Title of article :
Ab initio density functional theory for spin-polarized systems
Author/Authors :
P. A. Bokhan، نويسنده , , Denis and Bartlett، نويسنده , , Rodney J.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2006
Pages :
6
From page :
466
To page :
471
Abstract :
Ab initio density functional method, based on second-order many-body perturbation theory has been generalized to apply to spin-polarized open-shell systems. Results for energies and Vxc are presented.
Journal title :
Chemical Physics Letters
Serial Year :
2006
Journal title :
Chemical Physics Letters
Record number :
1919851
Link To Document :
بازگشت