[CP2K-user] [CP2K:19933] Energies of the atoms of my system
Nathalie Smith
nathaliesmith26 at gmail.com
Tue Feb 20 13:26:59 UTC 2024
Hello everyone,
I am trying to run a MD simulation and want to print the energies of each
atom, similarly to the force output of MOTION/PRINT/FORCES. Could someone
kindly tell me where to find such an option in CP2K? Thanks in advance!
Best wishes,
Nathalie Smith
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