[CP2K-user] Tree monte carlo (TMC) algorithm

pankaj singh pokhriya pankajsingh... at gmail.com
Wed Mar 25 04:20:53 UTC 2020


Hello everyone,

I am trying to calculate dipole moment of As2Se3 using TMC.
I want to know if there is a way to calculate the values of SIZE & PROB 
keywords of subsection MOVE_TYPE of section TMC and keyword CHARGE of 
subsection CHARGE?

Thank you for your time

Best Regards,
Pankaj Singh Pokhriya
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