STATIC HIGHER POLARIZABILITIES OF H-2

被引:22
作者
BISHOP, DM
CHEUNG, LM
机构
[1] Department of Chemistry, University of Ottawa, Ottawa
来源
PHYSICAL REVIEW A | 1979年 / 20卷 / 04期
关键词
D O I
10.1103/PhysRevA.20.1310
中图分类号
O43 [光学];
学科分类号
070207 ; 0803 ;
摘要
The higher polarizabilities zzzz, Bzz:zz, and Czz:zz have been calculated for H2 using different-sized basis sets composed of James-Coolidge basis functions. The most-accurate wave functions led to the values 674, -89.8, and 5.97 a.u., respectively. It is emphasized that these properties are critically sensitive to wave-function quality. © 1979 The American Physical Society.
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页码:1310 / 1312
页数:3
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