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<div style="word-wrap: break-word; ">Yes, the &quot;-ec 0.0001Ry&quot; &nbsp;should be &quot;-ec 0.0001&quot;. But that's not the reason for this problem.
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<div>Now I think the problem may come from the inappropriate compile or installation. Because I encountered the similar problem when I redo the TiC example.</div>
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<div>&gt; &nbsp; lcore &nbsp; &nbsp; &nbsp; (21:19:37) 0.000u 0.000s 0:00.00 0.0% &nbsp; 0&#43;0k 0&#43;0io 0pf&#43;0w</div>
<div>error: command &nbsp; /home/x_yunli/wien2k/lcore lcore.def &nbsp; failed</div>
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<div>After I&nbsp;recompiled the lcore and mixer, the example got succeed.</div>
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<div>But I don't know how to do with l<span class="Apple-style-span" style="color: rgb(103, 3, 0); ">apw2cpara.&nbsp;</span></div>
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<blockquote type="cite">&nbsp; lapw2 -c -up &nbsp;-p &nbsp;&nbsp;&nbsp;(13:57:16) running LAPW2 in parallel mode<br>
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<blockquote type="cite">** &nbsp;LAPW2 crashed!<br>
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<blockquote type="cite">0.027u 0.039s 0:00.15 33.3% &nbsp;&nbsp;&nbsp;&nbsp;0&#43;0k 0&#43;0io 0pf&#43;0w<br>
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<blockquote type="cite">error: command &nbsp;&nbsp;/home/x_yunli/wien2k/lapw2cpara -up -c uplapw2.def &nbsp;&nbsp;failed</blockquote>
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<div>On Aug 16, 2012, at 6:42 PM, Laurence Marks wrote:</div>
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