[CP2K-user] [CP2K:15316] Number of steps not matching

[sumit agrawal]

Hello Matthis,

I increase the walltime of my job. Now it's working fine.

Thanks,
Sumit

On Sat, May 8, 2021 at 5:57 PM Krack Matthias (PSI) <matthi... at psi.ch>
wrote:

> 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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