Monte Carlo simulations

7 views

Skip to first unread message

jona...@hotmail.com

unread,

May 5, 2025, 5:04:44 AMMay 5

to cp2k

Hi!

I'm wondering if CP2K has the ability to preform Path Integral Monte Carlo (PIMC), Variational Monte Carlo (VMC) or Diffusion Monte Carlo simulations (DMC)?

I can see that CP2K has the PINT module which at least supports Gibbs ensemble Monte Carlo, but nothing more is indicated.

Best regards,

Jonas Båtnes

Reply all

Reply to author

Forward

0 new messages