[CP2K-user] How to implement the polarizable ion model in cp2k for molecular dynamics simulation?

Qiong Cai qiongc... at gmail.com
Tue May 12 20:53:20 UTC 2020


We want to do MD simulations for a molten salt mixture system. From 
literature we find that people use cp2k with the polarizable ion model 
(PIM). However, it seems that there is no PIM force field in cp2k. Does 
anybody know how to implement the PIM in cp2k? Many thanks
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