AN APPROXIMATE AB-INITIO SCFMO METHOD

被引：5
|
作者：
BODY, RG
机构：
来源：
THEORETICA CHIMICA ACTA | 1970年 / 18卷 / 02期
关键词：
D O I：
10.1007/BF00529130
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：107 / +
相关论文
共 50 条
  • [1] COMPARISON OF APPROXIMATE INDO AND AB-INITIO WAVE-FUNCTIONS
    VANCATLEDGE, FA
    JOURNAL OF PHYSICAL CHEMISTRY, 1974, 78 (08): : 763 - 769
  • [2] AN APPROXIMATE AB-INITIO THEORY OF LARGE MOLECULAR-SYSTEMS
    DAS, GP
    CHEMICAL PHYSICS LETTERS, 1988, 147 (06) : 591 - 596
  • [3] THE STABILIZATION METHOD IS AN AB-INITIO AND CONVERGENT APPROACH
    RIERA, A
    JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM, 1993, 103 (03): : 175 - 187
  • [4] Approximate Reduced Density Matrix for Bioactive Systems: an Ab-initio Approach
    Courcot, Blandine
    Gillet, Jean-Michel
    Ghermani, Nour Eddine
    Becker, Pierre
    ACTA CRYSTALLOGRAPHICA A-FOUNDATION AND ADVANCES, 2005, 61 : C351 - C351
  • [5] Ab-initio are synthesis
    Hintermann, L
    NACHRICHTEN AUS DER CHEMIE, 2005, 53 (7-8) : 776 - 779
  • [6] Ab-initio Gutzwiller method: First application to plutonium
    Julien, J. -P.
    Bouchet, J.
    RECENT ADVANCES IN THE THEORY OF CHEMICAL AND PHYSICAL SYSTEMS, 2006, 15 : 509 - +
  • [7] SIMPLIFIED AB-INITIO METHOD CALCULATION OF LINEAR POLARIZABILITY
    BROWN, RD
    WILLIAMS, GR
    AUSTRALIAN JOURNAL OF CHEMISTRY, 1973, 26 (05) : 921 - 925
  • [8] MATRIX-ELEMENTS FOR AN APPROXIMATE AB-INITIO PI-ELECTRON THEORY
    PILKINGTON, PW
    NEELY, SC
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1976, 10 (03) : 473 - 493
  • [9] An approximate ab initio method based on the DIM model
    Cullen, JM
    CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE, 2000, 78 (12): : 1575 - 1586
  • [10] Ab-initio materials spectra
    McClain, James
    Berkelbach, Tim
    Sun, Qiming
    Chan, Garnet
    ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 253
12345