[Pw_forum] london=true
Mohamad Moadeli
mohammad.moaddeli at gmail.com
Thu May 7 08:43:59 CEST 2015
Dear all,
I set london=.true. in a pw input file in order to include vdW forces. The
QE 5.1.1 output is:
....
Message from routine iosys:
london is obsolete, use "vdw_corr='grimme-d2'" instead
....
not seen before in the previous versions. Is it wrong to set london=.true.
? Final answers are different?
Any help will be greatly appreciated.
Mohammad Moaddeli,
Shahid Chamran University of Ahvaz, Ahvaz, Iran
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20150507/92e53187/attachment.html>
More information about the users
mailing list