<html>
<head>
<meta http-equiv="Content-Type" content="text/html; charset=utf-8">
</head>
<body style="word-wrap: break-word; -webkit-nbsp-mode: space; line-break: after-white-space;" class="">
Hi Konda,
<div class=""><br class="">
</div>
<div class="">I have had the same issue with the latest QE. I found that by running QE (under slurm) with the following command always avoids the cholesky issue:</div>
<div class=""><br class="">
</div>
<div class="">srun pw.x -npools $SLURM_NTASKS < relax.in > relax.out</div>
<div class=""><br class="">
</div>
<div class="">Don’t ask why because I do not know.</div>
<div class=""><br class="">
</div>
<div class="">Cheers,</div>
<div class="">Vahid </div>
<div class=""><br class="">
</div>
<div class="">Vahid Askarpour<br class="">
Department of physics and atmospheric science<br class="">
Dalhousie University<br class="">
Halifax, NS<br class="">
CANADA<br class="">
<div><br class="">
<blockquote type="cite" class="">
<div class="">On Aug 25, 2021, at 7:09 AM, Kondaiah Samudrala <<a href="mailto:konda.physics@gmail.com" class="">konda.physics@gmail.com</a>> wrote:</div>
<br class="Apple-interchange-newline">
<div class="">
<div class=""><!-- START CAUTION Box Code -->
<table align="center" border="0" cellpadding="0" cellspacing="0" style="padding:10px 0 10px 0" width="100%" class="">
<tbody class="">
<tr class="">
<td style="line-height:0px;font-size:0px;mso-line-height-rule:exactly;" class="">
<table align="center" border="0" cellpadding="0" cellspacing="0" style="background:#707372;background-color:#707372;width:100%;border-radius:5px;overflow:hidden;" class="">
<tbody class="">
<tr class="">
<td style="border-top:solid 8px #fbe122;padding:4px 8px;text-align:left;vertical-align:top;" class="">
<table role="presentation" border="0" cellpadding="0" cellspacing="0" class="">
<tbody class="">
<tr class="">
<td align="left" class="">
<div style="font-family:Arial,sans-serif;font-size:12px;line-height:16px;text-align:left;color:#ffffff;" class="">
<span style="font-weight:bold;font-size:12px;" class="">CAUTION:</span> The Sender of this email is not from within Dalhousie.</div>
</td>
</tr>
</tbody>
</table>
</td>
</tr>
</tbody>
</table>
</td>
</tr>
</tbody>
</table>
<!-- END CAUTION Box Code -->
<div class="">
<div dir="ltr" class="">Dear Paolo,
<div class=""><br class="">
<div class="">This is happening for the past two months for every input structure with new intel compilers(2020). If I use internal lapack and blas, then the same input is running without any errors. But the computational time is very high while using internal
lapack and blas. </div>
<div class="">If need I can share the inputs with you personally for the test run(PS: this work is going to publication). I am very confident about my input structure but somehow diagonalization process is having some issues (I am not a developer but frequent
use. If I am wrong consider my apologies). Kindly help me in this regard</div>
<div class=""><br class="">
</div>
<div class="">with Regards</div>
<div class="">Konda</div>
<div class=""> <br clear="all" class="">
<div class="">
<div dir="ltr" class="gmail_signature" data-smartmail="gmail_signature">
<div dir="ltr" class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">Dr.
</font><font style="vertical-align:inherit" class="">Samudrala Appalakondaiah</font></font>
<div class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">Postdoctoral Researcher</font></font></div>
<div class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">Department of Physics, </font></font></div>
<div class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">University of Seoul, Seoul 02504</font></font></div>
<div class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">South Korea</font></font></div>
<div class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">Phone no : +821028514541</font></font></div>
<div class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">Google Scholar ID: </font></font><a href="https://scholar.google.co.in/citations?user=d8_gVLwAAAAJ&hl=en" target="_blank" class=""><font style="vertical-align:inherit" class=""><font style="vertical-align:inherit" class="">https://scholar.google.co.in/citations?user=d8_gVLwAAAAJ&hl=en</font></font></a> </div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
</div>
_______________________________________________<br class="">
Quantum ESPRESSO is supported by MaX (<a href="http://www.max-centre.eu" class="">www.max-centre.eu</a>)<br class="">
users mailing list <a href="mailto:users@lists.quantum-espresso.org" class="">users@lists.quantum-espresso.org</a><br class="">
<a href="https://lists.quantum-espresso.org/mailman/listinfo/users" class="">https://lists.quantum-espresso.org/mailman/listinfo/users</a></div>
</blockquote>
</div>
<br class="">
</div>
</body>
</html>