sys.argv= ['/home/haule/dmft_w2k/bin/x_dmft.py', '-d', '-p', 'dmft1'] DmftEnvironment: mpi_prefix.dat exists -- running in parallel mode. /opt/mpich2/intel/11.1/bin/mpiexec -port 22225 -np 96 -machinefile /tmp/42225.1.wp12_hp/machines -env OMP_NUM_THREADS 1 -envlist LD_LIBRARY_PATH,SCRATCH,WIEN_DMFT_ROOT,PYTHONPATH,WIENROOT DmftEnvironment: mpi_prefix.dat2 is different from mpi_prefix.dat -- running dmft1/dmft2 in parallel mode. /opt/mpich2/intel/11.1/bin/mpiexec -port 22225 -np 48 -machinefile wmachines -env OMP_NUM_THREADS 2 -envlist LD_LIBRARY_PATH,SCRATCH,WIEN_DMFT_ROOT,PYTHONPATH,WIENROOT Found SrIrO3.vectorso file, hence assuming so-coupling exists. Switching -so switch! case= SrIrO3 root= /home/haule/dmft_w2k/bin cixs= [1, 2, 3, 4] NOE= 236.0 opening SrIrO3.scf2 Ef= 8.6019266089 Found DMFT-mu= 8.60188631132 nargs= 1 argi=dmft1.def mode=g EF= 8.6018863 1) Finished k-point number 2 with #bands= 160 3) Finished k-point number 4 with #bands= 160 5) Finished k-point number 6 with #bands= 160 2) Finished k-point number 3 with #bands= 158 15) Finished k-point number 16 with #bands= 160 19) Finished k-point number 20 with #bands= 160 35) Finished k-point number 36 with #bands= 160 11) Finished k-point number 12 with #bands= 160 33) Finished k-point number 34 with #bands= 158 34) Finished k-point number 35 with #bands= 160 21) Finished k-point number 22 with #bands= 156 41) Finished k-point number 42 with #bands= 160 14) Finished k-point number 15 with #bands= 158 47) Finished k-point number 48 with #bands= 160 4) Finished k-point number 5 with #bands= 158 22) Finished k-point number 23 with #bands= 160 7) Finished k-point number 8 with #bands= 160 43) Finished k-point number 44 with #bands= 160 6) Finished k-point number 7 with #bands= 160 25) Finished k-point number 26 with #bands= 160 23) Finished k-point number 24 with #bands= 160 17) Finished k-point number 18 with #bands= 158 30) Finished k-point number 31 with #bands= 160 45) Finished k-point number 46 with #bands= 160 27) Finished k-point number 28 with #bands= 160 9) Finished k-point number 10 with #bands= 156 39) Finished k-point number 40 with #bands= 160 10) Finished k-point number 11 with #bands= 160 38) Finished k-point number 39 with #bands= 160 46) Finished k-point number 47 with #bands= 160 29) Finished k-point number 30 with #bands= 158 16) Finished k-point number 17 with #bands= 160 31) Finished k-point number 32 with #bands= 160 13) Finished k-point number 14 with #bands= 162 26) Finished k-point number 27 with #bands= 160 18) Finished k-point number 19 with #bands= 160 12) Finished k-point number 13 with #bands= 162 8) Finished k-point number 9 with #bands= 160 20) Finished k-point number 21 with #bands= 160 28) Finished k-point number 29 with #bands= 160 24) Finished k-point number 25 with #bands= 160 40) Finished k-point number 41 with #bands= 160 37) Finished k-point number 38 with #bands= 156 44) Finished k-point number 45 with #bands= 160 32) Finished k-point number 33 with #bands= 160 0) Finished k-point number 1 with #bands= 162 42) Finished k-point number 43 with #bands= 160 36) Finished k-point number 37 with #bands= 156 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751801823775365 0.758319344220461 0.761082724798633 0.751801823775755 0.758319344220160 0.761082724798544 0.751801823775718 0.758319344220193 0.761082724798552 0.751801823775328 0.758319344220494 0.761082724798641 10) Finished k-point number 11 with #bands= 160 19) Finished k-point number 20 with #bands= 160 37) Finished k-point number 38 with #bands= 156 4) Finished k-point number 5 with #bands= 158 2) Finished k-point number 3 with #bands= 158 44) Finished k-point number 45 with #bands= 160 14) Finished k-point number 15 with #bands= 158 27) Finished k-point number 28 with #bands= 160 29) Finished k-point number 30 with #bands= 158 3) Finished k-point number 4 with #bands= 160 22) Finished k-point number 23 with #bands= 160 41) Finished k-point number 42 with #bands= 160 1) Finished k-point number 2 with #bands= 160 34) Finished k-point number 35 with #bands= 160 43) Finished k-point number 44 with #bands= 160 17) Finished k-point number 18 with #bands= 158 39) Finished k-point number 40 with #bands= 160 40) Finished k-point number 41 with #bands= 160 13) Finished k-point number 14 with #bands= 162 6) Finished k-point number 7 with #bands= 160 7) Finished k-point number 8 with #bands= 160 36) Finished k-point number 37 with #bands= 156 38) Finished k-point number 39 with #bands= 160 11) Finished k-point number 12 with #bands= 160 9) Finished k-point number 10 with #bands= 156 16) Finished k-point number 17 with #bands= 160 18) Finished k-point number 19 with #bands= 160 8) Finished k-point number 9 with #bands= 160 21) Finished k-point number 22 with #bands= 156 23) Finished k-point number 24 with #bands= 160 35) Finished k-point number 36 with #bands= 160 25) Finished k-point number 26 with #bands= 160 33) Finished k-point number 34 with #bands= 158 0) Finished k-point number 1 with #bands= 162 5) Finished k-point number 6 with #bands= 160 32) Finished k-point number 33 with #bands= 160 24) Finished k-point number 25 with #bands= 160 20) Finished k-point number 21 with #bands= 160 26) Finished k-point number 27 with #bands= 160 30) Finished k-point number 31 with #bands= 160 31) Finished k-point number 32 with #bands= 160 28) Finished k-point number 29 with #bands= 160 15) Finished k-point number 16 with #bands= 160 12) Finished k-point number 13 with #bands= 162 47) Finished k-point number 48 with #bands= 160 42) Finished k-point number 43 with #bands= 160 46) Finished k-point number 47 with #bands= 160 45) Finished k-point number 46 with #bands= 160 Eimp= -1.51249149904271 -1.74327436362073 -1.81818350355632 -1.51249149903950 -1.74327436362217 -1.81818350355893 -1.51249149903981 -1.74327436362314 -1.81818350355768 -1.51249149904302 -1.74327436362171 -1.81818350355507 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 44.1 nargs= 1 argi=dmft1.def mode=g EF= 8.5905913 5) Finished k-point number 6 with #bands= 160 1) Finished k-point number 2 with #bands= 160 3) Finished k-point number 4 with #bands= 160 2) Finished k-point number 3 with #bands= 158 19) Finished k-point number 20 with #bands= 160 31) Finished k-point number 32 with #bands= 160 15) Finished k-point number 16 with #bands= 160 39) Finished k-point number 40 with #bands= 160 38) Finished k-point number 39 with #bands= 160 13) Finished k-point number 14 with #bands= 162 14) Finished k-point number 15 with #bands= 158 9) Finished k-point number 10 with #bands= 156 30) Finished k-point number 31 with #bands= 160 37) Finished k-point number 38 with #bands= 156 46) Finished k-point number 47 with #bands= 160 23) Finished k-point number 24 with #bands= 160 12) Finished k-point number 13 with #bands= 162 4) Finished k-point number 5 with #bands= 158 6) Finished k-point number 7 with #bands= 160 36) Finished k-point number 37 with #bands= 156 21) Finished k-point number 22 with #bands= 156 47) Finished k-point number 48 with #bands= 160 43) Finished k-point number 44 with #bands= 160 17) Finished k-point number 18 with #bands= 158 22) Finished k-point number 23 with #bands= 160 7) Finished k-point number 8 with #bands= 160 11) Finished k-point number 12 with #bands= 160 20) Finished k-point number 21 with #bands= 160 18) Finished k-point number 19 with #bands= 160 8) Finished k-point number 9 with #bands= 160 29) Finished k-point number 30 with #bands= 158 41) Finished k-point number 42 with #bands= 160 28) Finished k-point number 29 with #bands= 160 42) Finished k-point number 43 with #bands= 160 10) Finished k-point number 11 with #bands= 160 34) Finished k-point number 35 with #bands= 160 33) Finished k-point number 34 with #bands= 158 25) Finished k-point number 26 with #bands= 160 35) Finished k-point number 36 with #bands= 160 40) Finished k-point number 41 with #bands= 160 16) Finished k-point number 17 with #bands= 160 32) Finished k-point number 33 with #bands= 160 26) Finished k-point number 27 with #bands= 160 27) Finished k-point number 28 with #bands= 160 24) Finished k-point number 25 with #bands= 160 0) Finished k-point number 1 with #bands= 162 45) Finished k-point number 46 with #bands= 160 44) Finished k-point number 45 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751802351885465 0.758325127683829 0.761081735979423 0.751802351885857 0.758325127683656 0.761081735979204 0.751802351885883 0.758325127683523 0.761081735979306 0.751802351885491 0.758325127683696 0.761081735979526 36) Finished k-point number 37 with #bands= 156 33) Finished k-point number 34 with #bands= 158 26) Finished k-point number 27 with #bands= 160 28) Finished k-point number 29 with #bands= 160 35) Finished k-point number 36 with #bands= 160 6) Finished k-point number 7 with #bands= 160 42) Finished k-point number 43 with #bands= 160 25) Finished k-point number 26 with #bands= 160 24) Finished k-point number 25 with #bands= 160 30) Finished k-point number 31 with #bands= 160 27) Finished k-point number 28 with #bands= 160 31) Finished k-point number 32 with #bands= 160 29) Finished k-point number 30 with #bands= 158 19) Finished k-point number 20 with #bands= 160 12) Finished k-point number 13 with #bands= 162 15) Finished k-point number 16 with #bands= 160 13) Finished k-point number 14 with #bands= 162 23) Finished k-point number 24 with #bands= 160 43) Finished k-point number 44 with #bands= 160 8) Finished k-point number 9 with #bands= 160 9) Finished k-point number 10 with #bands= 156 37) Finished k-point number 38 with #bands= 156 2) Finished k-point number 3 with #bands= 158 4) Finished k-point number 5 with #bands= 158 3) Finished k-point number 4 with #bands= 160 10) Finished k-point number 11 with #bands= 160 1) Finished k-point number 2 with #bands= 160 17) Finished k-point number 18 with #bands= 158 7) Finished k-point number 8 with #bands= 160 40) Finished k-point number 41 with #bands= 160 21) Finished k-point number 22 with #bands= 156 45) Finished k-point number 46 with #bands= 160 16) Finished k-point number 17 with #bands= 160 44) Finished k-point number 45 with #bands= 160 32) Finished k-point number 33 with #bands= 160 46) Finished k-point number 47 with #bands= 160 47) Finished k-point number 48 with #bands= 160 18) Finished k-point number 19 with #bands= 160 11) Finished k-point number 12 with #bands= 160 5) Finished k-point number 6 with #bands= 160 14) Finished k-point number 15 with #bands= 158 38) Finished k-point number 39 with #bands= 160 39) Finished k-point number 40 with #bands= 160 41) Finished k-point number 42 with #bands= 160 34) Finished k-point number 35 with #bands= 160 20) Finished k-point number 21 with #bands= 160 0) Finished k-point number 1 with #bands= 162 22) Finished k-point number 23 with #bands= 160 Eimp= -1.50116092617545 -1.73211004292759 -1.80712932368807 -1.50116092617237 -1.73211004292895 -1.80712932369075 -1.50116092617207 -1.73211004292976 -1.80712932369020 -1.50116092617515 -1.73211004292840 -1.80712932368753 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 50.1 nargs= 1 argi=dmft1.def mode=g EF= 8.5742204 2) Finished k-point number 3 with #bands= 158 3) Finished k-point number 4 with #bands= 160 1) Finished k-point number 2 with #bands= 160 5) Finished k-point number 6 with #bands= 160 27) Finished k-point number 28 with #bands= 160 31) Finished k-point number 32 with #bands= 160 7) Finished k-point number 8 with #bands= 160 10) Finished k-point number 11 with #bands= 160 17) Finished k-point number 18 with #bands= 158 11) Finished k-point number 12 with #bands= 160 37) Finished k-point number 38 with #bands= 156 21) Finished k-point number 22 with #bands= 156 9) Finished k-point number 10 with #bands= 156 43) Finished k-point number 44 with #bands= 160 25) Finished k-point number 26 with #bands= 160 39) Finished k-point number 40 with #bands= 160 42) Finished k-point number 43 with #bands= 160 15) Finished k-point number 16 with #bands= 160 26) Finished k-point number 27 with #bands= 160 14) Finished k-point number 15 with #bands= 158 41) Finished k-point number 42 with #bands= 160 47) Finished k-point number 48 with #bands= 160 33) Finished k-point number 34 with #bands= 158 45) Finished k-point number 46 with #bands= 160 23) Finished k-point number 24 with #bands= 160 13) Finished k-point number 14 with #bands= 162 32) Finished k-point number 33 with #bands= 160 38) Finished k-point number 39 with #bands= 160 36) Finished k-point number 37 with #bands= 156 22) Finished k-point number 23 with #bands= 160 40) Finished k-point number 41 with #bands= 160 46) Finished k-point number 47 with #bands= 160 34) Finished k-point number 35 with #bands= 160 35) Finished k-point number 36 with #bands= 160 20) Finished k-point number 21 with #bands= 160 18) Finished k-point number 19 with #bands= 160 6) Finished k-point number 7 with #bands= 160 19) Finished k-point number 20 with #bands= 160 44) Finished k-point number 45 with #bands= 160 12) Finished k-point number 13 with #bands= 162 4) Finished k-point number 5 with #bands= 158 30) Finished k-point number 31 with #bands= 160 29) Finished k-point number 30 with #bands= 158 8) Finished k-point number 9 with #bands= 160 0) Finished k-point number 1 with #bands= 162 16) Finished k-point number 17 with #bands= 160 24) Finished k-point number 25 with #bands= 160 28) Finished k-point number 29 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751803752158387 0.758325031188793 0.761072772940266 0.751803752158749 0.758325031188592 0.761072772940105 0.751803752158758 0.758325031188613 0.761072772940078 0.751803752158396 0.758325031188814 0.761072772940239 9) Finished k-point number 10 with #bands= 156 36) Finished k-point number 37 with #bands= 156 39) Finished k-point number 40 with #bands= 160 19) Finished k-point number 20 with #bands= 160 41) Finished k-point number 42 with #bands= 160 2) Finished k-point number 3 with #bands= 158 38) Finished k-point number 39 with #bands= 160 15) Finished k-point number 16 with #bands= 160 11) Finished k-point number 12 with #bands= 160 25) Finished k-point number 26 with #bands= 160 1) Finished k-point number 2 with #bands= 160 20) Finished k-point number 21 with #bands= 160 23) Finished k-point number 24 with #bands= 160 0) Finished k-point number 1 with #bands= 162 4) Finished k-point number 5 with #bands= 158 47) Finished k-point number 48 with #bands= 160 32) Finished k-point number 33 with #bands= 160 30) Finished k-point number 31 with #bands= 160 46) Finished k-point number 47 with #bands= 160 35) Finished k-point number 36 with #bands= 160 31) Finished k-point number 32 with #bands= 160 33) Finished k-point number 34 with #bands= 158 37) Finished k-point number 38 with #bands= 156 34) Finished k-point number 35 with #bands= 160 40) Finished k-point number 41 with #bands= 160 21) Finished k-point number 22 with #bands= 156 5) Finished k-point number 6 with #bands= 160 17) Finished k-point number 18 with #bands= 158 6) Finished k-point number 7 with #bands= 160 29) Finished k-point number 30 with #bands= 158 43) Finished k-point number 44 with #bands= 160 3) Finished k-point number 4 with #bands= 160 7) Finished k-point number 8 with #bands= 160 28) Finished k-point number 29 with #bands= 160 8) Finished k-point number 9 with #bands= 160 26) Finished k-point number 27 with #bands= 160 14) Finished k-point number 15 with #bands= 158 44) Finished k-point number 45 with #bands= 160 45) Finished k-point number 46 with #bands= 160 22) Finished k-point number 23 with #bands= 160 18) Finished k-point number 19 with #bands= 160 10) Finished k-point number 11 with #bands= 160 16) Finished k-point number 17 with #bands= 160 12) Finished k-point number 13 with #bands= 162 27) Finished k-point number 28 with #bands= 160 24) Finished k-point number 25 with #bands= 160 13) Finished k-point number 14 with #bands= 162 42) Finished k-point number 43 with #bands= 160 Eimp= -1.48465975627958 -1.71556947563327 -1.79054890766990 -1.48465975627653 -1.71556947563444 -1.79054890767268 -1.48465975627671 -1.71556947563438 -1.79054890767253 -1.48465975627977 -1.71556947563321 -1.79054890766975 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 41.3 nargs= 1 argi=dmft1.def mode=g EF= 8.5645444 3) Finished k-point number 4 with #bands= 160 5) Finished k-point number 6 with #bands= 160 1) Finished k-point number 2 with #bands= 160 2) Finished k-point number 3 with #bands= 158 11) Finished k-point number 12 with #bands= 160 25) Finished k-point number 26 with #bands= 160 17) Finished k-point number 18 with #bands= 158 9) Finished k-point number 10 with #bands= 156 33) Finished k-point number 34 with #bands= 158 29) Finished k-point number 30 with #bands= 158 31) Finished k-point number 32 with #bands= 160 19) Finished k-point number 20 with #bands= 160 37) Finished k-point number 38 with #bands= 156 28) Finished k-point number 29 with #bands= 160 30) Finished k-point number 31 with #bands= 160 36) Finished k-point number 37 with #bands= 156 46) Finished k-point number 47 with #bands= 160 7) Finished k-point number 8 with #bands= 160 23) Finished k-point number 24 with #bands= 160 47) Finished k-point number 48 with #bands= 160 6) Finished k-point number 7 with #bands= 160 38) Finished k-point number 39 with #bands= 160 39) Finished k-point number 40 with #bands= 160 45) Finished k-point number 46 with #bands= 160 35) Finished k-point number 36 with #bands= 160 34) Finished k-point number 35 with #bands= 160 22) Finished k-point number 23 with #bands= 160 4) Finished k-point number 5 with #bands= 158 10) Finished k-point number 11 with #bands= 160 27) Finished k-point number 28 with #bands= 160 21) Finished k-point number 22 with #bands= 156 26) Finished k-point number 27 with #bands= 160 41) Finished k-point number 42 with #bands= 160 43) Finished k-point number 44 with #bands= 160 42) Finished k-point number 43 with #bands= 160 44) Finished k-point number 45 with #bands= 160 40) Finished k-point number 41 with #bands= 160 16) Finished k-point number 17 with #bands= 160 32) Finished k-point number 33 with #bands= 160 14) Finished k-point number 15 with #bands= 158 24) Finished k-point number 25 with #bands= 160 18) Finished k-point number 19 with #bands= 160 20) Finished k-point number 21 with #bands= 160 15) Finished k-point number 16 with #bands= 160 13) Finished k-point number 14 with #bands= 162 8) Finished k-point number 9 with #bands= 160 12) Finished k-point number 13 with #bands= 162 0) Finished k-point number 1 with #bands= 162 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751815691014571 0.758330871752624 0.761097223176799 0.751815691014951 0.758330871752522 0.761097223176521 0.751815691015133 0.758330871752478 0.761097223176385 0.751815691014753 0.758330871752580 0.761097223176663 37) Finished k-point number 38 with #bands= 156 47) Finished k-point number 48 with #bands= 160 40) Finished k-point number 41 with #bands= 160 46) Finished k-point number 47 with #bands= 160 42) Finished k-point number 43 with #bands= 160 14) Finished k-point number 15 with #bands= 158 16) Finished k-point number 17 with #bands= 160 41) Finished k-point number 42 with #bands= 160 7) Finished k-point number 8 with #bands= 160 10) Finished k-point number 11 with #bands= 160 36) Finished k-point number 37 with #bands= 156 15) Finished k-point number 16 with #bands= 160 39) Finished k-point number 40 with #bands= 160 38) Finished k-point number 39 with #bands= 160 9) Finished k-point number 10 with #bands= 156 44) Finished k-point number 45 with #bands= 160 17) Finished k-point number 18 with #bands= 158 11) Finished k-point number 12 with #bands= 160 8) Finished k-point number 9 with #bands= 160 21) Finished k-point number 22 with #bands= 156 6) Finished k-point number 7 with #bands= 160 29) Finished k-point number 30 with #bands= 158 12) Finished k-point number 13 with #bands= 162 43) Finished k-point number 44 with #bands= 160 18) Finished k-point number 19 with #bands= 160 45) Finished k-point number 46 with #bands= 160 20) Finished k-point number 21 with #bands= 160 13) Finished k-point number 14 with #bands= 162 22) Finished k-point number 23 with #bands= 160 33) Finished k-point number 34 with #bands= 158 23) Finished k-point number 24 with #bands= 160 28) Finished k-point number 29 with #bands= 160 31) Finished k-point number 32 with #bands= 160 2) Finished k-point number 3 with #bands= 158 27) Finished k-point number 28 with #bands= 160 26) Finished k-point number 27 with #bands= 160 24) Finished k-point number 25 with #bands= 160 25) Finished k-point number 26 with #bands= 160 19) Finished k-point number 20 with #bands= 160 35) Finished k-point number 36 with #bands= 160 32) Finished k-point number 33 with #bands= 160 1) Finished k-point number 2 with #bands= 160 34) Finished k-point number 35 with #bands= 160 30) Finished k-point number 31 with #bands= 160 4) Finished k-point number 5 with #bands= 158 3) Finished k-point number 4 with #bands= 160 0) Finished k-point number 1 with #bands= 162 5) Finished k-point number 6 with #bands= 160 Eimp= -1.47583703428110 -1.70687876402184 -1.78194046193388 -1.47583703427820 -1.70687876402277 -1.78194046193689 -1.47583703427732 -1.70687876402312 -1.78194046193739 -1.47583703428023 -1.70687876402220 -1.78194046193438 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 60.0 nargs= 1 argi=dmft1.def mode=g EF= 8.5552728 1) Finished k-point number 2 with #bands= 160 5) Finished k-point number 6 with #bands= 160 3) Finished k-point number 4 with #bands= 160 2) Finished k-point number 3 with #bands= 158 35) Finished k-point number 36 with #bands= 160 25) Finished k-point number 26 with #bands= 160 39) Finished k-point number 40 with #bands= 160 23) Finished k-point number 24 with #bands= 160 29) Finished k-point number 30 with #bands= 158 21) Finished k-point number 22 with #bands= 156 10) Finished k-point number 11 with #bands= 160 17) Finished k-point number 18 with #bands= 158 11) Finished k-point number 12 with #bands= 160 27) Finished k-point number 28 with #bands= 160 9) Finished k-point number 10 with #bands= 156 14) Finished k-point number 15 with #bands= 158 15) Finished k-point number 16 with #bands= 160 19) Finished k-point number 20 with #bands= 160 8) Finished k-point number 9 with #bands= 160 38) Finished k-point number 39 with #bands= 160 13) Finished k-point number 14 with #bands= 162 18) Finished k-point number 19 with #bands= 160 12) Finished k-point number 13 with #bands= 162 6) Finished k-point number 7 with #bands= 160 7) Finished k-point number 8 with #bands= 160 4) Finished k-point number 5 with #bands= 158 22) Finished k-point number 23 with #bands= 160 47) Finished k-point number 48 with #bands= 160 46) Finished k-point number 47 with #bands= 160 20) Finished k-point number 21 with #bands= 160 45) Finished k-point number 46 with #bands= 160 43) Finished k-point number 44 with #bands= 160 44) Finished k-point number 45 with #bands= 160 36) Finished k-point number 37 with #bands= 156 26) Finished k-point number 27 with #bands= 160 40) Finished k-point number 41 with #bands= 160 41) Finished k-point number 42 with #bands= 160 37) Finished k-point number 38 with #bands= 156 42) Finished k-point number 43 with #bands= 160 31) Finished k-point number 32 with #bands= 160 16) Finished k-point number 17 with #bands= 160 24) Finished k-point number 25 with #bands= 160 28) Finished k-point number 29 with #bands= 160 30) Finished k-point number 31 with #bands= 160 32) Finished k-point number 33 with #bands= 160 0) Finished k-point number 1 with #bands= 162 34) Finished k-point number 35 with #bands= 160 33) Finished k-point number 34 with #bands= 158 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751790375864590 0.758308745883469 0.761063020141099 0.751790375864940 0.758308745883281 0.761063020140936 0.751790375864976 0.758308745883397 0.761063020140792 0.751790375864626 0.758308745883585 0.761063020140954 8) Finished k-point number 9 with #bands= 160 41) Finished k-point number 42 with #bands= 160 37) Finished k-point number 38 with #bands= 156 15) Finished k-point number 16 with #bands= 160 38) Finished k-point number 39 with #bands= 160 40) Finished k-point number 41 with #bands= 160 13) Finished k-point number 14 with #bands= 162 12) Finished k-point number 13 with #bands= 162 36) Finished k-point number 37 with #bands= 156 39) Finished k-point number 40 with #bands= 160 42) Finished k-point number 43 with #bands= 160 45) Finished k-point number 46 with #bands= 160 17) Finished k-point number 18 with #bands= 158 9) Finished k-point number 10 with #bands= 156 6) Finished k-point number 7 with #bands= 160 7) Finished k-point number 8 with #bands= 160 43) Finished k-point number 44 with #bands= 160 11) Finished k-point number 12 with #bands= 160 16) Finished k-point number 17 with #bands= 160 14) Finished k-point number 15 with #bands= 158 47) Finished k-point number 48 with #bands= 160 46) Finished k-point number 47 with #bands= 160 44) Finished k-point number 45 with #bands= 160 10) Finished k-point number 11 with #bands= 160 21) Finished k-point number 22 with #bands= 156 19) Finished k-point number 20 with #bands= 160 32) Finished k-point number 33 with #bands= 160 26) Finished k-point number 27 with #bands= 160 24) Finished k-point number 25 with #bands= 160 2) Finished k-point number 3 with #bands= 158 22) Finished k-point number 23 with #bands= 160 18) Finished k-point number 19 with #bands= 160 27) Finished k-point number 28 with #bands= 160 5) Finished k-point number 6 with #bands= 160 1) Finished k-point number 2 with #bands= 160 23) Finished k-point number 24 with #bands= 160 31) Finished k-point number 32 with #bands= 160 20) Finished k-point number 21 with #bands= 160 3) Finished k-point number 4 with #bands= 160 34) Finished k-point number 35 with #bands= 160 4) Finished k-point number 5 with #bands= 158 33) Finished k-point number 34 with #bands= 158 30) Finished k-point number 31 with #bands= 160 25) Finished k-point number 26 with #bands= 160 29) Finished k-point number 30 with #bands= 158 0) Finished k-point number 1 with #bands= 162 28) Finished k-point number 29 with #bands= 160 35) Finished k-point number 36 with #bands= 160 Eimp= -1.46499680884722 -1.69579084219439 -1.77065683798290 -1.46499680884418 -1.69579084219547 -1.77065683798571 -1.46499680884412 -1.69579084219555 -1.77065683798572 -1.46499680884715 -1.69579084219447 -1.77065683798291 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 61.5 nargs= 1 argi=dmft1.def mode=g EF= 8.5524210 2) Finished k-point number 3 with #bands= 158 5) Finished k-point number 6 with #bands= 160 1) Finished k-point number 2 with #bands= 160 3) Finished k-point number 4 with #bands= 160 11) Finished k-point number 12 with #bands= 160 25) Finished k-point number 26 with #bands= 160 9) Finished k-point number 10 with #bands= 156 7) Finished k-point number 8 with #bands= 160 27) Finished k-point number 28 with #bands= 160 41) Finished k-point number 42 with #bands= 160 17) Finished k-point number 18 with #bands= 158 45) Finished k-point number 46 with #bands= 160 21) Finished k-point number 22 with #bands= 156 29) Finished k-point number 30 with #bands= 158 39) Finished k-point number 40 with #bands= 160 43) Finished k-point number 44 with #bands= 160 6) Finished k-point number 7 with #bands= 160 4) Finished k-point number 5 with #bands= 158 13) Finished k-point number 14 with #bands= 162 15) Finished k-point number 16 with #bands= 160 10) Finished k-point number 11 with #bands= 160 38) Finished k-point number 39 with #bands= 160 14) Finished k-point number 15 with #bands= 158 37) Finished k-point number 38 with #bands= 156 8) Finished k-point number 9 with #bands= 160 12) Finished k-point number 13 with #bands= 162 31) Finished k-point number 32 with #bands= 160 47) Finished k-point number 48 with #bands= 160 28) Finished k-point number 29 with #bands= 160 46) Finished k-point number 47 with #bands= 160 42) Finished k-point number 43 with #bands= 160 44) Finished k-point number 45 with #bands= 160 40) Finished k-point number 41 with #bands= 160 30) Finished k-point number 31 with #bands= 160 26) Finished k-point number 27 with #bands= 160 34) Finished k-point number 35 with #bands= 160 36) Finished k-point number 37 with #bands= 156 35) Finished k-point number 36 with #bands= 160 24) Finished k-point number 25 with #bands= 160 33) Finished k-point number 34 with #bands= 158 32) Finished k-point number 33 with #bands= 160 19) Finished k-point number 20 with #bands= 160 16) Finished k-point number 17 with #bands= 160 22) Finished k-point number 23 with #bands= 160 20) Finished k-point number 21 with #bands= 160 18) Finished k-point number 19 with #bands= 160 0) Finished k-point number 1 with #bands= 162 23) Finished k-point number 24 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751777068514810 0.758301919764593 0.761063041032160 0.751777068515231 0.758301919764434 0.761063041031899 0.751777068515227 0.758301919764375 0.761063041031961 0.751777068514806 0.758301919764535 0.761063041032223 36) Finished k-point number 37 with #bands= 156 41) Finished k-point number 42 with #bands= 160 39) Finished k-point number 40 with #bands= 160 40) Finished k-point number 41 with #bands= 160 6) Finished k-point number 7 with #bands= 160 13) Finished k-point number 14 with #bands= 162 46) Finished k-point number 47 with #bands= 160 19) Finished k-point number 20 with #bands= 160 10) Finished k-point number 11 with #bands= 160 12) Finished k-point number 13 with #bands= 162 17) Finished k-point number 18 with #bands= 158 15) Finished k-point number 16 with #bands= 160 9) Finished k-point number 10 with #bands= 156 37) Finished k-point number 38 with #bands= 156 43) Finished k-point number 44 with #bands= 160 7) Finished k-point number 8 with #bands= 160 45) Finished k-point number 46 with #bands= 160 44) Finished k-point number 45 with #bands= 160 38) Finished k-point number 39 with #bands= 160 21) Finished k-point number 22 with #bands= 156 14) Finished k-point number 15 with #bands= 158 29) Finished k-point number 30 with #bands= 158 32) Finished k-point number 33 with #bands= 160 42) Finished k-point number 43 with #bands= 160 11) Finished k-point number 12 with #bands= 160 16) Finished k-point number 17 with #bands= 160 47) Finished k-point number 48 with #bands= 160 8) Finished k-point number 9 with #bands= 160 2) Finished k-point number 3 with #bands= 158 28) Finished k-point number 29 with #bands= 160 24) Finished k-point number 25 with #bands= 160 4) Finished k-point number 5 with #bands= 158 26) Finished k-point number 27 with #bands= 160 27) Finished k-point number 28 with #bands= 160 20) Finished k-point number 21 with #bands= 160 18) Finished k-point number 19 with #bands= 160 22) Finished k-point number 23 with #bands= 160 25) Finished k-point number 26 with #bands= 160 23) Finished k-point number 24 with #bands= 160 3) Finished k-point number 4 with #bands= 160 33) Finished k-point number 34 with #bands= 158 35) Finished k-point number 36 with #bands= 160 34) Finished k-point number 35 with #bands= 160 1) Finished k-point number 2 with #bands= 160 30) Finished k-point number 31 with #bands= 160 31) Finished k-point number 32 with #bands= 160 0) Finished k-point number 1 with #bands= 162 5) Finished k-point number 6 with #bands= 160 Eimp= -1.46168270038980 -1.69243399602794 -1.76723331900858 -1.46168270038673 -1.69243399602922 -1.76723331901143 -1.46168270038682 -1.69243399602962 -1.76723331901093 -1.46168270038989 -1.69243399602834 -1.76723331900807 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 58.9 nargs= 1 argi=dmft1.def mode=g EF= 8.5481028 5) Finished k-point number 6 with #bands= 160 2) Finished k-point number 3 with #bands= 158 1) Finished k-point number 2 with #bands= 160 3) Finished k-point number 4 with #bands= 160 39) Finished k-point number 40 with #bands= 160 19) Finished k-point number 20 with #bands= 160 7) Finished k-point number 8 with #bands= 160 37) Finished k-point number 38 with #bands= 156 13) Finished k-point number 14 with #bands= 162 27) Finished k-point number 28 with #bands= 160 21) Finished k-point number 22 with #bands= 156 23) Finished k-point number 24 with #bands= 160 25) Finished k-point number 26 with #bands= 160 26) Finished k-point number 27 with #bands= 160 35) Finished k-point number 36 with #bands= 160 29) Finished k-point number 30 with #bands= 158 22) Finished k-point number 23 with #bands= 160 11) Finished k-point number 12 with #bands= 160 4) Finished k-point number 5 with #bands= 158 14) Finished k-point number 15 with #bands= 158 10) Finished k-point number 11 with #bands= 160 15) Finished k-point number 16 with #bands= 160 47) Finished k-point number 48 with #bands= 160 18) Finished k-point number 19 with #bands= 160 20) Finished k-point number 21 with #bands= 160 9) Finished k-point number 10 with #bands= 156 34) Finished k-point number 35 with #bands= 160 31) Finished k-point number 32 with #bands= 160 17) Finished k-point number 18 with #bands= 158 12) Finished k-point number 13 with #bands= 162 6) Finished k-point number 7 with #bands= 160 8) Finished k-point number 9 with #bands= 160 28) Finished k-point number 29 with #bands= 160 33) Finished k-point number 34 with #bands= 158 16) Finished k-point number 17 with #bands= 160 46) Finished k-point number 47 with #bands= 160 43) Finished k-point number 44 with #bands= 160 30) Finished k-point number 31 with #bands= 160 24) Finished k-point number 25 with #bands= 160 42) Finished k-point number 43 with #bands= 160 0) Finished k-point number 1 with #bands= 162 32) Finished k-point number 33 with #bands= 160 44) Finished k-point number 45 with #bands= 160 40) Finished k-point number 41 with #bands= 160 38) Finished k-point number 39 with #bands= 160 45) Finished k-point number 46 with #bands= 160 36) Finished k-point number 37 with #bands= 156 41) Finished k-point number 42 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751793546852930 0.758319159599077 0.761083600295392 0.751793546853337 0.758319159598889 0.761083600295174 0.751793546853274 0.758319159599123 0.761083600295007 0.751793546852867 0.758319159599312 0.761083600295226 1) Finished k-point number 2 with #bands= 160 17) Finished k-point number 18 with #bands= 158 22) Finished k-point number 23 with #bands= 160 0) Finished k-point number 1 with #bands= 162 9) Finished k-point number 10 with #bands= 156 37) Finished k-point number 38 with #bands= 156 11) Finished k-point number 12 with #bands= 160 8) Finished k-point number 9 with #bands= 160 19) Finished k-point number 20 with #bands= 160 42) Finished k-point number 43 with #bands= 160 36) Finished k-point number 37 with #bands= 156 10) Finished k-point number 11 with #bands= 160 15) Finished k-point number 16 with #bands= 160 7) Finished k-point number 8 with #bands= 160 6) Finished k-point number 7 with #bands= 160 38) Finished k-point number 39 with #bands= 160 39) Finished k-point number 40 with #bands= 160 31) Finished k-point number 32 with #bands= 160 23) Finished k-point number 24 with #bands= 160 41) Finished k-point number 42 with #bands= 160 40) Finished k-point number 41 with #bands= 160 29) Finished k-point number 30 with #bands= 158 13) Finished k-point number 14 with #bands= 162 35) Finished k-point number 36 with #bands= 160 21) Finished k-point number 22 with #bands= 156 18) Finished k-point number 19 with #bands= 160 16) Finished k-point number 17 with #bands= 160 46) Finished k-point number 47 with #bands= 160 20) Finished k-point number 21 with #bands= 160 5) Finished k-point number 6 with #bands= 160 30) Finished k-point number 31 with #bands= 160 43) Finished k-point number 44 with #bands= 160 27) Finished k-point number 28 with #bands= 160 2) Finished k-point number 3 with #bands= 158 34) Finished k-point number 35 with #bands= 160 4) Finished k-point number 5 with #bands= 158 24) Finished k-point number 25 with #bands= 160 14) Finished k-point number 15 with #bands= 158 33) Finished k-point number 34 with #bands= 158 3) Finished k-point number 4 with #bands= 160 12) Finished k-point number 13 with #bands= 162 25) Finished k-point number 26 with #bands= 160 44) Finished k-point number 45 with #bands= 160 45) Finished k-point number 46 with #bands= 160 47) Finished k-point number 48 with #bands= 160 32) Finished k-point number 33 with #bands= 160 26) Finished k-point number 27 with #bands= 160 28) Finished k-point number 29 with #bands= 160 Eimp= -1.45852572038780 -1.68941445767671 -1.76433055106579 -1.45852572038436 -1.68941445767817 -1.76433055106880 -1.45852572038481 -1.68941445767828 -1.76433055106832 -1.45852572038825 -1.68941445767682 -1.76433055106531 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 39.8 nargs= 1 argi=dmft1.def mode=g EF= 8.5454249 2) Finished k-point number 3 with #bands= 158 5) Finished k-point number 6 with #bands= 160 3) Finished k-point number 4 with #bands= 160 1) Finished k-point number 2 with #bands= 160 23) Finished k-point number 24 with #bands= 160 7) Finished k-point number 8 with #bands= 160 22) Finished k-point number 23 with #bands= 160 43) Finished k-point number 44 with #bands= 160 15) Finished k-point number 16 with #bands= 160 14) Finished k-point number 15 with #bands= 158 10) Finished k-point number 11 with #bands= 160 13) Finished k-point number 14 with #bands= 162 11) Finished k-point number 12 with #bands= 160 45) Finished k-point number 46 with #bands= 160 21) Finished k-point number 22 with #bands= 156 19) Finished k-point number 20 with #bands= 160 6) Finished k-point number 7 with #bands= 160 47) Finished k-point number 48 with #bands= 160 12) Finished k-point number 13 with #bands= 162 8) Finished k-point number 9 with #bands= 160 29) Finished k-point number 30 with #bands= 158 4) Finished k-point number 5 with #bands= 158 9) Finished k-point number 10 with #bands= 156 46) Finished k-point number 47 with #bands= 160 37) Finished k-point number 38 with #bands= 156 44) Finished k-point number 45 with #bands= 160 35) Finished k-point number 36 with #bands= 160 34) Finished k-point number 35 with #bands= 160 41) Finished k-point number 42 with #bands= 160 25) Finished k-point number 26 with #bands= 160 17) Finished k-point number 18 with #bands= 158 20) Finished k-point number 21 with #bands= 160 18) Finished k-point number 19 with #bands= 160 42) Finished k-point number 43 with #bands= 160 26) Finished k-point number 27 with #bands= 160 27) Finished k-point number 28 with #bands= 160 33) Finished k-point number 34 with #bands= 158 39) Finished k-point number 40 with #bands= 160 38) Finished k-point number 39 with #bands= 160 40) Finished k-point number 41 with #bands= 160 36) Finished k-point number 37 with #bands= 156 16) Finished k-point number 17 with #bands= 160 24) Finished k-point number 25 with #bands= 160 28) Finished k-point number 29 with #bands= 160 31) Finished k-point number 32 with #bands= 160 0) Finished k-point number 1 with #bands= 162 32) Finished k-point number 33 with #bands= 160 30) Finished k-point number 31 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751778392646286 0.758300142721177 0.761065801342736 0.751778392646607 0.758300142721015 0.761065801342577 0.751778392646440 0.758300142721067 0.761065801342694 0.751778392646119 0.758300142721228 0.761065801342854 47) Finished k-point number 48 with #bands= 160 11) Finished k-point number 12 with #bands= 160 17) Finished k-point number 18 with #bands= 158 12) Finished k-point number 13 with #bands= 162 37) Finished k-point number 38 with #bands= 156 36) Finished k-point number 37 with #bands= 156 7) Finished k-point number 8 with #bands= 160 9) Finished k-point number 10 with #bands= 156 45) Finished k-point number 46 with #bands= 160 39) Finished k-point number 40 with #bands= 160 8) Finished k-point number 9 with #bands= 160 41) Finished k-point number 42 with #bands= 160 21) Finished k-point number 22 with #bands= 156 38) Finished k-point number 39 with #bands= 160 6) Finished k-point number 7 with #bands= 160 14) Finished k-point number 15 with #bands= 158 40) Finished k-point number 41 with #bands= 160 16) Finished k-point number 17 with #bands= 160 13) Finished k-point number 14 with #bands= 162 43) Finished k-point number 44 with #bands= 160 42) Finished k-point number 43 with #bands= 160 44) Finished k-point number 45 with #bands= 160 46) Finished k-point number 47 with #bands= 160 10) Finished k-point number 11 with #bands= 160 15) Finished k-point number 16 with #bands= 160 29) Finished k-point number 30 with #bands= 158 19) Finished k-point number 20 with #bands= 160 24) Finished k-point number 25 with #bands= 160 25) Finished k-point number 26 with #bands= 160 4) Finished k-point number 5 with #bands= 158 27) Finished k-point number 28 with #bands= 160 26) Finished k-point number 27 with #bands= 160 18) Finished k-point number 19 with #bands= 160 20) Finished k-point number 21 with #bands= 160 23) Finished k-point number 24 with #bands= 160 28) Finished k-point number 29 with #bands= 160 3) Finished k-point number 4 with #bands= 160 5) Finished k-point number 6 with #bands= 160 22) Finished k-point number 23 with #bands= 160 1) Finished k-point number 2 with #bands= 160 2) Finished k-point number 3 with #bands= 158 0) Finished k-point number 1 with #bands= 162 33) Finished k-point number 34 with #bands= 158 32) Finished k-point number 33 with #bands= 160 31) Finished k-point number 32 with #bands= 160 35) Finished k-point number 36 with #bands= 160 30) Finished k-point number 31 with #bands= 160 34) Finished k-point number 35 with #bands= 160 Eimp= -1.45476345713716 -1.68553713652604 -1.76035550119310 -1.45476345713420 -1.68553713652713 -1.76035550119575 -1.45476345713466 -1.68553713652780 -1.76035550119471 -1.45476345713761 -1.68553713652671 -1.76035550119206 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 61.9 nargs= 1 argi=dmft1.def mode=g EF= 8.5426973 1) Finished k-point number 2 with #bands= 160 5) Finished k-point number 6 with #bands= 160 3) Finished k-point number 4 with #bands= 160 2) Finished k-point number 3 with #bands= 158 11) Finished k-point number 12 with #bands= 160 33) Finished k-point number 34 with #bands= 158 10) Finished k-point number 11 with #bands= 160 45) Finished k-point number 46 with #bands= 160 35) Finished k-point number 36 with #bands= 160 7) Finished k-point number 8 with #bands= 160 29) Finished k-point number 30 with #bands= 158 26) Finished k-point number 27 with #bands= 160 27) Finished k-point number 28 with #bands= 160 9) Finished k-point number 10 with #bands= 156 17) Finished k-point number 18 with #bands= 158 25) Finished k-point number 26 with #bands= 160 41) Finished k-point number 42 with #bands= 160 6) Finished k-point number 7 with #bands= 160 37) Finished k-point number 38 with #bands= 156 13) Finished k-point number 14 with #bands= 162 19) Finished k-point number 20 with #bands= 160 4) Finished k-point number 5 with #bands= 158 39) Finished k-point number 40 with #bands= 160 36) Finished k-point number 37 with #bands= 156 15) Finished k-point number 16 with #bands= 160 8) Finished k-point number 9 with #bands= 160 43) Finished k-point number 44 with #bands= 160 14) Finished k-point number 15 with #bands= 158 12) Finished k-point number 13 with #bands= 162 38) Finished k-point number 39 with #bands= 160 42) Finished k-point number 43 with #bands= 160 24) Finished k-point number 25 with #bands= 160 44) Finished k-point number 45 with #bands= 160 28) Finished k-point number 29 with #bands= 160 40) Finished k-point number 41 with #bands= 160 46) Finished k-point number 47 with #bands= 160 47) Finished k-point number 48 with #bands= 160 31) Finished k-point number 32 with #bands= 160 32) Finished k-point number 33 with #bands= 160 30) Finished k-point number 31 with #bands= 160 34) Finished k-point number 35 with #bands= 160 16) Finished k-point number 17 with #bands= 160 18) Finished k-point number 19 with #bands= 160 0) Finished k-point number 1 with #bands= 162 22) Finished k-point number 23 with #bands= 160 21) Finished k-point number 22 with #bands= 156 20) Finished k-point number 21 with #bands= 160 23) Finished k-point number 24 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751786041328200 0.758307210355741 0.761068876180509 0.751786041328518 0.758307210355535 0.761068876180397 0.751786041328534 0.758307210355519 0.761068876180397 0.751786041328216 0.758307210355725 0.761068876180509 11) Finished k-point number 12 with #bands= 160 13) Finished k-point number 14 with #bands= 162 14) Finished k-point number 15 with #bands= 158 43) Finished k-point number 44 with #bands= 160 39) Finished k-point number 40 with #bands= 160 46) Finished k-point number 47 with #bands= 160 47) Finished k-point number 48 with #bands= 160 36) Finished k-point number 37 with #bands= 156 9) Finished k-point number 10 with #bands= 156 37) Finished k-point number 38 with #bands= 156 21) Finished k-point number 22 with #bands= 156 7) Finished k-point number 8 with #bands= 160 16) Finished k-point number 17 with #bands= 160 15) Finished k-point number 16 with #bands= 160 41) Finished k-point number 42 with #bands= 160 6) Finished k-point number 7 with #bands= 160 10) Finished k-point number 11 with #bands= 160 17) Finished k-point number 18 with #bands= 158 12) Finished k-point number 13 with #bands= 162 42) Finished k-point number 43 with #bands= 160 8) Finished k-point number 9 with #bands= 160 29) Finished k-point number 30 with #bands= 158 38) Finished k-point number 39 with #bands= 160 40) Finished k-point number 41 with #bands= 160 44) Finished k-point number 45 with #bands= 160 27) Finished k-point number 28 with #bands= 160 45) Finished k-point number 46 with #bands= 160 20) Finished k-point number 21 with #bands= 160 19) Finished k-point number 20 with #bands= 160 22) Finished k-point number 23 with #bands= 160 18) Finished k-point number 19 with #bands= 160 28) Finished k-point number 29 with #bands= 160 3) Finished k-point number 4 with #bands= 160 25) Finished k-point number 26 with #bands= 160 24) Finished k-point number 25 with #bands= 160 5) Finished k-point number 6 with #bands= 160 23) Finished k-point number 24 with #bands= 160 1) Finished k-point number 2 with #bands= 160 26) Finished k-point number 27 with #bands= 160 31) Finished k-point number 32 with #bands= 160 30) Finished k-point number 31 with #bands= 160 33) Finished k-point number 34 with #bands= 158 2) Finished k-point number 3 with #bands= 158 34) Finished k-point number 35 with #bands= 160 0) Finished k-point number 1 with #bands= 162 4) Finished k-point number 5 with #bands= 158 35) Finished k-point number 36 with #bands= 160 32) Finished k-point number 33 with #bands= 160 Eimp= -1.45229164675976 -1.68315179077291 -1.75815453756500 -1.45229164675682 -1.68315179077391 -1.75815453756768 -1.45229164675668 -1.68315179077395 -1.75815453756779 -1.45229164675962 -1.68315179077294 -1.75815453756511 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 64.9 nargs= 1 argi=dmft1.def mode=g EF= 8.5466601 3) Finished k-point number 4 with #bands= 160 5) Finished k-point number 6 with #bands= 160 1) Finished k-point number 2 with #bands= 160 2) Finished k-point number 3 with #bands= 158 29) Finished k-point number 30 with #bands= 158 21) Finished k-point number 22 with #bands= 156 23) Finished k-point number 24 with #bands= 160 35) Finished k-point number 36 with #bands= 160 34) Finished k-point number 35 with #bands= 160 45) Finished k-point number 46 with #bands= 160 9) Finished k-point number 10 with #bands= 156 22) Finished k-point number 23 with #bands= 160 37) Finished k-point number 38 with #bands= 156 13) Finished k-point number 14 with #bands= 162 31) Finished k-point number 32 with #bands= 160 47) Finished k-point number 48 with #bands= 160 33) Finished k-point number 34 with #bands= 158 46) Finished k-point number 47 with #bands= 160 11) Finished k-point number 12 with #bands= 160 10) Finished k-point number 11 with #bands= 160 17) Finished k-point number 18 with #bands= 158 7) Finished k-point number 8 with #bands= 160 25) Finished k-point number 26 with #bands= 160 44) Finished k-point number 45 with #bands= 160 4) Finished k-point number 5 with #bands= 158 6) Finished k-point number 7 with #bands= 160 43) Finished k-point number 44 with #bands= 160 41) Finished k-point number 42 with #bands= 160 20) Finished k-point number 21 with #bands= 160 38) Finished k-point number 39 with #bands= 160 42) Finished k-point number 43 with #bands= 160 30) Finished k-point number 31 with #bands= 160 14) Finished k-point number 15 with #bands= 158 32) Finished k-point number 33 with #bands= 160 12) Finished k-point number 13 with #bands= 162 15) Finished k-point number 16 with #bands= 160 8) Finished k-point number 9 with #bands= 160 28) Finished k-point number 29 with #bands= 160 26) Finished k-point number 27 with #bands= 160 27) Finished k-point number 28 with #bands= 160 16) Finished k-point number 17 with #bands= 160 0) Finished k-point number 1 with #bands= 162 24) Finished k-point number 25 with #bands= 160 39) Finished k-point number 40 with #bands= 160 19) Finished k-point number 20 with #bands= 160 18) Finished k-point number 19 with #bands= 160 40) Finished k-point number 41 with #bands= 160 36) Finished k-point number 37 with #bands= 156 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751767987003634 0.758297421752087 0.761056295026251 0.751767987003960 0.758297421752054 0.761056295025958 0.751767987003920 0.758297421752057 0.761056295025998 0.751767987003594 0.758297421752090 0.761056295026291 10) Finished k-point number 11 with #bands= 160 11) Finished k-point number 12 with #bands= 160 38) Finished k-point number 39 with #bands= 160 20) Finished k-point number 21 with #bands= 160 14) Finished k-point number 15 with #bands= 158 21) Finished k-point number 22 with #bands= 156 25) Finished k-point number 26 with #bands= 160 36) Finished k-point number 37 with #bands= 156 33) Finished k-point number 34 with #bands= 158 13) Finished k-point number 14 with #bands= 162 47) Finished k-point number 48 with #bands= 160 39) Finished k-point number 40 with #bands= 160 43) Finished k-point number 44 with #bands= 160 15) Finished k-point number 16 with #bands= 160 31) Finished k-point number 32 with #bands= 160 7) Finished k-point number 8 with #bands= 160 6) Finished k-point number 7 with #bands= 160 9) Finished k-point number 10 with #bands= 156 37) Finished k-point number 38 with #bands= 156 29) Finished k-point number 30 with #bands= 158 2) Finished k-point number 3 with #bands= 158 4) Finished k-point number 5 with #bands= 158 24) Finished k-point number 25 with #bands= 160 18) Finished k-point number 19 with #bands= 160 3) Finished k-point number 4 with #bands= 160 5) Finished k-point number 6 with #bands= 160 8) Finished k-point number 9 with #bands= 160 46) Finished k-point number 47 with #bands= 160 1) Finished k-point number 2 with #bands= 160 17) Finished k-point number 18 with #bands= 158 30) Finished k-point number 31 with #bands= 160 42) Finished k-point number 43 with #bands= 160 12) Finished k-point number 13 with #bands= 162 27) Finished k-point number 28 with #bands= 160 26) Finished k-point number 27 with #bands= 160 45) Finished k-point number 46 with #bands= 160 0) Finished k-point number 1 with #bands= 162 23) Finished k-point number 24 with #bands= 160 16) Finished k-point number 17 with #bands= 160 28) Finished k-point number 29 with #bands= 160 41) Finished k-point number 42 with #bands= 160 35) Finished k-point number 36 with #bands= 160 44) Finished k-point number 45 with #bands= 160 40) Finished k-point number 41 with #bands= 160 19) Finished k-point number 20 with #bands= 160 32) Finished k-point number 33 with #bands= 160 22) Finished k-point number 23 with #bands= 160 34) Finished k-point number 35 with #bands= 160 Eimp= -1.45511260184054 -1.68606243755054 -1.76114440125438 -1.45511260183757 -1.68606243755143 -1.76114440125738 -1.45511260183817 -1.68606243755045 -1.76114440125782 -1.45511260184114 -1.68606243754956 -1.76114440125482 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 50.5 nargs= 1 argi=dmft1.def mode=g EF= 8.5502904 2) Finished k-point number 3 with #bands= 158 1) Finished k-point number 2 with #bands= 160 3) Finished k-point number 4 with #bands= 160 5) Finished k-point number 6 with #bands= 160 23) Finished k-point number 24 with #bands= 160 19) Finished k-point number 20 with #bands= 160 39) Finished k-point number 40 with #bands= 160 7) Finished k-point number 8 with #bands= 160 17) Finished k-point number 18 with #bands= 158 31) Finished k-point number 32 with #bands= 160 18) Finished k-point number 19 with #bands= 160 10) Finished k-point number 11 with #bands= 160 25) Finished k-point number 26 with #bands= 160 11) Finished k-point number 12 with #bands= 160 22) Finished k-point number 23 with #bands= 160 37) Finished k-point number 38 with #bands= 156 9) Finished k-point number 10 with #bands= 156 4) Finished k-point number 5 with #bands= 158 6) Finished k-point number 7 with #bands= 160 47) Finished k-point number 48 with #bands= 160 46) Finished k-point number 47 with #bands= 160 21) Finished k-point number 22 with #bands= 156 40) Finished k-point number 41 with #bands= 160 41) Finished k-point number 42 with #bands= 160 45) Finished k-point number 46 with #bands= 160 30) Finished k-point number 31 with #bands= 160 20) Finished k-point number 21 with #bands= 160 44) Finished k-point number 45 with #bands= 160 38) Finished k-point number 39 with #bands= 160 42) Finished k-point number 43 with #bands= 160 43) Finished k-point number 44 with #bands= 160 14) Finished k-point number 15 with #bands= 158 36) Finished k-point number 37 with #bands= 156 15) Finished k-point number 16 with #bands= 160 8) Finished k-point number 9 with #bands= 160 12) Finished k-point number 13 with #bands= 162 13) Finished k-point number 14 with #bands= 162 34) Finished k-point number 35 with #bands= 160 26) Finished k-point number 27 with #bands= 160 33) Finished k-point number 34 with #bands= 158 32) Finished k-point number 33 with #bands= 160 28) Finished k-point number 29 with #bands= 160 35) Finished k-point number 36 with #bands= 160 29) Finished k-point number 30 with #bands= 158 0) Finished k-point number 1 with #bands= 162 16) Finished k-point number 17 with #bands= 160 24) Finished k-point number 25 with #bands= 160 27) Finished k-point number 28 with #bands= 160 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.751745357063606 0.758277781256248 0.761032906387844 0.751745357063900 0.758277781256206 0.761032906387592 0.751745357063871 0.758277781256043 0.761032906387778 0.751745357063577 0.758277781256085 0.761032906388030 37) Finished k-point number 38 with #bands= 156 4) Finished k-point number 5 with #bands= 158 27) Finished k-point number 28 with #bands= 160 38) Finished k-point number 39 with #bands= 160 1) Finished k-point number 2 with #bands= 160 3) Finished k-point number 4 with #bands= 160 43) Finished k-point number 44 with #bands= 160 31) Finished k-point number 32 with #bands= 160 25) Finished k-point number 26 with #bands= 160 28) Finished k-point number 29 with #bands= 160 23) Finished k-point number 24 with #bands= 160 6) Finished k-point number 7 with #bands= 160 17) Finished k-point number 18 with #bands= 158 30) Finished k-point number 31 with #bands= 160 45) Finished k-point number 46 with #bands= 160 14) Finished k-point number 15 with #bands= 158 33) Finished k-point number 34 with #bands= 158 9) Finished k-point number 10 with #bands= 156 42) Finished k-point number 43 with #bands= 160 21) Finished k-point number 22 with #bands= 156 36) Finished k-point number 37 with #bands= 156 18) Finished k-point number 19 with #bands= 160 40) Finished k-point number 41 with #bands= 160 39) Finished k-point number 40 with #bands= 160 24) Finished k-point number 25 with #bands= 160 20) Finished k-point number 21 with #bands= 160 29) Finished k-point number 30 with #bands= 158 2) Finished k-point number 3 with #bands= 158 44) Finished k-point number 45 with #bands= 160 46) Finished k-point number 47 with #bands= 160 10) Finished k-point number 11 with #bands= 160 26) Finished k-point number 27 with #bands= 160 5) Finished k-point number 6 with #bands= 160 7) Finished k-point number 8 with #bands= 160 16) Finished k-point number 17 with #bands= 160 11) Finished k-point number 12 with #bands= 160 15) Finished k-point number 16 with #bands= 160 8) Finished k-point number 9 with #bands= 160 0) Finished k-point number 1 with #bands= 162 41) Finished k-point number 42 with #bands= 160 35) Finished k-point number 36 with #bands= 160 22) Finished k-point number 23 with #bands= 160 47) Finished k-point number 48 with #bands= 160 12) Finished k-point number 13 with #bands= 162 32) Finished k-point number 33 with #bands= 160 34) Finished k-point number 35 with #bands= 160 19) Finished k-point number 20 with #bands= 160 13) Finished k-point number 14 with #bands= 162 Eimp= -1.45717173869106 -1.68823355793580 -1.76342952066439 -1.45717173868796 -1.68823355793658 -1.76342952066750 -1.45717173868820 -1.68823355793701 -1.76342952066682 -1.45717173869130 -1.68823355793622 -1.76342952066371 final Z due to interstitals= 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 1.00000000000000 =====>>> CPU TIME SUMMARY TOTAL : 49.2