSICS LETTERS | 1993年 / 211卷 / 2-3期

关键词：

D O I：

10.1016/0009-2614(93)85194-S

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 calculation of accurate self-consistent-field values for many of the electric and magnetic properties of the noble gases (He, Ne, Ar, Kr, and Xe) is reported. Because of the large basis sets used, in most cases, these values are superior to those previously given in the literature and, for some properties and species, are the first to be published.

引用

页码：255 / 258

页数：4

共 20 条

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ALMLOF J, MOLECULE 3 VECTORIZE

[2] THE ELECTROSTATIC MODEL OF FIELD GRADIENTS AT NUCLEI - AN APPLICATION TO HYDROGEN-BONDED COMPLEXES OF HCL [J].