<div dir="ltr"><div dir="ltr"><div class="gmail_default" style="font-size:small">Seems you are trying to restart your calculations. Searching a bit on google or qe-archive might help you; please see this link: <a href="https://lists.quantum-espresso.org/pipermail/users/2017-November/039771.html">https://lists.quantum-espresso.org/pipermail/users/2017-November/039771.html</a></div><div class="gmail_default" style="font-size:small"><br></div><div class="gmail_default" style="font-size:small"><br clear="all"></div><div><div dir="ltr" class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div><div dir="ltr"><div><div dir="ltr"><div><div dir="ltr"><span style="color:rgb(56,118,29)"><b><span style="background-color:rgb(243,243,243)"></span></b></span><div><span style="color:rgb(56,118,29)"><b><span style="background-color:rgb(243,243,243)">With kind regards,<span></span><br></span></b></span></div><div><span style="color:rgb(56,118,29)"><b><span style="background-color:rgb(243,243,243)">S Kumar | PhD.<br></span></b></span></div><div><span style="color:rgb(56,118,29)"><b><span style="background-color:rgb(243,243,243)"><span class="gmail_default" style="font-size:small">ICReDD,</span></span></b></span></div><div><span style="color:rgb(56,118,29)"><b><span style="background-color:rgb(243,243,243)"><span class="gmail_default" style="font-size:small">Hokkaido University, Japan</span><br></span></b></span></div><span style="color:rgb(56,118,29)"><b><span style="background-color:rgb(243,243,243)"></span></b></span></div></div></div></div></div></div></div></div></div></div></div><br></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Fri, Oct 4, 2019 at 6:54 PM Maxim Arsentev <<a href="mailto:arsentev@isc.nw.ru">arsentev@isc.nw.ru</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">Dear Quantum ESPRESSO users and developers,<br>
<br>
When running my input with fhi pseudos from espresso database I got this <br>
error<br>
<br>
<br>
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
task # 0<br>
from pw_readfile : error # 1<br>
error opening xml data file<br>
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
<br>
Do I have too many waves for my computer (reduce cutoff)? How to make <br>
this task converged?<br>
<br>
I attach the files<br>
<a href="https://cloud.mail.ru/public/2Dzt/5rjkGS12j" rel="noreferrer" target="_blank">https://cloud.mail.ru/public/2Dzt/5rjkGS12j</a><br>
<br>
Thank you<br>
<br>
<br>
Maxim Arsent'ev, Ph.D. (Chemistry)<br>
Laboratory of research of nanostructures<br>
Institute of Silicate Chemistry of RAS<br>
<br>
_______________________________________________<br>
Quantum ESPRESSO is supported by MaX (<a href="http://www.max-centre.eu/quantum-espresso" rel="noreferrer" target="_blank">www.max-centre.eu/quantum-espresso</a>)<br>
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