<div dir="ltr">mistake in your input?</div><div class="gmail_extra"><br><br><div class="gmail_quote">On Thu, Aug 28, 2014 at 5:28 PM, Hemza Kouarta <span dir="ltr"><<a href="mailto:hemzakouarta.phy@gmail.com" target="_blank">hemzakouarta.phy@gmail.com</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div><div><div><div>Hi,<br><br></div>i use HF function on the 3d metal (Fe) intercalated in NbSe2 ,my calculation is fine and converged,but when i do :<br>
<br>" x lapw2 -up -so -eece -qtl " to calculate dos ,they give me this error :<br>
<br><br> WARNING: EF not accurate, new emin,emax,NE-min,NE-max -2.96097358895238 <br> -2.96097358242661 87.9999969931765 88.0000074270098 <br> LAPW2 END<br>106.7u 4.6s 1:51.69 99.6% 0+0k 56+69824io 0pf+0w<br>
<br><br></div>And when i draw the dos there is no EF in my dos.<br><br></div>Any suggestions will help.<br></div><br>thank-you.<br><br></div>
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