[CP2K-user] How to use optB88-vdW functional correctly in cp2k?

Nimali Rathnayake nimalira... at gmail.com
Mon Sep 23 04:21:49 UTC 2019


Dear CP2k users,

I am trying to use the optB88-vdW function in cp2k for my calculations.

Can anyone teach me how to put this function under XC subsection?

Thank you.

Kind regards,

Nimali
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