[molpro-user] DDR, MIXING, ENERGY
William Chua
dodong70 at yahoo.com
Tue May 31 17:28:33 BST 2005
Dear Molpro Users,
In the case of
DDR
Mixing, state1, state2
Energy, e1, e2
should I be careful about the order of states and
energies? That is, will I get the same results if I do
DDR
Mixing, state1, state2
Energy, e2, e1
or
DDR
Mixing, state2, state1
Energy, e1, e2 ?
Best Regards,
Chua
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