Firefly and PC GAMESS-related discussion club



Learn how to ask questions correctly


define solvents in pcm model

Ahmad Mashhadi
ahmad_1865@yahoo.com


Hello dear reader,
I’m going to run my job in pcm solvent model. We have example of the default solvent names is in the samples ($pcm    solvnt=water $end). But nothing for something likes this:
$pcm   radius=2.94 dielec=8.93 $end
Please guide me.
truly

[ Previous ] [ Next ] [ Index ]           Wed Jul 14 '10 9:08pm
[ Reply ] [ Edit ] [ Delete ]           This message read 962 times