DIRECT-SPACE ANALYSIS OF THE HARTREE-FOCK ENERGY-BANDS AND DENSITY OF STATES FOR METALLIC EXTENDED SYSTEMS

被引：41

作者：

DELHALLE, J ^{[1
]}

CALAIS, JL ^{[1
]}

机构：

[1] UNIV UPPSALA, QUANTUM CHEM GRP, S-75120 UPPSALA, SWEDEN

来源：

关键词：

D O I：

10.1103/PhysRevB.35.9460

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

引用

页码：9460 / 9466

页数：7

共 25 条

[1] WANNIER FUNCTION FOR METALLIC HYDROGEN [J].

ANDREONI, W .

PHYSICAL REVIEW B, 1976, 14 (10) :4247-4253

[2] VARIATIONAL PROCEDURE FOR SYMMETRY-ADAPTED WANNIER FUNCTIONS [J].

BOEHM, JV ;

CALAIS, JL .

JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1979, 12 (18) :3661-3675

[3]

BULYANITSA DS, 1962, SOV PHYS-SOL STATE, V4, P981

[4]

Calais J.-L., 1987, UNDERSTANDING MOL PR, P511

[5] ORTHOGONAL ORBITALS AND GENERALIZED WANNIER FUNCTIONS [J].

CLOIZEAUX, JD .

PHYSICAL REVIEW, 1963, 129 (02) :554-&

DELHALLE, J ;

CALAIS, JL .

[7]

DESCLOIZEAUX J, 1964, PHYS REV, V135, pA685

[8]

DESCLOIZEAUX J, 1964, PHYS REV, V135, pA698

[9]

HARRIS FE, 1975, THEORETICAL CHEMISTR, V1, P147

[10]

Hirschfelder J. O., 1954, MOL THEORY GASES LIQ