TRANSITION-METAL LIGAND BONDING .2.

被引：110

作者：

BAUSCHLICHER, CW

机构：

来源：

JOURNAL OF CHEMICAL PHYSICS | 1986年 / 84卷 / 01期

关键词：

D O I：

10.1063/1.450179

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：260 / 267

页数：8

共 24 条

[11]

Huber KP.., 1979, MOL SPECTRA MOL STRU, DOI [DOI 10.1007/978-1-4757-0961-2, DOI 10.1021/ol101485n]

[12] THE CRYSTAL STRUCTURE OF NICKEL CARBONYL, NI(CO)4 [J].

LADELL, J ;

POST, B ;

FANKUCHEN, I .

ACTA CRYSTALLOGRAPHICA, 1952, 5 (06) :795-800

[13] GENERAL 2ND-ORDER MCSCF THEORY FOR LARGE CL EXPANSIONS [J].

LENGSFIELD, BH .

JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (08) :4073-4083

[14]

LISCHKA H, 1981, INT J QUANTUM CHEM, P91

[15] THE ALCHEMY CONFIGURATION-INTERACTION METHOD .1. THE SYMBOLIC MATRIX-METHOD FOR DETERMINING ELEMENTS OF MATRIX OPERATORS [J].

LIU, B ;

YOSHIMINE, M .

JOURNAL OF CHEMICAL PHYSICS, 1981, 74 (01) :612-616

[16] A COMPLETE ACTIVE SPACE SCF METHOD (CASSCF) USING A DENSITY-MATRIX FORMULATED SUPER-CI APPROACH [J].

ROOS, BO ;

TAYLOR, PR ;

SIEGBAHN, PEM .

CHEMICAL PHYSICS, 1980, 48 (02) :157-173

[17]

ROOS BO, 1980, INT J QUANTUM CHEM, V17, P175

[18] THE SHAPE-DRIVEN GRAPHICAL UNITARY-GROUP APPROACH TO THE ELECTRON CORRELATION-PROBLEM - APPLICATION TO THE ETHYLENE MOLECULE [J].

SAXE, P ;

FOX, DJ ;

SCHAEFER, HF ;

HANDY, NC .

JOURNAL OF CHEMICAL PHYSICS, 1982, 77 (11) :5584-5592

[19] COMPARISON OF THE SUPER-CL AND THE NEWTON-RAPHSON SCHEME IN THE COMPLETE ACTIVE SPACE SCF METHOD [J].

SIEGBAHN, P ;

HEIBERG, A ;

ROOS, B ;

LEVY, B .

PHYSICA SCRIPTA, 1980, 21 (3-4) :323-327

[20] GENERALIZATIONS OF THE DIRECT CL METHOD BASED ON THE GRAPHICAL UNITARY GROUP-APPROACH .2. SINGLE AND DOUBLE REPLACEMENTS FROM ANY SET OF REFERENCE CONFIGURATIONS [J].

SIEGBAHN, PEM .

JOURNAL OF CHEMICAL PHYSICS, 1980, 72 (03) :1647-1656

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