CONTINUUM HARTREE-FOCK SCHEME FOR 1-D ORGANIC POLYMERS

被引:6
|
作者
ASLANGUL, C
SAINTJAMES, D
机构
来源
JOURNAL DE PHYSIQUE | 1984年 / 45卷 / 09期
关键词
D O I
10.1051/jphys:019840045090140100
中图分类号
学科分类号
摘要
12
引用
收藏
页码:1401 / 1407
页数:7
相关论文
共 50 条
  • [31] HARTREE-FOCK SOFT COULOMB HOLE TO ESTIMATE CORRELATION ENERGIES IN ATOMS, MOLECULES AND POLYMERS
    OTTO, P
    REIF, H
    HERNANDEZLAGUNA, A
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1995, 340 : 51 - 62
  • [32] Charge transfer excitations from excited state Hartree-Fock subsequent minimization scheme
    Theophilou, Iris
    Tassi, M.
    Thanos, S.
    JOURNAL OF CHEMICAL PHYSICS, 2014, 140 (16):
  • [33] Analytical Time-Dependent Hartree-Fock Scheme to Evaluate the Vibrational (Hyper)Polarizabilities
    Liegeois, Vincent
    Champagne, Benoit
    COMPUTATIONAL METHODS IN SCIENCE AND ENGINEERING, VOL 2: ADVANCES IN COMPUTATIONAL SCIENCE, 2009, 1148 : 693 - 696
  • [34] PROJECTED HARTREE-FOCK METHOD AND STRETCH SCHEME - ENERGY LEVELS OF 44TI
    KHADKIKAR, SB
    BANERJEE, B
    NUCLEAR PHYSICS A, 1969, A129 (01) : 220 - +
  • [35] NEW ENERGY DECOMPOSITION SCHEME FOR MOLECULAR-INTERACTIONS WITHIN HARTREE-FOCK APPROXIMATION
    KITAURA, K
    MOROKUMA, K
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1976, 10 (02) : 325 - 340
  • [36] An alternative scheme for calculating the unrestricted Hartree-Fock equation: Application to the boron and neon atoms
    Miyasita, Mitiyasu
    Higuchi, Katsuhiko
    Higuchi, Masahiko
    PHYSICA B-CONDENSED MATTER, 2012, 407 (14) : 2758 - 2762
  • [37] HARTREE-FOCK CALCULATIONS WITH SKYRMES INTERACTION .1. SPHERICAL NUCLEI
    VAUTHERIN, D
    BRINK, DM
    PHYSICAL REVIEW C, 1972, 5 (03): : 626 - +
  • [38] HARTREE-FOCK CALCULATIONS OF MG-1 SPECTRUM IN EXTREME ULTRAVIOLET
    MANSFIELD, MW
    CONNERAD.JP
    PHYSICA SCRIPTA, 1972, 6 (04) : 191 - 194
  • [39] A NEW EXTENDED HARTREE-FOCK FUNCTION - THE OMEGA FUNCTION .1.
    SMEYERS, YG
    DELGADOBARRIO, G
    DORESTESUAREZ, L
    MARTINGONZALEZ, JM
    RUIZEGEA, E
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1985, 21 (FEB): : 431 - 436
  • [40] RESTRICTED HARTREE-FOCK APPROXIMATION .1. TECHNIQUES FOR THE ENERGY MINIMIZATION
    RICO, JF
    DELAVEGA, JMG
    ALONSO, JIF
    FANTUCCI, P
    JOURNAL OF COMPUTATIONAL CHEMISTRY, 1983, 4 (01) : 33 - 40