[CP2K-user] [CP2K:16456] Restart MD simulation

Thorren Kirschbaum thorren100 at gmail.com
Fri Jan 14 10:44:00 UTC 2022

Hello everyone,

I have an MD trajectory from a third party and I want to restart the 
propagation from a specific frame of that trajectory. Can I do that with 
cp2k, e.g. by calculating the current velocities of the atoms and providing 
them to cp2k in the input somewhere?

Thank you in andvance and best

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