AB-INITIO CALCULATION OF LOWEST IONIZATION POTENTIAL AND TRANSITION ENERGIES OF METHANE

被引：28
|
作者：
PAUZAT, F
RIDARD, J
LEVY, B
机构：
来源：
MOLECULAR PHYSICS | 1972年 / 23卷 / 06期
关键词：
D O I：
10.1080/00268977200101131
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：1163 / +
页数：1
相关论文
共 50 条
  • [1] AN AB-INITIO CALCULATION OF THE VERTICAL EXCITATION-ENERGIES OF NAPHTHALENE
    SUTER, HU
    HA, TK
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1994, 115 (01): : 13 - 19
  • [2] AB-INITIO CALCULATION OF FIRST IONIZATION POTENTIAL IN LINEAR ALKANES USING EXCITON THEORY
    PAUZAT, F
    RIDARD, J
    MILLIE, P
    MOLECULAR PHYSICS, 1972, 24 (05) : 1039 - &
  • [3] AB-INITIO CALCULATION OF ROVIBRONIC TRANSITION SPECTRA OF CAH
    LEININGER, T
    JEUNG, GH
    JOURNAL OF CHEMICAL PHYSICS, 1995, 103 (10): : 3942 - 3949
  • [4] AB-INITIO CALCULATION OF VERTICAL TRANSITION ENERGIES OF C2H2 MOLECULE
    KAMMER, WE
    CHEMICAL PHYSICS, 1974, 5 (03) : 408 - 417
  • [5] AN AB-INITIO INVESTIGATION OF THE LOWEST POTENTIAL-ENERGY SURFACE OF DISILOXANE
    LUKE, BT
    JOURNAL OF PHYSICAL CHEMISTRY, 1993, 97 (29): : 7505 - 7510
  • [6] AB-INITIO AMO CALCULATION OF LOWEST SINGLET-TRIPLET SEPARATION IN BENZENE
    GILMAN, RR
    DEHEER, J
    JOURNAL OF CHEMICAL PHYSICS, 1970, 52 (08): : 4287 - &
  • [7] AN AB-INITIO CALCULATION OF THE VIBRONIC ENERGIES OF THE CH2+ MOLECULE
    KRAEMER, WP
    JENSEN, P
    BUNKER, PR
    CANADIAN JOURNAL OF PHYSICS, 1994, 72 (11-12) : 871 - 878
  • [8] Ab-Initio Calculation of Migration Energies of Adatoms on the Si (100) Surface
    Brocks, G.
    Kelly, P. J.
    Car, R.
    INTERNATIONAL JOURNAL OF MODERN PHYSICS C, 1991, 2 (01): : 288 - 291
  • [9] AN AB-INITIO CALCULATION OF THE ROVIBRONIC ENERGIES OF THE CH2+ MOLECULE
    JENSEN, P
    BRUMM, M
    KRAEMER, WP
    BUNKER, PR
    JOURNAL OF MOLECULAR SPECTROSCOPY, 1995, 172 (01) : 194 - 204
  • [10] An ab initio calculation of the vibrational energies and transition moments of HSOH
    Yurchenko, Sergei N.
    Yachmenev, Andrey
    Thiel, Walter
    Baum, Oliver
    Giesen, Thomas F.
    Melnikov, Vladlen V.
    Jensen, Per
    JOURNAL OF MOLECULAR SPECTROSCOPY, 2009, 257 (01) : 57 - 65
12345