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<p class="MsoNormal"><span style="font-size:11.0pt">Hi,<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">I am sending this message as I am running into some issues when trying to perform a pw.x calculation.<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">I am using a hybrid approach, with the flag input_dft = b3lpyv1r. The first SCF calculation can be performed, however when it comes to introducing the hybrid correction the program stops with the mpi exit
code 9 error. <o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">I am running this on a HPC, and I am using 100+ processors. I am also using the pw.x -pd .true flag in the command line.<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">I normally up the number of processors needed when I encounter this issue, however I have a similar calculations, similar structure but same hybrid correction, that uses a lot less processors to run.<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">Is there something I am missing?<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">Thank you for your help, and if there is anything else I can provide that will aid in this request I will try to provide it.<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">Thanks you again<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt">Joseph Page<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;color:black">Research Associate<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;color:black">Department of Physics<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;color:black">Loughborough University<o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt;color:black">j.page3@lboro.ac.uk
</span><span style="font-size:11.0pt"><o:p></o:p></span></p>
<p class="MsoNormal"><span style="font-size:11.0pt"><o:p> </o:p></span></p>
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