<div dir="ltr"><div>Hi, </div><div>Please use this one </div><div><br></div><a class="element_anchor" target="_blank" href="https://www.quantum-espresso.org/upf_files/N.pbe-n-kjpaw_psl.0.1.UPF" style="margin:0px;padding:0px;color:rgb(175,16,29);text-decoration:none;outline:none;font-family:Arial,Helvetica,sans-serif;text-align:left">N.pbe-n-kjpaw_psl.0.1.UPF</a><br><div><br></div><div>Please check the functional type and full relativistic or core collection + relativistic correction.</div><div><br></div><div>The are pz, pbe and pbesol functionals.</div><div><br></div><div>With Regards,</div><div>Subrata Jana</div></div><div class="gmail_extra"><br clear="all"><div><div class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div style="font-size:12.8px"><div><b style="color:rgb(56,118,29);font-size:12.8px">--------------------------------------------------------------------------------------------------------------<br></b></div><div><b style="color:rgb(56,118,29);font-size:12.8px">SUBRATA JANA</b><br></div></div><div><div style="font-size:12.8px"><font color="#38761d"><b>Research Scholar</b></font></div><div dir="ltr" style="font-size:12.8px"><font color="#38761d"><b>School of Physical Sciences<br>National Institute of Science Education and Research (NISER), </b><b style="font-size:12.8px">Bhubaneswar</b></font></div><div dir="ltr" style="font-size:12.8px"><font color="#38761d"><b><span style="font-size:12.8px">PO- Bhimpur-Padanpur, </span><span style="font-size:12.8px">Via- Jatni, District:- Khurda</span></b><br style="font-size:12.8px"></font><blockquote style="font-size:12.8px;margin:0px 0px 0px 40px;border:medium none;padding:0px"></blockquote><b><font color="#38761d">PIN – 752050, Odisha, INDIA</font></b></div></div></div></div></div></div></div>
<br><div class="gmail_quote">On Fri, Jun 15, 2018 at 11:30 PM, Franck Ngassamnyakam <span dir="ltr"><<a href="mailto:franck.ngassamnyakam@ipcms.unistra.fr" target="_blank">franck.ngassamnyakam@ipcms.unistra.fr</a>></span> wrote:<br><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><u></u>
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<p><span style="font-size:18px">Hi,</span></p>
<p><span style="font-size:18px">I am a new  user of Quantum Espresso user. I would like to remake calculations already performed with VASP using the speudoptential PAW_PBE and I am confused with the different speudopentiel on the site <a href="https://www.quantum-espresso.org/pseudopotentials" target="_blank">https://www.quantum-espresso.<wbr>org/pseudopotentials</a>. for example for nitrogen N I have two types "N.rel-pbe-n-kjpaw_psl.0.1.<wbr>UPF" and "N.pbe-n-kjpaw_psl.0.1.UPF" same for Mn, F, C, H, Cu, Co, that i want to use. <br></span></p>
<pre id="m_5864607885578077104tw-target-text" class="m_5864607885578077104tw-data-text m_5864607885578077104tw-ta m_5864607885578077104tw-text-small" dir="ltr" style="text-align:left;height:312px"><span><span style="font-size:18px">please which should I choose which would be equivalent to PAW_PBE in VASP?.

thank you in advance</span><br><br><span style="font-size:18px">Franck O</span>.<br></span></pre>
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