DENSITY-FUNCTIONAL THEORY WITH SELF-INTERACTION CORRECTION - APPLICATION TO THE LITHIUM MOLECULE

被引：163

作者：

PEDERSON, MR

HEATON, RA

LIN, CC

机构：

来源：

关键词：

D O I：

10.1063/1.448266

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：2688 / 2699

页数：12

共 34 条

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RAUK, A
BAERENDS, EJ
[J]. THEORETICA CHIMICA ACTA, 1977, 43 (03): : 261 - 271
[34] GROUND-STATE AND EXCITED-STATE PROPERTIES OF LIF IN LOCAL-DENSITY FORMALISM
ZUNGER, A
FREEMAN, AJ
[J]. PHYSICAL REVIEW B, 1977, 16 (06): : 2901 - 2926