[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://www.democritos.it/pipermail/pw_forum/attachments/20090330/7a46afbe/attachment.htm 


More information about the Pw_forum mailing list