EXCHANGE DENSITY-FUNCTIONAL GRADIENT EXPANSION

被引:38
作者
KLEINMAN, L
机构
来源
PHYSICAL REVIEW B | 1984年 / 30卷 / 04期
关键词
D O I
10.1103/PhysRevB.30.2223
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
引用
收藏
页码:2223 / 2225
页数:3
相关论文
共 10 条
[1]   SELF-CONSISTENT HARTREE-FOCK CALCULATION OF EXCHANGE EFFECTS IN A WEAKLY INHOMOGENEOUS ELECTRON-GAS [J].
GELDART, DJW ;
RASOLT, M ;
ALMBLADH, CO .
SOLID STATE COMMUNICATIONS, 1975, 16 (02) :243-246
[2]   INHOMOGENEOUS ELECTRON-GAS [J].
RAJAGOPAL, AK ;
CALLAWAY, J .
PHYSICAL REVIEW B, 1973, 7 (05) :1912-1919
[3]   CORRECTION [J].
KLEINMAN, L .
PHYSICAL REVIEW B, 1975, 12 (08) :3512-3512
[4]   GRADIENT TERM IN KOHN-SHAM EXCHANGE-CORRELATION POTENTIAL [J].
KLEINMAN, L .
PHYSICAL REVIEW B, 1974, 10 (06) :2221-2225
[5]   SELF-CONSISTENT EQUATIONS INCLUDING EXCHANGE AND CORRELATION EFFECTS [J].
KOHN, W ;
SHAM, LJ .
PHYSICAL REVIEW, 1965, 140 (4A) :1133-&
[6]   THEORY OF NONUNIFORM ELECTRONIC SYSTEMS .1. ANALYSIS OF THE GRADIENT APPROXIMATION AND A GENERALIZATION THAT WORKS [J].
LANGRETH, DC ;
PERDEW, JP .
PHYSICAL REVIEW B, 1980, 21 (12) :5469-5493
[7]  
PERDEW JP, UNPUB
[8]   GRADIENT EXPANSION IN DENSITY FUNCTIONAL APPROACH TO AN INHOMOGENEOUS ELECTRON-SYSTEM [J].
RAJAGOPAL, AK ;
RAY, S .
PHYSICAL REVIEW B, 1975, 12 (08) :3129-3135
[9]   STUDY OF THE DENSITY-GRADIENT EXPANSION FOR THE EXCHANGE ENERGY [J].
SAHNI, V ;
GRUENEBAUM, J ;
PERDEW, JP .
PHYSICAL REVIEW B, 1982, 26 (08) :4371-4377
[10]  
SHAM LJ, 1971, COMPUTATIONAL METHOD, P458