QUADRATIC CONFIGURATION-INTERACTION - REPLY TO COMMENT BY PALDUS, CIZEK, AND JEZIORSKI

被引：70

作者：

POPLE, JA ^{[1
]}

HEADGORDON, M ^{[1
]}

RAGHAVACHARI, K ^{[1
]}

机构：

[1] AT&T BELL LABS,PHYS & INORGAN CHEM RES LABS,MURRAY HILL,NJ 07974

来源：

JOURNAL OF CHEMICAL PHYSICS | 1989年 / 90卷 / 08期

关键词：

D O I：

10.1063/1.456607

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：4635 / 4636

页数：2

共 7 条

[1]

Cizek J., 1971, International Journal of Quantum Chemistry, V5, P359, DOI 10.1002/qua.560050402

[2]

CIZEK J, 1966, J CHEM PHYS, V45, P4256

[3] COUPLED CLUSTER APPROACH OR QUADRATIC CONFIGURATION-INTERACTION [J].

PALDUS, J ;

CIZEK, J ;

JEZIORSKI, B .

JOURNAL OF CHEMICAL PHYSICS, 1989, 90 (08) :4356-4362

[4] CORRELATION PROBLEMS IN ATOMIC AND MOLECULAR SYSTEMS .4. EXTENDED COUPLED-PAIR MANY-ELECTRON THEORY AND ITS APPLICATION TO BH3 MOLECULE [J].

PALDUS, J ;

SHAVITT, I ;

CIZEK, J .

PHYSICAL REVIEW A, 1972, 5 (01) :50-&

[5] QUADRATIC CONFIGURATION-INTERACTION - A GENERAL TECHNIQUE FOR DETERMINING ELECTRON CORRELATION ENERGIES [J].

POPLE, JA ;

HEADGORDON, M ;

RAGHAVACHARI, K .

JOURNAL OF CHEMICAL PHYSICS, 1987, 87 (10) :5968-5975

[6] A FULL COUPLED-CLUSTER SINGLES AND DOUBLES MODEL - THE INCLUSION OF DISCONNECTED TRIPLES [J].

PURVIS, GD ;

BARTLETT, RJ .

JOURNAL OF CHEMICAL PHYSICS, 1982, 76 (04) :1910-1918

[7] THE REDUCED LINEAR-EQUATION METHOD IN COUPLED CLUSTER THEORY [J].

PURVIS, GD ;

BARTLETT, RJ .

JOURNAL OF CHEMICAL PHYSICS, 1981, 75 (03) :1284-1292

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