[QE-users] Problem using ph.x with DFPT+U in QE 6.4.(1)
Paolo Giannozzi
p.giannozzi at gmail.com
Wed Nov 13 15:19:53 CET 2019
On Wed, Nov 13, 2019 at 11:54 AM Timrov Iurii <iurii.timrov at epfl.ch> wrote:
Paolo: I do not know what to say why you obtain NaN's...
>
nor do I, since the NaN's have disappeared after I recompiled with debug
flags!
Paolo
--
Paolo Giannozzi, Dip. Scienze Matematiche Informatiche e Fisiche,
Univ. Udine, via delle Scienze 208, 33100 Udine, Italy
Phone +39-0432-558216, fax +39-0432-558222
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20191113/d1b7d0ce/attachment.html>
More information about the users
mailing list