COMPARISON OF SCF-X-ALPHA-SW AND CNDO-BW CALCULATIONS ON S4N4H4 AND F4S4N4

被引：15

作者：

FOTI, AE ^{[1
]}

SMITH, VH ^{[1
]}

KISHNER, S ^{[1
]}

GOPINATHAN, MS ^{[1
]}

WHITEHEAD, MA ^{[1
]}

机构：

[1] MCGILL UNIV,DEPT CHEM,MONTREAL H3A 2K6,QUEBEC,CANADA

来源：

MOLECULAR PHYSICS | 1978年 / 35卷 / 01期

关键词：

D O I：

10.1080/00268977800100081

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：111 / 127

页数：17

共 51 条

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[7]

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[9] TOTAL ENERGY IN MULTIPLE-SCATTERING FORMALISM - APPLICATION TO WATER MOLECULE [J].

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[10]

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