omea state assignment

Antara Dutta adutta at tlanta.com
Sun May 18 22:01:00 BST 2003


Hello Group,
I'm having problem in assigning omega (spin-orbit) states done
in my calc. on top CASSCF of the system I+O2. I've total 96 omega
states and they  are of 1/2, 3/2, 5/2,7/2,9/2 . I would be thankful
if anybody can provide any systematic method (or any specific
trick) to assign those states correctly.

Regards,
Antara





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