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<div class="moz-cite-prefix"> Dear Kenan <br>
<br>
when you send attachment via dropbox it would be much easier for
the other users to read them if you collected them in an archive
and sent a link to the archive directly in the main message. <br>
kind regards - Pietro <br>
<br>
<br>
<br>
On 04/15/2019 01:26 PM, Kenan Song wrote:<br>
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<div>Dear Sir/Madam,</div>
<div><br>
</div>
<div>I used Quantum Espresso (QE) to compute the band structure
for the same system that I examined by VASP but QE gives me
very different band structure from that given by VASP,
including both of the band shape and energy.</div>
<div><br>
</div>
<div>I think that the remain reason comes from the
pseudopotential I choose is not proper. VASP provides the
pseudopotential for Co element with 9 valence electron; while,
QE provides one with 27 valence electrons. Would you anyone
please tell me how to choose or generate a proper
pseudopotential? Thank you.</div>
<div><br>
</div>
<div>Kind regards,</div>
<div><br>
</div>
<div>Kenan Song<br>
</div>
</div>
<br>
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