Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5386707 | Chemical Physics Letters | 2009 | 4 Pages |
Abstract
The CPU time for a QTAIM property calculation can be reduced to that of a SCF-single point calculation.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
Juan I. RodrÃguez, Richard F.W. Bader, Paul W. Ayers, Carine Michel, Andreas W. Götz, Carles Bo,