[CP2K-user] [CP2K:16961] Change hydrogen mass for molecular dynamics
Raghav
raghavsaxena24 at gmail.com
Fri May 13 02:33:27 UTC 2022
Dear cp2k community,
Is it possible to change mass of hydrogen to that of deuterium or tritium
for AIMD simulations? I want to use heavier hydrogen isotopes to leverage
larger time step.
Best Regards,
Raghav Saxena
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