[CP2K-user] Widom Particle Insertion Method
Josue Raya
josue... at gmail.com
Thu May 20 20:52:20 UTC 2021
Hi, we want to do some random and periodic insertions of particles in an
existent cp2k trajectory of molten salt to calculate energy differences
between states. Is there a way to do this in cp2k? If not what would be a
good way to do random particle insertions periodically on a pure molten
salt? I appreciate you help in advance.
Blessings!
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