<html><head><style type="text/css"><!-- DIV {margin:0px;} --></style></head><body><div style="font-family:'times new roman', 'new york', times, serif;font-size:12pt;color:#000000;"><div></div><div><div>Dear Prof. Blaha and Wien2k users</div><div><br></div><div>I am running wien2k10.1 in parallel mode for my case in Graphene and I receive the following message in dayfile. I tried for my other cases too, and received the same message. Is this a problem with x_lapw already being expressed in mailing list or I am facing the something new.</div><div>I have to mention that I have successful running cases with this new version.</div><div><br></div><div>best regards,</div><div>Monazam</div><div><br></div><div>case.dayfile:</div><div><br></div><div><div>Calculating graphene_wien2k in /data1/home/k3503/k358674/WIEN2k-DATA-DIR/graphene_wien2k</div><div>on r1i0n3 with PID 4640</div><div>using WIEN2k_10.1 (Release 7/6/2010) in
/apps/WIEN2k_10/inst</div><div><br></div><div><br></div><div> start <span class="Apple-tab-span" style="white-space:pre"> </span>(Thu Jul 1 11:14:10 CEST 2010) with lapw0 (40/99 to go)</div><div><br></div><div> cycle 1 <span class="Apple-tab-span" style="white-space:pre"> </span>(Thu Jul 1 11:14:10 CEST 2010) <span class="Apple-tab-span" style="white-space:pre"> </span>(40/99 to go)</div><div><br></div><div>> lapw0 -p<span class="Apple-tab-span" style="white-space:pre"> </span>(11:14:10) starting parallel lapw0 at Thu Jul 1 11:14:10 CEST 2010</div><div>-------- .machine0 : processors</div><div>running lapw0 in single mode</div><div>13.316u 0.200s 0:14.13 95.6%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div>> lapw1 -c -p <span class="Apple-tab-span" style="white-space:pre"> </span>(11:14:25) starting parallel lapw1 at Thu Jul
1 11:14:25 CEST 2010</div><div>-> starting parallel LAPW1 jobs at Thu Jul 1 11:14:25 CEST 2010</div><div>running LAPW1 in parallel mode (using .machines)</div><div>24 number_of_parallel_jobs</div><div> r1i0n3(1) 646.352u 1.044s 5:28.02 197.3%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n3(1) 818.171u 2.244s 6:58.42 196.0%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n3(1) 807.222u 2.436s 6:53.09 195.9%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n3(1) 847.012u 1.280s 7:08.71 197.8%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n4(1) 829.719u 2.656s 7:05.20 195.7%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io
0pf+0w</div><div> r1i0n4(1) 629.955u 0.872s 5:20.02 197.1%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n4(1) 783.356u 2.252s 6:41.88 195.4%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n4(1) 834.484u 1.080s 7:02.45 197.7%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n5(1) 625.551u 1.020s 5:17.96 197.0%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n5(1) 680.154u 1.432s 5:44.99 197.5%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n5(1) 734.349u 1.932s 6:13.81 196.9%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n5(1) 735.977u 1.108s 6:12.98
197.6%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n6(1) 642.716u 0.916s 5:26.40 197.1%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n6(1) 767.131u 2.212s 6:31.39 196.5%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n6(1) 781.212u 2.652s 6:38.29 196.8%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n6(1) 793.573u 1.420s 6:42.68 197.4%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n7(1) 816.483u 1.236s 6:53.05 197.9%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n7(1) 640.756u 1.024s 5:25.69 197.0%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k
0+0io 0pf+0w</div><div> r1i0n7(1) 768.432u 2.304s 6:33.80 195.7%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n7(1) 794.593u 2.296s 6:45.66 196.4%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n0(1) 850.205u 1.480s 7:10.92 197.6%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n0(1) 828.679u 2.352s 7:04.04 195.9%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n0(1) 656.889u 1.024s 5:33.49 197.2%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n0(1) 836.792u 2.876s 7:08.81 195.8%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> r1i0n3(1) 634.839u 1.644s
5:24.42 196.1%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div> Summary of lapw1para:</div><div> r1i0n3<span class="Apple-tab-span" style="white-space:pre"> </span> k=5<span class="Apple-tab-span" style="white-space:pre"> </span> user=3753.6<span class="Apple-tab-span" style="white-space:pre"> </span> wallclock=1912.66</div><div> r1i0n4<span class="Apple-tab-span" style="white-space:pre"> </span> k=4<span class="Apple-tab-span" style="white-space:pre"> </span> user=3077.51<span class="Apple-tab-span" style="white-space:pre"> </span> wallclock=1569.55</div><div> r1i0n5<span class="Apple-tab-span" style="white-space:pre"> </span> k=4<span class="Apple-tab-span" style="white-space:pre"> </span> user=2776.03<span class="Apple-tab-span" style="white-space:pre"> </span> wallclock=1409.74</div><div> r1i0n6<span class="Apple-tab-span" style="white-space:pre">
</span> k=4<span class="Apple-tab-span" style="white-space:pre"> </span> user=2984.63<span class="Apple-tab-span" style="white-space:pre"> </span> wallclock=1518.76</div><div> r1i0n7<span class="Apple-tab-span" style="white-space:pre"> </span> k=4<span class="Apple-tab-span" style="white-space:pre"> </span> user=3020.26<span class="Apple-tab-span" style="white-space:pre"> </span> wallclock=1538.2</div><div> r1i0n0<span class="Apple-tab-span" style="white-space:pre"> </span> k=4<span class="Apple-tab-span" style="white-space:pre"> </span> user=3172.57<span class="Apple-tab-span" style="white-space:pre"> </span> wallclock=1617.26</div><div>1.296u 1.856s 10:57.75 0.4%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div>> lapw2 -c -p <span class="Apple-tab-span" style="white-space:pre"> </span>(11:25:23) running LAPW2 in parallel mode</div><div>** LAPW2
crashed!</div><div>0.848u 0.960s 0:31.88 5.6%<span class="Apple-tab-span" style="white-space:pre"> </span>0+0k 0+0io 0pf+0w</div><div>error: command /apps/WIEN2k_10/inst/lapw2cpara -c lapw2.def failed</div><div><br></div><div>> stop error</div></div></div><div style="position:fixed"></div>
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