HARTREE-FOCK STUDY OF LITHIUM HYDRIDE WITH THE USE OF A POLARIZABLE BASIS SET

被引:153
作者
DOVESI, R
ERMONDI, C
FERRERO, E
PISANI, C
ROETTI, C
机构
来源
PHYSICAL REVIEW B | 1984年 / 29卷 / 06期
关键词
D O I
10.1103/PhysRevB.29.3591
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
引用
收藏
页码:3591 / 3600
页数:10
相关论文
共 43 条
  • [11] EXACT-EXCHANGE HARTREE-FOCK CALCULATIONS FOR PERIODIC-SYSTEMS .4. GROUND-STATE PROPERTIES OF CUBIC BORON-NITRIDE
    DOVESI, R
    PISANI, C
    ROETTI, C
    DELLAROLE, P
    [J]. PHYSICAL REVIEW B, 1981, 24 (08): : 4170 - 4176
  • [12] TREATMENT OF COULOMB INTERACTIONS IN HARTREE-FOCK CALCULATIONS OF PERIODIC-SYSTEMS
    DOVESI, R
    PISANI, C
    ROETTI, C
    SAUNDERS, VR
    [J]. PHYSICAL REVIEW B, 1983, 28 (10): : 5781 - 5792
  • [13] COMPTON PROFILE OF LIH
    FELSTEINER, J
    FOX, R
    KAHANE, S
    [J]. PHYSICAL REVIEW B, 1972, 6 (12) : 4689 - 4695
  • [14] REPULSIVE INTERACTIONS FOR LIH
    FISCHER, CR
    DELLIN, TA
    HARRISON, SW
    HATCHER, RD
    WILSON, WD
    [J]. PHYSICAL REVIEW B-SOLID STATE, 1970, 1 (02): : 876 - &
  • [15] HARTREE-FOCK ENERGY-BANDS BY THE ORTHOGONALIZED-PLANE-WAVE METHOD - LITHIUM HYDRIDE RESULTS
    GROSSO, G
    PARRAVICINI, GP
    [J]. PHYSICAL REVIEW B, 1979, 20 (06): : 2366 - 2372
  • [16] MAGNETIC-SUSCEPTIBILITY OF SOLID LITHIUM HYDRIDE
    GROSSO, G
    PARRAVICINI, GP
    [J]. JOURNAL OF PHYSICS C-SOLID STATE PHYSICS, 1977, 10 (16): : L451 - L454
  • [17] DENSITY MATRIX AND X-RAY STRUCTURE FACTORS IN LIH
    GROSSO, G
    PARRAVICINI, GP
    [J]. PHYSICAL REVIEW B, 1978, 17 (08): : 3421 - 3426
  • [18] GROSSO G, 1976, PHYS STATUS SOLIDI B, V73, P371, DOI 10.1002/pssb.2220730137
  • [19] HANSEN N, UNPUB
  • [20] HARRIS FE, 1975, THEORETICAL CHEMISTR, V1, P147