[Molpro-user] CASPT2 transition density
oedoen at web.de
oedoen at web.de
Tue Aug 19 16:09:21 BST 2008
Dear MOLPRO users,
I would like to calculate an overlap and transition density with CASPT2 for the ground and excited state and store them to files.
How can I do that?
Thank you very much for your help,
Robert
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