[CP2K-user] Classical Forcefield

Pierre-André Cazade pierre.a... at gmail.com
Tue Jun 9 12:41:22 UTC 2020


Dear CP2K users,

I would like to know which types of classical forcefields CP2K is capable 
of handling. I am well aware of the types of input formats CP2K can read 
(Amber, Charmm, Gromos) but I am more interested in the nature of the 
forcefield. Aside from Amber, Charmm and Gromos forcefields, can CP2K use 
AMOEBA? Can it use a multipolar model? What are the limits in terms of 
potential forms? etc

Regards,
Pierre 
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