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
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
Journal title :
Chemical Physics Letters