bug in cipt2

Dr. Paolo Celani celani at indy4.theochem.uni-stuttgart.de
Sat Mar 23 11:27:34 GMT 2002


In the present implementation CIPT2 does not allow to perform multistate
calculation but only single state, single reference calculations like for example


for the second root.
I placed an explicit trap to block multistate calculations in previous versions of the code
but I must have removed it inadvertently as I worked to later versions.
I will make a patch as soon as possible to stop immediately a CIPT2
calculation involving more than 1 reference/state.

Sorry for the inconvenience.

Paolo Celani

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