[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."
>
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--
------------------------------------------------------------------------------------------------
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
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