-------------------------------------------------- S T R U C T U R A L I N F O R M A T I O N -------------------------------------------------- SUBSTANCE = FeSi LATTICE = P LATTICE CONSTANTS ARE = 8.4905400 8.4905400 8.4905400 NUMBER OF ATOMS IN UNITCELL = 2 MODE OF CALCULATION IS = RELA :POS01: AT.NR. -1 POSITION = 0.13580 0.13580 0.13580 MULTIPLICITY = 4 NOT EQUIV ATOM Fe1 EQUIV ATOM 1 POSITION: 0.136 0.136 0.136 EQUIV ATOM 2 POSITION: 0.364 0.864 0.636 EQUIV ATOM 3 POSITION: 0.636 0.364 0.864 EQUIV ATOM 4 POSITION: 0.864 0.636 0.364 ATOMIC PARAMETERS FOR Fe1 ENERGY PARAMETERS ARE 0.26 0.44 0.63 0.57 0.57 0.57 0.57 ENERGY PARAMETERS ARE 0.57 0.57 L U(R) U'(R) DU/DE DU'/DE NORM-U' 0 -0.571565E+00 0.217882E-01 0.104295E+00 0.338572E+00 0.129865E-01 3 3 3 1 0.637588E+00 0.192190E+00 -0.774183E-01 -0.330425E+00 0.128628E-01 2 2 2 2 0.195620E+00 -0.157933E+00 -0.572367E+00 -0.538923E+00 0.576934E+00 0 0 0 3 0.810664E+00 0.848277E+00 -0.591600E-01 -0.303420E+00 0.373006E-02 0 0 0 4 0.932610E+00 0.146295E+01 -0.399021E-01 -0.272523E+00 0.134379E-02 0 0 0 5 0.103048E+01 0.211554E+01 -0.302732E-01 -0.252136E+00 0.659523E-03 0 0 0 6 0.111650E+01 0.281588E+01 -0.242340E-01 -0.236462E+00 0.371666E-03 0 0 0 7 0.119481E+01 0.356436E+01 -0.200558E-01 -0.223674E+00 0.228044E-03 0 0 0 8 0.126745E+01 0.435949E+01 -0.169919E-01 -0.212891E+00 0.148554E-03 0 0 0 1 -0.630013E-01 0.943676E-01 0.104328E+01 0.154528E+01 0.139781E+01 1 1 1 LO COEFFICIENT: l,A,B,C 0 0.84818 4.64826 0.00000 LO COEFFICIENT: l,A,B,C 1 0.73080 6.01858 0.00000 LO COEFFICIENT: l,A,B,C 1 0.09736 0.00000 0.98532 LO COEFFICIENT: l,A,B,C 2 0.96792 0.33081 0.00000 ATOMNUMBER: 1 L Duu1 Dupu1 Duup1 Dupup1 1 -0.61059E-01 -0.11190E+00 0.42167E+00 -0.10336E-01 2 0.95126E+00 -0.25423E+00 -0.10281E+00 0.28627E+00 3 -0.58519E+00 -0.43766E-01 -0.10680E+01 -0.37461E-01 4 0.11364E+01 0.96443E-02 -0.27478E+00 0.22750E-02 5 0.17034E+01 0.83288E-02 -0.20823E+00 0.16899E-02 6 0.22076E+01 0.67918E-02 -0.17198E+00 0.11827E-02 7 0.26884E+01 0.55764E-02 -0.14762E+00 0.84994E-03 8 0.31572E+01 0.46434E-02 -0.12973E+00 0.62937E-03 L Duu2 Dupu2 Duup2 Dupup2 1 -0.45578E+00 -0.62988E-01 0.36282E+00 -0.16411E-01 2 -0.10688E+00 -0.98606E-01 -0.67228E+00 -0.87591E-01 3 0.71599E+00 -0.70486E+00 -0.75200E-01 0.19353E+00 4 0.17353E+01 -0.51149E-02 -0.18503E+00 0.72112E-02 5 0.22374E+01 -0.14144E-02 -0.15762E+00 0.34433E-02 6 0.27150E+01 -0.56138E-03 -0.13740E+00 0.20358E-02 7 0.31811E+01 -0.25914E-03 -0.12198E+00 0.13289E-02 8 0.36407E+01 -0.12789E-03 -0.10978E+00 0.92292E-03 L Ruu Rupu Ruup Rupup 1 -0.67213E+00 -0.95100E-02 -0.12457E-01 -0.72455E-02 2 -0.10362E+00 0.62022E-01 -0.46868E+00 0.13822E-01 3 0.33958E+00 -0.29852E+00 0.29923E-01 0.84421E-02 4 0.49488E+00 -0.96214E-03 0.50756E-02 0.12855E-02 5 0.48385E+00 -0.19745E-03 0.25269E-02 0.51847E-03 6 0.47689E+00 -0.65598E-04 0.15128E-02 0.26447E-03 7 0.47202E+00 -0.26695E-04 0.99477E-03 0.15202E-03 8 0.46840E+00 -0.11898E-04 0.69484E-03 0.94427E-04 L Duul1 Duul2 Dulup1 Dulup2 1 0.00000E+00 -0.76608E-01 0.37146E-01 0.00000E+00 2 0.69840E+00 0.00000E+00 0.00000E+00 0.11091E+01 3 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 L Dupul1 Dupul2 Dulu1 Dulu2 1 0.00000E+00 -0.76608E-01 0.97349E+00 0.00000E+00 2 -0.31512E+00 0.00000E+00 0.00000E+00 0.12491E+01 3 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 L Dulul1 Dulul2 Ruul Rulu 1 0.00000E+00 0.00000E+00 0.00000E+00 -0.24967E+00 2 0.00000E+00 0.00000E+00 -0.10051E+01 0.00000E+00 3 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 L Rupul Rulup Rulul 1 0.00000E+00 0.29589E-02 0.00000E+00 2 -0.30485E+00 0.00000E+00 0.00000E+00 3 0.00000E+00 0.00000E+00 0.00000E+00 CPUTIM FOR ATOMIC INTEGRALS . 0.00 :POS02: AT.NR. -2 POSITION = 0.84400 0.84400 0.84400 MULTIPLICITY = 4 NOT EQUIV ATOM Si2 EQUIV ATOM 1 POSITION: 0.844 0.844 0.844 EQUIV ATOM 2 POSITION: 0.656 0.156 0.344 EQUIV ATOM 3 POSITION: 0.344 0.656 0.156 EQUIV ATOM 4 POSITION: 0.156 0.344 0.656 ATOMIC PARAMETERS FOR Si2 ENERGY PARAMETERS ARE 0.15 0.46 0.59 0.57 0.57 0.57 0.57 ENERGY PARAMETERS ARE 0.57 0.57 L U(R) U'(R) DU/DE DU'/DE NORM-U' 0 0.553394E+00 -0.293231E+00 -0.139393E+00 -0.377904E+00 0.169522E-01 2 2 2 1 -0.634699E+00 0.968858E-01 0.120348E+00 0.375539E+00 0.131606E-01 1 1 1 2 0.747519E+00 0.293534E+00 -0.105218E+00 -0.375769E+00 0.105871E-01 0 0 0 3 0.971219E+00 0.111531E+01 -0.543312E-01 -0.319803E+00 0.206728E-02 0 0 0 4 0.111467E+01 0.194197E+01 -0.376960E-01 -0.289951E+00 0.820226E-03 0 0 0 5 0.123281E+01 0.282918E+01 -0.286974E-01 -0.268634E+00 0.409448E-03 0 0 0 6 0.133698E+01 0.378265E+01 -0.229651E-01 -0.251944E+00 0.231437E-03 0 0 0 7 0.143176E+01 0.480151E+01 -0.189862E-01 -0.238255E+00 0.141923E-03 0 0 0 8 0.151959E+01 0.588343E+01 -0.160688E-01 -0.226698E+00 0.923127E-04 0 0 0 LO COEFFICIENT: l,A,B,C 0 0.88834 3.52674 0.00000 LO COEFFICIENT: l,A,B,C 1 0.85559 4.51229 0.00000 LO COEFFICIENT: l,A,B,C 2 0.80730 5.73546 0.00000 ATOMNUMBER: 2 L Duu1 Dupu1 Duup1 Dupup1 1 0.63663E-01 -0.90519E-01 0.42891E+00 -0.21925E-01 2 -0.38068E+00 -0.89200E-01 0.37745E+00 -0.19331E-01 3 0.42855E+00 0.77849E-02 -0.38038E+00 0.85743E-03 4 0.12719E+01 0.94405E-02 -0.23840E+00 0.17296E-02 5 0.18983E+01 0.76411E-02 -0.18467E+00 0.12025E-02 6 0.24689E+01 0.61309E-02 -0.15297E+00 0.83367E-03 7 0.30149E+01 0.49973E-02 -0.13130E+00 0.59666E-03 8 0.35475E+01 0.41450E-02 -0.11531E+00 0.44065E-03 L Duu2 Dupu2 Duup2 Dupup2 1 0.28583E-01 -0.32806E-01 0.40984E+00 -0.22326E-01 2 -0.39651E+00 -0.20356E-02 0.35586E+00 -0.15693E-01 3 0.13143E+01 -0.15745E-01 -0.19423E+00 0.15767E-01 4 0.19395E+01 -0.25733E-02 -0.16453E+00 0.47807E-02 5 0.25043E+01 -0.90913E-03 -0.14011E+00 0.24051E-02 6 0.30458E+01 -0.41706E-03 -0.12213E+00 0.14314E-02 7 0.35749E+01 -0.21673E-03 -0.10837E+00 0.93391E-03 8 0.40964E+01 -0.11875E-03 -0.97475E-01 0.64737E-03 L Ruu Rupu Ruup Rupup 1 -0.74854E+00 -0.21101E-01 -0.26456E-01 -0.11424E-01 2 -0.56028E+00 -0.77816E-02 0.23296E-03 -0.78122E-02 3 0.58055E+00 -0.63139E-02 0.11990E-01 0.31210E-02 4 0.55943E+00 -0.64181E-03 0.43106E-02 0.84104E-03 5 0.54702E+00 -0.16722E-03 0.22435E-02 0.35982E-03 6 0.53909E+00 -0.60399E-04 0.13550E-02 0.18564E-03 7 0.53353E+00 -0.25557E-04 0.89226E-03 0.10690E-03 8 0.52938E+00 -0.11558E-04 0.62286E-03 0.66340E-04 L Duul1 Duul2 Dulup1 Dulup2 1 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 2 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 3 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 L Dupul1 Dupul2 Dulu1 Dulu2 1 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 2 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 3 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 L Dulul1 Dulul2 Ruul Rulu 1 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 2 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 3 0.00000E+00 0.00000E+00 0.00000E+00 0.00000E+00 L Rupul Rulup Rulul 1 0.00000E+00 0.00000E+00 0.00000E+00 2 0.00000E+00 0.00000E+00 0.00000E+00 3 0.00000E+00 0.00000E+00 0.00000E+00 CPUTIM FOR ATOMIC INTEGRALS . 0.00 K-POINT 1: [ 0.0000 0.0000 0.0000] NEMIN-MAX: 1 61 NE: 92 K-POINT 2: [ 0.0000 0.0000 0.0476] NEMIN-MAX: 1 61 NE: 93 K-POINT 3: [ 0.0000 0.0000 0.0952] NEMIN-MAX: 1 61 NE: 92 K-POINT 4: [ 0.0000 0.0000 0.1429] NEMIN-MAX: 1 62 NE: 92 K-POINT 5: [ 0.0000 0.0000 0.1905] NEMIN-MAX: 1 63 NE: 92 K-POINT 6: [ 0.0000 0.0000 0.2381] NEMIN-MAX: 1 64 NE: 91 K-POINT 7: [ 0.0000 0.0000 0.2857] NEMIN-MAX: 1 64 NE: 91 K-POINT 8: [ 0.0000 0.0000 0.3333] NEMIN-MAX: 1 64 NE: 91 K-POINT 9: [ 0.0000 0.0000 0.3810] NEMIN-MAX: 1 64 NE: 91 K-POINT 10: [ 0.0000 0.0000 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 11: [ 0.0000 0.0000 0.4762] NEMIN-MAX: 1 64 NE: 92 K-POINT 12: [ 0.0000 0.0476 0.0476] NEMIN-MAX: 1 61 NE: 92 K-POINT 13: [ 0.0000 0.0476 0.0952] NEMIN-MAX: 1 61 NE: 93 K-POINT 14: [ 0.0000 0.0476 0.1429] NEMIN-MAX: 1 62 NE: 93 K-POINT 15: [ 0.0000 0.0476 0.1905] NEMIN-MAX: 1 63 NE: 92 K-POINT 16: [ 0.0000 0.0476 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 17: [ 0.0000 0.0476 0.2857] NEMIN-MAX: 1 64 NE: 91 K-POINT 18: [ 0.0000 0.0476 0.3333] NEMIN-MAX: 1 64 NE: 91 K-POINT 19: [ 0.0000 0.0476 0.3810] NEMIN-MAX: 1 64 NE: 91 K-POINT 20: [ 0.0000 0.0476 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 21: [ 0.0000 0.0476 0.4762] NEMIN-MAX: 1 64 NE: 91 K-POINT 22: [ 0.0000 0.0952 0.0476] NEMIN-MAX: 1 62 NE: 92 K-POINT 23: [ 0.0000 0.0952 0.0952] NEMIN-MAX: 1 63 NE: 92 K-POINT 24: [ 0.0000 0.0952 0.1429] NEMIN-MAX: 1 63 NE: 92 K-POINT 25: [ 0.0000 0.0952 0.1905] NEMIN-MAX: 1 63 NE: 92 K-POINT 26: [ 0.0000 0.0952 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 27: [ 0.0000 0.0952 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 28: [ 0.0000 0.0952 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 29: [ 0.0000 0.0952 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 30: [ 0.0000 0.0952 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 31: [ 0.0000 0.0952 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 32: [ 0.0000 0.1429 0.0476] NEMIN-MAX: 1 62 NE: 92 K-POINT 33: [ 0.0000 0.1429 0.0952] NEMIN-MAX: 1 63 NE: 92 K-POINT 34: [ 0.0000 0.1429 0.1429] NEMIN-MAX: 1 63 NE: 93 K-POINT 35: [ 0.0000 0.1429 0.1905] NEMIN-MAX: 1 63 NE: 93 K-POINT 36: [ 0.0000 0.1429 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 37: [ 0.0000 0.1429 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 38: [ 0.0000 0.1429 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 39: [ 0.0000 0.1429 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 40: [ 0.0000 0.1429 0.4286] NEMIN-MAX: 1 65 NE: 90 K-POINT 41: [ 0.0000 0.1429 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 42: [ 0.0000 0.1905 0.0476] NEMIN-MAX: 1 63 NE: 92 K-POINT 43: [ 0.0000 0.1905 0.0952] NEMIN-MAX: 1 63 NE: 93 K-POINT 44: [ 0.0000 0.1905 0.1429] NEMIN-MAX: 1 63 NE: 93 K-POINT 45: [ 0.0000 0.1905 0.1905] NEMIN-MAX: 1 63 NE: 93 K-POINT 46: [ 0.0000 0.1905 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 47: [ 0.0000 0.1905 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 48: [ 0.0000 0.1905 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 49: [ 0.0000 0.1905 0.3810] NEMIN-MAX: 1 65 NE: 90 K-POINT 50: [ 0.0000 0.1905 0.4286] NEMIN-MAX: 1 65 NE: 90 K-POINT 51: [ 0.0000 0.1905 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 52: [ 0.0000 0.2381 0.0476] NEMIN-MAX: 1 64 NE: 92 K-POINT 53: [ 0.0000 0.2381 0.0952] NEMIN-MAX: 1 63 NE: 93 K-POINT 54: [ 0.0000 0.2381 0.1429] NEMIN-MAX: 1 63 NE: 93 K-POINT 55: [ 0.0000 0.2381 0.1905] NEMIN-MAX: 1 63 NE: 92 K-POINT 56: [ 0.0000 0.2381 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 57: [ 0.0000 0.2381 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 58: [ 0.0000 0.2381 0.3333] NEMIN-MAX: 1 64 NE: 91 K-POINT 59: [ 0.0000 0.2381 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 60: [ 0.0000 0.2381 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 61: [ 0.0000 0.2381 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 62: [ 0.0000 0.2857 0.0476] NEMIN-MAX: 1 64 NE: 92 K-POINT 63: [ 0.0000 0.2857 0.0952] NEMIN-MAX: 1 64 NE: 92 K-POINT 64: [ 0.0000 0.2857 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 65: [ 0.0000 0.2857 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 66: [ 0.0000 0.2857 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 67: [ 0.0000 0.2857 0.2857] NEMIN-MAX: 1 64 NE: 91 K-POINT 68: [ 0.0000 0.2857 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 69: [ 0.0000 0.2857 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 70: [ 0.0000 0.2857 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 71: [ 0.0000 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 72: [ 0.0000 0.3333 0.0476] NEMIN-MAX: 1 64 NE: 92 K-POINT 73: [ 0.0000 0.3333 0.0952] NEMIN-MAX: 1 64 NE: 92 K-POINT 74: [ 0.0000 0.3333 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 75: [ 0.0000 0.3333 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 76: [ 0.0000 0.3333 0.2381] NEMIN-MAX: 1 64 NE: 91 K-POINT 77: [ 0.0000 0.3333 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 78: [ 0.0000 0.3333 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 79: [ 0.0000 0.3333 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 80: [ 0.0000 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 81: [ 0.0000 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 82: [ 0.0000 0.3810 0.0476] NEMIN-MAX: 1 64 NE: 92 K-POINT 83: [ 0.0000 0.3810 0.0952] NEMIN-MAX: 1 65 NE: 91 K-POINT 84: [ 0.0000 0.3810 0.1429] NEMIN-MAX: 1 65 NE: 91 K-POINT 85: [ 0.0000 0.3810 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 86: [ 0.0000 0.3810 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 87: [ 0.0000 0.3810 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 88: [ 0.0000 0.3810 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 89: [ 0.0000 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 90: [ 0.0000 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 91: [ 0.0000 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 92: [ 0.0000 0.4286 0.0476] NEMIN-MAX: 1 65 NE: 92 K-POINT 93: [ 0.0000 0.4286 0.0952] NEMIN-MAX: 1 65 NE: 92 K-POINT 94: [ 0.0000 0.4286 0.1429] NEMIN-MAX: 1 65 NE: 91 K-POINT 95: [ 0.0000 0.4286 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 96: [ 0.0000 0.4286 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 97: [ 0.0000 0.4286 0.2857] NEMIN-MAX: 1 65 NE: 90 K-POINT 98: [ 0.0000 0.4286 0.3333] NEMIN-MAX: 1 65 NE: 90 K-POINT 99: [ 0.0000 0.4286 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 100: [ 0.0000 0.4286 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 101: [ 0.0000 0.4286 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 102: [ 0.0000 0.4762 0.0476] NEMIN-MAX: 1 64 NE: 92 K-POINT 103: [ 0.0000 0.4762 0.0952] NEMIN-MAX: 1 65 NE: 92 K-POINT 104: [ 0.0000 0.4762 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 105: [ 0.0000 0.4762 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 106: [ 0.0000 0.4762 0.2381] NEMIN-MAX: 1 65 NE: 90 K-POINT 107: [ 0.0000 0.4762 0.2857] NEMIN-MAX: 1 64 NE: 90 K-POINT 108: [ 0.0000 0.4762 0.3333] NEMIN-MAX: 1 64 NE: 90 K-POINT 109: [ 0.0000 0.4762 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 110: [ 0.0000 0.4762 0.4286] NEMIN-MAX: 1 67 NE: 89 K-POINT 111: [ 0.0000 0.4762 0.4762] NEMIN-MAX: 1 68 NE: 88 K-POINT 112: [ 0.0476 0.0476 0.0476] NEMIN-MAX: 1 61 NE: 93 K-POINT 113: [ 0.0476 0.0476 0.0952] NEMIN-MAX: 1 62 NE: 93 K-POINT 114: [ 0.0476 0.0476 0.1429] NEMIN-MAX: 1 63 NE: 92 K-POINT 115: [ 0.0476 0.0476 0.1905] NEMIN-MAX: 1 63 NE: 92 K-POINT 116: [ 0.0476 0.0476 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 117: [ 0.0476 0.0476 0.2857] NEMIN-MAX: 1 64 NE: 92 K-POINT 118: [ 0.0476 0.0476 0.3333] NEMIN-MAX: 1 64 NE: 91 K-POINT 119: [ 0.0476 0.0476 0.3810] NEMIN-MAX: 1 64 NE: 91 K-POINT 120: [ 0.0476 0.0476 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 121: [ 0.0476 0.0476 0.4762] NEMIN-MAX: 1 64 NE: 91 K-POINT 122: [ 0.0476 0.0952 0.0952] NEMIN-MAX: 1 63 NE: 92 K-POINT 123: [ 0.0476 0.0952 0.1429] NEMIN-MAX: 1 63 NE: 93 K-POINT 124: [ 0.0476 0.0952 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 125: [ 0.0476 0.0952 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 126: [ 0.0476 0.0952 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 127: [ 0.0476 0.0952 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 128: [ 0.0476 0.0952 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 129: [ 0.0476 0.0952 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 130: [ 0.0476 0.0952 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 131: [ 0.0476 0.1429 0.0952] NEMIN-MAX: 1 63 NE: 93 K-POINT 132: [ 0.0476 0.1429 0.1429] NEMIN-MAX: 1 63 NE: 93 K-POINT 133: [ 0.0476 0.1429 0.1905] NEMIN-MAX: 1 64 NE: 93 K-POINT 134: [ 0.0476 0.1429 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 135: [ 0.0476 0.1429 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 136: [ 0.0476 0.1429 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 137: [ 0.0476 0.1429 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 138: [ 0.0476 0.1429 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 139: [ 0.0476 0.1429 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 140: [ 0.0476 0.1905 0.0952] NEMIN-MAX: 1 63 NE: 93 K-POINT 141: [ 0.0476 0.1905 0.1429] NEMIN-MAX: 1 64 NE: 93 K-POINT 142: [ 0.0476 0.1905 0.1905] NEMIN-MAX: 1 64 NE: 93 K-POINT 143: [ 0.0476 0.1905 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 144: [ 0.0476 0.1905 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 145: [ 0.0476 0.1905 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 146: [ 0.0476 0.1905 0.3810] NEMIN-MAX: 1 65 NE: 90 K-POINT 147: [ 0.0476 0.1905 0.4286] NEMIN-MAX: 1 65 NE: 90 K-POINT 148: [ 0.0476 0.1905 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 149: [ 0.0476 0.2381 0.0952] NEMIN-MAX: 1 64 NE: 93 K-POINT 150: [ 0.0476 0.2381 0.1429] NEMIN-MAX: 1 64 NE: 93 K-POINT 151: [ 0.0476 0.2381 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 152: [ 0.0476 0.2381 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 153: [ 0.0476 0.2381 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 154: [ 0.0476 0.2381 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 155: [ 0.0476 0.2381 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 156: [ 0.0476 0.2381 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 157: [ 0.0476 0.2381 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 158: [ 0.0476 0.2857 0.0952] NEMIN-MAX: 1 64 NE: 92 K-POINT 159: [ 0.0476 0.2857 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 160: [ 0.0476 0.2857 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 161: [ 0.0476 0.2857 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 162: [ 0.0476 0.2857 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 163: [ 0.0476 0.2857 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 164: [ 0.0476 0.2857 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 165: [ 0.0476 0.2857 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 166: [ 0.0476 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 167: [ 0.0476 0.3333 0.0952] NEMIN-MAX: 1 64 NE: 91 K-POINT 168: [ 0.0476 0.3333 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 169: [ 0.0476 0.3333 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 170: [ 0.0476 0.3333 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 171: [ 0.0476 0.3333 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 172: [ 0.0476 0.3333 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 173: [ 0.0476 0.3333 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 174: [ 0.0476 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 175: [ 0.0476 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 176: [ 0.0476 0.3810 0.0952] NEMIN-MAX: 1 65 NE: 91 K-POINT 177: [ 0.0476 0.3810 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 178: [ 0.0476 0.3810 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 179: [ 0.0476 0.3810 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 180: [ 0.0476 0.3810 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 181: [ 0.0476 0.3810 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 182: [ 0.0476 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 183: [ 0.0476 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 184: [ 0.0476 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 185: [ 0.0476 0.4286 0.0952] NEMIN-MAX: 1 65 NE: 92 K-POINT 186: [ 0.0476 0.4286 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 187: [ 0.0476 0.4286 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 188: [ 0.0476 0.4286 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 189: [ 0.0476 0.4286 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 190: [ 0.0476 0.4286 0.3333] NEMIN-MAX: 1 65 NE: 90 K-POINT 191: [ 0.0476 0.4286 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 192: [ 0.0476 0.4286 0.4286] NEMIN-MAX: 1 67 NE: 90 K-POINT 193: [ 0.0476 0.4286 0.4762] NEMIN-MAX: 1 67 NE: 89 K-POINT 194: [ 0.0476 0.4762 0.0952] NEMIN-MAX: 1 65 NE: 92 K-POINT 195: [ 0.0476 0.4762 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 196: [ 0.0476 0.4762 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 197: [ 0.0476 0.4762 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 198: [ 0.0476 0.4762 0.2857] NEMIN-MAX: 1 65 NE: 90 K-POINT 199: [ 0.0476 0.4762 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 200: [ 0.0476 0.4762 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 201: [ 0.0476 0.4762 0.4286] NEMIN-MAX: 1 67 NE: 89 K-POINT 202: [ 0.0476 0.4762 0.4762] NEMIN-MAX: 1 68 NE: 88 K-POINT 203: [ 0.0952 0.0952 0.0952] NEMIN-MAX: 1 63 NE: 93 K-POINT 204: [ 0.0952 0.0952 0.1429] NEMIN-MAX: 1 64 NE: 93 K-POINT 205: [ 0.0952 0.0952 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 206: [ 0.0952 0.0952 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 207: [ 0.0952 0.0952 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 208: [ 0.0952 0.0952 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 209: [ 0.0952 0.0952 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 210: [ 0.0952 0.0952 0.4286] NEMIN-MAX: 1 65 NE: 92 K-POINT 211: [ 0.0952 0.0952 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 212: [ 0.0952 0.1429 0.1429] NEMIN-MAX: 1 64 NE: 93 K-POINT 213: [ 0.0952 0.1429 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 214: [ 0.0952 0.1429 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 215: [ 0.0952 0.1429 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 216: [ 0.0952 0.1429 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 217: [ 0.0952 0.1429 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 218: [ 0.0952 0.1429 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 219: [ 0.0952 0.1429 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 220: [ 0.0952 0.1905 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 221: [ 0.0952 0.1905 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 222: [ 0.0952 0.1905 0.2381] NEMIN-MAX: 1 65 NE: 92 K-POINT 223: [ 0.0952 0.1905 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 224: [ 0.0952 0.1905 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 225: [ 0.0952 0.1905 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 226: [ 0.0952 0.1905 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 227: [ 0.0952 0.1905 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 228: [ 0.0952 0.2381 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 229: [ 0.0952 0.2381 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 230: [ 0.0952 0.2381 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 231: [ 0.0952 0.2381 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 232: [ 0.0952 0.2381 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 233: [ 0.0952 0.2381 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 234: [ 0.0952 0.2381 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 235: [ 0.0952 0.2381 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 236: [ 0.0952 0.2857 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 237: [ 0.0952 0.2857 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 238: [ 0.0952 0.2857 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 239: [ 0.0952 0.2857 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 240: [ 0.0952 0.2857 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 241: [ 0.0952 0.2857 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 242: [ 0.0952 0.2857 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 243: [ 0.0952 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 244: [ 0.0952 0.3333 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 245: [ 0.0952 0.3333 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 246: [ 0.0952 0.3333 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 247: [ 0.0952 0.3333 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 248: [ 0.0952 0.3333 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 249: [ 0.0952 0.3333 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 250: [ 0.0952 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 251: [ 0.0952 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 252: [ 0.0952 0.3810 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 253: [ 0.0952 0.3810 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 254: [ 0.0952 0.3810 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 255: [ 0.0952 0.3810 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 256: [ 0.0952 0.3810 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 257: [ 0.0952 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 258: [ 0.0952 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 259: [ 0.0952 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 260: [ 0.0952 0.4286 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 261: [ 0.0952 0.4286 0.1905] NEMIN-MAX: 1 65 NE: 92 K-POINT 262: [ 0.0952 0.4286 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 263: [ 0.0952 0.4286 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 264: [ 0.0952 0.4286 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 265: [ 0.0952 0.4286 0.3810] NEMIN-MAX: 1 67 NE: 91 K-POINT 266: [ 0.0952 0.4286 0.4286] NEMIN-MAX: 1 67 NE: 90 K-POINT 267: [ 0.0952 0.4286 0.4762] NEMIN-MAX: 1 67 NE: 90 K-POINT 268: [ 0.0952 0.4762 0.1429] NEMIN-MAX: 1 65 NE: 92 K-POINT 269: [ 0.0952 0.4762 0.1905] NEMIN-MAX: 1 66 NE: 91 K-POINT 270: [ 0.0952 0.4762 0.2381] NEMIN-MAX: 1 66 NE: 90 K-POINT 271: [ 0.0952 0.4762 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 272: [ 0.0952 0.4762 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 273: [ 0.0952 0.4762 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 274: [ 0.0952 0.4762 0.4286] NEMIN-MAX: 1 68 NE: 90 K-POINT 275: [ 0.0952 0.4762 0.4762] NEMIN-MAX: 1 68 NE: 90 K-POINT 276: [ 0.1429 0.1429 0.1429] NEMIN-MAX: 1 64 NE: 92 K-POINT 277: [ 0.1429 0.1429 0.1905] NEMIN-MAX: 1 64 NE: 92 K-POINT 278: [ 0.1429 0.1429 0.2381] NEMIN-MAX: 1 64 NE: 92 K-POINT 279: [ 0.1429 0.1429 0.2857] NEMIN-MAX: 1 65 NE: 92 K-POINT 280: [ 0.1429 0.1429 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 281: [ 0.1429 0.1429 0.3810] NEMIN-MAX: 1 65 NE: 92 K-POINT 282: [ 0.1429 0.1429 0.4286] NEMIN-MAX: 1 65 NE: 92 K-POINT 283: [ 0.1429 0.1429 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 284: [ 0.1429 0.1905 0.1905] NEMIN-MAX: 1 64 NE: 91 K-POINT 285: [ 0.1429 0.1905 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 286: [ 0.1429 0.1905 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 287: [ 0.1429 0.1905 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 288: [ 0.1429 0.1905 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 289: [ 0.1429 0.1905 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 290: [ 0.1429 0.1905 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 291: [ 0.1429 0.2381 0.1905] NEMIN-MAX: 1 65 NE: 91 K-POINT 292: [ 0.1429 0.2381 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 293: [ 0.1429 0.2381 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 294: [ 0.1429 0.2381 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 295: [ 0.1429 0.2381 0.3810] NEMIN-MAX: 1 65 NE: 91 K-POINT 296: [ 0.1429 0.2381 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 297: [ 0.1429 0.2381 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 298: [ 0.1429 0.2857 0.1905] NEMIN-MAX: 1 65 NE: 91 K-POINT 299: [ 0.1429 0.2857 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 300: [ 0.1429 0.2857 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 301: [ 0.1429 0.2857 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 302: [ 0.1429 0.2857 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 303: [ 0.1429 0.2857 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 304: [ 0.1429 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 305: [ 0.1429 0.3333 0.1905] NEMIN-MAX: 1 65 NE: 91 K-POINT 306: [ 0.1429 0.3333 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 307: [ 0.1429 0.3333 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 308: [ 0.1429 0.3333 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 309: [ 0.1429 0.3333 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 310: [ 0.1429 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 311: [ 0.1429 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 312: [ 0.1429 0.3810 0.1905] NEMIN-MAX: 1 65 NE: 91 K-POINT 313: [ 0.1429 0.3810 0.2381] NEMIN-MAX: 1 66 NE: 91 K-POINT 314: [ 0.1429 0.3810 0.2857] NEMIN-MAX: 1 66 NE: 91 K-POINT 315: [ 0.1429 0.3810 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 316: [ 0.1429 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 317: [ 0.1429 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 318: [ 0.1429 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 319: [ 0.1429 0.4286 0.1905] NEMIN-MAX: 1 65 NE: 91 K-POINT 320: [ 0.1429 0.4286 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 321: [ 0.1429 0.4286 0.2857] NEMIN-MAX: 1 66 NE: 91 K-POINT 322: [ 0.1429 0.4286 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 323: [ 0.1429 0.4286 0.3810] NEMIN-MAX: 1 67 NE: 90 K-POINT 324: [ 0.1429 0.4286 0.4286] NEMIN-MAX: 1 67 NE: 90 K-POINT 325: [ 0.1429 0.4286 0.4762] NEMIN-MAX: 1 67 NE: 90 K-POINT 326: [ 0.1429 0.4762 0.1905] NEMIN-MAX: 1 64 NE: 91 K-POINT 327: [ 0.1429 0.4762 0.2381] NEMIN-MAX: 1 65 NE: 90 K-POINT 328: [ 0.1429 0.4762 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 329: [ 0.1429 0.4762 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 330: [ 0.1429 0.4762 0.3810] NEMIN-MAX: 1 67 NE: 90 K-POINT 331: [ 0.1429 0.4762 0.4286] NEMIN-MAX: 1 68 NE: 90 K-POINT 332: [ 0.1429 0.4762 0.4762] NEMIN-MAX: 1 68 NE: 90 K-POINT 333: [ 0.1905 0.1905 0.1905] NEMIN-MAX: 1 64 NE: 91 K-POINT 334: [ 0.1905 0.1905 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 335: [ 0.1905 0.1905 0.2857] NEMIN-MAX: 1 65 NE: 91 K-POINT 336: [ 0.1905 0.1905 0.3333] NEMIN-MAX: 1 65 NE: 91 K-POINT 337: [ 0.1905 0.1905 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 338: [ 0.1905 0.1905 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 339: [ 0.1905 0.1905 0.4762] NEMIN-MAX: 1 65 NE: 91 K-POINT 340: [ 0.1905 0.2381 0.2381] NEMIN-MAX: 1 65 NE: 91 K-POINT 341: [ 0.1905 0.2381 0.2857] NEMIN-MAX: 1 66 NE: 91 K-POINT 342: [ 0.1905 0.2381 0.3333] NEMIN-MAX: 1 66 NE: 91 K-POINT 343: [ 0.1905 0.2381 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 344: [ 0.1905 0.2381 0.4286] NEMIN-MAX: 1 65 NE: 91 K-POINT 345: [ 0.1905 0.2381 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 346: [ 0.1905 0.2857 0.2381] NEMIN-MAX: 1 66 NE: 90 K-POINT 347: [ 0.1905 0.2857 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 348: [ 0.1905 0.2857 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 349: [ 0.1905 0.2857 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 350: [ 0.1905 0.2857 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 351: [ 0.1905 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 352: [ 0.1905 0.3333 0.2381] NEMIN-MAX: 1 66 NE: 91 K-POINT 353: [ 0.1905 0.3333 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 354: [ 0.1905 0.3333 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 355: [ 0.1905 0.3333 0.3810] NEMIN-MAX: 1 67 NE: 90 K-POINT 356: [ 0.1905 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 357: [ 0.1905 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 358: [ 0.1905 0.3810 0.2381] NEMIN-MAX: 1 66 NE: 91 K-POINT 359: [ 0.1905 0.3810 0.2857] NEMIN-MAX: 1 66 NE: 91 K-POINT 360: [ 0.1905 0.3810 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 361: [ 0.1905 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 362: [ 0.1905 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 363: [ 0.1905 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 364: [ 0.1905 0.4286 0.2381] NEMIN-MAX: 1 66 NE: 91 K-POINT 365: [ 0.1905 0.4286 0.2857] NEMIN-MAX: 1 66 NE: 91 K-POINT 366: [ 0.1905 0.4286 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 367: [ 0.1905 0.4286 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 368: [ 0.1905 0.4286 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 369: [ 0.1905 0.4286 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 370: [ 0.1905 0.4762 0.2381] NEMIN-MAX: 1 66 NE: 91 K-POINT 371: [ 0.1905 0.4762 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 372: [ 0.1905 0.4762 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 373: [ 0.1905 0.4762 0.3810] NEMIN-MAX: 1 67 NE: 90 K-POINT 374: [ 0.1905 0.4762 0.4286] NEMIN-MAX: 1 67 NE: 90 K-POINT 375: [ 0.1905 0.4762 0.4762] NEMIN-MAX: 1 67 NE: 90 K-POINT 376: [ 0.2381 0.2381 0.2381] NEMIN-MAX: 1 66 NE: 90 K-POINT 377: [ 0.2381 0.2381 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 378: [ 0.2381 0.2381 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 379: [ 0.2381 0.2381 0.3810] NEMIN-MAX: 1 66 NE: 91 K-POINT 380: [ 0.2381 0.2381 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 381: [ 0.2381 0.2381 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 382: [ 0.2381 0.2857 0.2857] NEMIN-MAX: 1 67 NE: 90 K-POINT 383: [ 0.2381 0.2857 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 384: [ 0.2381 0.2857 0.3810] NEMIN-MAX: 1 67 NE: 91 K-POINT 385: [ 0.2381 0.2857 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 386: [ 0.2381 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 91 K-POINT 387: [ 0.2381 0.3333 0.2857] NEMIN-MAX: 1 67 NE: 90 K-POINT 388: [ 0.2381 0.3333 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 389: [ 0.2381 0.3333 0.3810] NEMIN-MAX: 1 67 NE: 90 K-POINT 390: [ 0.2381 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 391: [ 0.2381 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 392: [ 0.2381 0.3810 0.2857] NEMIN-MAX: 1 67 NE: 90 K-POINT 393: [ 0.2381 0.3810 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 394: [ 0.2381 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 395: [ 0.2381 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 396: [ 0.2381 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 397: [ 0.2381 0.4286 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 398: [ 0.2381 0.4286 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 399: [ 0.2381 0.4286 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 400: [ 0.2381 0.4286 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 401: [ 0.2381 0.4286 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 402: [ 0.2381 0.4762 0.2857] NEMIN-MAX: 1 66 NE: 90 K-POINT 403: [ 0.2381 0.4762 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 404: [ 0.2381 0.4762 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 405: [ 0.2381 0.4762 0.4286] NEMIN-MAX: 1 67 NE: 90 K-POINT 406: [ 0.2381 0.4762 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 407: [ 0.2857 0.2857 0.2857] NEMIN-MAX: 1 67 NE: 90 K-POINT 408: [ 0.2857 0.2857 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 409: [ 0.2857 0.2857 0.3810] NEMIN-MAX: 1 67 NE: 90 K-POINT 410: [ 0.2857 0.2857 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 411: [ 0.2857 0.2857 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 412: [ 0.2857 0.3333 0.3333] NEMIN-MAX: 1 67 NE: 90 K-POINT 413: [ 0.2857 0.3333 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 414: [ 0.2857 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 91 K-POINT 415: [ 0.2857 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 416: [ 0.2857 0.3810 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 417: [ 0.2857 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 418: [ 0.2857 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 419: [ 0.2857 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 420: [ 0.2857 0.4286 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 421: [ 0.2857 0.4286 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 422: [ 0.2857 0.4286 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 423: [ 0.2857 0.4286 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 424: [ 0.2857 0.4762 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 425: [ 0.2857 0.4762 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 426: [ 0.2857 0.4762 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 427: [ 0.2857 0.4762 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 428: [ 0.3333 0.3333 0.3333] NEMIN-MAX: 1 66 NE: 90 K-POINT 429: [ 0.3333 0.3333 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 430: [ 0.3333 0.3333 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 431: [ 0.3333 0.3333 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 432: [ 0.3333 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 433: [ 0.3333 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 89 K-POINT 434: [ 0.3333 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 435: [ 0.3333 0.4286 0.3810] NEMIN-MAX: 1 66 NE: 89 K-POINT 436: [ 0.3333 0.4286 0.4286] NEMIN-MAX: 1 66 NE: 89 K-POINT 437: [ 0.3333 0.4286 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 438: [ 0.3333 0.4762 0.3810] NEMIN-MAX: 1 66 NE: 90 K-POINT 439: [ 0.3333 0.4762 0.4286] NEMIN-MAX: 1 66 NE: 90 K-POINT 440: [ 0.3333 0.4762 0.4762] NEMIN-MAX: 1 66 NE: 90 K-POINT 441: [ 0.3810 0.3810 0.3810] NEMIN-MAX: 1 66 NE: 89 K-POINT 442: [ 0.3810 0.3810 0.4286] NEMIN-MAX: 1 66 NE: 88 K-POINT 443: [ 0.3810 0.3810 0.4762] NEMIN-MAX: 1 66 NE: 88 K-POINT 444: [ 0.3810 0.4286 0.4286] NEMIN-MAX: 1 66 NE: 88 K-POINT 445: [ 0.3810 0.4286 0.4762] NEMIN-MAX: 1 66 NE: 88 K-POINT 446: [ 0.3810 0.4762 0.4286] NEMIN-MAX: 1 66 NE: 88 K-POINT 447: [ 0.3810 0.4762 0.4762] NEMIN-MAX: 1 66 NE: 88 K-POINT 448: [ 0.4286 0.4286 0.4286] NEMIN-MAX: 1 65 NE: 88 K-POINT 449: [ 0.4286 0.4286 0.4762] NEMIN-MAX: 1 65 NE: 88 K-POINT 450: [ 0.4286 0.4762 0.4762] NEMIN-MAX: 1 64 NE: 88 K-POINT 451: [ 0.4762 0.4762 0.4762] NEMIN-MAX: 1 64 NE: 88 =====>>> CPU TIME SUMMARY MATRIX ELEMENTS: 0.0 ... 0. PERCENT TOTAL : 178.8 ... 100. PERCENT