Dear all users,
I want to create e prepin file for Potassium cation. For this i use
following procedure- First i make a neutral pdb in Gaussian and then
convert it into .com file using Antechamber as follows-
antechamber -i K.pdb -fi pdb -o K.com -fo gcrt -gv 1 -ge K.resp -nc 1
Then i load this .com file in G09 and calculate job but i got error. Can
anyone told me what is going wrong.
--
Robin Jain
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Received on Fri Jul 03 2015 - 00:30:02 PDT