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<p>I used to run the older version of QE in parallel on a cluster using SLURM with the following command in job script and it worked fine.
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<p> <b>mpirun </b><b>pw.x -inp $INPUTFILE</b></p>
<p><b><br>
</b></p>
<p>However, after I compiled it to the newer version 6, apparently the simulation gets frozen (it dumps some information on the output file though). It recognizes the parallel version also (writes down the number of processors at the beginning of the output
file). So I can't diagnose what the problem is. Any help would be thoroughly appreciated.
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<div id="x_divRplyFwdMsg" dir="ltr"><font face="Calibri, sans-serif" color="#000000" style="font-size:11pt"><b>From:</b> pw_forum-bounces@pwscf.org <pw_forum-bounces@pwscf.org> on behalf of Filippo SPIGA <filippo.spiga@quantum-espresso.org><br>
<b>Sent:</b> Wednesday, November 23, 2016 4:57:06 AM<br>
<b>To:</b> PWSCF Forum<br>
<b>Subject:</b> Re: [Pw_forum] Running in Parallel</font>
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<div class="PlainText">On Nov 22, 2016, at 11:48 PM, Mofrad, Amir Mehdi (MU-Student) <amzf5@mail.missouri.edu> wrote:<br>
> After I compiled version 6 I can't run it in parallel.<br>
<br>
A bit more information about how you compiled and how your run will be useful to understand your problem<br>
<br>
--<br>
Filippo SPIGA ~ Quantum ESPRESSO Foundation ~ <a href="http://www.quantum-espresso.org">
http://www.quantum-espresso.org</a><br>
<br>
<br>
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