Posted by Ivan Cernusak on July 23, 2015 at 15:01:39:
From vers. 7.9 Molcas RASSI prints msg:Omega values will not be computed.Looks like it does it unconditionally.Also Abs_M are not printed in spin-free version.
Why?
I.
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if B is 1s22s22p1, what is Li?
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Comments: : From vers. 7.9 Molcas RASSI prints msg: : Omega values will not be computed. : Looks like it does it unconditionally. : Also Abs_M are not printed in spin-free version. : Why? : I.