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<p><span id="result_box"><span class="hps">I managed to</span> <span class="hps">reduce my</span> <span class="hps">structure.</span><br /><span class="hps">I</span> <span class="hps">can</span> <span class="hps">start the</span> <span class="hps">calculation</span><span>.</span><br /><span class="hps">No longer appears</span> <span class="hps">ghost</span> <span class="hps">bands</span><span>.</span><br /><span class="hps">But</span> <span class="hps">is</span> <span class="hps">running</span> <span class="hps">indefinitely</span> <span class="hps">LAPW2C.</span></span></p>
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<p>Em 02/04/2012 16:28, Laurence Marks escreveu:</p>
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<p>Did you redo the initialisation, you have to.</p>
<p>---------------------------<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> 1-847-491-3996<br />"Research is to see what everybody else has seen, and to think what nobody else has thought"<br />Albert Szent-Gyorgi</p>
<div class="gmail_quote">On Apr 2, 2012 1:19 PM, "Antonio Vanderlei dos Santos - Fisica" <<a href="mailto:vandao@urisan.tche.br">vandao@urisan.tche.br</a>> wrote:<br />
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<p> <span><span>Dear</span> <span>users</span><br /><br /><span>I</span> <span>modifications and</span> <span>decreases</span> <span>the structure</span><span>, but now</span> <span>the</span> <span>seurge</span> <span>sequinte</span> <span>error.</span></span></p>
<p><span><span>Error in LAPW1<br /> 'SELECT' - no energy limits found for L= 1 <br /> 'SELECT' - E-bottom -17.57300 E-top -200.00000 <br /> <br /></span></span></p>
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