[CP2K-user] [CP2K:16913] MPI version of Multiple walkers metadynamics with PLUMED
qingh...@gmail.com
qingh.liao at gmail.com
Wed May 4 13:11:24 UTC 2022
Hello,
With FARMING, it is possible to run metadynamics with multiple walkers with
CP2K.
For the file-shared multiple walkers, sure, I think it can be done. But for
the MPI version
of multiple walker metadynamics, how should I let the walkers read bias
from other walkers, but not just running independently? Any suggestions are
appreciated.
All the best,
Qinghua
--
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/6600f009-6571-47d1-82a7-f25d6d3c5e32n%40googlegroups.com.
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20220504/c8b26b82/attachment.htm>
More information about the CP2K-user
mailing list