AN IMPROVED 2-PARAMETER OMEGA TECHNIQUE FOR MOLECULAR-ORBITAL CALCULATIONS .2. POLYENES

被引:0
|
作者
CASTRO, EA
FERNANDEZ, FM
机构
关键词
D O I
暂无
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
引用
收藏
页码:643 / 650
页数:8
相关论文
共 50 条
  • [41] CNDO-2 MOLECULAR-ORBITAL CALCULATIONS OF THE HEMIDEWAR AND VALENE STRUCTURES OF NAPHTHALENE
    LATAJKA, Z
    RATAJCZAK, H
    ORVILLETHOMAS, WJ
    RATAJCZAK, E
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1981, 3 (1-2): : 91 - 95
  • [42] MOLECULAR-ORBITAL CALCULATIONS ON DINITROGEN TRIOXIDE, N2O3
    DOONAN, IJ
    MACLAGAN, RGAR
    AUSTRALIAN JOURNAL OF CHEMISTRY, 1977, 30 (12) : 2613 - 2619
  • [43] CONFORMATIONAL-ANALYSIS OF 2',3' AND 4'-AZACHALCONES BY MOLECULAR-ORBITAL CALCULATIONS
    REMKO, M
    DURINDA, J
    HEGER, J
    JOURNAL OF MOLECULAR STRUCTURE, 1981, 72 (MAR) : 197 - 202
  • [44] MOLECULAR-ORBITAL CALCULATIONS FOR NP3+ CENTERS IN CAF2
    WANG, SD
    ARTMAN, JO
    NATARAJAN, A
    BULLETIN OF THE AMERICAN PHYSICAL SOCIETY, 1975, 20 (04): : 654 - 654
  • [45] MOLECULAR-ORBITAL CALCULATIONS FOR CLOSE ATOMIC COLLISIONS - N2 SYSTEM
    BRIGGS, JS
    HAYNS, MR
    JOURNAL OF PHYSICS B-ATOMIC MOLECULAR AND OPTICAL PHYSICS, 1973, 6 (03) : 514 - 520
  • [46] MOLECULAR-ORBITAL CALCULATIONS ON C2H4SH+ CATION
    GORDON, JW
    SCHMID, GH
    CSIZMADIA, IG
    JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2, 1975, (15): : 1722 - 1726
  • [47] ABINITIO MOLECULAR-ORBITAL CALCULATIONS ON SI2H4 MOLECULE
    DAUDEL, R
    KARI, RE
    POIRIER, RA
    GODDARD, JD
    CSIZMADIA, IG
    JOURNAL OF MOLECULAR STRUCTURE, 1978, 50 (01) : 115 - 121
  • [48] A COMPARATIVE-STUDY OF ISOELECTRONIC AND ISOGYRIC REACTIONS .2. MOLECULAR-ORBITAL CALCULATIONS OF DIATOMIC SULFIDES, OXIDES AND HALIDES
    DEAKYNE, CA
    BROWN, KK
    PACINI, CS
    POHLMAN, DC
    GRAY, DN
    LIEBMAN, JF
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1992, 92 : 395 - 418
  • [49] SIMULATED SEMIEMPIRICAL MOLECULAR-ORBITAL CALCULATIONS .2. TRANSFERABILITY OF FOCK MATRIX-ELEMENTS IN SILICON-COMPOUNDS
    LOVAS, S
    BALINT, I
    BAN, MI
    ACTA CHIMICA HUNGARICA-MODELS IN CHEMISTRY, 1983, 113 (03): : 309 - 315
  • [50] THE OVERLAP INTEGRAL IN THE MOLECULAR-ORBITAL THEORY OF CONJUGATED COMPOUNDS .2. HYDROCARBONS
    BASSETT, IM
    BROWN, RD
    AUSTRALIAN JOURNAL OF CHEMISTRY, 1956, 9 (03) : 315 - 318