Gamess->Estar
Hi gamess users and CClers,
I am a novice user of the gamess programm. My general problem is to
calculate multipoles for big molecules. I thought to use gamess to
calculate the multipoles on the molecule's fragments and then reconstruct
the whole molecule using the estar program.
here is my question:
there is anyone out there that can tell me if exist any conversion routine
from the gamess output to estar?
Any suggestion would be appreciated.
Thank to all
Ciao
-- Rino Ragno
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