[CP2K-user] Output File Size Problem

Dev Rana dev.... at gmail.com
Fri Feb 21 22:40:05 UTC 2020


Thanks Fabian!

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:
> &MULLIKEN
>   &EACH
>     MD 10
>   &END EACH
> &END MULLIKEN
>
> I don't think there is a global way to set this parameter.
>
> Best,
> Fabian
>
>
> On Friday, 21 February 2020 16:34:01 UTC+1, Dev Rana wrote:
>>
>> Hello,
>>
>> 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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