NUMERICAL STUDY OF THE CONVERGENCY OF 2ND AND APPROXIMATE 2ND-ORDER MULTICONFIGURATION HARTREE-FOCK PROCEDURES

被引：54

作者：

YEAGER, DL ^{[1
]}

JORGENSEN, P ^{[1
]}

机构：

[1] AARHUS UNIV,DEPT CHEM,DK-8000 AARHUS C,DENMARK

来源：

关键词：

D O I：

10.1080/00268978000100491

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：587 / 596

页数：10

共 18 条

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[15] ROOTHAAN CCJ, 1979, INT J QUANT CHEM, P135
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[J]. THEORETICA CHIMICA ACTA, 1966, 4 (01): : 22 - &
[17] WAHL AC, 1977, MODERN THEORETICAL C, V3, pCH3
[18] CONVERGENCY STUDIES OF SECOND AND APPROXIMATE 2ND ORDER MULTICONFIGURATIONAL HARTREE-FOCK PROCEDURES
YEAGER, DL
JORGENSEN, P
[J]. JOURNAL OF CHEMICAL PHYSICS, 1979, 71 (02) : 755 - 760