EXTENDED HUCKEL MOLECULAR-ORBITAL CALCULATION OF DEFECTS IN LIH CLUSTER CRYSTALS

被引:2
|
作者
IKEYA, M [1 ]
SCHWAN, LO [1 ]
机构
[1] UNIV STUTTGART,INST PHYS 2,D-7000 STUTTGART 80,FED REP GER
来源
关键词
D O I
10.1002/pssb.2220910208
中图分类号
O469 [凝聚态物理学];
学科分类号
070205 ;
摘要
引用
收藏
页码:433 / 441
页数:9
相关论文
共 50 条
  • [1] MOLECULAR GEOMETRIES BY THE EXTENDED HUCKEL MOLECULAR-ORBITAL METHOD
    CALZAFERRI, G
    FORSS, L
    KAMBER, I
    JOURNAL OF PHYSICAL CHEMISTRY, 1989, 93 (14): : 5366 - 5371
  • [2] EXTENDED HUCKEL MOLECULAR-ORBITAL CALCULATION ON 4-METHYLUMBELLIFERONE AND ITS TAUTOMER
    HUBER, JR
    NAKASHIMA, M
    SOUSA, JA
    JOURNAL OF PHYSICAL CHEMISTRY, 1973, 77 (06): : 860 - 861
  • [3] EXTENDED HUCKEL MOLECULAR-ORBITAL CALCULATIONS FOR BRIDGED ANNULENES
    GAVEZZOTTI, A
    SIMONETTA, M
    HELVETICA CHIMICA ACTA, 1976, 59 (08) : 2984 - 2998
  • [4] STABILITY PATTERNS IN BORANE CLUSTER CHEMISTRY RATIONALIZED BY EXTENDED HUCKEL MOLECULAR-ORBITAL STUDIES
    GILL, WR
    JONES, ME
    WADE, K
    PORTERFIELD, WW
    WONG, EH
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1992, 93 : 161 - 174
  • [5] MOLECULAR GEOMETRIES BY THE EXTENDED-HUCKEL MOLECULAR-ORBITAL METHOD - A COMMENT
    CALZAFERRI, G
    MARCOLLI, C
    JOURNAL OF PHYSICAL CHEMISTRY, 1995, 99 (12): : 3895 - 3897
  • [6] EXTENDED HUCKEL MOLECULAR-ORBITAL MODEL FOR LANTHANIDE BISPHTHALOCYANINE COMPLEXES
    ROUSSEAU, R
    AROCA, R
    RODRIGUEZMENDEZ, ML
    JOURNAL OF MOLECULAR STRUCTURE, 1995, 356 (01) : 49 - 62
  • [7] CALCULATION OF NMR SPIN SPIN COUPLING-CONSTANTS USING THE EXTENDED HUCKEL MOLECULAR-ORBITAL METHOD
    DELEEUW, FAAM
    HAASNOOT, CAG
    ALTONA, C
    JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1984, 106 (08) : 2299 - 2306
  • [8] MOLECULAR-ORBITAL STUDIES OF TTF AND TCNQ DIMERS BY EXTENDED HUCKEL METHOD
    BERLINSKY, AJ
    CAROLAN, JF
    WEILER, L
    SOLID STATE COMMUNICATIONS, 1976, 19 (12) : 1165 - 1168
  • [9] HUCKEL MOLECULAR-ORBITAL MODELING OF THE METHYLAZULENES
    KIRBY, EC
    JOURNAL OF CHEMICAL RESEARCH-S, 1982, (11): : 303 - 303
  • [10] REACTION OF HALOGENOACETYLENES WITH SULFUR NUCLEOPHILES STUDIED BY EXTENDED HUCKEL MOLECULAR-ORBITAL THEORY
    BELTRAME, P
    GAVEZZOT.A
    SIMONETT.M
    JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1974, (05): : 502 - 507