[CP2K-user] A question about running plumed together with cp2k
Hang LYU
terryh... at gmail.com
Thu Apr 15 07:51:59 UTC 2021
Dear users and developers,
I am running a dft-based metadynamics using cp2k and plumed. I follow
the instruction in the cp2k website to trigger the plumed interface, and
cp2k can successfully run together with plumed. However, the simulation
doesn't write the HILLS file after it was created. The HILLS file remains
vacant after 7000 timesteps (The stride I set to dump the gaussian hills is
500). My question is whether anyone in the group also encountered this kind
of problem when running cp2k together with plumed. Does this means that
there are some problems in building the interface between cp2k and plumed?
Best wishes,
Hang LYU
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