[molpro-user] Analytical Hessian for SA-CASSCF
SCAr Chung
s4c6ar at gmail.com
Wed Nov 21 08:08:52 GMT 2012
Dear all,
I can successfully run analytical Hessian for CASSCF (S0 only), but I
can't manage to run analytical Hessian for SA-CASSCF. I use Molpro2012. Is
analytical Hessian available for SA-CASSCF? Thanks for any comments.
Best Wishes,
Oscar
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