[Pw_forum] QE with EPW 3.0

Samuel Poncé samuel.pon at gmail.com
Tue Apr 26 13:25:05 CEST 2016


Dear A.Anandaraman,

EPW is only parallelized over k-points. You therefore need to run it with
-npool. In your case it would be something like:

mpirun -np 4 XXX/epw.x -npool 4 < input_file.

Please note that the version 4 of EPW is now available in the QE 5.4.0
package.

Best,

Samuel



On 25 April 2016 at 11:27, Anandaraman Raman <rmkaadhi at gmail.com> wrote:

> Dear Sir,
>
> I installed espresso 4.0.3 with EPW3.0, When is am running EPW with 4
> cores. I am encountering the following error.
>
> Can any one suggest me the changes I want to do to run it in parallel?
>
>
>
> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>      from setphases_wrap : error #         1
>      only one proc per pool
>
>  %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
>
>      stopping ...
>
>
>
> Regards
> A.Anandaraman
>
> --
> "Religion is just a set of symbols. It is being hijacked for political and
> monetary gains."
>
> _______________________________________________
> Pw_forum mailing list
> Pw_forum at pwscf.org
> http://pwscf.org/mailman/listinfo/pw_forum
>



-- 

------------------------------------------------------------------------------------------------
    Dr. Samuel Poncé
    Department of Materials
    University of Oxford
    Parks Road
    Oxford OX1 3PH, UK

    Phone: +44 1865 612789
    email: samuel.ponce at materials.ox.ac.uk  <fabio.caruso at materials.ox.ac.uk>
    web: http://giustino.materials.ox.ac.uk/index.php/Site/SamuelPonc%e9
------------------------------------------------------------------------------------------------
-------------- next part --------------
An HTML attachment was scrubbed...
URL: <http://lists.quantum-espresso.org/pipermail/users/attachments/20160426/eecbf616/attachment.html>


More information about the users mailing list