Calculating FeSi in /mnt/p03/8916jtomczak on n48 with PID 29054 start Thu Jul 14 18:49:59 2011 with lapw0 (1/100 to go) cycle 0 Thu Jul 14 18:49:59 2011 5/5 to go >lapw0 ( 18:49:59 ) 2.976u 0.052s 0:03.09 97.7% 0+0k 4208+1360io 1pf+0w >lapw1 -c ( 18:50:03 ) 358.966u 3.304s 6:05.21 99.1% 0+0k 11560+821840io 1pf+0w >dmft0 ( 18:56:08 ) DMFT END >dmft1 ( 18:57:48 ) 0.01user 0.04system 0:28.45elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >dmft2 ( 23:59:00 ) 0.02user 0.06system 1:14.74elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 00:00:15 ) 0.024u 0.004s 0:00.13 15.3% 0+0k 2168+880io 1pf+0w >mixer ( 00:00:15 ) 0.064u 0.016s 0:00.17 41.1% 0+0k 3072+2216io 1pf+0w :ENERGY convergence: 1.0 :CHARGE convergence: 8e-05 :EF convergence: 0.000613139 :ITT1 cycle 1 Fri Jul 15 00:00:16 2011 4/4 to go >lapw0 ( 00:00:16 ) 2.960u 0.056s 0:03.06 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 00:00:19 ) 359.266u 3.240s 6:04.51 99.4% 0+0k 0+821840io 0pf+0w >dmft2 ( 00:06:24 ) 0.01user 0.04system 1:19.64elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 00:07:43 ) 0.020u 0.016s 0:00.05 60.0% 0+0k 0+880io 0pf+0w >mixer ( 00:07:44 ) 0.048u 0.036s 0:00.14 50.0% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 6.99999873177e-06 :CHARGE convergence: 6.5e-05 :EF convergence: -3.98341e-05 :ITT2 cycle 1 Fri Jul 15 00:07:44 2011 4/4 to go >lapw0 ( 00:07:44 ) 2.964u 0.064s 0:03.08 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 00:07:47 ) 358.942u 3.428s 6:04.73 99.3% 0+0k 0+821832io 0pf+0w >dmft2 ( 00:13:52 ) 0.03user 0.04system 1:16.51elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 00:15:09 ) 0.016u 0.004s 0:00.05 20.0% 0+0k 0+880io 0pf+0w >mixer ( 00:15:09 ) 0.076u 0.016s 0:00.15 53.3% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 3.60000012734e-05 :CHARGE convergence: 2.22e-05 :EF convergence: -0.000226561 :ITT3 cycle 1 Fri Jul 15 00:15:09 2011 4/4 to go >lapw0 ( 00:15:09 ) 3.004u 0.032s 0:03.09 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 00:15:12 ) 358.950u 3.248s 6:05.32 99.1% 0+0k 0+821856io 0pf+0w >dmft2 ( 00:21:18 ) 0.01user 0.05system 1:52.02elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 00:23:10 ) 0.012u 0.008s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 00:23:10 ) 0.064u 0.036s 0:00.15 60.0% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 9.99998519546e-07 :CHARGE convergence: 2e-05 :EF convergence: 4.0422e-06 :ITT4 cycle 1 Fri Jul 15 00:23:10 2011 4/4 to go >lapw0 ( 00:23:10 ) 2.956u 0.060s 0:03.06 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 00:23:13 ) 358.738u 3.512s 6:04.88 99.2% 0+0k 0+821848io 0pf+0w >dmft2 ( 00:29:19 ) 0.01user 0.03system 1:42.71elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 00:31:01 ) 0.020u 0.020s 0:00.06 66.6% 0+0k 0+880io 0pf+0w >mixer ( 00:31:02 ) 0.052u 0.032s 0:00.15 53.3% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 6.00000021223e-06 :CHARGE convergence: 6.4e-06 :EF convergence: 4.22703e-05 :ITT1 cycle 2 Fri Jul 15 00:31:02 2011 3/3 to go >lapw0 ( 00:31:02 ) 2.992u 0.044s 0:03.08 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 00:31:05 ) 358.778u 3.352s 6:04.57 99.3% 0+0k 0+821832io 0pf+0w >dmft0 ( 00:37:10 ) DMFT END >dmft1 ( 00:38:49 ) 0.01user 0.01system 0:28.75elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >dmft2 ( 05:39:25 ) 0.02user 0.04system 0:58.95elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 05:40:24 ) 0.016u 0.008s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 05:40:24 ) 0.076u 0.028s 0:00.15 60.0% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 0.000350000000253 :CHARGE convergence: 3.96e-05 :EF convergence: -0.000220996 :ITT1 cycle 2 Fri Jul 15 05:40:24 2011 3/3 to go >lapw0 ( 05:40:24 ) 2.976u 0.056s 0:03.08 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 05:40:27 ) 359.094u 3.420s 6:04.59 99.4% 0+0k 0+821800io 0pf+0w >dmft2 ( 05:46:33 ) 0.01user 0.05system 2:07.77elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 05:48:40 ) 0.024u 0.000s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 05:48:41 ) 0.080u 0.012s 0:00.16 56.2% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.69999984792e-05 :CHARGE convergence: 3.81e-05 :EF convergence: 4.4933e-06 :ITT2 cycle 2 Fri Jul 15 05:48:41 2011 3/3 to go >lapw0 ( 05:48:41 ) 3.008u 0.036s 0:03.09 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 05:48:44 ) 359.074u 3.196s 6:05.30 99.1% 0+0k 0+821856io 0pf+0w >dmft2 ( 05:54:50 ) 0.01user 0.04system 1:18.55elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 05:56:08 ) 0.016u 0.004s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 05:56:08 ) 0.068u 0.028s 0:00.16 50.0% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.99999994948e-05 :CHARGE convergence: 3.02e-05 :EF convergence: -2.89243e-05 :ITT3 cycle 2 Fri Jul 15 05:56:09 2011 3/3 to go >lapw0 ( 05:56:09 ) 2.964u 0.064s 0:03.07 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 05:56:12 ) 359.002u 3.384s 6:05.22 99.2% 0+0k 0+821840io 0pf+0w >dmft2 ( 06:02:17 ) 0.01user 0.04system 1:45.31elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 06:04:03 ) 0.016u 0.012s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 06:04:03 ) 0.080u 0.020s 0:00.16 62.5% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 3.99999953515e-06 :CHARGE convergence: 3.95e-05 :EF convergence: 2.56754e-05 :ITT4 cycle 2 Fri Jul 15 06:04:03 2011 3/3 to go >lapw0 ( 06:04:03 ) 2.984u 0.044s 0:03.07 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 06:04:06 ) 358.778u 3.488s 6:05.39 99.1% 0+0k 0+821856io 0pf+0w >dmft2 ( 06:10:12 ) 0.02user 0.04system 2:01.13elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 06:12:13 ) 0.016u 0.008s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 06:12:13 ) 0.072u 0.032s 0:00.17 58.8% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.00000015664e-05 :CHARGE convergence: 3.9e-05 :EF convergence: 4.6401e-06 :ITT5 cycle 2 Fri Jul 15 06:12:14 2011 3/3 to go >lapw0 ( 06:12:14 ) 2.972u 0.044s 0:03.07 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 06:12:17 ) 359.010u 3.308s 6:05.35 99.1% 0+0k 0+821832io 0pf+0w >dmft2 ( 06:18:23 ) 0.02user 0.06system 1:16.95elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 06:19:40 ) 0.012u 0.012s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 06:19:40 ) 0.072u 0.020s 0:00.20 45.0% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.10000000859e-05 :CHARGE convergence: 3.94e-05 :EF convergence: -2.9335e-06 :ITT1 cycle 3 Fri Jul 15 06:19:40 2011 2/2 to go >lapw0 ( 06:19:40 ) 2.976u 0.048s 0:03.07 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 06:19:43 ) 358.838u 3.528s 6:05.89 99.0% 0+0k 0+821808io 0pf+0w >dmft0 ( 06:25:50 ) DMFT END >dmft1 ( 06:27:29 ) 0.00user 0.03system 0:28.56elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >dmft2 ( 11:29:19 ) 0.01user 0.05system 1:16.42elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 11:30:35 ) 0.020u 0.004s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 11:30:36 ) 0.068u 0.040s 0:00.16 62.5% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 0.00173299999915 :CHARGE convergence: 2.75e-05 :EF convergence: 0.0002594943 :ITT1 cycle 3 Fri Jul 15 11:30:36 2011 2/2 to go >lapw0 ( 11:30:36 ) 2.992u 0.056s 0:03.08 98.7% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 11:30:39 ) 359.274u 3.188s 6:05.30 99.2% 0+0k 0+821816io 0pf+0w >dmft2 ( 11:36:45 ) 0.03user 0.01system 1:44.38elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 11:38:29 ) 0.020u 0.012s 0:00.05 60.0% 0+0k 0+880io 0pf+0w >mixer ( 11:38:29 ) 0.064u 0.032s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.00000033854e-06 :CHARGE convergence: 2.66e-05 :EF convergence: 4.3498e-06 :ITT2 cycle 3 Fri Jul 15 11:38:30 2011 2/2 to go >lapw0 ( 11:38:30 ) 2.996u 0.040s 0:03.09 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 11:38:33 ) 359.322u 3.444s 6:05.73 99.1% 0+0k 0+821848io 0pf+0w >dmft2 ( 11:44:39 ) 0.02user 0.03system 2:02.56elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 11:46:41 ) 0.016u 0.012s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 11:46:42 ) 0.080u 0.016s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 7.99999907031e-06 :CHARGE convergence: 2.71e-05 :EF convergence: 2.3308e-06 :ITT3 cycle 3 Fri Jul 15 11:46:42 2011 2/2 to go >lapw0 ( 11:46:42 ) 2.956u 0.052s 0:03.06 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 11:46:45 ) 359.074u 3.460s 6:05.10 99.2% 0+0k 0+821856io 0pf+0w >dmft2 ( 11:52:51 ) 0.02user 0.03system 1:18.52elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 11:54:09 ) 0.024u 0.000s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 11:54:09 ) 0.072u 0.028s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.10000000859e-05 :CHARGE convergence: 2.79e-05 :EF convergence: -7.7968e-06 :ITT4 cycle 3 Fri Jul 15 11:54:10 2011 2/2 to go >lapw0 ( 11:54:10 ) 2.996u 0.028s 0:03.07 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 11:54:13 ) 358.818u 3.428s 6:05.39 99.1% 0+0k 0+821824io 0pf+0w >dmft2 ( 12:00:18 ) 0.01user 0.05system 1:14.65elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 12:01:33 ) 0.016u 0.016s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 12:01:33 ) 0.052u 0.048s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 9.99998519546e-07 :CHARGE convergence: 3.02e-05 :EF convergence: -5.6193e-06 :ITT5 cycle 3 Fri Jul 15 12:01:34 2011 2/2 to go >lapw0 ( 12:01:34 ) 2.960u 0.064s 0:03.06 98.6% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 12:01:37 ) 358.958u 3.444s 6:05.08 99.2% 0+0k 0+821840io 0pf+0w >dmft2 ( 12:07:42 ) 0.01user 0.04system 1:19.11elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 12:09:01 ) 0.012u 0.008s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 12:09:02 ) 0.064u 0.032s 0:00.16 56.2% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.0 :CHARGE convergence: 3.33e-05 :EF convergence: -1.98048e-05 :ITT1 cycle 4 Fri Jul 15 12:09:02 2011 1/1 to go >lapw0 ( 12:09:02 ) 2.968u 0.052s 0:03.06 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 12:09:05 ) 359.010u 3.308s 6:05.34 99.1% 0+0k 0+821840io 0pf+0w >dmft0 ( 12:15:11 ) DMFT END >dmft1 ( 12:16:49 ) 0.01user 0.03system 0:28.69elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >dmft2 ( 17:18:24 ) 0.01user 0.04system 1:18.56elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 17:19:43 ) 0.016u 0.016s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 17:19:43 ) 0.084u 0.020s 0:00.17 58.8% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 0.00198799999998 :CHARGE convergence: 7.29e-05 :EF convergence: 0.000106971 :ITT1 cycle 4 Fri Jul 15 17:19:43 2011 1/1 to go >lapw0 ( 17:19:43 ) 2.956u 0.052s 0:03.06 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 17:19:46 ) 358.734u 3.508s 6:04.64 99.3% 0+0k 0+821824io 0pf+0w >dmft2 ( 17:25:51 ) 0.01user 0.05system 2:01.03elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 17:27:52 ) 0.024u 0.008s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 17:27:53 ) 0.084u 0.028s 0:00.17 58.8% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.2999998944e-05 :CHARGE convergence: 7.19e-05 :EF convergence: 4.4631e-06 :ITT2 cycle 4 Fri Jul 15 17:27:53 2011 1/1 to go >lapw0 ( 17:27:53 ) 2.944u 0.060s 0:03.06 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 17:27:56 ) 359.470u 3.388s 6:05.75 99.2% 0+0k 0+821816io 0pf+0w >dmft2 ( 17:34:02 ) 0.02user 0.03system 1:15.79elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 17:35:18 ) 0.016u 0.008s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 17:35:18 ) 0.064u 0.032s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.20000004245e-05 :CHARGE convergence: 7.3e-05 :EF convergence: -3.27e-06 :ITT3 cycle 4 Fri Jul 15 17:35:18 2011 1/1 to go >lapw0 ( 17:35:18 ) 3.000u 0.044s 0:03.09 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 17:35:22 ) 358.966u 3.348s 6:05.22 99.2% 0+0k 0+821832io 0pf+0w >dmft2 ( 17:41:27 ) 0.03user 0.04system 1:41.29elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 17:43:09 ) 0.020u 0.004s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 17:43:09 ) 0.068u 0.036s 0:00.18 50.0% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.00000033854e-06 :CHARGE convergence: 7.95e-05 :EF convergence: 1.57347e-05 :ITT4 cycle 4 Fri Jul 15 17:43:09 2011 1/1 to go >lapw0 ( 17:43:09 ) 3.004u 0.048s 0:03.10 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 17:43:12 ) 358.878u 3.532s 6:04.69 99.3% 0+0k 0+821848io 0pf+0w >dmft2 ( 17:49:17 ) 0.02user 0.05system 1:44.94elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 17:51:02 ) 0.016u 0.008s 0:00.07 14.2% 0+0k 0+880io 0pf+0w >mixer ( 17:51:02 ) 0.068u 0.036s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.0 :CHARGE convergence: 8.1e-05 :EF convergence: 3.1677e-06 :ITT5 cycle 4 Fri Jul 15 17:51:03 2011 1/1 to go >lapw0 ( 17:51:03 ) 2.968u 0.052s 0:03.07 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 17:51:06 ) 359.054u 3.272s 6:05.16 99.2% 0+0k 0+821824io 0pf+0w >dmft2 ( 17:57:11 ) 0.02user 0.04system 2:09.25elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 17:59:21 ) 0.020u 0.004s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 17:59:21 ) 0.072u 0.028s 0:00.16 56.2% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 9.00000122783e-06 :CHARGE convergence: 7.99e-05 :EF convergence: 2.332e-06 :ITT1 cycle 5 Fri Jul 15 17:59:21 2011 0/0 to go >lapw0 ( 17:59:21 ) 2.960u 0.052s 0:03.06 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 17:59:24 ) 359.230u 3.528s 6:05.10 99.3% 0+0k 0+821816io 0pf+0w >dmft0 ( 18:05:30 ) DMFT END >dmft1 ( 18:07:08 ) 0.00user 0.02system 0:29.15elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >dmft2 ( 23:09:29 ) 0.01user 0.02system 1:25.99elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 23:10:55 ) 0.024u 0.008s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 23:10:56 ) 0.076u 0.028s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 0.00149499999861 :CHARGE convergence: 1.65e-05 :EF convergence: 4.51597e-05 :ITT1 cycle 5 Fri Jul 15 23:10:56 2011 0/0 to go >lapw0 ( 23:10:56 ) 2.964u 0.044s 0:03.06 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 23:10:59 ) 359.042u 3.528s 6:05.34 99.2% 0+0k 0+821848io 0pf+0w >dmft2 ( 23:17:05 ) 0.02user 0.04system 1:16.00elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 23:18:21 ) 0.020u 0.004s 0:00.05 40.0% 0+0k 0+880io 0pf+0w >mixer ( 23:18:21 ) 0.080u 0.016s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.00000033854e-06 :CHARGE convergence: 1.78e-05 :EF convergence: -7.666e-06 :ITT2 cycle 5 Fri Jul 15 23:18:21 2011 0/0 to go >lapw0 ( 23:18:21 ) 2.980u 0.040s 0:03.07 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 23:18:24 ) 358.574u 3.428s 6:05.31 99.0% 0+0k 0+821808io 0pf+0w >dmft2 ( 23:24:30 ) 0.04user 0.04system 1:46.40elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 23:26:17 ) 0.016u 0.004s 0:00.06 16.6% 0+0k 0+880io 0pf+0w >mixer ( 23:26:17 ) 0.084u 0.024s 0:00.17 58.8% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.0 :CHARGE convergence: 1.87e-05 :EF convergence: 5.4641e-06 :ITT3 cycle 5 Fri Jul 15 23:26:17 2011 0/0 to go >lapw0 ( 23:26:17 ) 2.992u 0.040s 0:03.08 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 23:26:20 ) 358.762u 3.500s 6:05.04 99.2% 0+0k 0+821848io 0pf+0w >dmft2 ( 23:32:26 ) 0.03user 0.02system 1:20.26elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 23:33:46 ) 0.012u 0.016s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 23:33:46 ) 0.076u 0.024s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 2.99999919662e-06 :CHARGE convergence: 3.2e-05 :EF convergence: -4.43032e-05 :ITT4 cycle 5 Fri Jul 15 23:33:46 2011 0/0 to go >lapw0 ( 23:33:46 ) 2.964u 0.052s 0:03.06 98.3% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 23:33:50 ) 358.954u 3.380s 6:04.84 99.3% 0+0k 0+821848io 0pf+0w >dmft2 ( 23:39:55 ) 0.02user 0.03system 1:21.67elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 23:41:17 ) 0.008u 0.024s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 23:41:17 ) 0.080u 0.028s 0:00.17 58.8% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 1.0 :CHARGE convergence: 3.2e-05 :EF convergence: -3.4757e-06 :ITT5 cycle 5 Fri Jul 15 23:41:17 2011 0/0 to go >lapw0 ( 23:41:17 ) 2.996u 0.036s 0:03.09 97.7% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 23:41:20 ) 359.006u 3.360s 6:05.13 99.2% 0+0k 0+821848io 0pf+0w >dmft2 ( 23:47:26 ) 0.02user 0.05system 1:18.72elapsed 0%CPU (0avgtext+0avgdata 0maxresident)k >lcore ( 23:48:44 ) 0.020u 0.008s 0:00.06 33.3% 0+0k 0+880io 0pf+0w >mixer ( 23:48:45 ) 0.068u 0.036s 0:00.17 52.9% 0+0k 0+2216io 0pf+0w :ENERGY convergence: 3.00000101561e-06 :CHARGE convergence: 3.3e-05 :EF convergence: -3.93971e-05 :ITT1 cycle 6 Fri Jul 15 23:48:45 2011 -1/99 to go >lapw0 ( 23:48:45 ) 3.012u 0.044s 0:03.11 98.0% 0+0k 0+1360io 0pf+0w >lapw1 -c ( 23:48:48 ) 358.938u 3.412s 6:05.51 99.1% 0+0k 0+821856io 0pf+0w