Title of article :
Improved definition of bond orders for correlated wave functions
Author/Authors :
Mayer، نويسنده , , I.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 2012
Abstract :
The definition of bond orders for singlet correlated wave functions is improved by adding a term providing the correct dissociation behaviour if the system dissociates into open-shell fragments.
Journal title :
Chemical Physics Letters
Journal title :
Chemical Physics Letters
