[CP2K-user] polarizable embedding QM/MM in CP2K?

Xiuyun strawber... at gmail.com
Thu Feb 21 22:04:55 UTC 2019

Dear community

I am wondering if anyone knows whether there is any way to do polarizable 
embedding QM/MM in CP2K? I have tried a setup with normal QM/MM where in 
the MM section I used AMBER02 polarizable force field. But this setting 
only did a polarizable MM calculation in MM region only (rather than 
self-consistently iterating QM with MM-pol), which is not what I want.

Kind regards,
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