[CP2K-user] Initial velocity of impinging molecule
Amin
amin.ja... at gmail.com
Wed May 22 13:19:09 UTC 2019
Dear CP2K experts,
My question may seem very trivial but considering that I'm very new to the
field of AIMD simulations with CP2K, I hope it can be bearable :)
How can I specify the initial velocity of an impinging molecule (toward the
surface) while the rest of the system has zero initial velocity?
I'm going to to AIMD bu using a GLE thermostat. I do appreciate any remark
or advise.
All the best,
Amin
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20190522/a6fb6bfd/attachment.htm>
More information about the CP2K-user
mailing list