[molpro-user] excited states

oliver.potzel at uni-ulm.de oliver.potzel at uni-ulm.de
Fri Jun 12 11:06:15 BST 2009


Hello,
I`m new to MOLPRO and still a little puzzled about the wavefunktion  
and symmetry
input. Can anybody please give me an example for the
wf, closed, open variables for the triplet and the singlet state of magnesium
Rydbergstate 1s2 2s2 2p6 3s1 5s1.

thank you
Dr. Oliver Potzel



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