<div dir="auto">Sorry, I did not notice that you included the version.<div dir="auto"><br></div><div dir="auto">"touch .lcore" should help.<br><br><div data-smartmail="gmail_signature" dir="auto">---<br>Professor Laurence Marks<br>Department of Materials Science and Engineering<br>Northwestern University<br><a href="http://www.numis.northwestern.edu">www.numis.northwestern.edu</a><br>"Research is to see what everybody else has seen, and to think what nobody else has thought" Albert Szent-Györgyi</div></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Sun, Jan 22, 2023, 18:13 Laurence Marks <<a href="mailto:laurence.marks@gmail.com">laurence.marks@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="auto">Which Wien2k & mixer version are you using?<div dir="auto"><br></div><div dir="auto">Doing "touch .lcore" may work. I would compare the results.<br><br><div data-smartmail="gmail_signature" dir="auto">---<br>Professor Laurence Marks<br>Department of Materials Science and Engineering<br>Northwestern University<br><a href="http://www.numis.northwestern.edu" target="_blank" rel="noreferrer">www.numis.northwestern.edu</a><br>"Research is to see what everybody else has seen, and to think what nobody else has thought" Albert Szent-Györgyi</div></div></div><br><div class="gmail_quote"><div dir="ltr" class="gmail_attr">On Sun, Jan 22, 2023, 16:21 Wahid Kamal <<a href="mailto:kamal.wahhid@gmail.com" target="_blank" rel="noreferrer">kamal.wahhid@gmail.com</a>> wrote:<br></div><blockquote class="gmail_quote" style="margin:0 0 0 .8ex;border-left:1px #ccc solid;padding-left:1ex"><div dir="ltr"><div>Hi,</div><div>
<span lang="en"><span><span>I wanted to use the method described 
by G. Madsen and P. Novak

to estimate Hubbard term, but after changing case.incup/dn the calculation stops with "NEC01 charge leakage too large" error </span></span>(using WIEN21)<br></span></div><div><span lang="en"><span><span>Using the old version of mixer (wien19), the calculation works without problem, it only happens with the new versions .</span></span><span><span>
</span></span><span><span>How to correct this problem.</span></span></span></div><div><span lang="en"><span><span>Sincerely<br></span></span></span>

</div></div>
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