STABILITY CONDITIONS FOR SOLUTIONS OF HALF-PROJECTED HARTREE-FOCK SCHEME - LITHIUM-HYDRIDE GROUND-STATE

被引：17

作者：

SMEYERS, YG ^{[1
]}

DELGADOBARRIO, G ^{[1
]}

机构：

[1] CSIC,MADRID,SPAIN

来源：

PHYSICAL REVIEW A | 1977年 / 15卷 / 04期

关键词：

D O I：

10.1103/PhysRevA.15.1359

中图分类号：

O43 [光学];

学科分类号：

070207 ; 0803 ;

摘要：

引用

页码：1359 / 1362

页数：4

共 19 条

[1] STABILITY OF HARTREE-FOCK STATES [J].

ADAMS, WH .

PHYSICAL REVIEW, 1962, 127 (05) :1650-&

[2] STABILITY CONDITIONS FOR SOLUTIONS OF HARTREE-FOCK EQUATIONS FOR ATOMIC AND MOLECULAR SYSTEMS .5. NONANALYTIC BEHAVIOR OF BROKEN-SYMMETRY SOLUTIONS AT BRANCHING POINT [J].

CIZEK, J ;

PALDUS, J .

PHYSICAL REVIEW A, 1971, 3 (02) :525-&

[3]

CIZEK J, 1970, J CHEM PHYS, V53, P821, DOI 10.1063/1.1674065

[4]

CIZEK J, 1967, J CHEM PHYS, V47, P3976

[5] HALF-PROJECTED HARTREE-FOCK METHOD .2. RESULTS FOR SOME SMALL MOLECULES AND SOME SYMMETRY CONSIDERATIONS [J].

COX, PA ;

WOOD, MH .

THEORETICA CHIMICA ACTA, 1976, 41 (04) :279-285

[6] HALF-PROJECTED HARTREE-FOCK METHOD .1. EIGENVALUE FORMULATION AND SIMPLE APPLICATIONS [J].

COX, PA ;

WOOD, MH .

THEORETICA CHIMICA ACTA, 1976, 41 (04) :269-278

[7] DEFORMED HARTREE-FOCK SOLUTIONS FOR ATOMS .3. CONVERGENT ITERATIVE PROCESS AND RESULTS FOR O-- [J].

DELGADOBARRIO, G ;

PRAT, RF .

PHYSICAL REVIEW A, 1975, 12 (06) :2288-2297

[8] HARTREE-FOCK THEORY - SLATER DETERMINANTS OF MINIMUM ENERGY [J].

KAPLAN, TA ;

KLEINER, WH .

PHYSICAL REVIEW, 1967, 156 (01) :1-&

[9]

LEFEBVRE R, 1967, INT J QUANTUM CHEM, V1, P441

[10] Stability Conditions for the Solutions of the Hartree-Fock Equations for Atomic and Molecular Systems. VI. Singlet-Type Instabilities and Charge-Density-Wave Hartree-Fock Solutions for Cyclic Polyenes [J].

Paldus, J. ;

Cizek, J. .

PHYSICAL REVIEW A-GENERAL PHYSICS, 1970, 2 (06) :2268-2283

← 1 2 →