<div dir="ltr"><div>Dear Fabira,</div><div><br></div><div>Please add the line <br></div><div>raux(:) = raux(:,1) + vltot(:) <br></div><div><br></div><div><div>at the end of the block between lines</div><div>
ELSEIF (plot_num == 1) THEN</div><div> ...<br></div><div> ELSEIF (plot_num == 2) THEN <br></div><div>(as suggested by Paolo Giannozzi)</div><div><br></div><div><br></div><div>Best regards,<br></div></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Sat, Jul 20, 2019 at 10:44 AM Fariba Nazari <<a href="mailto:nazari@iasbs.ac.ir">nazari@iasbs.ac.ir</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"><div dir="" style="font-size:10pt;font-family:"Source Sans Pro",sans-serif;background-image:none;background-repeat:repeat"><font face="Source Sans Pro, sans-serif"><span style="font-size:10pt">Dear all,</span></font><div style="font-family:"Source Sans Pro",sans-serif;font-size:10pt"><br></div><div><font face="Source Sans Pro, sans-serif"><span style="font-size:10pt">The output file for </span></font><span style="font-family:arial,helvetica,sans-serif;font-size:medium;background-color:rgb(255,255,153);font-weight:700">plot_num=1 </span><span style="font-family:"Source Sans Pro",sans-serif;font-size:10pt"> by running pp.x with quantum esperesso 6.4.1 is different from older versions. I did check it in </span><font face="Source Sans Pro, sans-serif"><span style="font-size:13.3333px">WorkFct_example. For plot_num=11 the obtained files are the same but they are different with plot_num=1. Would you please let me know what is the reason?</span></font></div><div><font face="Source Sans Pro, sans-serif"><span style="font-size:13.3333px"><br></span></font></div><div><font face="Source Sans Pro, sans-serif"><span style="font-size:13.3333px">Regards</span></font></div><div><font face="Source Sans Pro, sans-serif"><span style="font-size:13.3333px">Fariba </span></font></div><div><font face="Source Sans Pro, sans-serif"><span style="font-size:13.3333px">IASBS</span></font></div></div>_______________________________________________<br>
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<a href="https://lists.quantum-espresso.org/mailman/listinfo/users" rel="noreferrer" target="_blank">https://lists.quantum-espresso.org/mailman/listinfo/users</a></blockquote></div><br clear="all"><br>-- <br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div><div dir="ltr">Manoar Hossain<div>Research Scholar</div><div>School of Physical Sciences</div><div>National Institute of Science Education and Research (<span style="font-size:12.8px">NISER)</span></div><div><span style="font-size:12.8px">Bhubaneswar, Jatni, Khurda, Odisha, 752050, INDIA</span></div></div></div></div></div>