[CP2K-user] Geometric constraints in CP2K

Nam Tran trann... at gmail.com
Mon Jul 22 04:20:17 UTC 2019

Dear CP2K's experts

Is there a way or trick to perform complex constraints in CP2K ?. 
For example, I want to fix the center of a Benzen ring on top of a surface 
but lets the atoms of the molecule to routate freely around this center. 

Best regards
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