[QE-users] Problem when running pw.x relax calculation on supercomputer
Paolo Giannozzi
p.giannozzi at gmail.com
Mon Nov 19 15:15:05 CET 2018
On Mon, Nov 19, 2018 at 3:04 PM Chan, Edmund <thc208 at exeter.ac.uk> wrote:
>
>
> It is not a problem regarding submitting the job to supercomputer
>
it is not a problem of QE either. See here:
https://www.quantum-espresso.org/Doc/pw_user_guide/node21.html#SECTION00060010000000000000
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
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