HYBRID MOLECULAR-ORBITALS FOR REACTING SYSTEMS - ELUCIDATION OF REACTIVE DOMAINS

被引:7
|
作者
FUJIMOTO, H
KOGA, N
ENDO, M
FUKUI, K
机构
关键词
D O I
10.1016/S0040-4039(01)81923-7
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
引用
收藏
页码:3427 / 3430
页数:4
相关论文
共 50 条
  • [21] MOLECULAR-ORBITALS OF ZINC PHTHALOCYANINE
    MATHUR, SC
    SINGH, J
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1972, 6 (04) : 747 - &
  • [22] GRAPH THEORY OF MOLECULAR-ORBITALS
    TANG, AC
    KIANG, YS
    SCIENTIA SINICA, 1976, 19 (02): : 207 - 226
  • [23] EXPONENTIAL TRANSFORMATION OF MOLECULAR-ORBITALS
    HUTTER, J
    PARRINELLO, M
    VOGEL, S
    JOURNAL OF CHEMICAL PHYSICS, 1994, 101 (05): : 3862 - 3865
  • [24] NATURAL LOCALIZED MOLECULAR-ORBITALS
    REED, AE
    WEINHOLD, F
    JOURNAL OF CHEMICAL PHYSICS, 1985, 83 (04): : 1736 - 1740
  • [25] METHOD OF COMPLEX MOLECULAR-ORBITALS
    HENDEKOVIC, J
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1974, 8 (05) : 799 - 815
  • [26] ILLUSTRATED MOLECULAR-ORBITALS OF FORMALDEHYDE
    ORLOFF, MK
    COLTHUP, NB
    JOURNAL OF CHEMICAL EDUCATION, 1973, 50 (06) : 400 - 401
  • [27] TRANSFORMATION PROPERTIES OF MOLECULAR-ORBITALS
    MOSKVIN, AS
    GUDKOV, VG
    IZVESTIYA VYSSHIKH UCHEBNYKH ZAVEDENII FIZIKA, 1978, (07): : 46 - 49
  • [28] SYMMETRY IN ATOMIC AND MOLECULAR-ORBITALS
    KOBER, F
    CHEMIKER-ZEITUNG, 1980, 104 (05): : 151 - 163
  • [29] MOLECULAR-ORBITALS AND HADAMARD-MATRICES
    BALASUBRAMANIAN, K
    CHEMICAL PHYSICS LETTERS, 1993, 210 (1-3) : 216 - 222
  • [30] THE BONDING PROPERTIES OF POLYHEDRAL MOLECULAR-ORBITALS
    ZHANG, QN
    YU, YI
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1986, 29 (1-2): : 45 - 55