[Pw_forum] force and stress in the Berry phase method
hanghui chen
chenhanghuipwscf at gmail.com
Mon Mar 30 22:20:02 CEST 2009
Dear PWSCF users,
In addition to my previous email, I would like to know: if I use
ultrasoft psedopotential, are the forces and stress correctly calculated in
the Berry phase method in the latest version 4.0.4?
Thank you very much.
Hanghui Chen
Department of Physics,
Yale University
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20090330/7a46afbe/attachment.html>
More information about the users
mailing list