Calculating Ba122 in /mnt/wk01/yinzping/WIEN2k/DMFT/FeAs/Ba122/Bbmb-QM/Ba122/no-SO/Ba122 on rupc04 with PID 25859 start (Thu Mar 11 19:18:06 EST 2010) with lapw0 (40/99 to go) cycle 1 (Thu Mar 11 19:18:06 EST 2010) (40/99 to go) > lapw0 (19:18:06) 6.684u 0.152s 0:06.98 97.8% 0+0k 0+0io 0pf+0w > lapw1 (19:18:13) 254.131u 1.124s 4:16.21 99.6% 0+0k 0+0io 13pf+0w > lapw2 (19:22:30) 50.959u 1.296s 0:53.21 98.1% 0+0k 0+0io 9pf+0w > lcore (19:23:23) 0.036u 0.032s 0:00.28 21.4% 0+0k 0+0io 5pf+0w > mixer (19:23:24) 0.104u 0.040s 0:00.39 35.8% 0+0k 0+0io 5pf+0w :ENERGY convergence: 0 0.0001 .0001886400000000 :CHARGE convergence: 0 0.0000 .0017436 ec cc and fc_conv 0 1 1 cycle 2 (Thu Mar 11 19:23:24 EST 2010) (39/98 to go) > lapw0 (19:23:25) 6.708u 0.148s 0:06.96 98.2% 0+0k 0+0io 0pf+0w > lapw1 (19:23:32) 254.155u 1.264s 4:16.03 99.7% 0+0k 0+0io 0pf+0w > lapw2 (19:27:48) 50.851u 1.368s 0:52.78 98.9% 0+0k 0+0io 0pf+0w > lcore (19:28:41) 0.052u 0.020s 0:00.17 41.1% 0+0k 0+0io 0pf+0w > mixer (19:28:41) 0.096u 0.048s 0:00.25 52.0% 0+0k 0+0io 0pf+0w :ENERGY convergence: 1 0.0001 .0000955900000000 :CHARGE convergence: 0 0.0000 .0011866 ec cc and fc_conv 1 1 1 > stop