<div dir="ltr">Dear  <span style="color:rgb(32,33,36);font-size:0.875rem;letter-spacing:0.2px;font-family:Roboto,RobotoDraft,Helvetica,Arial,sans-serif;white-space:nowrap">Raghottam,</span><div><span style="color:rgb(32,33,36);font-size:0.875rem;letter-spacing:0.2px;font-family:Roboto,RobotoDraft,Helvetica,Arial,sans-serif;white-space:nowrap"><br></span></div><div><span style="color:rgb(32,33,36);font-size:0.875rem;letter-spacing:0.2px;font-family:Roboto,RobotoDraft,Helvetica,Arial,sans-serif;white-space:nowrap">Thank you so much. It works now. </span></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Tue, Feb 1, 2022 at 11:20 AM Raghottam Sattigeri <<a href="mailto:raghottam.s-phy@msubaroda.ac.in">raghottam.s-phy@msubaroda.ac.in</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="auto">You have given both prefix and seedname and the script does not end with a "/". Probably this is creating the problem.</div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Tue, Feb 1, 2022, 10:34 Soumendra Kumar Das <<a href="mailto:soumendra.batu@gmail.com" target="_blank">soumendra.batu@gmail.com</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="ltr">Dear QE users,<div><br></div><div>I am running the wannier canculation for Bi2Se3. I have successfully run scf, nscf, wannier90.x -pp. But while running pw2wannier90.x I am getting this error.</div><div><br></div><div><br></div><div> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br>     Error in routine pw2wannier90 (1):<br>     reading inputpp namelist<br> %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%<br><br>     stopping ...<br><br><div>Here is my input filr for pw2wan. </div><div><br></div><div>&inputpp<br>  outdir     =  'temp2'<br>  prefix     =  'Bi2Se3'<br>  seedname   =  'wannier'<br>  write_amn  =  .true.<br>  write_mmn  =  .true.<br>  write_unk  =  .true.<br></div><div><br></div><div><br></div><div>Please suggest to me what I should do on this. I am using qe-6.5. </div>-- <br><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><font face="arial, sans-serif"><b>---------------------------------------</b></font></div><div dir="ltr"><font face="arial, sans-serif"><b>Thanks and Regards</b></font></div><div dir="ltr"><b style="color:rgb(0,0,255);font-family:arial,sans-serif">Soumendra Kumar Das</b><div><div style="color:rgb(34,34,34)"><br></div></div></div></div></div></div></div></div>
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Quantum ESPRESSO is supported by MaX (<a href="http://www.max-centre.eu" rel="noreferrer" target="_blank">www.max-centre.eu</a>)<br>
users mailing list <a href="mailto:users@lists.quantum-espresso.org" target="_blank">users@lists.quantum-espresso.org</a><br>
<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"><div><br></div>-- <br><div dir="ltr" class="gmail_signature"><div dir="ltr"><div dir="ltr"><div dir="ltr"><font face="arial, sans-serif"><b>---------------------------------------</b></font></div><div dir="ltr"><font face="arial, sans-serif"><b>Thanks and Regards</b></font></div><div dir="ltr"><b style="color:rgb(0,0,255);font-family:arial,sans-serif">Soumendra Kumar Das</b><div><div style="color:rgb(34,34,34)"><font color="#0000ff" face="arial, sans-serif"><b>Postdoc. Research Scholar</b></font></div><div style="color:rgb(34,34,34)"><font face="arial, sans-serif"><b style="color:rgb(0,0,255)">School of Physical Sciences</b><br></font></div><div style="color:rgb(34,34,34)"><div dir="ltr"><font color="#0000ff" face="arial, sans-serif"><b>National Institute of Science Education and Research (NISER), </b><b>Bhubaneswar</b></font></div><div dir="ltr"><font color="#0000ff" face="arial, sans-serif"><b>PO- Bhimpur-Padanpur, Via- Jatni, District:- Khurda</b><br></font><blockquote style="margin:0px 0px 0px 40px;border:medium none;padding:0px"></blockquote><b><font color="#0000ff" face="arial, sans-serif">PIN – 752050, Odisha, INDIA</font></b></div></div></div></div></div></div></div>