[CP2K-user] [CP2K:20760] Dipole of PIMD in CP2K

[sh X]

Dear all,


The dipole moments output by CP2K when doing a PIMD simulation seem to be 
the dipole moments of all the beads individually defined. If I want to get 
the dipole moment of the centroid, how should I set it up?


Thank you all in advance for any help.


Best regards,

hsuh

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