Re: population analysis with RASSCF

Posted by Samira mecabih on October 30, 2001 at 12:30:16:

In Reply to: population analysis with RASSCF posted by Martinez Jean-Raphael on September 03, 2001 at 15:10:29:

: In the RASSCF the total mulliken population is given.
: Is it possible to have an analysis of the population
: of each occupied orbital in the RASSCF code ?
: If so, how do I do it ?

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: : In the RASSCF the total mulliken population is given. : : Is it possible to have an analysis of the population : : of each occupied orbital in the RASSCF code ? : : If so, how do I do it ?