CONFIGURATION INTERACTION CALCULATIONS ON NITROGEN MOLECULE

被引:2941
|
作者
LANGHOFF, SR [1 ]
DAVIDSON, ER [1 ]
机构
[1] UNIV WASHINGTON,CHEM DEPT BG10,SEATTLE,WA 98105
关键词
D O I
10.1002/qua.560080106
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:61 / 72
页数:12
相关论文
共 50 条
  • [31] Hybrid eigensolvers for nuclear configuration interaction calculations
    Alperen, Abdullah
    Aktulga, Hasan Metin
    Maris, Pieter
    Yang, Chao
    COMPUTER PHYSICS COMMUNICATIONS, 2023, 292
  • [32] VERY LARGE CONFIGURATION-INTERACTION CALCULATIONS
    FOX, D
    HANDY, N
    SAXE, P
    SCHAEFER, H
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 1982, 183 (MAR): : 117 - PHYS
  • [33] Diagrammatic screening approach to configuration interaction calculations
    Bayne, Mike
    Chakraborty, Arindam
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2016, 251
  • [34] Configuration interaction calculations of positronic atoms and ions
    Bromley, MWJ
    Mitroy, J
    Ryzhikh, GG
    NUCLEAR INSTRUMENTS & METHODS IN PHYSICS RESEARCH SECTION B-BEAM INTERACTIONS WITH MATERIALS AND ATOMS, 2000, 171 (1-2): : 47 - 59
  • [35] MATRIX-ELEMENTS IN CONFIGURATION INTERACTION CALCULATIONS
    SASAKI, F
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1974, 8 (04) : 605 - 617
  • [36] String-truncated configuration interaction calculations
    Bendazzoli, G. L.
    Evangelisti, S.
    Gazzetta Chimica Italiana, 126 (09):
  • [37] RELCI: A program for relativistic configuration interaction calculations
    Fritzsche, S
    Fischer, CF
    Gaigalas, G
    COMPUTER PHYSICS COMMUNICATIONS, 2002, 148 (01) : 103 - 123
  • [38] CONFIGURATION INTERACTION CALCULATIONS ON DINEGATIVE ION OF CORONENE
    HAUPT, A
    HOYTINK, GJ
    THEORETICA CHIMICA ACTA, 1969, 14 (03): : 250 - &
  • [39] Accelerating Configuration Interaction Calculations for Nuclear Structure
    Sternberg, Philip
    Ng, Esmond G.
    Yang, Chao
    Maris, Pieter
    Vary, James P.
    Sosonkina, Masha
    Le, Hung Viet
    INTERNATIONAL CONFERENCE FOR HIGH PERFORMANCE COMPUTING, NETWORKING, STORAGE AND ANALYSIS, 2008, : 252 - +
  • [40] CONFIGURATION INTERACTION IN THE HYDROGEN MOLECULE - THE GROUND STATE
    MCLEAN, AD
    WEISS, A
    YOSHIMINE, M
    REVIEWS OF MODERN PHYSICS, 1960, 32 (02) : 211 - 218