omea states assignment

Antara Dutta dutta at euch4e.chem.emory.edu
Sun May 18 21:55:58 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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