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<div class="moz-cite-prefix">Hi,</div>
<div class="moz-cite-prefix">I barley remember an issue if the last
sign in a block is a ','<br>
</div>
<div class="moz-cite-prefix">could you please try to remove those?</div>
<div class="moz-cite-prefix">E.g.</div>
<div class="moz-cite-prefix"><br>
</div>
<div class="moz-cite-prefix">verbosity='high'</div>
<div class="moz-cite-prefix">instead of <br>
</div>
<div class="moz-cite-prefix">verbosity='high',</div>
<div class="moz-cite-prefix"><br>
</div>
<div class="moz-cite-prefix">and</div>
<div class="moz-cite-prefix"><br>
</div>
<div class="moz-cite-prefix">conv_thr=1d-8</div>
<div class="moz-cite-prefix">instead of <br>
</div>
<div class="moz-cite-prefix">conv_thr=1d-8,</div>
<div class="moz-cite-prefix"><br>
</div>
<div class="moz-cite-prefix">Kind regards,</div>
<div class="moz-cite-prefix"><br>
</div>
<div class="moz-cite-prefix">On 2/18/20 10:30 AM, Pietro Delugas
wrote:<br>
</div>
<blockquote type="cite"
cite="mid:5cdfd753-6a47-4069-064b-fad01bbf22a0@sissa.it">
<meta http-equiv="Content-Type" content="text/html; charset=UTF-8">
<p><font size="-1">Hi <br>
</font></p>
<p><font size="-1">I checked your input with version 6.5, it
seems to be working fine. <br>
</font></p>
<p><font size="-1">Your issue could be related with the compiler
you are using. <br>
</font></p>
<p><font size="-1">Could you give us more details ?</font></p>
<p><font size="-1">regards - Pietro</font><br>
</p>
<div class="moz-cite-prefix">On 18/02/20 07:40, vinsa kharisma
wrote:<br>
</div>
<blockquote type="cite"
cite="mid:CAFpX6pPkt1N=bRNH_pzgRB0cph993nc0RG958B5QqLYK8oD8UA@mail.gmail.com">
<div dir="ltr"> <span class="gmail-tlid-translation
gmail-translation" lang="en"><span title="" class="gmail-">Dear
developer of quantum espresso</span><br>
<br>
</span>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="" class="gmail-">I have done
calculations with quantum espresso starting in version 5
and there are no problems in calculating scf, nscf,
bands, or dos.</span> <span title="" class="gmail-">but
when I use version 6.4.1 there is an error like this:</span><br>
</span></div>
<div><br>
<span class="gmail-tlid-translation gmail-translation"
lang="en"></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
task # 0<br>
from read_conf_from_file : error # 1<br>
fatal error reading xml file<br>
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>
<br>
<br>
</span></div>
<span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="">I think this is a bug and I try to
use the latest version, which is version 6.5 and do the
scf, kpoint, and bandstructure calculations, but when I
count nscf,</span><br>
</span>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="">there is the same CRASH as
version 6.4.1.</span> <span title="">I have tried
asking my professor who has also used quantum espresso
for a long time, but he has never experienced an error
like this.</span> <span title="">how is the solution?</span>
<span title="">Please help.</span></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title=""><br>
</span></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="">Thank you <br>
</span></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="">Best Regards</span></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="">vinsa<br>
</span></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title=""><br>
</span></span></div>
<div><span class="gmail-tlid-translation gmail-translation"
lang="en"><span title="">here I attach my input :<br>
</span></span></div>
</div>
<br>
<fieldset class="mimeAttachmentHeader"></fieldset>
<pre class="moz-quote-pre" wrap="">_______________________________________________
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</pre>
</blockquote>
<br>
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<pre class="moz-quote-pre" wrap="">_______________________________________________
developers mailing list
<a class="moz-txt-link-abbreviated" href="mailto:developers@lists.quantum-espresso.org">developers@lists.quantum-espresso.org</a>
<a class="moz-txt-link-freetext" href="https://lists.quantum-espresso.org/mailman/listinfo/developers">https://lists.quantum-espresso.org/mailman/listinfo/developers</a>
</pre>
</blockquote>
<p><br>
</p>
<pre class="moz-signature" cols="72">--
M.Sc. Tobias Klöffel
=======================================================
HPC (High Performance Computing) group
Erlangen Regional Computing Center(RRZE)
Friedrich-Alexander-Universität Erlangen-Nürnberg
Martensstr. 1
91058 Erlangen
Room: 1.133
Phone: +49 (0) 9131 / 85 - 20101
=======================================================
E-mail: <a class="moz-txt-link-abbreviated" href="mailto:tobias.kloeffel@fau.de">tobias.kloeffel@fau.de</a></pre>
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