REFINEMENT OF LCAO MO SCF WAVEFUNCTION AND RECALCULATION OF ONE-ELECTRON PROPERTIES FOR FORMALDEHYDE MOLECULE

被引：21

作者：

AUNG, S

PITZER, RM

CHAN, SI

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1966年 / 45卷 / 09期

关键词：

D O I：

10.1063/1.1728135

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：3457 / &

共 8 条

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[7]

PITZER RM, 1964, QCPE2225 QUANT CHEM

[8] GAUSSIAN-TRANSFORM METHOD FOR MOLECULAR INTEGRALS .I. FORMULATION FOR ENERGY INTEGRALS [J].

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