MATRIX-ELEMENTS OF TIGHT-BINDING METHOD FOR LATTICES WITH D-14(4H) SYMMETRY

被引：2
|
作者：
JOUANIN, C [1 ]
GOUT, C [1 ]
ALBERT, JP [1 ]
机构：
[1] UNIV SCI & TECH LANGUEDOC,CNRS,CTR ETUD ELECTR SOLIDES,MONTPELLIER,FRANCE
来源：
JOURNAL OF CHEMICAL PHYSICS | 1975年 / 63卷 / 01期
关键词：
D O I：
10.1063/1.431102
中图分类号：
O64 [物理化学（理论化学）、化学物理学];
学科分类号：
070304 ; 081704 ;
摘要：
引用
收藏
页码：326 / 332
页数：7
相关论文
共 12 条
  • [1] MATRIX-ELEMENTS OF TIGHT-BINDING METHOD FOR LATTICES WITH D144H SYMMETRY .2.
    JOUANIN, C
    ALBERT, JP
    GOUT, C
    DAUDE, N
    JOURNAL OF CHEMICAL PHYSICS, 1975, 63 (08): : 3412 - 3416
  • [2] TRANSFERABILITY OF TIGHT-BINDING MATRIX-ELEMENTS
    CHADI, DJ
    ATOMISTIC SIMULATION OF MATERIALS : BEYOND PAIR POTENTIALS, 1989, : 309 - 315
  • [3] TIGHT-BINDING REPRESENTATION OF THE OPTICAL MATRIX-ELEMENTS - THEORY AND APPLICATIONS
    VOON, LCLY
    RAMMOHAN, LR
    PHYSICAL REVIEW B, 1993, 47 (23): : 15500 - 15508
  • [4] TIGHT-BINDING MODEL WITH INTRA-ATOMIC MATRIX-ELEMENTS
    MERCER, JL
    CHOU, MY
    PHYSICAL REVIEW B, 1994, 49 (12): : 8506 - 8509
  • [5] SYMMETRY AND ANALYTICAL EXPRESSIONS OF MATRIX COMPONENTS IN TIGHT-BINDING METHOD
    KUZNETSOV, VN
    MEN, AN
    PHYSICA STATUS SOLIDI B-BASIC RESEARCH, 1978, 85 (01): : 95 - 104
  • [6] THE DETERMINATION OF THE MOMENTUM MATRIX-ELEMENTS INVOLVED IN CALCULATING THE DIELECTRIC-CONSTANTS OF SUPERLATTICES USING THE TIGHT-BINDING METHOD
    XU, ZH
    SOLID STATE COMMUNICATIONS, 1990, 76 (09) : 1143 - 1147
  • [7] Computational method for the intrasite matrix elements of the Hamiltonian for tight-binding molecular dynamics calculations
    Hayami, W
    PHYSICAL REVIEW B, 2004, 70 (23) : 1 - 4
  • [8] Application of a new tight-binding total energy method to 4-d transition metals and compounds
    Papaconstantopoulos, DA
    Mehl, MJ
    Akdim, B
    PROPERTIES OF COMPLEX INORGANIC SOLIDS, 1997, : 253 - 259
  • [9] Spectral and transmission properties of periodic 1D tight-binding lattices with a generic unit cell: an analysis within the transfer matrix approach
    Lambropoulos, K.
    Simserides, C.
    JOURNAL OF PHYSICS COMMUNICATIONS, 2018, 2 (03):
  • [10] Development of constraint algorithm for the number of electrons in molecular orbitals consisting mainly 4f atomic orbitals of rare-earth elements and its introduction to tight-binding quantum chemical molecular dynamics method
    Endou, Akira
    Onuma, Hiroaki
    Jung, Sun-ho
    Ishimoto, Ryota
    Tsuboi, Hideyuki
    Koyama, Michihisa
    Takaba, Hiromitsu
    Kubo, Momoji
    Del Carpio, Carlos A.
    Miyamoto, Akira
    JAPANESE JOURNAL OF APPLIED PHYSICS PART 1-REGULAR PAPERS BRIEF COMMUNICATIONS & REVIEW PAPERS, 2007, 46 (4B): : 2505 - 2509
12