SELF-CONSISTENT WARPED-MUFFIN-TIN-POTENTIAL ENERGY BANDS OF GAMMA-FE WITH VARIOUS EXCHANGE APPROXIMATIONS

被引:8
作者
SHURTLEFF, R
KLEINMAN, L
机构
来源
PHYSICAL REVIEW B-SOLID STATE | 1971年 / 3卷 / 08期
关键词
D O I
10.1103/PhysRevB.3.2418
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
引用
收藏
页码:2418 / +
页数:1
相关论文
共 8 条
[1]   FIRST-PRINCIPLES CALCULATION OF BULK MODULUS OF DIAMOND [J].
GOROFF, I ;
KLEINMAN, L .
PHYSICAL REVIEW B, 1970, 1 (06) :2574-&
[2]  
Herman F., 1970, INT J QUANTUM CHEM, V3, P827
[3]   INHOMOGENEOUS ELECTRON-GAS [J].
RAJAGOPAL, AK ;
CALLAWAY, J .
PHYSICAL REVIEW B, 1973, 7 (05) :1912-1919
[4]   MODIFIED AUGMENTED-PLANE-WAVE METHOD FOR CALCULATING ENERGY BANDS [J].
KLEINMAN, L ;
SHURTLEFF, R .
PHYSICAL REVIEW, 1969, 188 (03) :1111-+
[5]   ORTHOGONALIZED-PLANE-WAVE THEORY OF METALLIC BINDING [J].
KLEINMAN, L .
PHYSICAL REVIEW, 1966, 146 (02) :472-&
[6]   SELF-CONSISTENT EQUATIONS INCLUDING EXCHANGE AND CORRELATION EFFECTS [J].
KOHN, W ;
SHAM, LJ .
PHYSICAL REVIEW, 1965, 140 (4A) :1133-&
[7]   A SIMPLIFICATION OF THE HARTREE-FOCK METHOD [J].
SLATER, JC .
PHYSICAL REVIEW, 1951, 81 (03) :385-390
[8]   ENERGY BANDS IN IRON VIA AUGMENTED PLANE WAVE METHOD [J].
WOOD, JH .
PHYSICAL REVIEW, 1962, 126 (02) :517-&