<div dir="ltr"><div dir="ltr">Yes, this works. <div>Thank you so much. </div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Oct 8, 2021 at 9:41 PM Pietro Bonfa' <<a href="mailto:pietro.bonfa@unipr.it">pietro.bonfa@unipr.it</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0px 0px 0px 0.8ex;border-left:1px solid rgb(204,204,204);padding-left:1ex">Does this work?<br>
<br>
export OMP_NUM_THREADS=1<br>
mpirun -np 1 pw.x -inp <a href="http://input.in" rel="noreferrer" target="_blank">input.in</a><br>
<br>
<br>
Best,<br>
Pietro<br>
<br>
On 10/8/21 18:08, Anson Thomas wrote:<br>
> Thanks for the suggestion.<br>
> I exported OMP_NUM_THREADS= 1 to my bashrc (I am not using a script to<br>
> run QE; doing it directly using mpirun pw.x -inp <a href="http://input.in" rel="noreferrer" target="_blank">input.in</a><br>
> <<a href="http://input.in/" rel="noreferrer" target="_blank">http://input.in/</a><br>
> > output). However, it is still giving the same error<br>
><br>
> from addusdens_gpu : error # 1<br>
> cannot allocate aux2_d<br>
><br>
> I even tried experimenting with OMP_NUM_THREADS= 2,3 .. but all in vain.<br>
> Also, I have noted that always MPI processes is distributed on 1 node<br>
> only regardless of the number of threads or processors (using mpirun -np<br>
> ) provided.<br>
><br>
> Do you have any other suggestions?<br>
><br>
><br>
> Regards,<br>
> Anson<br>
><br>
><br>
><br>
><br>
><br>
><br>
> --<br>
> Sent by *ANSON THOMAS*<br>
> *M.Sc. Chemistry, IIT Roorkee, India*<br>
<br>
<br>
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</blockquote></div><br clear="all"><div><br></div>-- <br><div dir="ltr" class="gmail_signature"><div dir="ltr">Sent by <b>ANSON THOMAS</b></div><div><b>M.Sc. Chemistry, IIT Roorkee, India</b></div></div></div>