[molpro-user] excited state geometry optimization
Subhendu Ghosh
sgchem865 at gmail.com
Mon Feb 24 11:42:31 GMT 2014
Sir,
What will be the input for geometry optimization of a molecule in 1st
singlet excited state (S1) in CASSCF(8,8) method?
thanks.
--
*Best Wishes & Regards*
*Subhendu Ghosh*
*Banaras Hindu University*
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