[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
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <https://lists.cp2k.org/archives/cp2k-user/attachments/20200324/777ece04/attachment.htm>
More information about the CP2K-user
mailing list