PROJECTION OF DIATOMIC DIFFERENTIAL OVERLAP - LEAST-SQUARES PROJECTION OF 2-CENTER DISTRIBUTIONS ONTO ONE-CENTER FUNCTIONS

被引：30

作者：

NEWTON, MD

OSTLUND, NS

POPLE, JA

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1968年 / 49卷 / 11期

关键词：

D O I：

10.1063/1.1670022

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：5192 / +

页数：1

共 35 条

[1] ONE-CENTER COULOMB, 2-CENTER HYBRID, AND 2-CENTER COULOMB INTEGRALS OVER STP FUNCTIONS
ENGLAND, W
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1972, 6 (03) : 509 - &
[2] CALCULATION OF ONE-CENTER AND 2-CENTER MOLECULAR INTEGRALS OF SLATER FUNCTIONS IN ANALYTICAL FORM
ZIMONT, SL
MARYASHK.NY
DOKLADY AKADEMII NAUK SSSR, 1972, 205 (05): : 1059 - &
[3] ANALYTICAL EVALUATION OF ONE-CENTER AND 2-CENTER COULOMB AND 2-CENTER HYBRID INTEGRALS FOR SLATER-TYPE ORBITALS
GUSEINOV, II
JOURNAL OF CHEMICAL PHYSICS, 1977, 67 (08): : 3837 - 3839
[4] ANGULAR-MOMENTUM PROJECTION IN 2-CENTER MODEL BY PROJECTION OF HILBERT SPACES
SELIGMAN, TH
ZAHN, W
HELVETICA PHYSICA ACTA, 1976, 49 (02): : 217 - 226
[5] ALGEBRAIC APPROACH TO ONE-CENTER AND 2-CENTER HARMONIC-OSCILLATOR INTEGRALS
MORALES, J
PALMA, A
BERRONDO, M
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1984, : 57 - 60
[6] CLOSED FORMULAS FOR ONE-CENTER AND 2-CENTER HARMONIC-OSCILLATOR INTEGRALS
PALMA, A
SANDOVAL, L
MORALES, J
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1987, : 729 - 735
[7] ANALYTICAL EVALUATION OF ONE-CENTER AND 2-CENTER COULOMB AND 2-CENTER HYBRID INTEGRALS FOR SLATER-TYPE ORBITALS .2.
GUSEINOV, II
JOURNAL OF CHEMICAL PHYSICS, 1989, 90 (06): : 3196 - 3197
[8] A SIMPLE APPROXIMATION FOR INVERSE DISTANCE WITH APPLICATION TO THE ONE-CENTER AND 2-CENTER COULOMB INTEGRALS
MOHAMMAD, SN
JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (05): : 2616 - 2618
[9] QUANTITATIVE-DETERMINATION OF ONE-CENTER VS 2-CENTER THERMAL EPIMERIZATION OF A CYCLOPROPANE
GARIN, DL
TETRAHEDRON LETTERS, 1977, (35) : 3035 - 3036
[10] PROCEDURES FOR ANALYTICAL AND NUMERICAL-CALCULATION OF COULOMBIC ONE-CENTER AND 2-CENTER INTEGRALS
HANSEN, JP
DUBOIS, A
COMPUTER PHYSICS COMMUNICATIONS, 1992, 67 (03) : 456 - 464

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