<div dir="ltr"><img width="0" height="0" class="mailtrack-img" alt="" style="display:flex" src="https://mailtrack.io/trace/mail/d6b11179e9b073d3cd306d4fd2e91ed556c97607.png?u=1839753"><div></div><div>Hello all,</div><div>I am trying to converge a hexagonal and cubic system of BN. The cubic system shows a convergence while the hexagonal system doesn't, though the parameters are the same. I guess there might be some issue in the Nitrogen pseudopotential. Can you please look into the issue?</div><div>PFA the input files for both the systems.</div><div><br clear="all"><div><div dir="ltr" class="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><span style="background-color:rgb(51,204,255)"><font size="2" face="arial, helvetica, sans-serif"><span style="background-color:rgb(255,255,255)"><br></span></font></span></div><div dir="ltr"><span style="background-color:rgb(51,204,255)"><font size="2" face="arial, helvetica, sans-serif"><span style="background-color:rgb(255,255,255)"><br></span></font></span></div><div dir="ltr"><span style="background-color:rgb(51,204,255)"><font size="2" face="arial, helvetica, sans-serif"><span style="background-color:rgb(0,0,0)"></span><span style="background-color:rgb(255,255,255)">Thanks and Regards<br>Dr. Anuja Chanana</span></font></span></div></div></div></div></div></div></div></div></div></div></div><div><div dir="ltr" class="gmail_signature" data-smartmail="gmail_signature"><div dir="ltr"><div><div dir="ltr"><div><div dir="ltr"><div dir="ltr"><div dir="ltr"><div dir="ltr"><div><div><span style="background-color:rgb(255,255,255)"><font size="2"><font size="2"><br></font></font></span></div><div><br></div></div></div></div></div></div></div></div></div></div></div></div><br><div class="mt-signature">
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<span style="color:transparent;font-size:0">02/09/19, 2:41:41 PM</span>
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