[molpro-user] caculation of State-Average CASSCF with different irreducibile representation?

der Anbeter des Geistes 945129408 at qq.com
Mon Sep 25 04:26:36 CEST 2017


Dear Molpro user's
 How to set different {occ,cloesd,wf} option in one State-Average calculation,becasue of the states with different irreducible representation?
 Thanks!
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