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<p>Dear Prof. Paulatto</p>
<p>Thanks for your response.<br>
</p>
<br>
<div class="moz-cite-prefix">On 08/07/2016 04:34 PM, Lorenzo
Paulatto wrote:<br>
</div>
<blockquote
cite="mid:CAG+GtJduNmx149UY+nokAAWZeLaDD4rOphkkqOHvYk3P74rf-Q@mail.gmail.com"
type="cite">
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<div>any discrepancy would come from the choice of functional
more than fro mthe choice of pseudopotentials<br>
<br>
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hth<br>
</div>
<div class="gmail_extra"><br>
<div class="gmail_quote">On 6 August 2016 at 23:41, MSaqlain <span
dir="ltr"><<a moz-do-not-send="true"
href="mailto:saqlain@bilkent.edu.tr" target="_blank">saqlain@bilkent.edu.tr</a>></span>
wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0
.8ex;border-left:1px #ccc solid;padding-left:1ex">Dear
Paulatto<br>
<br>
thanks for your response. What would say about this?<br>
<span class=""><br>
If the the system is relaxed with paw/us peusodos, Is it
fair enough to<br>
</span>use NC pseudos with hybrid scheme for obtaining band
gap? (performing<br>
scf on ptimized configuration with paw/us pseudo)<br>
<span class="im HOEnZb"><br>
<br>
On 08/07/2016 01:28 AM, Lorenzo Paulatto wrote:<br>
> Can you please trough some light on this issue? If
the the system is<br>
> relaxed with paw/us peusodos, Is it fair enough to
use NC pseudos with<br>
> hybrid scheme for obtaining band gap?<br>
<br>
</span>
<div class="HOEnZb">
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<br>
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<br>
-- <br>
<div class="gmail_signature" data-smartmail="gmail_signature">
<div>Dr. Lorenzo Paulatto </div>
<div>IdR @ IMPMC -- CNRS & Université Paris 6</div>
<div>phone: +33 (0)1 44275 084 / skype: paulatz</div>
<div>www: <a moz-do-not-send="true"
href="http://www-int.impmc.upmc.fr/%7Epaulatto/"
target="_blank">http://www-int.impmc.upmc.fr/~paulatto/</a></div>
<div>mail: 23-24/4é16 Boîte courrier 115, 4 place Jussieu
75252 Paris Cédex 05</div>
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