Recent Changes - Search:

edit SideBar


QRHFIRR The symmetries of the orbitals which are involved in the QRHF orbital occupation alteration. A minus sign indicates that a $\beta$ orbital of the associated symmetry will be depopulated, while a positive sign indicates that an $\alpha$ orbital will be populated.

Data type: floating point. Dimension: QRHFTOT. Written by: xjoda.

Edit - History - Print - Recent Changes - Search
Page last modified on June 10, 2011, at 05:05 AM
This page has been visited 537 times since December 2010.
CFOUR is partially supported by the U.S. National Science Foundation.