[CP2K-user] [CP2K:20189] Re: unable to analyse the metadynamics output file of the cp2k

'Karl Irikura' via cp2k cp2k at googlegroups.com
Tue May 7 21:33:31 UTC 2024


I have the same question.  That tutorial does not explain how to extract 
free energy information from the output files.  

Thanks for any tips,
Karl

On Thursday, January 11, 2024 at 7:52:20 AM UTC-5 Marcella Iannuzzi wrote:

> Please refer to some tutorial like
> https://www.cp2k.org/exercises:2015_cecam_tutorial:mtd1
>
> Regards
> Marcella
>
>
> On Wednesday, January 10, 2024 at 1:02:01 PM UTC+1 cy22res... at iith.ac.in 
> wrote:
>
>> Hey Good afternoon everyone
>> Can anybody known how to analysis the cp2k metadynamics file? Please help 
>> if possible
>> Thank you
>> Deewan
>>
>

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