AB-INITIO CALCULATIONS OF HARMONIC FORCE CONSTANTS .6. APPLICATION TO SCF WAVEFUNCTIONS

被引：4

作者：

BISHOP, DM

MACIAS, A

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1972年 / 56卷 / 02期

关键词：

D O I：

10.1063/1.1677262

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：999 / &

共 10 条

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[7] FORCE CONSTANTS AND DIPOLE-MOMENT DERIVATIVES OF MOLECULES FROM PERTURBED HARTREE-FOCK CALCULATIONS .2. APPLICATIONS TO LIMITED BASIS-SET SCF-MO WAVEFUNCTIONS [J].

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[8] FORCE CONSTANTS AND DIPOLE-MOMENT DERIVATIVES OF MOLECULES FROM PERTURBED HARTREE-FOCK CALCULATIONS .I. [J].

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[10] CALCULATION OF HARMONIC FORCE CONSTANTS FROM HARTREE-FOCK-ROOTHAAN WAVEFUNCTIONS [J].

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