<div dir="ltr">Dear Samant,<div><br></div><div style> Just using more words to explain what Oliver wrote, you have to run kgen again (and lapw1, lapw2 ...), because the k-points used to plot bandstructure are not the tetrahedral mesh required by DOS calculations.</div>
<div style> All the best,</div><div style> Luis</div></div><div class="gmail_extra"><br><br><div class="gmail_quote">2013/12/13 Oliver Albertini <span dir="ltr"><<a href="mailto:ora@georgetown.edu" target="_blank">ora@georgetown.edu</a>></span><br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div>Hi, <br></div><div><br></div><div>kgen gives a list of k points on a tetrahedral mesh. lapw1 generates the case.vector files. </div>
<div class="gmail_extra"><br>Sincerely, </div><span class="HOEnZb"><font color="#888888"><div class="gmail_extra">
<br></div><div class="gmail_extra">Oliver Albertini</div></font></span><div><div class="h5"><div class="gmail_extra"><br></div><div class="gmail_extra"><br><div class="gmail_quote">On Fri, Dec 13, 2013 at 5:02 AM, saurabh samant <span dir="ltr"><<a href="mailto:saurabhsamant9@gmail.com" target="_blank">saurabhsamant9@gmail.com</a>></span> wrote:<br>
<blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex">Dear WIEN2k authors & users,<br>
<br>
Calculating DOS after bandstructure gives FERMI-ERROR. In UG it is<br>
given that we have to "recalculate case.vector file using tetrahedral<br>
k-mesh" to calculate DOS after bandstructure. Hence, it is requested<br>
to explain how to do the above step.<br>
<br>
Thanking you,<br>
Yours sincerely,<br>
Saurabh Samant<br>
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