restarting calcuation

salah boulf... at googlemail.com
Mon Dec 13 16:43:25 CET 2010


hi, try this

&EXT_RESTART
  RESTART_FILE_NAME myprojectname-1.restart
&END

regards,
salah

On Dec 11, 11:41 am, LS <laksh... at gmail.com> wrote:
> Hi,
>
> I would like to know how I can restart a MD calculation from where it
> stopped. Can I use the output restart files through some key word for
> this? Any help is appreciated.
>
> Thanks,
> Lakshmi


More information about the CP2K-user mailing list