ONE-ELECTRON 3-CENTER INTEGRALS CALCULATION

被引：0

作者：

BOUSCASSE, L ^{[1
]}

LORIDAN, G ^{[1
]}

机构：

[1] UNIV DROIT ECON & SCI AIX MARSEILLE,CNRS,LAB 126,13397 MARSEILLE,FRANCE

来源：

JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE | 1975年 / 72卷 / 04期

关键词：

D O I：

10.1051/jcp/1975720537

中图分类号：

Q5 [生物化学]; Q7 [分子生物学];

学科分类号：

071010 ; 081704 ;

摘要：

引用

页码：537 / 538

页数：2

共 50 条

[1] STUDY OF MOLECULAR INTEGRALS .2. 3-CENTER ONE-ELECTRON AND 2-ELECTRON INTEGRALS
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[J]. JOURNAL OF CHEMICAL PHYSICS, 1960, 33 (04): : 1022 - 1027
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[6] Calculation of 3-center one-electron integrals ⟨AB|rC-1⟩ and coulomb repulsion matrix elements ⟨AB|CC′⟩ in an exponential type spherical AO basis
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[7] 3-CENTER INTEGRALS CALCULATION FOR COMPUTATIONS OF CHEMICAL-SHIFTS
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[8] ANALYTICAL SOLUTION OF MOLECULAR 3-CENTER ONE-ELECTRON INTEGRALS OVER SLATER-TYPE ATOMIC ORBITALS AND REGULAR SOLID SPHERICAL HARMONICS
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[J]. THEORETICA CHIMICA ACTA, 1974, 34 (04): : 251 - 262
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[10] EVALUATION OF CERTAIN 3-CENTER INTEGRALS
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