### 2010-10-13 16:00:53 smallest number eigenvalues at k= 40 ( ) = 44 do not use irred. representations number of k-points read in case.irrep= 0 lattice is=F 2 atoms a= 9.48642900000000 b= 9.48642900000000 c= 9.48642900000000 lattice-type with triclinic basis assumed 0.66233 0.00000 0.00000 0.00000 0.66233 0.00000 0.00000 0.00000 0.66233 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= 0.468340925564126 line 3 is: GAMMA to X xmax= 1.04193907221158 line 4 is: X to W xmax= 1.70427316095874 line 5 is: W to K xmax= 2.03544020533232 reading case.insp 5.00000000000000 3.00000000000000 Energy in eV 1 1-47.350532 0.010000 2-47.350532 0.010000 3-27.506873 0.010000 4-27.506873 0.010000 5-17.095967 0.010000 6-17.095967 0.010000 7-16.829780 0.010000 8-16.829780 0.010000 9 -8.612137 0.010000 10 -8.612137 0.010000 11 -2.469879 0.010000 12 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4-27.506451 0.010000 5-17.103299 0.010000 6-17.103299 0.010000 7-16.819593 0.010000 8-16.819593 0.010000 9 -8.604218 0.010000 10 -8.604218 0.010000 11 -2.477124 0.010000 12 -2.477124 0.010000 13 -1.155707 0.010000 14 -1.155707 0.010000 15 -0.403073 0.010000 16 -0.403073 0.010000 17 -0.370520 0.010000 18 -0.370520 0.010000 19 -0.312310 0.010000 20 -0.312310 0.010000 21 0.284269 0.010000 22 0.284269 0.010000 23 0.799456 0.010000 24 0.799456 0.010000 25 0.834131 0.010000 26 0.834131 0.010000 27 0.878838 0.010000 28 0.878838 0.010000 29 1.395205 0.010000 30 1.395205 0.010000 31 5.164373 0.010000 32 5.164373 0.010000 33 5.199533 0.010000 34 5.199533 0.010000 35 9.247430 0.010000 36 9.247430 0.010000 37 9.484795 0.010000 38 9.484795 0.010000 39 10.145943 0.010000 40 10.145943 0.010000 41 13.764744 0.010000 42 13.764744 0.010000 43 14.910206 0.010000 44 14.910206 0.010000 45 16.218814 0.010000 46 16.218814 0.010000 47 18.292655 0.010000 48 18.292655 0.010000 49 20.778808 0.010000 50 20.778808 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0.010000 20 -0.325079 0.010000 21 0.037337 0.010000 22 0.037337 0.010000 23 0.772759 0.010000 24 0.772759 0.010000 25 0.863284 0.010000 26 0.863284 0.010000 27 0.924962 0.010000 28 0.924962 0.010000 29 1.346532 0.010000 30 1.346532 0.010000 31 5.173528 0.010000 32 5.173528 0.010000 33 5.283520 0.010000 34 5.283520 0.010000 35 8.913143 0.010000 36 8.913143 0.010000 37 10.116016 0.010000 38 10.116016 0.010000 39 10.252890 0.010000 40 10.252890 0.010000 41 13.720457 0.010000 42 13.720457 0.010000 43 14.387499 0.010000 44 14.387499 0.010000 45 16.332666 0.010000 46 16.332666 0.010000 47 17.900891 0.010000 48 17.900891 0.010000 49 21.616596 0.010000 50 21.616596 0.010000 51 21.971587 0.010000 52 21.971587 0.010000 53 22.582346 0.003333 54 22.582346 0.003333 7 1-47.355575 0.010000 2-47.355575 0.010000 3-27.493243 0.010000 4-27.493243 0.010000 5-17.237317 0.010000 6-17.237317 0.010000 7-16.589623 0.010000 8-16.589623 0.010000 9 -8.337187 0.010000 10 -8.337187 0.010000 11 -2.743027 0.010000 12 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and FERMI-energy done x-axis labeling done EF-labeling done y-axis labeling done 0.00000 0.00000 M 10.00000 0.0 RL 0.0 15.00000 RL -10.00000 0.0 RL 0.0 -15.00000 drawing energy-bands... writing energy-bands on file plotcl done