[QE-users] Vanderwaals contribution to total energy

masood yousaf masood.yousaf at ue.edu.pk
Sun May 6 20:14:47 CEST 2018

Dear Members,

I am using QE v.5.1. I am doing total energy calculations, At the end of
the run, I can see total energy that includes vanderwaals correction
but  *how/where
can I see the amount of energy contributed by vanderwaals correction (or
alternatively total energy without vanderwall correction).*

I am using the followings tags in my input file.


Thank you very much !

Best wishes
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20180506/51f89f0c/attachment.html>

More information about the users mailing list