AUGMENTED-PLANE-WAVE HARTREE-FOCK FIRST-PRINCIPLES CALCULATION OF FERMI SURFACES OF LI, NA, AND K

被引：50

作者：

DAGENS, L ^{[1
]}

PERROT, F ^{[1
]}

机构：

[1] COMM ENERGIE ATOM,CTR ETUD LIMEIL,BPNO27,94190 VILLENEUVE,FRANCE

来源：

PHYSICAL REVIEW B | 1973年 / 8卷 / 04期

关键词：

D O I：

10.1103/PhysRevB.8.1281

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

引用

页码：1281 / 1292

页数：12

共 39 条

[1] HOUSTON METHOD AND ITS APPLICATION TO THE CALCULATION OF CHARACTERISTIC TEMPERATURES OF CUBIC CRYSTALS [J].

BETTS, DD ;

BHATIA, AB ;

WYMAN, M .

PHYSICAL REVIEW, 1956, 104 (01) :37-42

[2] ENERGY BANDS IN LITHIUM [J].

CALLAWAY, J .

PHYSICAL REVIEW, 1961, 124 (06) :1824-&

[3] EXTENDED POLARIZATION POTENTIAL - APPLICATIONS TO ATOMIC SCATTERING [J].

CALLAWAY, J ;

LABAHN, RW ;

PU, RT ;

DUXLER, WM .

PHYSICAL REVIEW, 1968, 168 (01) :12-&

[4] CONTRIBUTION OF CORE POLARIZATION TO THE COHESIVE ENERGIES OF THE ALKALI METALS [J].

CALLAWAY, J .

PHYSICAL REVIEW, 1957, 106 (05) :868-874

[5] HARTREE-FOCK BAND-STRUCTURE AND OPTICAL GAP IN SOLID NEON AND ARGON [J].

DAGENS, L ;

PERROT, F .

PHYSICAL REVIEW B, 1972, 5 (02) :641-&

[6] BOUNDS FOR HARTREE-FOCK EFFECTIVE EXCHANGE INTERACTION AND STATIC DIELECTRIC CONSTANTS [J].

DAGENS, L .

JOURNAL OF PHYSICS PART C SOLID STATE PHYSICS, 1971, 4 (09) :L165-&

[7] VARIATIONAL CALCULATION OF EXCHANGE ENERGY OF AN INHOMOGENEOUS ELECTRON GAS AND OF CORRESPONDING EFFECTIVE EXCHANGE POTENTIAL [J].

DAGENS, L .

JOURNAL DE PHYSIQUE, 1971, 32 (10) :719-&

[8]

DAGENS L, 1972, J PHYS C, V3, P83

[9] SELF-CONSISTENT ENERGY BANDS AND COHESIVE ENERGY OF POTASSIUM CHLORIDE [J].

DECICCO, PD .

PHYSICAL REVIEW, 1967, 153 (03) :931-&

[10]

DESCLAUX JP, 1969, COMPUT PHYS COMMUN, V1, P216

← 1 2 3 4 →