[molpro-user] (no subject)

george george.iitm at gmail.com
Thu Nov 8 10:59:45 GMT 2012


Hello all

          I like to compute two state diabatization with molpro involving
two different symmetries.
The example given in the manual highlights the diabatization involving the
same symmetries.
I will be happy if anyone provides me an input file for diabatization for
two different symmetries.


Thanks in advance
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