<html><body><div style="color:#000; background-color:#fff; font-family:HelveticaNeue, Helvetica Neue, Helvetica, Arial, Lucida Grande, Sans-Serif;font-size:12pt"><div>Thank you very much for the reply.</div><div>Jamil.<br></div><div><br></div> <div class="" style="font-family: HelveticaNeue,Helvetica Neue,Helvetica,Arial,Lucida Grande,Sans-Serif; font-size: 12pt;"> <div class="" style="font-family: HelveticaNeue,Helvetica Neue,Helvetica,Arial,Lucida Grande,Sans-Serif; font-size: 12pt;"> <div dir="ltr"> <hr size="1"> <font face="Arial" size="2"> <b><span style="font-weight: bold;">From:</span></b> stefano de gironcoli <degironc@sissa.it><br> <b><span style="font-weight: bold;">To:</span></b> pw_forum@pwscf.org <br> <b><span style="font-weight: bold;">Sent:</span></b> Thursday, 20 February 2014, 16:59<br> <b><span style="font-weight: bold;">Subject:</span></b> Re: [Pw_forum] Band Structure calculation<br> </font> </div> <div class=""><br><div
id="yiv1732456519"><div>
<div class="">it's what typically happens in a
metal...<br clear="none">
Please provide your affilaition.<br clear="none">
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stefano<br clear="none">
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Stefano de Gironcoli - SISSA & DEMOCRITOS<br clear="none">
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iOn 02/20/2014 03:48 PM, MISSAOUI Jamil wrote:<br clear="none">
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<div><span class="" id="yiv1732456519result_box" lang="en"><span class="">Hi,</span> <br clear="none">
<span class="">In my calculation</span> <span class="">of</span> <span class="">band
structure</span> <span class="">I found</span>
<span class="">that the number of</span> <span class="">electrons</span> <span class="">in
some points</span> <span class="">K (</span><span class="">occupation</span> <span class="">numbers</span><span class="">) exceeds the</span> <span class="">total</span>
<span class="">number of</span> <span class="">electrons</span>
<span class="">of my</span> <span class="">system</span><span>.</span>
<span class="">can</span> <span class="">it</span>
<span class="">happen?</span></span></div>
<div class="" style="color: rgb(0, 0, 0); font-size: 16px; font-family: HelveticaNeue,Helvetica Neue,Helvetica,Arial,Lucida Grande,Sans-Serif; background-color: transparent; font-style: normal;"><span class="" id="yiv1732456519result_box" lang="en"><span class="">Best regard.</span></span></div>
<div class="" style="color: rgb(0, 0, 0); font-size: 16px; font-family: HelveticaNeue,Helvetica Neue,Helvetica,Arial,Lucida Grande,Sans-Serif; background-color: transparent; font-style: normal;"><span class="" id="yiv1732456519result_box" lang="en"><span class="">Jamil.<br clear="none">
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