CP2K does not print COLVAR in every MD step
jts2t... at gmail.com
jts2t... at gmail.com
Mon Nov 20 01:51:31 UTC 2017
You can set it in the PRINT subsection. The details you can refer to the
manual of CP2K.
在 2017年11月20日星期一 UTC+8上午12:06:01,luj... at gmail.com写道:
>
> Dear all,
> I use CP2K+PLUMED to do metadynamics. But I find that CP2K does not
> print COLVAR and HILLS in every MD step until the MD finished. So I can not
> get the COLVAR information in every step. The attached files are my input
> files. Can anyone give a help for me?
> Best regards,
> Junbo
>
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