[molpro-user] SAPT performance
berger at chem.helsinki.fi
Sun Nov 7 18:25:04 GMT 2010
I try to do some SAPT calcluations on a "relatively small" symmetric
Somehow I feel, that it runs not all too fast. I tried to use all the
possible speed-up options which I am aware of.
I wonder if there are other possibilities to increase the performance.
For instance the monomer B calculation is exactly the same as the monomer
I would be very grateful for any hints and suggestions (input is
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