ORTHOGONALIZED LINEAR COMBINATIONS OF ATOMIC ORBITALS - APPLICATION TO CALCULATION OF ENERGY-BANDS OF SIIII

被引：75

作者：

CHING, WY ^{[1
]}

LIN, CC ^{[1
]}

机构：

[1] UNIV WISCONSIN,DEPT PHYS,MADISON,WI 53706

来源：

PHYSICAL REVIEW B | 1975年 / 12卷 / 12期

关键词：

D O I：

10.1103/PhysRevB.12.5536

中图分类号：

T [工业技术];

学科分类号：

08 ;

摘要：

引用

页码：5536 / 5544

页数：9

共 50 条

[41] 1ST PRINCIPLES CALCULATION OF ENERGY-BANDS OF (100) IRON THIN-FILM
CARUTHERS, E
DEMPSEY, DG
KLEINMAN, L
BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1976, 21 (03): : 433 - 433
[42] EMPTY-LATTICE TEST OF THE LINEARIZED ATOMIC-CELL ORBITAL METHOD FOR ENERGY-BANDS
SUN, T
NESBET, RK
PHYSICAL REVIEW B, 1987, 36 (12): : 6356 - 6360
[43] VALENCE ENERGY-BANDS OF SOLID HYDROGEN IN HCP STRUCTURE - AB-INITIO LCMO CALCULATION
IACOVO, VD
RESCA, L
RESTA, R
PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1975, 69 (01): : 127 - 132
[44] RELATIVISTIC GREEN-FUNCTION THEORY OF THE ENERGY-BANDS OF HEAVY SOLIDS - APPLICATION TO THALLIUM
CHOWDHURI, J
CHATTERJEE, S
JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1979, 12 (11): : 2025 - 2032
[45] CALCULATION OF OPTICAL-CONSTANTS FOR POTASSIUM HALIDES FROM KORRINGA-KOHN-ROSTOKER ENERGY-BANDS
OVERHOF, H
PHYSICAL REVIEW B, 1972, 5 (10): : 4079 - &
[46] SCATTERING THEORY IN NARROW ENERGY-BANDS - APPLICATION TO WOLFF-KONDO HAMILTONIAN EQUIVALENCE
LLOYD, P
OSBORNE, CF
JOURNAL OF PHYSICS F-METAL PHYSICS, 1971, 1 (04): : 424 - &
[47] ABINITIO SELF-CONSISTENT-FIELD METHOD USING LINEAR COMBINATIONS OF ATOMIC ORBITALS FOR CALCULATION OF SURFACE-STATES OF 3-DIMENSIONAL CRYSTALS
LADIK, J
PHYSICAL REVIEW B, 1978, 17 (04): : 1663 - 1669
[48] CLUSTER-TYPE CALCULATIONS OF ELECTRONIC-STRUCTURES OF CRYSTALS BY METHOD OF LINEAR COMBINATIONS OF ATOMIC ORBITALS
MENZEL, WP
MEDNICK, K
LIN, CC
FRANKLIN, C
JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (11): : 4708 - 4715
[49] MOLECULAR ORBITAL LINEAR COMBINATION OF ATOMIC ORBITALS CALCULATION AND ELECTRONIC SPECTRA OF PHENYLBORONIC ACID AND TRIPHENYLBOROXINE
BOSSA, M
MARASCHI.F
JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1970, (09): : 1416 - &
[50] USE OF LINEAR COMBINATION OF PSEUDO-ATOMIC ORBITALS FOR CALCULATION OF ELECTRON-STRUCTURE OF CRYSTALS
GRINYAYEV, SN
CHALDYSHEV, VA
CHERNYSHOV, VN
IZVESTIYA VYSSHIKH UCHEBNYKH ZAVEDENII FIZIKA, 1988, 31 (01): : 119 - 121

← 1 2 3 4 5 →