Gaussian geminals in explicitly correlated coupled cluster theory including single and double excitations

被引：0
|
作者：
机构：
来源：
J Chem Phys | / 9卷 / 4165期
关键词：
D O I：
暂无
中图分类号：
学科分类号：
摘要：
引用
收藏
相关论文
共 50 条
  • [1] Gaussian geminals in explicitly correlated coupled cluster theory including single and double excitations
    Bukowski, R
    Jeziorski, B
    Szalewicz, K
    JOURNAL OF CHEMICAL PHYSICS, 1999, 110 (09): : 4165 - 4183
  • [2] Explicitly correlated coupled cluster F12 theory with single and double excitations
    Noga, Jozef
    Kedzuch, Stanislav
    Simunek, Jan
    Ten-no, Seiichiro
    JOURNAL OF CHEMICAL PHYSICS, 2008, 128 (17):
  • [3] Explicitly correlated coupled cluster methods with pair-specific geminals
    Werner, Hans-Joachim
    Knizia, Gerald
    Manby, Frederick R.
    MOLECULAR PHYSICS, 2011, 109 (03) : 407 - 417
  • [4] Explicitly correlated connected triple excitations in coupled-cluster theory
    Koehn, Andreas
    JOURNAL OF CHEMICAL PHYSICS, 2009, 130 (13):
  • [5] Explicitly correlated coupled cluster F12 theory with single and double excitations (vol 128, art no 174103, 2008)
    Noga, Jozef
    Kedzuch, Stanislav
    Simunek, Jan
    Ten-no, Seiichiro
    JOURNAL OF CHEMICAL PHYSICS, 2009, 130 (02):
  • [6] Explicitly correlated second order perturbation theory with frozen Gaussian-type geminals
    Ten-no, S
    COMPUTATIONAL SCIENCE - ICCS 2003, PT IV, PROCEEDINGS, 2003, 2660 : 152 - 158
  • [7] Analytic first derivatives for explicitly correlated, multicenter, Gaussian geminals
    Gilmore, DW
    Kozlowski, PM
    Kinghorn, DB
    Adamowicz, L
    INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 1997, 63 (05) : 991 - 999
  • [8] Explicitly-correlated Gaussian geminals in electronic structure calculations
    Szalewicz, Krzysztof
    Jeziorski, Bogumil
    MOLECULAR PHYSICS, 2010, 108 (21-23) : 3091 - 3103
  • [9] EFFICIENT APPROXIMATIONS FOR A RAPID OPTIMIZATION OF EXPLICITLY CORRELATED GAUSSIAN GEMINALS
    WENZEL, KB
    ZABOLITZKY, JG
    JOURNAL DE CHIMIE PHYSIQUE ET DE PHYSICO-CHIMIE BIOLOGIQUE, 1987, 84 (05) : 691 - 694
  • [10] ATOMIC AND MOLECULAR CORRELATION ENERGIES WITH EXPLICITLY CORRELATED GAUSSIAN GEMINALS .5. CARTESIAN GAUSSIAN GEMINALS AND THE NEON ATOM
    WENZEL, KB
    ZABOLITZKY, JG
    SZALEWICZ, K
    JEZIORSKI, B
    MONKHORST, HJ
    JOURNAL OF CHEMICAL PHYSICS, 1986, 85 (07): : 3964 - 3974
12345