[CP2K-user] [CP2K:15315] Number of steps not matching

[Krack Matthias (PSI)]

Hi Sumit

Did you check the output file? Maybe, your job hit an execution time limit.

Matthias

Von: cp... at googlegroups.com <cp... at googlegroups.com> Im Auftrag von sumit agrawal
Gesendet: Samstag, 8. Mai 2021 10:24
An: cp... at googlegroups.com
Betreff: [CP2K:15315] Number of steps not matching

Hii,

I am trying to equilibrate my system for 2000 steps (1ps). And after completion of this I'm getting only 865 steps (0.43 ps) in my .ener file. Can anybody help me on this?

Thanks,
Sumit
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