DmftEnvironment: mpi_prefix.dat exists -- running in parallel mode. /opt/mpich2/intel/10.1/bin/mpiexec -env LD_LIBRARY_PATH /opt/intel/mkl/9.0/lib/em64t -port 20968 -np 64 -machinefile /tmp/45968.1.wp7_hp/machines case= BFA root= /home/haule/dmft_w2k/bin cixs= [1, 2] NOE= 68.0 opening BFA.scf2 Ef= 7.23482668378 Found DMFT-mu= 8.2347594677 nargs= 1 argi=dmft1.def mode=g EF= 8.2347595 3) Finished k-point number 7 with #bands= 33 2) Finished k-point number 5 with #bands= 31 2) Finished k-point number 6 with #bands= 34 1) Finished k-point number 3 with #bands= 32 0) Finished k-point number 1 with #bands= 34 0) Finished k-point number 2 with #bands= 34 3) Finished k-point number 8 with #bands= 31 1) Finished k-point number 4 with #bands= 30 7) Finished k-point number 15 with #bands= 34 6) Finished k-point number 13 with #bands= 32 5) Finished k-point number 11 with #bands= 34 4) Finished k-point number 9 with #bands= 31 4) Finished k-point number 10 with #bands= 31 6) Finished k-point number 14 with #bands= 31 5) Finished k-point number 12 with #bands= 32 7) Finished k-point number 16 with #bands= 33 8) Finished k-point number 17 with #bands= 32 8) Finished k-point number 18 with #bands= 32 9) Finished k-point number 19 with #bands= 31 20) Finished k-point number 41 with #bands= 32 9) Finished k-point number 20 with #bands= 33 21) Finished k-point number 43 with #bands= 33 22) Finished k-point number 45 with #bands= 32 10) Finished k-point number 21 with #bands= 32 10) Finished k-point number 22 with #bands= 32 23) Finished k-point number 47 with #bands= 33 22) Finished k-point number 46 with #bands= 33 21) Finished k-point number 44 with #bands= 33 20) Finished k-point number 42 with #bands= 33 23) Finished k-point number 48 with #bands= 32 11) Finished k-point number 23 with #bands= 33 11) Finished k-point number 24 with #bands= 32 16) Finished k-point number 33 with #bands= 34 16) Finished k-point number 34 with #bands= 32 17) Finished k-point number 35 with #bands= 31 17) Finished k-point number 36 with #bands= 33 18) Finished k-point number 37 with #bands= 34 18) Finished k-point number 38 with #bands= 31 19) Finished k-point number 39 with #bands= 32 19) Finished k-point number 40 with #bands= 33 32) Finished k-point number 65 with #bands= 33 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 69 with #bands= 32 35) Finished k-point number 72 with #bands= 32 34) Finished k-point number 70 with #bands= 32 32) Finished k-point number 66 with #bands= 32 33) Finished k-point number 67 with #bands= 33 33) Finished k-point number 68 with #bands= 33 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 36) Finished k-point number 74 with #bands= 33 28) Finished k-point number 57 with #bands= 33 28) Finished k-point number 58 with #bands= 32 29) Finished k-point number 59 with #bands= 32 29) Finished k-point number 60 with #bands= 32 30) Finished k-point number 61 with #bands= 33 30) Finished k-point number 62 with #bands= 32 31) Finished k-point number 63 with #bands= 33 31) Finished k-point number 64 with #bands= 34 12) Finished k-point number 25 with #bands= 34 12) Finished k-point number 26 with #bands= 32 13) Finished k-point number 27 with #bands= 30 13) Finished k-point number 28 with #bands= 30 14) Finished k-point number 29 with #bands= 34 15) Finished k-point number 31 with #bands= 31 14) Finished k-point number 30 with #bands= 32 15) Finished k-point number 32 with #bands= 30 26) Finished k-point number 53 with #bands= 31 27) Finished k-point number 55 with #bands= 30 24) Finished k-point number 49 with #bands= 33 25) Finished k-point number 51 with #bands= 34 26) Finished k-point number 54 with #bands= 31 24) Finished k-point number 50 with #bands= 31 25) Finished k-point number 52 with #bands= 32 27) Finished k-point number 56 with #bands= 33 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947391931242793 0.927066509197666 0.945636055668033 0.944193871248643 0.948842434200599 0.947391931242793 0.927066509197666 0.945636055668033 0.944193871248643 0.948842434200599 13) Finished k-point number 27 with #bands= 30 27) Finished k-point number 55 with #bands= 30 2) Finished k-point number 5 with #bands= 31 9) Finished k-point number 19 with #bands= 31 4) Finished k-point number 9 with #bands= 31 15) Finished k-point number 31 with #bands= 31 26) Finished k-point number 53 with #bands= 31 37) Finished k-point number 75 with #bands= 32 1) Finished k-point number 3 with #bands= 32 17) Finished k-point number 35 with #bands= 31 36) Finished k-point number 73 with #bands= 32 8) Finished k-point number 17 with #bands= 32 6) Finished k-point number 13 with #bands= 32 10) Finished k-point number 21 with #bands= 32 19) Finished k-point number 39 with #bands= 32 22) Finished k-point number 45 with #bands= 32 20) Finished k-point number 41 with #bands= 32 29) Finished k-point number 59 with #bands= 32 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 69 with #bands= 32 3) Finished k-point number 7 with #bands= 33 33) Finished k-point number 67 with #bands= 33 11) Finished k-point number 23 with #bands= 33 24) Finished k-point number 49 with #bands= 33 23) Finished k-point number 47 with #bands= 33 21) Finished k-point number 43 with #bands= 33 31) Finished k-point number 63 with #bands= 33 28) Finished k-point number 57 with #bands= 33 0) Finished k-point number 1 with #bands= 34 32) Finished k-point number 65 with #bands= 33 30) Finished k-point number 61 with #bands= 33 5) Finished k-point number 11 with #bands= 34 12) Finished k-point number 25 with #bands= 34 7) Finished k-point number 15 with #bands= 34 14) Finished k-point number 29 with #bands= 34 25) Finished k-point number 51 with #bands= 34 16) Finished k-point number 33 with #bands= 34 18) Finished k-point number 37 with #bands= 34 13) Finished k-point number 28 with #bands= 30 15) Finished k-point number 32 with #bands= 30 1) Finished k-point number 4 with #bands= 30 26) Finished k-point number 54 with #bands= 31 4) Finished k-point number 10 with #bands= 31 6) Finished k-point number 14 with #bands= 31 8) Finished k-point number 18 with #bands= 32 27) Finished k-point number 56 with #bands= 33 10) Finished k-point number 22 with #bands= 32 36) Finished k-point number 74 with #bands= 33 29) Finished k-point number 60 with #bands= 32 35) Finished k-point number 72 with #bands= 32 34) Finished k-point number 70 with #bands= 32 3) Finished k-point number 8 with #bands= 31 9) Finished k-point number 20 with #bands= 33 24) Finished k-point number 50 with #bands= 31 17) Finished k-point number 36 with #bands= 33 11) Finished k-point number 24 with #bands= 32 2) Finished k-point number 6 with #bands= 34 19) Finished k-point number 40 with #bands= 33 32) Finished k-point number 66 with #bands= 32 23) Finished k-point number 48 with #bands= 32 22) Finished k-point number 46 with #bands= 33 28) Finished k-point number 58 with #bands= 32 30) Finished k-point number 62 with #bands= 32 18) Finished k-point number 38 with #bands= 31 20) Finished k-point number 42 with #bands= 33 5) Finished k-point number 12 with #bands= 32 33) Finished k-point number 68 with #bands= 33 12) Finished k-point number 26 with #bands= 32 14) Finished k-point number 30 with #bands= 32 25) Finished k-point number 52 with #bands= 32 16) Finished k-point number 34 with #bands= 32 21) Finished k-point number 44 with #bands= 33 7) Finished k-point number 16 with #bands= 33 31) Finished k-point number 64 with #bands= 34 0) Finished k-point number 2 with #bands= 34 Eimp= -1.08043848034566 -1.02960585280267 -0.959712707763245 -0.953042278428048 -1.02124227031690 -1.08043848034566 -1.02960585280267 -0.959712707763245 -0.953042278428048 -1.02124227031690 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 nargs= 1 argi=dmft1.def mode=g EF= 8.2359642 0) Finished k-point number 1 with #bands= 34 1) Finished k-point number 3 with #bands= 32 0) Finished k-point number 2 with #bands= 34 1) Finished k-point number 4 with #bands= 30 2) Finished k-point number 5 with #bands= 31 2) Finished k-point number 6 with #bands= 34 3) Finished k-point number 7 with #bands= 33 3) Finished k-point number 8 with #bands= 31 11) Finished k-point number 23 with #bands= 33 9) Finished k-point number 19 with #bands= 31 8) Finished k-point number 17 with #bands= 32 11) Finished k-point number 24 with #bands= 32 9) Finished k-point number 20 with #bands= 33 8) Finished k-point number 18 with #bands= 32 10) Finished k-point number 21 with #bands= 32 10) Finished k-point number 22 with #bands= 32 7) Finished k-point number 15 with #bands= 34 6) Finished k-point number 13 with #bands= 32 5) Finished k-point number 11 with #bands= 33 4) Finished k-point number 9 with #bands= 31 7) Finished k-point number 16 with #bands= 33 6) Finished k-point number 14 with #bands= 31 5) Finished k-point number 12 with #bands= 32 4) Finished k-point number 10 with #bands= 31 15) Finished k-point number 31 with #bands= 31 14) Finished k-point number 29 with #bands= 34 13) Finished k-point number 27 with #bands= 30 13) Finished k-point number 28 with #bands= 30 12) Finished k-point number 25 with #bands= 34 14) Finished k-point number 30 with #bands= 32 15) Finished k-point number 32 with #bands= 30 12) Finished k-point number 26 with #bands= 32 17) Finished k-point number 35 with #bands= 31 16) Finished k-point number 33 with #bands= 34 16) Finished k-point number 34 with #bands= 32 17) Finished k-point number 36 with #bands= 33 23) Finished k-point number 47 with #bands= 33 23) Finished k-point number 48 with #bands= 32 22) Finished k-point number 45 with #bands= 32 22) Finished k-point number 46 with #bands= 33 21) Finished k-point number 43 with #bands= 33 20) Finished k-point number 41 with #bands= 32 20) Finished k-point number 42 with #bands= 33 21) Finished k-point number 44 with #bands= 33 19) Finished k-point number 39 with #bands= 32 19) Finished k-point number 40 with #bands= 33 18) Finished k-point number 37 with #bands= 34 18) Finished k-point number 38 with #bands= 31 28) Finished k-point number 57 with #bands= 33 30) Finished k-point number 61 with #bands= 33 30) Finished k-point number 62 with #bands= 32 29) Finished k-point number 59 with #bands= 32 29) Finished k-point number 60 with #bands= 32 28) Finished k-point number 58 with #bands= 32 25) Finished k-point number 51 with #bands= 34 31) Finished k-point number 63 with #bands= 33 26) Finished k-point number 53 with #bands= 31 31) Finished k-point number 64 with #bands= 34 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 26) Finished k-point number 54 with #bands= 31 25) Finished k-point number 52 with #bands= 32 24) Finished k-point number 49 with #bands= 33 24) Finished k-point number 50 with #bands= 31 36) Finished k-point number 74 with #bands= 33 27) Finished k-point number 55 with #bands= 30 27) Finished k-point number 56 with #bands= 33 32) Finished k-point number 65 with #bands= 33 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 69 with #bands= 32 33) Finished k-point number 67 with #bands= 33 32) Finished k-point number 66 with #bands= 32 35) Finished k-point number 72 with #bands= 32 34) Finished k-point number 70 with #bands= 32 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947289951725370 0.927026968314429 0.944808179159236 0.943364548788683 0.948448271143371 0.947289951725370 0.927026968314429 0.944808179159236 0.943364548788683 0.948448271143371 33) Finished k-point number 68 with #bands= 33 13) Finished k-point number 27 with #bands= 30 2) Finished k-point number 5 with #bands= 31 27) Finished k-point number 55 with #bands= 30 4) Finished k-point number 9 with #bands= 31 26) Finished k-point number 53 with #bands= 31 15) Finished k-point number 31 with #bands= 31 9) Finished k-point number 19 with #bands= 31 10) Finished k-point number 21 with #bands= 32 34) Finished k-point number 69 with #bands= 32 20) Finished k-point number 41 with #bands= 32 1) Finished k-point number 3 with #bands= 32 17) Finished k-point number 35 with #bands= 31 8) Finished k-point number 17 with #bands= 32 37) Finished k-point number 75 with #bands= 32 35) Finished k-point number 71 with #bands= 32 36) Finished k-point number 73 with #bands= 32 6) Finished k-point number 13 with #bands= 32 22) Finished k-point number 45 with #bands= 32 19) Finished k-point number 39 with #bands= 32 29) Finished k-point number 59 with #bands= 32 5) Finished k-point number 11 with #bands= 33 3) Finished k-point number 7 with #bands= 33 23) Finished k-point number 47 with #bands= 33 33) Finished k-point number 67 with #bands= 33 21) Finished k-point number 43 with #bands= 33 32) Finished k-point number 65 with #bands= 33 30) Finished k-point number 61 with #bands= 33 11) Finished k-point number 23 with #bands= 33 7) Finished k-point number 15 with #bands= 34 14) Finished k-point number 29 with #bands= 34 28) Finished k-point number 57 with #bands= 33 16) Finished k-point number 33 with #bands= 34 24) Finished k-point number 49 with #bands= 33 0) Finished k-point number 1 with #bands= 34 31) Finished k-point number 63 with #bands= 33 18) Finished k-point number 37 with #bands= 34 12) Finished k-point number 25 with #bands= 34 25) Finished k-point number 51 with #bands= 34 13) Finished k-point number 28 with #bands= 30 15) Finished k-point number 32 with #bands= 30 4) Finished k-point number 10 with #bands= 31 26) Finished k-point number 54 with #bands= 31 1) Finished k-point number 4 with #bands= 30 34) Finished k-point number 70 with #bands= 32 35) Finished k-point number 72 with #bands= 32 6) Finished k-point number 14 with #bands= 31 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 18 with #bands= 32 29) Finished k-point number 60 with #bands= 32 5) Finished k-point number 12 with #bands= 32 3) Finished k-point number 8 with #bands= 31 23) Finished k-point number 48 with #bands= 32 2) Finished k-point number 6 with #bands= 34 27) Finished k-point number 56 with #bands= 33 30) Finished k-point number 62 with #bands= 32 20) Finished k-point number 42 with #bands= 33 36) Finished k-point number 74 with #bands= 33 32) Finished k-point number 66 with #bands= 32 14) Finished k-point number 30 with #bands= 32 9) Finished k-point number 20 with #bands= 33 28) Finished k-point number 58 with #bands= 32 17) Finished k-point number 36 with #bands= 33 24) Finished k-point number 50 with #bands= 31 22) Finished k-point number 46 with #bands= 33 16) Finished k-point number 34 with #bands= 32 11) Finished k-point number 24 with #bands= 32 18) Finished k-point number 38 with #bands= 31 33) Finished k-point number 68 with #bands= 33 21) Finished k-point number 44 with #bands= 33 19) Finished k-point number 40 with #bands= 33 7) Finished k-point number 16 with #bands= 33 25) Finished k-point number 52 with #bands= 32 12) Finished k-point number 26 with #bands= 32 31) Finished k-point number 64 with #bands= 34 0) Finished k-point number 2 with #bands= 34 Eimp= -1.08318914203540 -1.03229498642107 -0.959661897512545 -0.952985864256674 -1.02272129900142 -1.08318914203540 -1.03229498642107 -0.959661897512546 -0.952985864256674 -1.02272129900142 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 nargs= 1 argi=dmft1.def 1) Finished k-point number 3 with #bands= 32 1) Finished k-point number 4 with #bands= 30 2) Finished k-point number 5 with #bands= 31 2) Finished k-point number 6 with #bands= 34 3) Finished k-point number 7 with #bands= 33 3) Finished k-point number 8 with #bands= 31 mode=g EF= 8.2346694 0) Finished k-point number 1 with #bands= 34 0) Finished k-point number 2 with #bands= 34 7) Finished k-point number 15 with #bands= 34 6) Finished k-point number 13 with #bands= 32 6) Finished k-point number 14 with #bands= 31 5) Finished k-point number 11 with #bands= 34 5) Finished k-point number 12 with #bands= 32 4) Finished k-point number 9 with #bands= 31 4) Finished k-point number 10 with #bands= 31 7) Finished k-point number 16 with #bands= 33 20) Finished k-point number 41 with #bands= 32 21) Finished k-point number 43 with #bands= 33 20) Finished k-point number 42 with #bands= 33 22) Finished k-point number 45 with #bands= 32 23) Finished k-point number 47 with #bands= 33 21) Finished k-point number 44 with #bands= 33 22) Finished k-point number 46 with #bands= 33 31) Finished k-point number 63 with #bands= 33 28) Finished k-point number 57 with #bands= 33 28) Finished k-point number 58 with #bands= 32 30) Finished k-point number 61 with #bands= 33 23) Finished k-point number 48 with #bands= 32 31) Finished k-point number 64 with #bands= 34 30) Finished k-point number 62 with #bands= 32 29) Finished k-point number 59 with #bands= 32 29) Finished k-point number 60 with #bands= 32 12) Finished k-point number 25 with #bands= 34 8) Finished k-point number 17 with #bands= 32 12) Finished k-point number 26 with #bands= 32 9) Finished k-point number 19 with #bands= 31 13) Finished k-point number 27 with #bands= 30 13) Finished k-point number 28 with #bands= 30 11) Finished k-point number 23 with #bands= 33 11) Finished k-point number 24 with #bands= 32 10) Finished k-point number 21 with #bands= 32 9) Finished k-point number 20 with #bands= 33 8) Finished k-point number 18 with #bands= 32 10) Finished k-point number 22 with #bands= 32 14) Finished k-point number 29 with #bands= 34 14) Finished k-point number 30 with #bands= 32 27) Finished k-point number 55 with #bands= 30 27) Finished k-point number 56 with #bands= 33 26) Finished k-point number 53 with #bands= 31 26) Finished k-point number 54 with #bands= 31 25) Finished k-point number 51 with #bands= 34 15) Finished k-point number 31 with #bands= 31 24) Finished k-point number 49 with #bands= 33 24) Finished k-point number 50 with #bands= 31 25) Finished k-point number 52 with #bands= 32 15) Finished k-point number 32 with #bands= 30 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 69 with #bands= 32 33) Finished k-point number 67 with #bands= 33 32) Finished k-point number 65 with #bands= 33 34) Finished k-point number 70 with #bands= 32 35) Finished k-point number 72 with #bands= 32 33) Finished k-point number 68 with #bands= 33 32) Finished k-point number 66 with #bands= 32 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 36) Finished k-point number 74 with #bands= 33 17) Finished k-point number 35 with #bands= 31 19) Finished k-point number 39 with #bands= 32 16) Finished k-point number 33 with #bands= 34 18) Finished k-point number 37 with #bands= 34 17) Finished k-point number 36 with #bands= 33 16) Finished k-point number 34 with #bands= 32 19) Finished k-point number 40 with #bands= 33 18) Finished k-point number 38 with #bands= 31 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947391446295296 0.927053524944298 0.945633076292073 0.944190674858969 0.948837329953795 0.947391446295296 0.927053524944298 0.945633076292073 0.944190674858969 0.948837329953795 13) Finished k-point number 27 with #bands= 30 27) Finished k-point number 55 with #bands= 30 4) Finished k-point number 9 with #bands= 31 15) Finished k-point number 31 with #bands= 31 2) Finished k-point number 5 with #bands= 31 9) Finished k-point number 19 with #bands= 31 17) Finished k-point number 35 with #bands= 31 26) Finished k-point number 53 with #bands= 31 1) Finished k-point number 3 with #bands= 32 6) Finished k-point number 13 with #bands= 32 10) Finished k-point number 21 with #bands= 32 8) Finished k-point number 17 with #bands= 32 19) Finished k-point number 39 with #bands= 32 22) Finished k-point number 45 with #bands= 32 20) Finished k-point number 41 with #bands= 32 29) Finished k-point number 59 with #bands= 32 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 69 with #bands= 32 37) Finished k-point number 75 with #bands= 32 36) Finished k-point number 73 with #bands= 32 3) Finished k-point number 7 with #bands= 33 11) Finished k-point number 23 with #bands= 33 24) Finished k-point number 49 with #bands= 33 23) Finished k-point number 47 with #bands= 33 21) Finished k-point number 43 with #bands= 33 31) Finished k-point number 63 with #bands= 33 33) Finished k-point number 67 with #bands= 33 30) Finished k-point number 61 with #bands= 33 28) Finished k-point number 57 with #bands= 33 32) Finished k-point number 65 with #bands= 33 0) Finished k-point number 1 with #bands= 34 5) Finished k-point number 11 with #bands= 34 7) Finished k-point number 15 with #bands= 34 12) Finished k-point number 25 with #bands= 34 14) Finished k-point number 29 with #bands= 34 16) Finished k-point number 33 with #bands= 34 18) Finished k-point number 37 with #bands= 34 25) Finished k-point number 51 with #bands= 34 13) Finished k-point number 28 with #bands= 30 15) Finished k-point number 32 with #bands= 30 1) Finished k-point number 4 with #bands= 30 4) Finished k-point number 10 with #bands= 31 26) Finished k-point number 54 with #bands= 31 6) Finished k-point number 14 with #bands= 31 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 18 with #bands= 32 27) Finished k-point number 56 with #bands= 33 29) Finished k-point number 60 with #bands= 32 35) Finished k-point number 72 with #bands= 32 34) Finished k-point number 70 with #bands= 32 3) Finished k-point number 8 with #bands= 31 9) Finished k-point number 20 with #bands= 33 17) Finished k-point number 36 with #bands= 33 24) Finished k-point number 50 with #bands= 31 19) Finished k-point number 40 with #bands= 33 20) Finished k-point number 42 with #bands= 33 22) Finished k-point number 46 with #bands= 33 11) Finished k-point number 24 with #bands= 32 23) Finished k-point number 48 with #bands= 32 2) Finished k-point number 6 with #bands= 34 30) Finished k-point number 62 with #bands= 32 36) Finished k-point number 74 with #bands= 33 28) Finished k-point number 58 with #bands= 32 18) Finished k-point number 38 with #bands= 31 32) Finished k-point number 66 with #bands= 32 5) Finished k-point number 12 with #bands= 32 12) Finished k-point number 26 with #bands= 32 14) Finished k-point number 30 with #bands= 32 16) Finished k-point number 34 with #bands= 32 25) Finished k-point number 52 with #bands= 32 33) Finished k-point number 68 with #bands= 33 21) Finished k-point number 44 with #bands= 33 7) Finished k-point number 16 with #bands= 33 31) Finished k-point number 64 with #bands= 34 0) Finished k-point number 2 with #bands= 34 Eimp= -1.08058499431682 -1.03009137085552 -0.959893759561117 -0.953225676451531 -1.02177001588446 -1.08058499431682 -1.03009137085552 -0.959893759561117 -0.953225676451531 -1.02177001588446 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 nargs= 1 argi=dmft1.def mode=g EF= 8.2356365 2) Finished k-point number 5 with #bands= 31 1) Finished k-point number 3 with #bands= 32 0) Finished k-point number 1 with #bands= 34 3) Finished k-point number 7 with #bands= 33 2) Finished k-point number 6 with #bands= 34 1) Finished k-point number 4 with #bands= 30 0) Finished k-point number 2 with #bands= 34 3) Finished k-point number 8 with #bands= 31 4) Finished k-point number 9 with #bands= 31 5) Finished k-point number 11 with #bands= 34 4) Finished k-point number 10 with #bands= 31 5) Finished k-point number 12 with #bands= 32 6) Finished k-point number 13 with #bands= 32 17) Finished k-point number 35 with #bands= 31 29) Finished k-point number 59 with #bands= 32 9) Finished k-point number 19 with #bands= 31 28) Finished k-point number 57 with #bands= 33 8) Finished k-point number 17 with #bands= 32 19) Finished k-point number 39 with #bands= 32 18) Finished k-point number 37 with #bands= 34 16) Finished k-point number 33 with #bands= 34 17) Finished k-point number 36 with #bands= 33 18) Finished k-point number 38 with #bands= 31 6) Finished k-point number 14 with #bands= 31 10) Finished k-point number 21 with #bands= 32 7) Finished k-point number 15 with #bands= 34 28) Finished k-point number 58 with #bands= 32 29) Finished k-point number 60 with #bands= 32 30) Finished k-point number 61 with #bands= 33 9) Finished k-point number 20 with #bands= 33 8) Finished k-point number 18 with #bands= 32 19) Finished k-point number 40 with #bands= 33 16) Finished k-point number 34 with #bands= 32 7) Finished k-point number 16 with #bands= 33 31) Finished k-point number 63 with #bands= 33 30) Finished k-point number 62 with #bands= 32 31) Finished k-point number 64 with #bands= 34 14) Finished k-point number 29 with #bands= 34 13) Finished k-point number 27 with #bands= 30 12) Finished k-point number 25 with #bands= 34 13) Finished k-point number 28 with #bands= 30 14) Finished k-point number 30 with #bands= 32 12) Finished k-point number 26 with #bands= 32 15) Finished k-point number 31 with #bands= 31 32) Finished k-point number 65 with #bands= 33 10) Finished k-point number 22 with #bands= 32 15) Finished k-point number 32 with #bands= 30 11) Finished k-point number 23 with #bands= 33 33) Finished k-point number 67 with #bands= 33 32) Finished k-point number 66 with #bands= 32 11) Finished k-point number 24 with #bands= 32 33) Finished k-point number 68 with #bands= 33 34) Finished k-point number 69 with #bands= 32 24) Finished k-point number 49 with #bands= 33 25) Finished k-point number 51 with #bands= 34 24) Finished k-point number 50 with #bands= 31 34) Finished k-point number 70 with #bands= 32 25) Finished k-point number 52 with #bands= 32 26) Finished k-point number 53 with #bands= 31 35) Finished k-point number 71 with #bands= 32 26) Finished k-point number 54 with #bands= 31 35) Finished k-point number 72 with #bands= 32 27) Finished k-point number 55 with #bands= 30 27) Finished k-point number 56 with #bands= 33 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 36) Finished k-point number 74 with #bands= 33 22) Finished k-point number 45 with #bands= 32 21) Finished k-point number 43 with #bands= 33 21) Finished k-point number 44 with #bands= 33 22) Finished k-point number 46 with #bands= 33 23) Finished k-point number 47 with #bands= 33 20) Finished k-point number 41 with #bands= 32 23) Finished k-point number 48 with #bands= 32 20) Finished k-point number 42 with #bands= 33 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947393292619775 0.926976827758339 0.945629301482365 0.944186653864223 0.948812521778156 0.947393292619775 0.926976827758339 0.945629301482365 0.944186653864223 0.948812521778156 13) Finished k-point number 27 with #bands= 30 27) Finished k-point number 55 with #bands= 30 2) Finished k-point number 5 with #bands= 31 4) Finished k-point number 9 with #bands= 31 1) Finished k-point number 3 with #bands= 32 9) Finished k-point number 19 with #bands= 31 26) Finished k-point number 53 with #bands= 31 15) Finished k-point number 31 with #bands= 31 17) Finished k-point number 35 with #bands= 31 22) Finished k-point number 45 with #bands= 32 6) Finished k-point number 13 with #bands= 32 8) Finished k-point number 17 with #bands= 32 10) Finished k-point number 21 with #bands= 32 19) Finished k-point number 39 with #bands= 32 29) Finished k-point number 59 with #bands= 32 36) Finished k-point number 73 with #bands= 32 35) Finished k-point number 71 with #bands= 32 20) Finished k-point number 41 with #bands= 32 37) Finished k-point number 75 with #bands= 32 34) Finished k-point number 69 with #bands= 32 3) Finished k-point number 7 with #bands= 33 23) Finished k-point number 47 with #bands= 33 11) Finished k-point number 23 with #bands= 33 21) Finished k-point number 43 with #bands= 33 24) Finished k-point number 49 with #bands= 33 0) Finished k-point number 1 with #bands= 34 28) Finished k-point number 57 with #bands= 33 30) Finished k-point number 61 with #bands= 33 31) Finished k-point number 63 with #bands= 33 33) Finished k-point number 67 with #bands= 33 32) Finished k-point number 65 with #bands= 33 5) Finished k-point number 11 with #bands= 34 14) Finished k-point number 29 with #bands= 34 16) Finished k-point number 33 with #bands= 34 7) Finished k-point number 15 with #bands= 34 18) Finished k-point number 37 with #bands= 34 12) Finished k-point number 25 with #bands= 34 25) Finished k-point number 51 with #bands= 34 13) Finished k-point number 28 with #bands= 30 1) Finished k-point number 4 with #bands= 30 15) Finished k-point number 32 with #bands= 30 4) Finished k-point number 10 with #bands= 31 26) Finished k-point number 54 with #bands= 31 6) Finished k-point number 14 with #bands= 31 8) Finished k-point number 18 with #bands= 32 10) Finished k-point number 22 with #bands= 32 27) Finished k-point number 56 with #bands= 33 29) Finished k-point number 60 with #bands= 32 3) Finished k-point number 8 with #bands= 31 35) Finished k-point number 72 with #bands= 32 34) Finished k-point number 70 with #bands= 32 23) Finished k-point number 48 with #bands= 32 22) Finished k-point number 46 with #bands= 33 9) Finished k-point number 20 with #bands= 33 17) Finished k-point number 36 with #bands= 33 24) Finished k-point number 50 with #bands= 31 11) Finished k-point number 24 with #bands= 32 19) Finished k-point number 40 with #bands= 33 2) Finished k-point number 6 with #bands= 34 18) Finished k-point number 38 with #bands= 31 28) Finished k-point number 58 with #bands= 32 30) Finished k-point number 62 with #bands= 32 36) Finished k-point number 74 with #bands= 33 32) Finished k-point number 66 with #bands= 32 5) Finished k-point number 12 with #bands= 32 14) Finished k-point number 30 with #bands= 32 16) Finished k-point number 34 with #bands= 32 12) Finished k-point number 26 with #bands= 32 20) Finished k-point number 42 with #bands= 33 25) Finished k-point number 52 with #bands= 32 21) Finished k-point number 44 with #bands= 33 33) Finished k-point number 68 with #bands= 33 7) Finished k-point number 16 with #bands= 33 0) Finished k-point number 2 with #bands= 34 31) Finished k-point number 64 with #bands= 34 Eimp= -1.08227426061405 -1.03429700141100 -0.962141228008317 -0.955480396294053 -1.02620277909407 -1.08227426061405 -1.03429700141100 -0.962141228008317 -0.955480396294053 -1.02620277909407 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 nargs= 1 argi=dmft1.def mode=g EF= 8.2340740 3) Finished k-point number 7 with #bands= 33 2) Finished k-point number 5 with #bands= 31 2) Finished k-point number 6 with #bands= 34 1) Finished k-point number 3 with #bands= 32 0) Finished k-point number 1 with #bands= 34 0) Finished k-point number 2 with #bands= 34 1) Finished k-point number 4 with #bands= 30 3) Finished k-point number 8 with #bands= 31 9) Finished k-point number 19 with #bands= 31 11) Finished k-point number 23 with #bands= 33 9) Finished k-point number 20 with #bands= 33 11) Finished k-point number 24 with #bands= 32 10) Finished k-point number 21 with #bands= 32 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 17 with #bands= 32 8) Finished k-point number 18 with #bands= 32 7) Finished k-point number 15 with #bands= 34 6) Finished k-point number 13 with #bands= 32 5) Finished k-point number 11 with #bands= 34 7) Finished k-point number 16 with #bands= 33 5) Finished k-point number 12 with #bands= 32 4) Finished k-point number 9 with #bands= 31 6) Finished k-point number 14 with #bands= 31 4) Finished k-point number 10 with #bands= 31 20) Finished k-point number 41 with #bands= 32 21) Finished k-point number 43 with #bands= 33 22) Finished k-point number 45 with #bands= 32 37) Finished k-point number 75 with #bands= 32 36) Finished k-point number 73 with #bands= 32 36) Finished k-point number 74 with #bands= 33 20) Finished k-point number 42 with #bands= 33 21) Finished k-point number 44 with #bands= 33 23) Finished k-point number 47 with #bands= 33 22) Finished k-point number 46 with #bands= 33 23) Finished k-point number 48 with #bands= 32 17) Finished k-point number 35 with #bands= 31 16) Finished k-point number 33 with #bands= 34 16) Finished k-point number 34 with #bands= 32 17) Finished k-point number 36 with #bands= 33 18) Finished k-point number 37 with #bands= 34 12) Finished k-point number 25 with #bands= 34 13) Finished k-point number 27 with #bands= 30 18) Finished k-point number 38 with #bands= 31 12) Finished k-point number 26 with #bands= 32 13) Finished k-point number 28 with #bands= 30 19) Finished k-point number 39 with #bands= 32 19) Finished k-point number 40 with #bands= 33 14) Finished k-point number 29 with #bands= 34 14) Finished k-point number 30 with #bands= 32 15) Finished k-point number 31 with #bands= 31 15) Finished k-point number 32 with #bands= 30 25) Finished k-point number 51 with #bands= 34 27) Finished k-point number 55 with #bands= 30 27) Finished k-point number 56 with #bands= 33 26) Finished k-point number 53 with #bands= 31 26) Finished k-point number 54 with #bands= 31 25) Finished k-point number 52 with #bands= 32 24) Finished k-point number 49 with #bands= 33 24) Finished k-point number 50 with #bands= 31 28) Finished k-point number 57 with #bands= 33 28) Finished k-point number 58 with #bands= 32 29) Finished k-point number 59 with #bands= 32 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 69 with #bands= 32 33) Finished k-point number 67 with #bands= 33 31) Finished k-point number 63 with #bands= 33 30) Finished k-point number 61 with #bands= 33 29) Finished k-point number 60 with #bands= 32 30) Finished k-point number 62 with #bands= 32 32) Finished k-point number 65 with #bands= 33 35) Finished k-point number 72 with #bands= 32 34) Finished k-point number 70 with #bands= 32 33) Finished k-point number 68 with #bands= 33 31) Finished k-point number 64 with #bands= 34 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947395959083177 0.927031661076017 0.945635723834222 0.944193309782710 0.948833108573453 0.947395959083177 0.927031661076017 0.945635723834222 0.944193309782710 0.948833108573453 32) Finished k-point number 66 with #bands= 32 13) Finished k-point number 27 with #bands= 30 27) Finished k-point number 55 with #bands= 30 2) Finished k-point number 5 with #bands= 31 4) Finished k-point number 9 with #bands= 31 9) Finished k-point number 19 with #bands= 31 15) Finished k-point number 31 with #bands= 31 17) Finished k-point number 35 with #bands= 31 1) Finished k-point number 3 with #bands= 32 26) Finished k-point number 53 with #bands= 31 6) Finished k-point number 13 with #bands= 32 8) Finished k-point number 17 with #bands= 32 10) Finished k-point number 21 with #bands= 32 19) Finished k-point number 39 with #bands= 32 22) Finished k-point number 45 with #bands= 32 20) Finished k-point number 41 with #bands= 32 29) Finished k-point number 59 with #bands= 32 34) Finished k-point number 69 with #bands= 32 35) Finished k-point number 71 with #bands= 32 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 3) Finished k-point number 7 with #bands= 33 11) Finished k-point number 23 with #bands= 33 21) Finished k-point number 43 with #bands= 33 31) Finished k-point number 63 with #bands= 33 23) Finished k-point number 47 with #bands= 33 30) Finished k-point number 61 with #bands= 33 28) Finished k-point number 57 with #bands= 33 24) Finished k-point number 49 with #bands= 33 33) Finished k-point number 67 with #bands= 33 32) Finished k-point number 65 with #bands= 33 0) Finished k-point number 1 with #bands= 34 5) Finished k-point number 11 with #bands= 34 7) Finished k-point number 15 with #bands= 34 12) Finished k-point number 25 with #bands= 34 16) Finished k-point number 33 with #bands= 34 14) Finished k-point number 29 with #bands= 34 25) Finished k-point number 51 with #bands= 34 18) Finished k-point number 37 with #bands= 34 13) Finished k-point number 28 with #bands= 30 15) Finished k-point number 32 with #bands= 30 1) Finished k-point number 4 with #bands= 30 4) Finished k-point number 10 with #bands= 31 6) Finished k-point number 14 with #bands= 31 26) Finished k-point number 54 with #bands= 31 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 18 with #bands= 32 27) Finished k-point number 56 with #bands= 33 34) Finished k-point number 70 with #bands= 32 29) Finished k-point number 60 with #bands= 32 3) Finished k-point number 8 with #bands= 31 35) Finished k-point number 72 with #bands= 32 9) Finished k-point number 20 with #bands= 33 17) Finished k-point number 36 with #bands= 33 24) Finished k-point number 50 with #bands= 31 11) Finished k-point number 24 with #bands= 32 2) Finished k-point number 6 with #bands= 34 19) Finished k-point number 40 with #bands= 33 22) Finished k-point number 46 with #bands= 33 20) Finished k-point number 42 with #bands= 33 23) Finished k-point number 48 with #bands= 32 30) Finished k-point number 62 with #bands= 32 32) Finished k-point number 66 with #bands= 32 28) Finished k-point number 58 with #bands= 32 36) Finished k-point number 74 with #bands= 33 18) Finished k-point number 38 with #bands= 31 5) Finished k-point number 12 with #bands= 32 12) Finished k-point number 26 with #bands= 32 16) Finished k-point number 34 with #bands= 32 25) Finished k-point number 52 with #bands= 32 14) Finished k-point number 30 with #bands= 32 21) Finished k-point number 44 with #bands= 33 33) Finished k-point number 68 with #bands= 33 7) Finished k-point number 16 with #bands= 33 31) Finished k-point number 64 with #bands= 34 0) Finished k-point number 2 with #bands= 34 Eimp= -1.08001653565497 -1.03069379284886 -0.959700085300098 -0.953028014106501 -1.02239655282988 -1.08001653565497 -1.03069379284886 -0.959700085300098 -0.953028014106501 -1.02239655282988 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 nargs= 1 argi=dmft1.def 2) Finished k-point number 5 with #bands= 31 mode=g EF= 8.2340682 3) Finished k-point number 7 with #bands= 33 2) Finished k-point number 6 with #bands= 34 0) Finished k-point number 1 with #bands= 34 3) Finished k-point number 8 with #bands= 31 0) Finished k-point number 2 with #bands= 34 1) Finished k-point number 3 with #bands= 32 1) Finished k-point number 4 with #bands= 30 5) Finished k-point number 11 with #bands= 34 4) Finished k-point number 9 with #bands= 31 6) Finished k-point number 13 with #bands= 32 5) Finished k-point number 12 with #bands= 32 4) Finished k-point number 10 with #bands= 31 36) Finished k-point number 73 with #bands= 32 36) Finished k-point number 74 with #bands= 33 37) Finished k-point number 75 with #bands= 32 30) Finished k-point number 61 with #bands= 33 31) Finished k-point number 63 with #bands= 33 28) Finished k-point number 57 with #bands= 33 29) Finished k-point number 59 with #bands= 32 30) Finished k-point number 62 with #bands= 32 28) Finished k-point number 58 with #bands= 32 29) Finished k-point number 60 with #bands= 32 31) Finished k-point number 64 with #bands= 34 6) Finished k-point number 14 with #bands= 31 7) Finished k-point number 15 with #bands= 34 7) Finished k-point number 16 with #bands= 33 17) Finished k-point number 35 with #bands= 31 18) Finished k-point number 37 with #bands= 34 19) Finished k-point number 39 with #bands= 32 16) Finished k-point number 33 with #bands= 34 18) Finished k-point number 38 with #bands= 31 17) Finished k-point number 36 with #bands= 33 19) Finished k-point number 40 with #bands= 33 34) Finished k-point number 69 with #bands= 32 33) Finished k-point number 67 with #bands= 33 16) Finished k-point number 34 with #bands= 32 35) Finished k-point number 71 with #bands= 32 34) Finished k-point number 70 with #bands= 32 33) Finished k-point number 68 with #bands= 33 32) Finished k-point number 65 with #bands= 33 35) Finished k-point number 72 with #bands= 32 32) Finished k-point number 66 with #bands= 32 9) Finished k-point number 19 with #bands= 31 11) Finished k-point number 23 with #bands= 33 8) Finished k-point number 17 with #bands= 32 10) Finished k-point number 21 with #bands= 32 9) Finished k-point number 20 with #bands= 33 11) Finished k-point number 24 with #bands= 32 8) Finished k-point number 18 with #bands= 32 10) Finished k-point number 22 with #bands= 32 15) Finished k-point number 31 with #bands= 31 14) Finished k-point number 29 with #bands= 34 13) Finished k-point number 27 with #bands= 30 12) Finished k-point number 25 with #bands= 34 15) Finished k-point number 32 with #bands= 30 13) Finished k-point number 28 with #bands= 30 14) Finished k-point number 30 with #bands= 32 12) Finished k-point number 26 with #bands= 32 21) Finished k-point number 43 with #bands= 33 21) Finished k-point number 44 with #bands= 33 20) Finished k-point number 41 with #bands= 32 23) Finished k-point number 47 with #bands= 33 22) Finished k-point number 45 with #bands= 32 23) Finished k-point number 48 with #bands= 32 20) Finished k-point number 42 with #bands= 33 22) Finished k-point number 46 with #bands= 33 27) Finished k-point number 55 with #bands= 30 25) Finished k-point number 51 with #bands= 34 26) Finished k-point number 53 with #bands= 31 24) Finished k-point number 49 with #bands= 33 27) Finished k-point number 56 with #bands= 33 25) Finished k-point number 52 with #bands= 32 26) Finished k-point number 54 with #bands= 31 24) Finished k-point number 50 with #bands= 31 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947391605198326 0.927053019088663 0.945634549160495 0.944192393759563 0.948836484633043 0.947391605198326 0.927053019088663 0.945634549160495 0.944192393759563 0.948836484633043 13) Finished k-point number 27 with #bands= 30 27) Finished k-point number 55 with #bands= 30 2) Finished k-point number 5 with #bands= 31 9) Finished k-point number 19 with #bands= 31 4) Finished k-point number 9 with #bands= 31 17) Finished k-point number 35 with #bands= 31 15) Finished k-point number 31 with #bands= 31 26) Finished k-point number 53 with #bands= 31 1) Finished k-point number 3 with #bands= 32 6) Finished k-point number 13 with #bands= 32 8) Finished k-point number 17 with #bands= 32 10) Finished k-point number 21 with #bands= 32 20) Finished k-point number 41 with #bands= 32 19) Finished k-point number 39 with #bands= 32 22) Finished k-point number 45 with #bands= 32 35) Finished k-point number 71 with #bands= 32 29) Finished k-point number 59 with #bands= 32 34) Finished k-point number 69 with #bands= 32 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 3) Finished k-point number 7 with #bands= 33 11) Finished k-point number 23 with #bands= 33 23) Finished k-point number 47 with #bands= 33 31) Finished k-point number 63 with #bands= 33 24) Finished k-point number 49 with #bands= 33 30) Finished k-point number 61 with #bands= 33 21) Finished k-point number 43 with #bands= 33 32) Finished k-point number 65 with #bands= 33 28) Finished k-point number 57 with #bands= 33 0) Finished k-point number 1 with #bands= 34 33) Finished k-point number 67 with #bands= 33 5) Finished k-point number 11 with #bands= 34 7) Finished k-point number 15 with #bands= 34 12) Finished k-point number 25 with #bands= 34 14) Finished k-point number 29 with #bands= 34 18) Finished k-point number 37 with #bands= 34 25) Finished k-point number 51 with #bands= 34 16) Finished k-point number 33 with #bands= 34 13) Finished k-point number 28 with #bands= 30 15) Finished k-point number 32 with #bands= 30 1) Finished k-point number 4 with #bands= 30 4) Finished k-point number 10 with #bands= 31 26) Finished k-point number 54 with #bands= 31 6) Finished k-point number 14 with #bands= 31 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 18 with #bands= 32 27) Finished k-point number 56 with #bands= 33 35) Finished k-point number 72 with #bands= 32 3) Finished k-point number 8 with #bands= 31 34) Finished k-point number 70 with #bands= 32 29) Finished k-point number 60 with #bands= 32 9) Finished k-point number 20 with #bands= 33 17) Finished k-point number 36 with #bands= 33 24) Finished k-point number 50 with #bands= 31 11) Finished k-point number 24 with #bands= 32 2) Finished k-point number 6 with #bands= 34 20) Finished k-point number 42 with #bands= 33 22) Finished k-point number 46 with #bands= 33 23) Finished k-point number 48 with #bands= 32 19) Finished k-point number 40 with #bands= 33 18) Finished k-point number 38 with #bands= 31 30) Finished k-point number 62 with #bands= 32 36) Finished k-point number 74 with #bands= 33 28) Finished k-point number 58 with #bands= 32 32) Finished k-point number 66 with #bands= 32 5) Finished k-point number 12 with #bands= 32 12) Finished k-point number 26 with #bands= 32 14) Finished k-point number 30 with #bands= 32 16) Finished k-point number 34 with #bands= 32 25) Finished k-point number 52 with #bands= 32 21) Finished k-point number 44 with #bands= 33 33) Finished k-point number 68 with #bands= 33 7) Finished k-point number 16 with #bands= 33 31) Finished k-point number 64 with #bands= 34 0) Finished k-point number 2 with #bands= 34 Eimp= -1.07936612305439 -1.02920298390578 -0.958958154103759 -0.952290840811871 -1.02086462560273 -1.07936612305439 -1.02920298390578 -0.958958154103759 -0.952290840811872 -1.02086462560273 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 nargs= 1 argi=dmft1.def mode=g EF= 8.2347822 0) Finished k-point number 1 with #bands= 34 0) Finished k-point number 2 with #bands= 34 1) Finished k-point number 3 with #bands= 32 1) Finished k-point number 4 with #bands= 30 2) Finished k-point number 5 with #bands= 31 2) Finished k-point number 6 with #bands= 34 3) Finished k-point number 7 with #bands= 33 3) Finished k-point number 8 with #bands= 31 9) Finished k-point number 19 with #bands= 31 10) Finished k-point number 21 with #bands= 32 8) Finished k-point number 17 with #bands= 32 9) Finished k-point number 20 with #bands= 33 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 18 with #bands= 32 11) Finished k-point number 23 with #bands= 33 11) Finished k-point number 24 with #bands= 32 7) Finished k-point number 15 with #bands= 34 6) Finished k-point number 13 with #bands= 32 5) Finished k-point number 11 with #bands= 34 4) Finished k-point number 9 with #bands= 31 7) Finished k-point number 16 with #bands= 33 6) Finished k-point number 14 with #bands= 31 5) Finished k-point number 12 with #bands= 32 4) Finished k-point number 10 with #bands= 31 16) Finished k-point number 33 with #bands= 34 17) Finished k-point number 35 with #bands= 31 18) Finished k-point number 37 with #bands= 34 16) Finished k-point number 34 with #bands= 32 15) Finished k-point number 31 with #bands= 31 13) Finished k-point number 27 with #bands= 30 12) Finished k-point number 25 with #bands= 34 17) Finished k-point number 36 with #bands= 33 15) Finished k-point number 32 with #bands= 30 14) Finished k-point number 29 with #bands= 34 12) Finished k-point number 26 with #bands= 32 13) Finished k-point number 28 with #bands= 30 14) Finished k-point number 30 with #bands= 32 32) Finished k-point number 65 with #bands= 33 35) Finished k-point number 71 with #bands= 32 33) Finished k-point number 67 with #bands= 33 32) Finished k-point number 66 with #bands= 32 34) Finished k-point number 69 with #bands= 32 35) Finished k-point number 72 with #bands= 32 33) Finished k-point number 68 with #bands= 33 34) Finished k-point number 70 with #bands= 32 28) Finished k-point number 57 with #bands= 33 31) Finished k-point number 63 with #bands= 33 30) Finished k-point number 61 with #bands= 33 29) Finished k-point number 59 with #bands= 32 28) Finished k-point number 58 with #bands= 32 31) Finished k-point number 64 with #bands= 34 30) Finished k-point number 62 with #bands= 32 29) Finished k-point number 60 with #bands= 32 21) Finished k-point number 43 with #bands= 33 20) Finished k-point number 41 with #bands= 32 21) Finished k-point number 44 with #bands= 33 20) Finished k-point number 42 with #bands= 33 18) Finished k-point number 38 with #bands= 31 19) Finished k-point number 39 with #bands= 32 19) Finished k-point number 40 with #bands= 33 26) Finished k-point number 53 with #bands= 31 25) Finished k-point number 51 with #bands= 34 25) Finished k-point number 52 with #bands= 32 23) Finished k-point number 47 with #bands= 33 23) Finished k-point number 48 with #bands= 32 22) Finished k-point number 45 with #bands= 32 22) Finished k-point number 46 with #bands= 33 37) Finished k-point number 75 with #bands= 32 36) Finished k-point number 73 with #bands= 32 36) Finished k-point number 74 with #bands= 33 27) Finished k-point number 55 with #bands= 30 27) Finished k-point number 56 with #bands= 33 26) Finished k-point number 54 with #bands= 31 24) Finished k-point number 49 with #bands= 33 24) Finished k-point number 50 with #bands= 31 Renormalizing Gloc to account for the interstitials Z due to missing-interstitials= 0.947394611714705 0.927032742529739 0.945643797260731 0.944202565597841 0.948824129722917 0.947394611714705 0.927032742529739 0.945643797260731 0.944202565597841 0.948824129722917 13) Finished k-point number 27 with #bands= 30 27) Finished k-point number 55 with #bands= 30 2) Finished k-point number 5 with #bands= 31 4) Finished k-point number 9 with #bands= 31 17) Finished k-point number 35 with #bands= 31 15) Finished k-point number 31 with #bands= 31 1) Finished k-point number 3 with #bands= 32 9) Finished k-point number 19 with #bands= 31 6) Finished k-point number 13 with #bands= 32 19) Finished k-point number 39 with #bands= 32 26) Finished k-point number 53 with #bands= 31 22) Finished k-point number 45 with #bands= 32 20) Finished k-point number 41 with #bands= 32 29) Finished k-point number 59 with #bands= 32 8) Finished k-point number 17 with #bands= 32 10) Finished k-point number 21 with #bands= 32 36) Finished k-point number 73 with #bands= 32 37) Finished k-point number 75 with #bands= 32 34) Finished k-point number 69 with #bands= 32 35) Finished k-point number 71 with #bands= 32 3) Finished k-point number 7 with #bands= 33 21) Finished k-point number 43 with #bands= 33 31) Finished k-point number 63 with #bands= 33 28) Finished k-point number 57 with #bands= 33 23) Finished k-point number 47 with #bands= 33 30) Finished k-point number 61 with #bands= 33 32) Finished k-point number 65 with #bands= 33 0) Finished k-point number 1 with #bands= 34 11) Finished k-point number 23 with #bands= 33 33) Finished k-point number 67 with #bands= 33 24) Finished k-point number 49 with #bands= 33 7) Finished k-point number 15 with #bands= 34 5) Finished k-point number 11 with #bands= 34 14) Finished k-point number 29 with #bands= 34 16) Finished k-point number 33 with #bands= 34 18) Finished k-point number 37 with #bands= 34 12) Finished k-point number 25 with #bands= 34 25) Finished k-point number 51 with #bands= 34 13) Finished k-point number 28 with #bands= 30 15) Finished k-point number 32 with #bands= 30 1) Finished k-point number 4 with #bands= 30 4) Finished k-point number 10 with #bands= 31 6) Finished k-point number 14 with #bands= 31 26) Finished k-point number 54 with #bands= 31 29) Finished k-point number 60 with #bands= 32 10) Finished k-point number 22 with #bands= 32 8) Finished k-point number 18 with #bands= 32 3) Finished k-point number 8 with #bands= 31 34) Finished k-point number 70 with #bands= 32 27) Finished k-point number 56 with #bands= 33 35) Finished k-point number 72 with #bands= 32 17) Finished k-point number 36 with #bands= 33 9) Finished k-point number 20 with #bands= 33 24) Finished k-point number 50 with #bands= 31 19) Finished k-point number 40 with #bands= 33 22) Finished k-point number 46 with #bands= 33 20) Finished k-point number 42 with #bands= 33 2) Finished k-point number 6 with #bands= 34 28) Finished k-point number 58 with #bands= 32 36) Finished k-point number 74 with #bands= 33 32) Finished k-point number 66 with #bands= 32 18) Finished k-point number 38 with #bands= 31 23) Finished k-point number 48 with #bands= 32 30) Finished k-point number 62 with #bands= 32 11) Finished k-point number 24 with #bands= 32 16) Finished k-point number 34 with #bands= 32 14) Finished k-point number 30 with #bands= 32 5) Finished k-point number 12 with #bands= 32 12) Finished k-point number 26 with #bands= 32 25) Finished k-point number 52 with #bands= 32 21) Finished k-point number 44 with #bands= 33 33) Finished k-point number 68 with #bands= 33 7) Finished k-point number 16 with #bands= 33 31) Finished k-point number 64 with #bands= 34 0) Finished k-point number 2 with #bands= 34 Eimp= -1.07914029944583 -1.03060825002579 -0.959110500286476 -0.952447427868019 -1.02234578872895 -1.07914029944583 -1.03060825002579 -0.959110500286476 -0.952447427868019 -1.02234578872895 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