[CP2K-user] Output File Size Problem
dev.... at gmail.com
Fri Feb 21 22:40:05 UTC 2020
I was hoping for a global solution but I will have to do it this way if
there is none.
On Friday, February 21, 2020 at 10:45:15 AM UTC-5, Fabian Ducry wrote:
> Dear Devyesh,
> every print section has an "EACH" subsection where you can specify how
> often it should be printed. E.g. for Mulliken:
> MD 10
> &END EACH
> &END MULLIKEN
> I don't think there is a global way to set this parameter.
> On Friday, 21 February 2020 16:34:01 UTC+1, Dev Rana wrote:
>> I'm printing quite a lot of output information - trajectory, velocity,
>> force, energy, MO, MO_CUBE, Mulliken, PDOS. This is subsequently making my
>> output files massive. Is there a way to split the output file so I can for
>> example, get 1 output per 10 MD steps?
>> Best Regards,
>> Devyesh Rana
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