THE STRUCTURE AND PROPERTIES OF FLAVINS - MOLECULAR-ORBITAL STUDY BASED ON TOTALLY OPTIMIZED GEOMETRIES .2. MOLECULAR-ORBITAL STRUCTURE AND ELECTRON-DISTRIBUTION

被引：34
|
作者：
HALL, LH
ORCHARD, BJ
TRIPATHY, SK
机构：
[1] UNIV ILLINOIS,DEPT MATH,CHICAGO,IL 60608
[2] GTE LABS INC,WALTHAM,MA 02254
来源：
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY | 1987年 / 31卷 / 02期
关键词：
D O I：
10.1002/qua.560310204
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：217 / 242
页数：26
相关论文
共 50 条
  • [31] AN ABINITIO MOLECULAR-ORBITAL STUDY OF THE STRUCTURE AND SPECTROSCOPIC PROPERTIES OF CH3ALH
    QUELCH, GE
    HILLIER, IH
    [J]. JOURNAL OF THE CHEMICAL SOCIETY-FARADAY TRANSACTIONS II, 1987, 83 : 2287 - 2294
  • [32] MOLECULAR-ORBITAL CALCULATIONS OF THE ELECTRONIC-STRUCTURE OF MOS2
    STEWART, TR
    WINTER, NW
    PITZER, RM
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1992, 203 : 288 - COLL
  • [33] MOLECULAR-STRUCTURE OF ETHYNYLBENZENE FROM ELECTRON-DIFFRACTION AND ABINITIO MOLECULAR-ORBITAL CALCULATIONS
    SCHULTZ, G
    NAGY, T
    PORTALONE, G
    RAMONDO, F
    HARGITTAI, I
    DOMENICANO, A
    [J]. STRUCTURAL CHEMISTRY, 1993, 4 (03) : 183 - 190
  • [34] Molecular-orbital structure in light neutron-rich nuclei
    Itagaki, N
    Okabe, S
    Ikeda, K
    [J]. PROGRESS OF THEORETICAL PHYSICS SUPPLEMENT, 2001, (142): : 297 - 323
  • [35] MOLECULAR-ORBITAL CALCULATION OF ELECTRONIC-STRUCTURE OF BORANE CARBONYL
    KATO, S
    FUJIMOTO, H
    YAMABE, S
    FUKUI, K
    [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1974, 96 (07) : 2024 - 2029
  • [36] Molecular-orbital structure in neutron-rich C isotopes
    Itagaki, N
    Okabe, S
    Ikeda, K
    Tanihata, I
    [J]. PHYSICAL REVIEW C, 2001, 64 (01): : 143011 - 143015
  • [37] CONVULSANT AND ANTICONVULSANT BARBITURATES .2. MOLECULAR-ORBITAL CALCULATIONS
    ANDREWS, PR
    JONES, GP
    [J]. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 1981, 16 (02) : 139 - 143
  • [38] ABINITIO SCF MOLECULAR-ORBITAL CALCULATIONS OF THE DEWAR STRUCTURE OF THIOPHENE
    LATAJKA, Z
    RATAJCZAK, H
    SZCZESNIAK, MM
    ORVILLETHOMAS, WJ
    RATAJCZAK, E
    [J]. BULLETIN DE L ACADEMIE POLONAISE DES SCIENCES-SERIE DES SCIENCES CHIMIQUES, 1980, 28 (11-1): : 695 - 699
  • [39] MOLECULAR-ORBITAL INVESTIGATION OF VALENT STRUCTURE OF ORGANIC-COMPOUNDS
    BORISOVA, NP
    SEMENOV, SG
    [J]. VESTNIK LENINGRADSKOGO UNIVERSITETA SERIYA FIZIKA KHIMIYA, 1976, (03): : 98 - 103
  • [40] Molecular-orbital structure in neutron-rich Be and C isotopes
    N. Itagaki
    S. Okabe
    K. Ikeda
    I. Tanihata
    [J]. The European Physical Journal A - Hadrons and Nuclei, 2002, 13 (1-2): : 43 - 47
12345