PROJECTED HARTREE PRODUCT WAVEFUNCTIONS .2. GENERAL CONSIDERATIONS OF YOUNG OPERATORS

被引：40

作者：

GALLUP, GA

机构：

[1] Quantum Theory Project, University of Florida, Gainesville

[2] Department of Chemistry, University of Nebraska, Lincoln

来源：

JOURNAL OF CHEMICAL PHYSICS | 1969年 / 50卷 / 03期

关键词：

D O I：

10.1063/1.1671179

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：

A discussion is given of the forms of two specific and one general Young operator for the irreducible representations of Sn important for fermion space functions. Comparisons are made of the projected Hartree product version of Löwdon's projected Hartree-Fock method with CI calculations.

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页码：1206 / &

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共 31 条

[1] SINGLE DETERMINANT WAVE FUNCTIONS [J].

AMOS, AT ;

HALL, GG .

PROCEEDINGS OF THE ROYAL SOCIETY OF LONDON SERIES A-MATHEMATICAL AND PHYSICAL SCIENCES, 1961, 263 (1312) :483-+

[2] EXTENDED HARTREE-FOCK WAVENFUNCTIONS - OPTIMIZED VALENCE CONFIGURATIONS FOR H2 AND LI2 OPTIMIZED DOUBLE CONFIGURATIONS FOR F2 [J].

DAS, G ;

WAHL, AC .

JOURNAL OF CHEMICAL PHYSICS, 1966, 44 (01) :87-&

[3] PROJECTED HARTREE PRODUCT WAVEFUNCTIONS [J].

GALLUP, GA .

JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (04) :1752-&

[4] OPTIMUM-MULTICONFIGURATION SELF-CONSISTENT-FIELD EQUATIONS [J].

GILBERT, TL .

JOURNAL OF CHEMICAL PHYSICS, 1965, 43 (10) :S248-+

[5] MAGNETIC HYPERFINE STRUCTURE OF LITHIUM [J].

GODDARD, WA .

PHYSICAL REVIEW, 1967, 157 (01) :93-&

[6] IMPROVED QUANTUM THEORY OF MANY-ELECTRON SYSTEMS .3. GF METHOD [J].

GODDARD, WA .

JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (01) :450-&

[7] WAVEFUNCTIONS AND CORRELATION ENERGIES FOR 2-3- AND 4-ELECTRON ATOMS [J].

GODDARD, WA .

JOURNAL OF CHEMICAL PHYSICS, 1968, 48 (03) :1008-&

[8] IMPROVED QUANTUM THEORY OF MANY-ELECTRON SYSTEMS .I. CONSTRUCTION OF EIGENFUNCTIONS OF S2 WHICH SATISFY PAULIS PRINCIPLE [J].

GODDARD, WA .

PHYSICAL REVIEW, 1967, 157 (01) :73-&

[9] IMPROVED QUANTUM THEORY OF MANY-ELECTRON SYSTEMS .2. BASIC METHOD [J].

GODDARD, WA .

PHYSICAL REVIEW, 1967, 157 (01) :81-&

[10]

HARRIS FE, 1966, ADV QUANTUM CHEM, V3, P61

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