[molpro-user] freeze virtual

Jacek Koput koput at amu.edu.pl
Wed May 1 10:58:49 BST 2013


Dear All,

I have a simple question (and cannot find the answer in the manual): Is it 
possible in Molpro to freeze some highest energy unoccupied orbitals in the 
correlation treatment (no excitations into these orbitals)?

Best wishes,
Jacek Koput



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