• Title of article

    T5 operator in coupled cluster calculations

  • Author/Authors

    Musia?، نويسنده , , Monika and Kucharski، نويسنده , , Stanislaw A. and Bartlett، نويسنده , , Rodney J.، نويسنده ,

  • Issue Information
    روزنامه با شماره پیاپی سال 2000
  • Pages
    7
  • From page
    542
  • To page
    548
  • Abstract
    The first attempt to include the connected pentuple excitation, T5, into the coupled cluster method is reported. Construction of the lowest order, i.e. fourth-order T5 operator requires an inclusion of eight diagrammatic terms into the T5 equation. The method is applied to several small systems for which a comparison with full configuration interaction results can be made.
  • Journal title
    Chemical Physics Letters
  • Serial Year
    2000
  • Journal title
    Chemical Physics Letters
  • Record number

    1782009