[gmx-users] Three-site model for acetonitrile

Christoph Freudenberger christoph.freudenberger at chemie.uni-ulm.de
Mon Feb 24 13:03:39 CET 2003

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oopss, forgot the cut-offs:

rlist        = 1.2
rcoulomb     = 1.2
rvdw         = 1.2

regards
-- 
Christoph Freudenberger
Abt. Organische Chemie I AK Siehl - Uni Ulm -Tel: ++49-731-502-2785

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