how to calculate the spin natural orbital

Started by ardie, November 13, 2012, 01:35:05 PM

Previous topic - Next topic
Print
Go Down Pages1
User actions

ardie

November 13, 2012, 01:35:05 PM
Dear all,
Is it possible to calculate the spin natural orbital of an open-shell system by Turbomole? If so, how to do it? Thanks.

Ardie
Print
Go Up Pages1
User actions