fellow users.
i have an easy casscf question, but one that is confusing me. with gaussian i can interchange orbitals if i have to by using
Guess=Alter
in the route section, and then adding which orbitals to interchange below the molecule specification section,
11, 13
16, 18im not sure how to do this molpro. im most likely getting bogged in terminology. i would appreciate any help anyone might have.
thanks.
p
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