[QE-users] Missing Hubbard atoms from ATOMIC_POSITIONS card

[Paolo Giannozzi]

On Fri, Feb 21, 2020 at 8:45 PM Hooman Yaghoobnejad Asl <hynr8 at mst.edu>
wrote:


> "     WARNING! All Hubbard atoms must be listed first in the
> ATOMIC_POSITIONS card of PWscf
>      Stopping..."
> Any hint to show me what I'm doing wrong is highly appreciated.
>

hint: read the above message. It tells you exactly what you need to do

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/20200222/3e4f965e/attachment.html>