[CP2K-user] AIMD energy profile

Akshay Malik akshayma... at gmail.com
Wed Oct 2 20:20:58 UTC 2019

In the AIMD energy profile(energy VS time(fs)) there is a sudden increase
in energy initially and then it decreases but even after running for 6 ps
it is not coming down from the initial value.
Can anyone please tell me what can be the possible error.
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