[CP2K-user] [CP2K:16546] Restart run. Help wanted.
z sh
zsh192095 at gmail.com
Sat Feb 5 15:13:55 UTC 2022
Hello everyone,
I am trying to do vibrational analysis for the liquid phase system of ionic
liquids. I am following the tutorial" Computing Bulk Phase Vibrational
Spectra with CP2k and TRAVIS (2018)". Initially, I have done massive
equilibration for 6000 steps. Unfortunately, the run was failed after 3000
steps, due to hardware failure. I don't know how can restart this run.
Would you please guide me on how to restart this run?
Please help me.
Thanks.
--
You received this message because you are subscribed to the Google Groups "cp2k" group.
To unsubscribe from this group and stop receiving emails from it, send an email to cp2k+unsubscribe at googlegroups.com.
To view this discussion on the web visit https://groups.google.com/d/msgid/cp2k/0d19ca15-8199-4608-85ca-b0459b140569n%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220205/1e58bb19/attachment.htm>
More information about the CP2K-user
mailing list