### 2010-10-13 16:07:00 smallest number eigenvalues at k= 39 ( ) = 58 do not use irred. representations number of k-points read in case.irrep= 0 lattice is=F 2 atoms a= 10.1244010000000 b= 10.1244010000000 c= 10.1244010000000 lattice-type with triclinic basis assumed 0.62060 0.00000 0.00000 0.00000 0.62060 0.00000 0.00000 0.00000 0.62060 transforming k-points to cartesian coordinates... checking for lines... numbers of BRILLOUIN-zone lines found: 5 numbers of breaks 0 line 1 is: W to L xmax= 0.000000000000000E+000 line 2 is: L to GAMMA xmax= 0.438829214504479 line 3 is: GAMMA to X xmax= 0.976283044385640 line 4 is: X to W xmax= 1.59688127110341 line 5 is: W to K xmax= 1.90718038446229 reading case.insp 5.00000000000000 3.00000000000000 Energy in eV 1 1-49.080528 0.010000 2-49.080528 0.010000 3-28.556491 0.010000 4-28.556491 0.010000 5-19.716421 0.010000 6-19.716421 0.010000 7-18.669846 0.010000 8-18.669846 0.010000 9-15.647426 0.010000 10-15.647426 0.010000 11-14.380427 0.010000 12-14.380427 0.010000 13 -5.222430 0.010000 14 -5.222430 0.010000 15 -4.279115 0.010000 16 -4.279115 0.010000 17 -2.851750 0.010000 18 -2.851750 0.010000 19 -2.753792 0.010000 20 -2.753792 0.010000 21 -2.565446 0.010000 22 -2.565446 0.010000 23 -2.054234 0.010000 24 -2.054234 0.010000 25 -0.785004 0.010000 26 -0.785004 0.010000 27 -0.477013 0.010000 28 -0.477013 0.010000 29 -0.020779 0.010000 30 -0.020779 0.010000 31 0.559343 0.010000 32 0.559343 0.010000 33 0.760118 0.010000 34 0.760118 0.010000 35 0.914244 0.010000 36 0.914244 0.010000 37 1.836324 0.010000 38 1.836324 0.010000 39 5.392342 0.010000 40 5.392342 0.010000 41 6.863756 0.010000 42 6.863756 0.010000 43 8.579838 0.010000 44 8.579838 0.010000 45 8.618544 0.010000 46 8.618544 0.010000 47 10.600185 0.010000 48 10.600185 0.010000 49 14.150119 0.010000 50 14.150119 0.010000 51 14.211220 0.010000 52 14.211220 0.010000 53 15.439885 0.010000 54 15.439885 0.010000 55 16.524277 0.010000 56 16.524277 0.010000 57 19.873716 0.010000 58 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34 0.760370 0.010000 35 0.914970 0.010000 36 0.914970 0.010000 37 1.832916 0.010000 38 1.832916 0.010000 39 5.391143 0.010000 40 5.391143 0.010000 41 6.861268 0.010000 42 6.861268 0.010000 43 8.579437 0.010000 44 8.579437 0.010000 45 8.631460 0.010000 46 8.631460 0.010000 47 10.602778 0.010000 48 10.602778 0.010000 49 14.117458 0.010000 50 14.117458 0.010000 51 14.154193 0.010000 52 14.154193 0.010000 53 15.489485 0.010000 54 15.489485 0.010000 55 16.568509 0.010000 56 16.568509 0.010000 57 19.875279 0.010000 58 19.875279 0.010000 59 20.120174 0.010000 60 20.120174 0.010000 61 21.556549 0.010000 62 21.556549 0.010000 63 23.690012 0.010000 64 23.690012 0.010000 65 24.663815 0.010000 66 24.663815 0.010000 67 24.892368 0.010000 68 24.892368 0.010000 69 25.255716 0.003333 70 25.255716 0.003333 3 1-49.080887 0.010000 2-49.080887 0.010000 3-28.555030 0.010000 4-28.555030 0.010000 5-19.711555 0.010000 6-19.711555 0.010000 7-18.663202 0.010000 8-18.663202 0.010000 9-15.647909 0.010000 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34 0.760902 0.010000 35 0.919717 0.010000 36 0.919717 0.010000 37 1.798182 0.010000 38 1.798182 0.010000 39 5.383920 0.010000 40 5.383920 0.010000 41 6.841315 0.010000 42 6.841315 0.010000 43 8.586018 0.010000 44 8.586018 0.010000 45 8.718564 0.010000 46 8.718564 0.010000 47 10.622350 0.010000 48 10.622350 0.010000 49 13.730361 0.010000 50 13.730361 0.010000 51 13.958266 0.010000 52 13.958266 0.010000 53 15.796262 0.010000 54 15.796262 0.010000 55 16.880320 0.010000 56 16.880320 0.010000 57 19.884421 0.010000 58 19.884421 0.010000 59 20.116496 0.010000 60 20.116496 0.010000 61 21.671982 0.010000 62 21.671982 0.010000 63 23.525043 0.010000 64 23.525043 0.010000 65 24.298353 0.010000 66 24.298353 0.010000 67 24.942399 0.003333 68 24.942399 0.003333 5 1-49.081967 0.010000 2-49.081967 0.010000 3-28.551443 0.010000 4-28.551443 0.010000 5-19.698020 0.010000 6-19.698020 0.010000 7-18.642074 0.010000 8-18.642074 0.010000 9-15.654865 0.010000 10-15.654865 0.010000 11-14.422068 0.010000 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-10.00000 0.0 RL 0.0 -15.00000 drawing energy-bands... writing energy-bands on file plotcl done