Program PWSCF v.5.1.1 starts on 10Oct2015 at 20:48: 2 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./KNbO3.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 30 18 5 892 402 67 Max 31 19 7 899 417 72 Sum 1485 885 277 43051 19641 3287 bravais-lattice index = 14 lattice parameter (alat) = 7.6293 a.u. unit-cell volume = 437.1163 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.629271 celldm(2)= 1.000000 celldm(3)= 0.984356 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.004571 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.004571 0.999990 0.000000 ) a(3) = ( 0.000000 0.000000 0.984356 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.004571 -0.000000 ) b(2) = ( 0.000000 1.000010 -0.000000 ) b(3) = ( 0.000000 0.000000 1.015892 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for K read from file: /home/autes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Nb 13.00 92.90640 Nb( 1.00) K 9.00 39.09830 K( 1.00) 2 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 472 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 2) = ( 0.0090495 0.0090910 -0.0000000), wk = 0.0021186 k( 3) = ( 0.0180991 0.0181820 -0.0000000), wk = 0.0021186 k( 4) = ( 0.0271486 0.0272730 -0.0000000), wk = 0.0021186 k( 5) = ( 0.0361982 0.0363640 -0.0000000), wk = 0.0021186 k( 6) = ( 0.0452477 0.0454550 -0.0000000), wk = 0.0021186 k( 7) = ( 0.0542972 0.0545460 -0.0000000), wk = 0.0021186 k( 8) = ( 0.0633468 0.0636370 -0.0000000), wk = 0.0021186 k( 9) = ( 0.0723963 0.0727280 -0.0000000), wk = 0.0021186 k( 10) = ( 0.0814459 0.0818190 -0.0000000), wk = 0.0021186 k( 11) = ( 0.0904954 0.0909100 -0.0000000), wk = 0.0021186 k( 12) = ( 0.0995449 0.1000010 -0.0000000), wk = 0.0021186 k( 13) = ( 0.1085945 0.1090920 -0.0000000), wk = 0.0021186 k( 14) = ( 0.1176440 0.1181831 -0.0000000), wk = 0.0021186 k( 15) = ( 0.1266936 0.1272741 -0.0000000), wk = 0.0021186 k( 16) = ( 0.1357431 0.1363651 -0.0000000), wk = 0.0021186 k( 17) = ( 0.1447926 0.1454561 -0.0000000), wk = 0.0021186 k( 18) = ( 0.1538422 0.1545471 -0.0000000), wk = 0.0021186 k( 19) = ( 0.1628917 0.1636381 -0.0000000), wk = 0.0021186 k( 20) = ( 0.1719413 0.1727291 -0.0000000), wk = 0.0021186 k( 21) = ( 0.1809908 0.1818201 -0.0000000), wk = 0.0021186 k( 22) = ( 0.1900404 0.1909111 -0.0000000), wk = 0.0021186 k( 23) = ( 0.1990899 0.2000021 -0.0000000), wk = 0.0021186 k( 24) = ( 0.2081394 0.2090931 -0.0000000), wk = 0.0021186 k( 25) = ( 0.2171890 0.2181841 -0.0000000), wk = 0.0021186 k( 26) = ( 0.2262385 0.2272751 -0.0000000), wk = 0.0021186 k( 27) = ( 0.2352881 0.2363661 -0.0000000), wk = 0.0021186 k( 28) = ( 0.2443376 0.2454571 -0.0000000), wk = 0.0021186 k( 29) = ( 0.2533871 0.2545481 -0.0000000), wk = 0.0021186 k( 30) = ( 0.2624367 0.2636391 -0.0000000), wk = 0.0021186 k( 31) = ( 0.2714862 0.2727301 -0.0000000), wk = 0.0021186 k( 32) = ( 0.2805358 0.2818211 -0.0000000), wk = 0.0021186 k( 33) = ( 0.2895853 0.2909121 -0.0000000), wk = 0.0021186 k( 34) = ( 0.2986349 0.3000031 -0.0000000), wk = 0.0021186 k( 35) = ( 0.3076844 0.3090941 -0.0000000), wk = 0.0021186 k( 36) = ( 0.3167339 0.3181851 -0.0000000), wk = 0.0021186 k( 37) = ( 0.3257835 0.3272761 -0.0000000), wk = 0.0021186 k( 38) = ( 0.3348330 0.3363671 -0.0000000), wk = 0.0021186 k( 39) = ( 0.3438826 0.3454582 -0.0000000), wk = 0.0021186 k( 40) = ( 0.3529321 0.3545492 -0.0000000), wk = 0.0021186 k( 41) = ( 0.3619816 0.3636402 -0.0000000), wk = 0.0021186 k( 42) = ( 0.3710312 0.3727312 -0.0000000), wk = 0.0021186 k( 43) = ( 0.3800807 0.3818222 -0.0000000), wk = 0.0021186 k( 44) = ( 0.3891303 0.3909132 -0.0000000), wk = 0.0021186 k( 45) = ( 0.3981798 0.4000042 -0.0000000), wk = 0.0021186 k( 46) = ( 0.4072293 0.4090952 -0.0000000), wk = 0.0021186 k( 47) = ( 0.4162789 0.4181862 -0.0000000), wk = 0.0021186 k( 48) = ( 0.4253284 0.4272772 -0.0000000), wk = 0.0021186 k( 49) = ( 0.4343780 0.4363682 -0.0000000), wk = 0.0021186 k( 50) = ( 0.4434275 0.4454592 -0.0000000), wk = 0.0021186 k( 51) = ( 0.4524770 0.4545502 -0.0000000), wk = 0.0021186 k( 52) = ( 0.4615266 0.4636412 -0.0000000), wk = 0.0021186 k( 53) = ( 0.4705761 0.4727322 -0.0000000), wk = 0.0021186 k( 54) = ( 0.4796257 0.4818232 -0.0000000), wk = 0.0021186 k( 55) = ( 0.4886752 0.4909142 -0.0000000), wk = 0.0021186 k( 56) = ( 0.4977247 0.5000052 -0.0000000), wk = 0.0021186 k( 57) = ( 0.4977247 0.5000052 -0.0000000), wk = 0.0021186 k( 58) = ( 0.4849626 0.5000052 -0.0000000), wk = 0.0021186 k( 59) = ( 0.4722004 0.5000052 -0.0000000), wk = 0.0021186 k( 60) = ( 0.4594382 0.5000052 -0.0000000), wk = 0.0021186 k( 61) = ( 0.4466761 0.5000052 -0.0000000), wk = 0.0021186 k( 62) = ( 0.4339139 0.5000052 -0.0000000), wk = 0.0021186 k( 63) = ( 0.4211517 0.5000052 -0.0000000), wk = 0.0021186 k( 64) = ( 0.4083895 0.5000052 -0.0000000), wk = 0.0021186 k( 65) = ( 0.3956274 0.5000052 -0.0000000), wk = 0.0021186 k( 66) = ( 0.3828652 0.5000052 -0.0000000), wk = 0.0021186 k( 67) = ( 0.3701030 0.5000052 -0.0000000), wk = 0.0021186 k( 68) = ( 0.3573408 0.5000052 -0.0000000), wk = 0.0021186 k( 69) = ( 0.3445787 0.5000052 -0.0000000), wk = 0.0021186 k( 70) = ( 0.3318165 0.5000052 -0.0000000), wk = 0.0021186 k( 71) = ( 0.3190543 0.5000052 -0.0000000), wk = 0.0021186 k( 72) = ( 0.3062921 0.5000052 -0.0000000), wk = 0.0021186 k( 73) = ( 0.2935300 0.5000052 -0.0000000), wk = 0.0021186 k( 74) = ( 0.2807678 0.5000052 -0.0000000), wk = 0.0021186 k( 75) = ( 0.2680056 0.5000052 -0.0000000), wk = 0.0021186 k( 76) = ( 0.2552435 0.5000052 -0.0000000), wk = 0.0021186 k( 77) = ( 0.2424813 0.5000052 -0.0000000), wk = 0.0021186 k( 78) = ( 0.2297191 0.5000052 -0.0000000), wk = 0.0021186 k( 79) = ( 0.2169569 0.5000052 -0.0000000), wk = 0.0021186 k( 80) = ( 0.2041948 0.5000052 -0.0000000), wk = 0.0021186 k( 81) = ( 0.1914326 0.5000052 -0.0000000), wk = 0.0021186 k( 82) = ( 0.1786704 0.5000052 -0.0000000), wk = 0.0021186 k( 83) = ( 0.1659083 0.5000052 -0.0000000), wk = 0.0021186 k( 84) = ( 0.1531461 0.5000052 -0.0000000), wk = 0.0021186 k( 85) = ( 0.1403839 0.5000052 -0.0000000), wk = 0.0021186 k( 86) = ( 0.1276217 0.5000052 -0.0000000), wk = 0.0021186 k( 87) = ( 0.1148596 0.5000052 -0.0000000), wk = 0.0021186 k( 88) = ( 0.1020974 0.5000052 -0.0000000), wk = 0.0021186 k( 89) = ( 0.0893352 0.5000052 -0.0000000), wk = 0.0021186 k( 90) = ( 0.0765730 0.5000052 -0.0000000), wk = 0.0021186 k( 91) = ( 0.0638109 0.5000052 -0.0000000), wk = 0.0021186 k( 92) = ( 0.0510487 0.5000052 -0.0000000), wk = 0.0021186 k( 93) = ( 0.0382865 0.5000052 -0.0000000), wk = 0.0021186 k( 94) = ( 0.0255244 0.5000052 -0.0000000), wk = 0.0021186 k( 95) = ( 0.0127622 0.5000052 -0.0000000), wk = 0.0021186 k( 96) = ( 0.0000000 0.5000052 -0.0000000), wk = 0.0021186 k( 97) = ( 0.0000000 0.5000052 -0.0000000), wk = 0.0021186 k( 98) = ( 0.0000000 0.5000052 0.0126987), wk = 0.0021186 k( 99) = ( 0.0000000 0.5000052 0.0253973), wk = 0.0021186 k( 100) = ( 0.0000000 0.5000052 0.0380960), wk = 0.0021186 k( 101) = ( 0.0000000 0.5000052 0.0507946), wk = 0.0021186 k( 102) = ( 0.0000000 0.5000052 0.0634933), wk = 0.0021186 k( 103) = ( 0.0000000 0.5000052 0.0761919), wk = 0.0021186 k( 104) = ( 0.0000000 0.5000052 0.0888906), wk = 0.0021186 k( 105) = ( 0.0000000 0.5000052 0.1015892), wk = 0.0021186 k( 106) = ( 0.0000000 0.5000052 0.1142879), wk = 0.0021186 k( 107) = ( 0.0000000 0.5000052 0.1269865), wk = 0.0021186 k( 108) = ( 0.0000000 0.5000052 0.1396852), wk = 0.0021186 k( 109) = ( 0.0000000 0.5000052 0.1523838), wk = 0.0021186 k( 110) = ( 0.0000000 0.5000052 0.1650825), wk = 0.0021186 k( 111) = ( 0.0000000 0.5000052 0.1777811), wk = 0.0021186 k( 112) = ( 0.0000000 0.5000052 0.1904798), wk = 0.0021186 k( 113) = ( 0.0000000 0.5000052 0.2031784), wk = 0.0021186 k( 114) = ( 0.0000000 0.5000052 0.2158771), wk = 0.0021186 k( 115) = ( 0.0000000 0.5000052 0.2285757), wk = 0.0021186 k( 116) = ( 0.0000000 0.5000052 0.2412744), wk = 0.0021186 k( 117) = ( 0.0000000 0.5000052 0.2539730), wk = 0.0021186 k( 118) = ( 0.0000000 0.5000052 0.2666717), wk = 0.0021186 k( 119) = ( 0.0000000 0.5000052 0.2793703), wk = 0.0021186 k( 120) = ( 0.0000000 0.5000052 0.2920690), wk = 0.0021186 k( 121) = ( 0.0000000 0.5000052 0.3047676), wk = 0.0021186 k( 122) = ( 0.0000000 0.5000052 0.3174663), wk = 0.0021186 k( 123) = ( 0.0000000 0.5000052 0.3301650), wk = 0.0021186 k( 124) = ( 0.0000000 0.5000052 0.3428636), wk = 0.0021186 k( 125) = ( 0.0000000 0.5000052 0.3555623), wk = 0.0021186 k( 126) = ( 0.0000000 0.5000052 0.3682609), wk = 0.0021186 k( 127) = ( 0.0000000 0.5000052 0.3809596), wk = 0.0021186 k( 128) = ( 0.0000000 0.5000052 0.3936582), wk = 0.0021186 k( 129) = ( 0.0000000 0.5000052 0.4063569), wk = 0.0021186 k( 130) = ( 0.0000000 0.5000052 0.4190555), wk = 0.0021186 k( 131) = ( 0.0000000 0.5000052 0.4317542), wk = 0.0021186 k( 132) = ( 0.0000000 0.5000052 0.4444528), wk = 0.0021186 k( 133) = ( 0.0000000 0.5000052 0.4571515), wk = 0.0021186 k( 134) = ( 0.0000000 0.5000052 0.4698501), wk = 0.0021186 k( 135) = ( 0.0000000 0.5000052 0.4825488), wk = 0.0021186 k( 136) = ( 0.0000000 0.5000052 0.4952474), wk = 0.0021186 k( 137) = ( 0.0000000 0.5000052 0.5079461), wk = 0.0021186 k( 138) = ( 0.0000000 0.5000052 0.5079461), wk = 0.0021186 k( 139) = ( 0.0127622 0.5000052 0.5079461), wk = 0.0021186 k( 140) = ( 0.0255244 0.5000052 0.5079461), wk = 0.0021186 k( 141) = ( 0.0382865 0.5000052 0.5079461), wk = 0.0021186 k( 142) = ( 0.0510487 0.5000052 0.5079461), wk = 0.0021186 k( 143) = ( 0.0638109 0.5000052 0.5079461), wk = 0.0021186 k( 144) = ( 0.0765730 0.5000052 0.5079461), wk = 0.0021186 k( 145) = ( 0.0893352 0.5000052 0.5079461), wk = 0.0021186 k( 146) = ( 0.1020974 0.5000052 0.5079461), wk = 0.0021186 k( 147) = ( 0.1148596 0.5000052 0.5079461), wk = 0.0021186 k( 148) = ( 0.1276217 0.5000052 0.5079461), wk = 0.0021186 k( 149) = ( 0.1403839 0.5000052 0.5079461), wk = 0.0021186 k( 150) = ( 0.1531461 0.5000052 0.5079461), wk = 0.0021186 k( 151) = ( 0.1659083 0.5000052 0.5079461), wk = 0.0021186 k( 152) = ( 0.1786704 0.5000052 0.5079461), wk = 0.0021186 k( 153) = ( 0.1914326 0.5000052 0.5079461), wk = 0.0021186 k( 154) = ( 0.2041948 0.5000052 0.5079461), wk = 0.0021186 k( 155) = ( 0.2169569 0.5000052 0.5079461), wk = 0.0021186 k( 156) = ( 0.2297191 0.5000052 0.5079461), wk = 0.0021186 k( 157) = ( 0.2424813 0.5000052 0.5079461), wk = 0.0021186 k( 158) = ( 0.2552435 0.5000052 0.5079461), wk = 0.0021186 k( 159) = ( 0.2680056 0.5000052 0.5079461), wk = 0.0021186 k( 160) = ( 0.2807678 0.5000052 0.5079461), wk = 0.0021186 k( 161) = ( 0.2935300 0.5000052 0.5079461), wk = 0.0021186 k( 162) = ( 0.3062921 0.5000052 0.5079461), wk = 0.0021186 k( 163) = ( 0.3190543 0.5000052 0.5079461), wk = 0.0021186 k( 164) = ( 0.3318165 0.5000052 0.5079461), wk = 0.0021186 k( 165) = ( 0.3445787 0.5000052 0.5079461), wk = 0.0021186 k( 166) = ( 0.3573408 0.5000052 0.5079461), wk = 0.0021186 k( 167) = ( 0.3701030 0.5000052 0.5079461), wk = 0.0021186 k( 168) = ( 0.3828652 0.5000052 0.5079461), wk = 0.0021186 k( 169) = ( 0.3956274 0.5000052 0.5079461), wk = 0.0021186 k( 170) = ( 0.4083895 0.5000052 0.5079461), wk = 0.0021186 k( 171) = ( 0.4211517 0.5000052 0.5079461), wk = 0.0021186 k( 172) = ( 0.4339139 0.5000052 0.5079461), wk = 0.0021186 k( 173) = ( 0.4466761 0.5000052 0.5079461), wk = 0.0021186 k( 174) = ( 0.4594382 0.5000052 0.5079461), wk = 0.0021186 k( 175) = ( 0.4722004 0.5000052 0.5079461), wk = 0.0021186 k( 176) = ( 0.4849626 0.5000052 0.5079461), wk = 0.0021186 k( 177) = ( 0.4977247 0.5000052 0.5079461), wk = 0.0021186 k( 178) = ( 0.4977247 0.5000052 0.5079461), wk = 0.0021186 k( 179) = ( 0.4886752 0.4909142 0.5079461), wk = 0.0021186 k( 180) = ( 0.4796257 0.4818232 0.5079461), wk = 0.0021186 k( 181) = ( 0.4705761 0.4727322 0.5079461), wk = 0.0021186 k( 182) = ( 0.4615266 0.4636412 0.5079461), wk = 0.0021186 k( 183) = ( 0.4524770 0.4545502 0.5079461), wk = 0.0021186 k( 184) = ( 0.4434275 0.4454592 0.5079461), wk = 0.0021186 k( 185) = ( 0.4343780 0.4363682 0.5079461), wk = 0.0021186 k( 186) = ( 0.4253284 0.4272772 0.5079461), wk = 0.0021186 k( 187) = ( 0.4162789 0.4181862 0.5079461), wk = 0.0021186 k( 188) = ( 0.4072293 0.4090952 0.5079461), wk = 0.0021186 k( 189) = ( 0.3981798 0.4000042 0.5079461), wk = 0.0021186 k( 190) = ( 0.3891303 0.3909132 0.5079461), wk = 0.0021186 k( 191) = ( 0.3800807 0.3818222 0.5079461), wk = 0.0021186 k( 192) = ( 0.3710312 0.3727312 0.5079461), wk = 0.0021186 k( 193) = ( 0.3619816 0.3636402 0.5079461), wk = 0.0021186 k( 194) = ( 0.3529321 0.3545492 0.5079461), wk = 0.0021186 k( 195) = ( 0.3438826 0.3454582 0.5079461), wk = 0.0021186 k( 196) = ( 0.3348330 0.3363671 0.5079461), wk = 0.0021186 k( 197) = ( 0.3257835 0.3272761 0.5079461), wk = 0.0021186 k( 198) = ( 0.3167339 0.3181851 0.5079461), wk = 0.0021186 k( 199) = ( 0.3076844 0.3090941 0.5079461), wk = 0.0021186 k( 200) = ( 0.2986349 0.3000031 0.5079461), wk = 0.0021186 k( 201) = ( 0.2895853 0.2909121 0.5079461), wk = 0.0021186 k( 202) = ( 0.2805358 0.2818211 0.5079461), wk = 0.0021186 k( 203) = ( 0.2714862 0.2727301 0.5079461), wk = 0.0021186 k( 204) = ( 0.2624367 0.2636391 0.5079461), wk = 0.0021186 k( 205) = ( 0.2533871 0.2545481 0.5079461), wk = 0.0021186 k( 206) = ( 0.2443376 0.2454571 0.5079461), wk = 0.0021186 k( 207) = ( 0.2352881 0.2363661 0.5079461), wk = 0.0021186 k( 208) = ( 0.2262385 0.2272751 0.5079461), wk = 0.0021186 k( 209) = ( 0.2171890 0.2181841 0.5079461), wk = 0.0021186 k( 210) = ( 0.2081394 0.2090931 0.5079461), wk = 0.0021186 k( 211) = ( 0.1990899 0.2000021 0.5079461), wk = 0.0021186 k( 212) = ( 0.1900404 0.1909111 0.5079461), wk = 0.0021186 k( 213) = ( 0.1809908 0.1818201 0.5079461), wk = 0.0021186 k( 214) = ( 0.1719413 0.1727291 0.5079461), wk = 0.0021186 k( 215) = ( 0.1628917 0.1636381 0.5079461), wk = 0.0021186 k( 216) = ( 0.1538422 0.1545471 0.5079461), wk = 0.0021186 k( 217) = ( 0.1447926 0.1454561 0.5079461), wk = 0.0021186 k( 218) = ( 0.1357431 0.1363651 0.5079461), wk = 0.0021186 k( 219) = ( 0.1266936 0.1272741 0.5079461), wk = 0.0021186 k( 220) = ( 0.1176440 0.1181831 0.5079461), wk = 0.0021186 k( 221) = ( 0.1085945 0.1090920 0.5079461), wk = 0.0021186 k( 222) = ( 0.0995449 0.1000010 0.5079461), wk = 0.0021186 k( 223) = ( 0.0904954 0.0909100 0.5079461), wk = 0.0021186 k( 224) = ( 0.0814459 0.0818190 0.5079461), wk = 0.0021186 k( 225) = ( 0.0723963 0.0727280 0.5079461), wk = 0.0021186 k( 226) = ( 0.0633468 0.0636370 0.5079461), wk = 0.0021186 k( 227) = ( 0.0542972 0.0545460 0.5079461), wk = 0.0021186 k( 228) = ( 0.0452477 0.0454550 0.5079461), wk = 0.0021186 k( 229) = ( 0.0361982 0.0363640 0.5079461), wk = 0.0021186 k( 230) = ( 0.0271486 0.0272730 0.5079461), wk = 0.0021186 k( 231) = ( 0.0180991 0.0181820 0.5079461), wk = 0.0021186 k( 232) = ( 0.0090495 0.0090910 0.5079461), wk = 0.0021186 k( 233) = ( 0.0000000 0.0000000 0.5079461), wk = 0.0021186 k( 234) = ( 0.0000000 0.0000000 0.5079461), wk = 0.0021186 k( 235) = ( 0.0000000 0.0000000 0.4952474), wk = 0.0021186 k( 236) = ( 0.0000000 0.0000000 0.4825488), wk = 0.0021186 k( 237) = ( 0.0000000 0.0000000 0.4698501), wk = 0.0021186 k( 238) = ( 0.0000000 0.0000000 0.4571515), wk = 0.0021186 k( 239) = ( 0.0000000 0.0000000 0.4444528), wk = 0.0021186 k( 240) = ( 0.0000000 0.0000000 0.4317542), wk = 0.0021186 k( 241) = ( 0.0000000 0.0000000 0.4190555), wk = 0.0021186 k( 242) = ( 0.0000000 0.0000000 0.4063569), wk = 0.0021186 k( 243) = ( 0.0000000 0.0000000 0.3936582), wk = 0.0021186 k( 244) = ( 0.0000000 0.0000000 0.3809596), wk = 0.0021186 k( 245) = ( 0.0000000 0.0000000 0.3682609), wk = 0.0021186 k( 246) = ( 0.0000000 0.0000000 0.3555623), wk = 0.0021186 k( 247) = ( 0.0000000 0.0000000 0.3428636), wk = 0.0021186 k( 248) = ( 0.0000000 0.0000000 0.3301650), wk = 0.0021186 k( 249) = ( 0.0000000 0.0000000 0.3174663), wk = 0.0021186 k( 250) = ( 0.0000000 0.0000000 0.3047676), wk = 0.0021186 k( 251) = ( 0.0000000 0.0000000 0.2920690), wk = 0.0021186 k( 252) = ( 0.0000000 0.0000000 0.2793703), wk = 0.0021186 k( 253) = ( 0.0000000 0.0000000 0.2666717), wk = 0.0021186 k( 254) = ( 0.0000000 0.0000000 0.2539730), wk = 0.0021186 k( 255) = ( 0.0000000 0.0000000 0.2412744), wk = 0.0021186 k( 256) = ( 0.0000000 0.0000000 0.2285757), wk = 0.0021186 k( 257) = ( 0.0000000 0.0000000 0.2158771), wk = 0.0021186 k( 258) = ( 0.0000000 0.0000000 0.2031784), wk = 0.0021186 k( 259) = ( 0.0000000 0.0000000 0.1904798), wk = 0.0021186 k( 260) = ( 0.0000000 0.0000000 0.1777811), wk = 0.0021186 k( 261) = ( 0.0000000 0.0000000 0.1650825), wk = 0.0021186 k( 262) = ( 0.0000000 0.0000000 0.1523838), wk = 0.0021186 k( 263) = ( 0.0000000 0.0000000 0.1396852), wk = 0.0021186 k( 264) = ( 0.0000000 0.0000000 0.1269865), wk = 0.0021186 k( 265) = ( 0.0000000 0.0000000 0.1142879), wk = 0.0021186 k( 266) = ( 0.0000000 0.0000000 0.1015892), wk = 0.0021186 k( 267) = ( 0.0000000 0.0000000 0.0888906), wk = 0.0021186 k( 268) = ( 0.0000000 0.0000000 0.0761919), wk = 0.0021186 k( 269) = ( 0.0000000 0.0000000 0.0634933), wk = 0.0021186 k( 270) = ( 0.0000000 0.0000000 0.0507946), wk = 0.0021186 k( 271) = ( 0.0000000 0.0000000 0.0380960), wk = 0.0021186 k( 272) = ( 0.0000000 0.0000000 0.0253973), wk = 0.0021186 k( 273) = ( 0.0000000 0.0000000 0.0126987), wk = 0.0021186 k( 274) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 275) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 276) = ( -0.0090909 0.0090494 0.0000000), wk = 0.0021186 k( 277) = ( -0.0181818 0.0180989 0.0000000), wk = 0.0021186 k( 278) = ( -0.0272727 0.0271483 0.0000000), wk = 0.0021186 k( 279) = ( -0.0363636 0.0361978 0.0000000), wk = 0.0021186 k( 280) = ( -0.0454546 0.0452472 0.0000000), wk = 0.0021186 k( 281) = ( -0.0545455 0.0542967 0.0000000), wk = 0.0021186 k( 282) = ( -0.0636364 0.0633461 0.0000000), wk = 0.0021186 k( 283) = ( -0.0727273 0.0723956 0.0000000), wk = 0.0021186 k( 284) = ( -0.0818182 0.0814450 0.0000000), wk = 0.0021186 k( 285) = ( -0.0909091 0.0904945 0.0000000), wk = 0.0021186 k( 286) = ( -0.1000000 0.0995439 0.0000000), wk = 0.0021186 k( 287) = ( -0.1090909 0.1085934 0.0000000), wk = 0.0021186 k( 288) = ( -0.1181818 0.1176428 0.0000000), wk = 0.0021186 k( 289) = ( -0.1272727 0.1266923 0.0000000), wk = 0.0021186 k( 290) = ( -0.1363636 0.1357417 0.0000000), wk = 0.0021186 k( 291) = ( -0.1454545 0.1447911 0.0000000), wk = 0.0021186 k( 292) = ( -0.1545455 0.1538406 0.0000000), wk = 0.0021186 k( 293) = ( -0.1636364 0.1628900 0.0000000), wk = 0.0021186 k( 294) = ( -0.1727273 0.1719395 0.0000000), wk = 0.0021186 k( 295) = ( -0.1818182 0.1809889 0.0000000), wk = 0.0021186 k( 296) = ( -0.1909091 0.1900384 0.0000000), wk = 0.0021186 k( 297) = ( -0.2000000 0.1990878 0.0000000), wk = 0.0021186 k( 298) = ( -0.2090909 0.2081373 0.0000000), wk = 0.0021186 k( 299) = ( -0.2181818 0.2171867 0.0000000), wk = 0.0021186 k( 300) = ( -0.2272727 0.2262362 0.0000000), wk = 0.0021186 k( 301) = ( -0.2363636 0.2352856 0.0000000), wk = 0.0021186 k( 302) = ( -0.2454545 0.2443351 0.0000000), wk = 0.0021186 k( 303) = ( -0.2545455 0.2533845 0.0000000), wk = 0.0021186 k( 304) = ( -0.2636364 0.2624339 0.0000000), wk = 0.0021186 k( 305) = ( -0.2727273 0.2714834 0.0000000), wk = 0.0021186 k( 306) = ( -0.2818182 0.2805328 0.0000000), wk = 0.0021186 k( 307) = ( -0.2909091 0.2895823 0.0000000), wk = 0.0021186 k( 308) = ( -0.3000000 0.2986317 0.0000000), wk = 0.0021186 k( 309) = ( -0.3090909 0.3076812 0.0000000), wk = 0.0021186 k( 310) = ( -0.3181818 0.3167306 0.0000000), wk = 0.0021186 k( 311) = ( -0.3272727 0.3257801 0.0000000), wk = 0.0021186 k( 312) = ( -0.3363636 0.3348295 0.0000000), wk = 0.0021186 k( 313) = ( -0.3454546 0.3438790 0.0000000), wk = 0.0021186 k( 314) = ( -0.3545454 0.3529284 0.0000000), wk = 0.0021186 k( 315) = ( -0.3636364 0.3619778 0.0000000), wk = 0.0021186 k( 316) = ( -0.3727273 0.3710273 0.0000000), wk = 0.0021186 k( 317) = ( -0.3818182 0.3800767 0.0000000), wk = 0.0021186 k( 318) = ( -0.3909091 0.3891262 0.0000000), wk = 0.0021186 k( 319) = ( -0.4000000 0.3981756 0.0000000), wk = 0.0021186 k( 320) = ( -0.4090909 0.4072251 0.0000000), wk = 0.0021186 k( 321) = ( -0.4181818 0.4162745 0.0000000), wk = 0.0021186 k( 322) = ( -0.4272727 0.4253240 0.0000000), wk = 0.0021186 k( 323) = ( -0.4363636 0.4343734 0.0000000), wk = 0.0021186 k( 324) = ( -0.4454546 0.4434229 0.0000000), wk = 0.0021186 k( 325) = ( -0.4545455 0.4524723 0.0000000), wk = 0.0021186 k( 326) = ( -0.4636364 0.4615218 0.0000000), wk = 0.0021186 k( 327) = ( -0.4727273 0.4705712 0.0000000), wk = 0.0021186 k( 328) = ( -0.4818182 0.4796207 0.0000000), wk = 0.0021186 k( 329) = ( -0.4909091 0.4886701 0.0000000), wk = 0.0021186 k( 330) = ( -0.5000000 0.4977195 0.0000000), wk = 0.0021186 k( 331) = ( -0.5000000 0.4977195 0.0000000), wk = 0.0021186 k( 332) = ( -0.4977247 0.5000052 -0.0000000), wk = 0.0021186 k( 333) = ( -0.4977247 0.5000052 -0.0000000), wk = 0.0021186 k( 334) = ( -0.4977247 0.5000052 0.0126987), wk = 0.0021186 k( 335) = ( -0.4977247 0.5000052 0.0253973), wk = 0.0021186 k( 336) = ( -0.4977247 0.5000052 0.0380960), wk = 0.0021186 k( 337) = ( -0.4977247 0.5000052 0.0507946), wk = 0.0021186 k( 338) = ( -0.4977247 0.5000052 0.0634933), wk = 0.0021186 k( 339) = ( -0.4977247 0.5000052 0.0761919), wk = 0.0021186 k( 340) = ( -0.4977247 0.5000052 0.0888906), wk = 0.0021186 k( 341) = ( -0.4977247 0.5000052 0.1015892), wk = 0.0021186 k( 342) = ( -0.4977247 0.5000052 0.1142879), wk = 0.0021186 k( 343) = ( -0.4977247 0.5000052 0.1269865), wk = 0.0021186 k( 344) = ( -0.4977247 0.5000052 0.1396852), wk = 0.0021186 k( 345) = ( -0.4977247 0.5000052 0.1523838), wk = 0.0021186 k( 346) = ( -0.4977247 0.5000052 0.1650825), wk = 0.0021186 k( 347) = ( -0.4977247 0.5000052 0.1777811), wk = 0.0021186 k( 348) = ( -0.4977247 0.5000052 0.1904798), wk = 0.0021186 k( 349) = ( -0.4977247 0.5000052 0.2031784), wk = 0.0021186 k( 350) = ( -0.4977247 0.5000052 0.2158771), wk = 0.0021186 k( 351) = ( -0.4977247 0.5000052 0.2285757), wk = 0.0021186 k( 352) = ( -0.4977247 0.5000052 0.2412744), wk = 0.0021186 k( 353) = ( -0.4977247 0.5000052 0.2539730), wk = 0.0021186 k( 354) = ( -0.4977247 0.5000052 0.2666717), wk = 0.0021186 k( 355) = ( -0.4977247 0.5000052 0.2793703), wk = 0.0021186 k( 356) = ( -0.4977247 0.5000052 0.2920690), wk = 0.0021186 k( 357) = ( -0.4977247 0.5000052 0.3047676), wk = 0.0021186 k( 358) = ( -0.4977247 0.5000052 0.3174663), wk = 0.0021186 k( 359) = ( -0.4977247 0.5000052 0.3301650), wk = 0.0021186 k( 360) = ( -0.4977247 0.5000052 0.3428636), wk = 0.0021186 k( 361) = ( -0.4977247 0.5000052 0.3555623), wk = 0.0021186 k( 362) = ( -0.4977247 0.5000052 0.3682609), wk = 0.0021186 k( 363) = ( -0.4977247 0.5000052 0.3809596), wk = 0.0021186 k( 364) = ( -0.4977247 0.5000052 0.3936582), wk = 0.0021186 k( 365) = ( -0.4977247 0.5000052 0.4063569), wk = 0.0021186 k( 366) = ( -0.4977247 0.5000052 0.4190555), wk = 0.0021186 k( 367) = ( -0.4977247 0.5000052 0.4317542), wk = 0.0021186 k( 368) = ( -0.4977247 0.5000052 0.4444528), wk = 0.0021186 k( 369) = ( -0.4977247 0.5000052 0.4571515), wk = 0.0021186 k( 370) = ( -0.4977247 0.5000052 0.4698501), wk = 0.0021186 k( 371) = ( -0.4977247 0.5000052 0.4825488), wk = 0.0021186 k( 372) = ( -0.4977247 0.5000052 0.4952474), wk = 0.0021186 k( 373) = ( -0.4977247 0.5000052 0.5079461), wk = 0.0021186 k( 374) = ( -0.4977247 0.5000052 0.5079461), wk = 0.0021186 k( 375) = ( -0.5000000 0.4977195 0.5079461), wk = 0.0021186 k( 376) = ( -0.5000000 0.4977195 0.5079461), wk = 0.0021186 k( 377) = ( -0.5000000 0.4977195 0.4952474), wk = 0.0021186 k( 378) = ( -0.5000000 0.4977195 0.4825488), wk = 0.0021186 k( 379) = ( -0.5000000 0.4977195 0.4698501), wk = 0.0021186 k( 380) = ( -0.5000000 0.4977195 0.4571515), wk = 0.0021186 k( 381) = ( -0.5000000 0.4977195 0.4444528), wk = 0.0021186 k( 382) = ( -0.5000000 0.4977195 0.4317542), wk = 0.0021186 k( 383) = ( -0.5000000 0.4977195 0.4190555), wk = 0.0021186 k( 384) = ( -0.5000000 0.4977195 0.4063569), wk = 0.0021186 k( 385) = ( -0.5000000 0.4977195 0.3936582), wk = 0.0021186 k( 386) = ( -0.5000000 0.4977195 0.3809596), wk = 0.0021186 k( 387) = ( -0.5000000 0.4977195 0.3682609), wk = 0.0021186 k( 388) = ( -0.5000000 0.4977195 0.3555623), wk = 0.0021186 k( 389) = ( -0.5000000 0.4977195 0.3428636), wk = 0.0021186 k( 390) = ( -0.5000000 0.4977195 0.3301650), wk = 0.0021186 k( 391) = ( -0.5000000 0.4977195 0.3174663), wk = 0.0021186 k( 392) = ( -0.5000000 0.4977195 0.3047676), wk = 0.0021186 k( 393) = ( -0.5000000 0.4977195 0.2920690), wk = 0.0021186 k( 394) = ( -0.5000000 0.4977195 0.2793703), wk = 0.0021186 k( 395) = ( -0.5000000 0.4977195 0.2666717), wk = 0.0021186 k( 396) = ( -0.5000000 0.4977195 0.2539730), wk = 0.0021186 k( 397) = ( -0.5000000 0.4977195 0.2412744), wk = 0.0021186 k( 398) = ( -0.5000000 0.4977195 0.2285757), wk = 0.0021186 k( 399) = ( -0.5000000 0.4977195 0.2158771), wk = 0.0021186 k( 400) = ( -0.5000000 0.4977195 0.2031784), wk = 0.0021186 k( 401) = ( -0.5000000 0.4977195 0.1904798), wk = 0.0021186 k( 402) = ( -0.5000000 0.4977195 0.1777811), wk = 0.0021186 k( 403) = ( -0.5000000 0.4977195 0.1650825), wk = 0.0021186 k( 404) = ( -0.5000000 0.4977195 0.1523838), wk = 0.0021186 k( 405) = ( -0.5000000 0.4977195 0.1396852), wk = 0.0021186 k( 406) = ( -0.5000000 0.4977195 0.1269865), wk = 0.0021186 k( 407) = ( -0.5000000 0.4977195 0.1142879), wk = 0.0021186 k( 408) = ( -0.5000000 0.4977195 0.1015892), wk = 0.0021186 k( 409) = ( -0.5000000 0.4977195 0.0888906), wk = 0.0021186 k( 410) = ( -0.5000000 0.4977195 0.0761919), wk = 0.0021186 k( 411) = ( -0.5000000 0.4977195 0.0634933), wk = 0.0021186 k( 412) = ( -0.5000000 0.4977195 0.0507946), wk = 0.0021186 k( 413) = ( -0.5000000 0.4977195 0.0380960), wk = 0.0021186 k( 414) = ( -0.5000000 0.4977195 0.0253973), wk = 0.0021186 k( 415) = ( -0.5000000 0.4977195 0.0126987), wk = 0.0021186 k( 416) = ( -0.5000000 0.4977195 0.0000000), wk = 0.0021186 k( 417) = ( 0.0000000 0.0000000 0.5079461), wk = 0.0021186 k( 418) = ( -0.0090909 0.0090494 0.5079461), wk = 0.0021186 k( 419) = ( -0.0181818 0.0180989 0.5079461), wk = 0.0021186 k( 420) = ( -0.0272727 0.0271483 0.5079461), wk = 0.0021186 k( 421) = ( -0.0363636 0.0361978 0.5079461), wk = 0.0021186 k( 422) = ( -0.0454546 0.0452472 0.5079461), wk = 0.0021186 k( 423) = ( -0.0545455 0.0542967 0.5079461), wk = 0.0021186 k( 424) = ( -0.0636364 0.0633461 0.5079461), wk = 0.0021186 k( 425) = ( -0.0727273 0.0723956 0.5079461), wk = 0.0021186 k( 426) = ( -0.0818182 0.0814450 0.5079461), wk = 0.0021186 k( 427) = ( -0.0909091 0.0904945 0.5079461), wk = 0.0021186 k( 428) = ( -0.1000000 0.0995439 0.5079461), wk = 0.0021186 k( 429) = ( -0.1090909 0.1085934 0.5079461), wk = 0.0021186 k( 430) = ( -0.1181818 0.1176428 0.5079461), wk = 0.0021186 k( 431) = ( -0.1272727 0.1266923 0.5079461), wk = 0.0021186 k( 432) = ( -0.1363636 0.1357417 0.5079461), wk = 0.0021186 k( 433) = ( -0.1454545 0.1447911 0.5079461), wk = 0.0021186 k( 434) = ( -0.1545455 0.1538406 0.5079461), wk = 0.0021186 k( 435) = ( -0.1636364 0.1628900 0.5079461), wk = 0.0021186 k( 436) = ( -0.1727273 0.1719395 0.5079461), wk = 0.0021186 k( 437) = ( -0.1818182 0.1809889 0.5079461), wk = 0.0021186 k( 438) = ( -0.1909091 0.1900384 0.5079461), wk = 0.0021186 k( 439) = ( -0.2000000 0.1990878 0.5079461), wk = 0.0021186 k( 440) = ( -0.2090909 0.2081373 0.5079461), wk = 0.0021186 k( 441) = ( -0.2181818 0.2171867 0.5079461), wk = 0.0021186 k( 442) = ( -0.2272727 0.2262362 0.5079461), wk = 0.0021186 k( 443) = ( -0.2363636 0.2352856 0.5079461), wk = 0.0021186 k( 444) = ( -0.2454545 0.2443351 0.5079461), wk = 0.0021186 k( 445) = ( -0.2545455 0.2533845 0.5079461), wk = 0.0021186 k( 446) = ( -0.2636364 0.2624339 0.5079461), wk = 0.0021186 k( 447) = ( -0.2727273 0.2714834 0.5079461), wk = 0.0021186 k( 448) = ( -0.2818182 0.2805328 0.5079461), wk = 0.0021186 k( 449) = ( -0.2909091 0.2895823 0.5079461), wk = 0.0021186 k( 450) = ( -0.3000000 0.2986317 0.5079461), wk = 0.0021186 k( 451) = ( -0.3090909 0.3076812 0.5079461), wk = 0.0021186 k( 452) = ( -0.3181818 0.3167306 0.5079461), wk = 0.0021186 k( 453) = ( -0.3272727 0.3257801 0.5079461), wk = 0.0021186 k( 454) = ( -0.3363636 0.3348295 0.5079461), wk = 0.0021186 k( 455) = ( -0.3454546 0.3438790 0.5079461), wk = 0.0021186 k( 456) = ( -0.3545454 0.3529284 0.5079461), wk = 0.0021186 k( 457) = ( -0.3636364 0.3619778 0.5079461), wk = 0.0021186 k( 458) = ( -0.3727273 0.3710273 0.5079461), wk = 0.0021186 k( 459) = ( -0.3818182 0.3800767 0.5079461), wk = 0.0021186 k( 460) = ( -0.3909091 0.3891262 0.5079461), wk = 0.0021186 k( 461) = ( -0.4000000 0.3981756 0.5079461), wk = 0.0021186 k( 462) = ( -0.4090909 0.4072251 0.5079461), wk = 0.0021186 k( 463) = ( -0.4181818 0.4162745 0.5079461), wk = 0.0021186 k( 464) = ( -0.4272727 0.4253240 0.5079461), wk = 0.0021186 k( 465) = ( -0.4363636 0.4343734 0.5079461), wk = 0.0021186 k( 466) = ( -0.4454546 0.4434229 0.5079461), wk = 0.0021186 k( 467) = ( -0.4545455 0.4524723 0.5079461), wk = 0.0021186 k( 468) = ( -0.4636364 0.4615218 0.5079461), wk = 0.0021186 k( 469) = ( -0.4727273 0.4705712 0.5079461), wk = 0.0021186 k( 470) = ( -0.4818182 0.4796207 0.5079461), wk = 0.0021186 k( 471) = ( -0.4909091 0.4886701 0.5079461), wk = 0.0021186 k( 472) = ( -0.5000000 0.4977195 0.5079461), wk = 0.0021186 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 2) = ( 0.0090495 0.0090495 0.0000000), wk = 0.0021186 k( 3) = ( 0.0180991 0.0180991 0.0000000), wk = 0.0021186 k( 4) = ( 0.0271486 0.0271486 0.0000000), wk = 0.0021186 k( 5) = ( 0.0361982 0.0361982 0.0000000), wk = 0.0021186 k( 6) = ( 0.0452477 0.0452477 0.0000000), wk = 0.0021186 k( 7) = ( 0.0542972 0.0542973 0.0000000), wk = 0.0021186 k( 8) = ( 0.0633468 0.0633468 0.0000000), wk = 0.0021186 k( 9) = ( 0.0723963 0.0723963 0.0000000), wk = 0.0021186 k( 10) = ( 0.0814459 0.0814459 0.0000000), wk = 0.0021186 k( 11) = ( 0.0904954 0.0904954 -0.0000000), wk = 0.0021186 k( 12) = ( 0.0995449 0.0995449 0.0000000), wk = 0.0021186 k( 13) = ( 0.1085945 0.1085945 0.0000000), wk = 0.0021186 k( 14) = ( 0.1176440 0.1176440 0.0000000), wk = 0.0021186 k( 15) = ( 0.1266936 0.1266936 0.0000000), wk = 0.0021186 k( 16) = ( 0.1357431 0.1357431 0.0000000), wk = 0.0021186 k( 17) = ( 0.1447926 0.1447926 0.0000000), wk = 0.0021186 k( 18) = ( 0.1538422 0.1538422 0.0000000), wk = 0.0021186 k( 19) = ( 0.1628917 0.1628917 0.0000000), wk = 0.0021186 k( 20) = ( 0.1719413 0.1719413 -0.0000000), wk = 0.0021186 k( 21) = ( 0.1809908 0.1809908 -0.0000000), wk = 0.0021186 k( 22) = ( 0.1900404 0.1900404 0.0000000), wk = 0.0021186 k( 23) = ( 0.1990899 0.1990899 0.0000000), wk = 0.0021186 k( 24) = ( 0.2081394 0.2081394 0.0000000), wk = 0.0021186 k( 25) = ( 0.2171890 0.2171890 0.0000000), wk = 0.0021186 k( 26) = ( 0.2262385 0.2262385 0.0000000), wk = 0.0021186 k( 27) = ( 0.2352881 0.2352881 0.0000000), wk = 0.0021186 k( 28) = ( 0.2443376 0.2443376 0.0000000), wk = 0.0021186 k( 29) = ( 0.2533871 0.2533871 0.0000000), wk = 0.0021186 k( 30) = ( 0.2624367 0.2624367 0.0000000), wk = 0.0021186 k( 31) = ( 0.2714862 0.2714862 0.0000000), wk = 0.0021186 k( 32) = ( 0.2805358 0.2805358 0.0000000), wk = 0.0021186 k( 33) = ( 0.2895853 0.2895853 0.0000000), wk = 0.0021186 k( 34) = ( 0.2986349 0.2986349 0.0000000), wk = 0.0021186 k( 35) = ( 0.3076844 0.3076844 0.0000000), wk = 0.0021186 k( 36) = ( 0.3167339 0.3167339 0.0000000), wk = 0.0021186 k( 37) = ( 0.3257835 0.3257835 0.0000000), wk = 0.0021186 k( 38) = ( 0.3348330 0.3348330 0.0000000), wk = 0.0021186 k( 39) = ( 0.3438826 0.3438826 0.0000000), wk = 0.0021186 k( 40) = ( 0.3529321 0.3529321 -0.0000000), wk = 0.0021186 k( 41) = ( 0.3619816 0.3619816 -0.0000000), wk = 0.0021186 k( 42) = ( 0.3710312 0.3710312 0.0000000), wk = 0.0021186 k( 43) = ( 0.3800807 0.3800807 0.0000000), wk = 0.0021186 k( 44) = ( 0.3891303 0.3891303 -0.0000000), wk = 0.0021186 k( 45) = ( 0.3981798 0.3981798 0.0000000), wk = 0.0021186 k( 46) = ( 0.4072293 0.4072293 0.0000000), wk = 0.0021186 k( 47) = ( 0.4162789 0.4162789 0.0000000), wk = 0.0021186 k( 48) = ( 0.4253284 0.4253284 0.0000000), wk = 0.0021186 k( 49) = ( 0.4343780 0.4343780 0.0000000), wk = 0.0021186 k( 50) = ( 0.4434275 0.4434275 0.0000000), wk = 0.0021186 k( 51) = ( 0.4524770 0.4524770 0.0000000), wk = 0.0021186 k( 52) = ( 0.4615266 0.4615266 0.0000000), wk = 0.0021186 k( 53) = ( 0.4705761 0.4705761 0.0000000), wk = 0.0021186 k( 54) = ( 0.4796257 0.4796257 0.0000000), wk = 0.0021186 k( 55) = ( 0.4886752 0.4886752 0.0000000), wk = 0.0021186 k( 56) = ( 0.4977247 0.4977248 0.0000000), wk = 0.0021186 k( 57) = ( 0.4977247 0.4977248 0.0000000), wk = 0.0021186 k( 58) = ( 0.4849626 0.4977831 0.0000000), wk = 0.0021186 k( 59) = ( 0.4722004 0.4978414 0.0000000), wk = 0.0021186 k( 60) = ( 0.4594382 0.4978998 0.0000000), wk = 0.0021186 k( 61) = ( 0.4466761 0.4979581 0.0000000), wk = 0.0021186 k( 62) = ( 0.4339139 0.4980165 0.0000000), wk = 0.0021186 k( 63) = ( 0.4211517 0.4980748 0.0000000), wk = 0.0021186 k( 64) = ( 0.4083895 0.4981331 0.0000000), wk = 0.0021186 k( 65) = ( 0.3956274 0.4981915 0.0000000), wk = 0.0021186 k( 66) = ( 0.3828652 0.4982498 0.0000000), wk = 0.0021186 k( 67) = ( 0.3701030 0.4983082 0.0000000), wk = 0.0021186 k( 68) = ( 0.3573408 0.4983665 0.0000000), wk = 0.0021186 k( 69) = ( 0.3445787 0.4984248 0.0000000), wk = 0.0021186 k( 70) = ( 0.3318165 0.4984832 0.0000000), wk = 0.0021186 k( 71) = ( 0.3190543 0.4985415 0.0000000), wk = 0.0021186 k( 72) = ( 0.3062921 0.4985999 0.0000000), wk = 0.0021186 k( 73) = ( 0.2935300 0.4986582 0.0000000), wk = 0.0021186 k( 74) = ( 0.2807678 0.4987165 0.0000000), wk = 0.0021186 k( 75) = ( 0.2680056 0.4987749 0.0000000), wk = 0.0021186 k( 76) = ( 0.2552435 0.4988332 0.0000000), wk = 0.0021186 k( 77) = ( 0.2424813 0.4988915 0.0000000), wk = 0.0021186 k( 78) = ( 0.2297191 0.4989499 0.0000000), wk = 0.0021186 k( 79) = ( 0.2169569 0.4990082 0.0000000), wk = 0.0021186 k( 80) = ( 0.2041948 0.4990666 0.0000000), wk = 0.0021186 k( 81) = ( 0.1914326 0.4991249 0.0000000), wk = 0.0021186 k( 82) = ( 0.1786704 0.4991832 -0.0000000), wk = 0.0021186 k( 83) = ( 0.1659083 0.4992416 0.0000000), wk = 0.0021186 k( 84) = ( 0.1531461 0.4992999 0.0000000), wk = 0.0021186 k( 85) = ( 0.1403839 0.4993583 0.0000000), wk = 0.0021186 k( 86) = ( 0.1276217 0.4994166 0.0000000), wk = 0.0021186 k( 87) = ( 0.1148596 0.4994749 0.0000000), wk = 0.0021186 k( 88) = ( 0.1020974 0.4995333 -0.0000000), wk = 0.0021186 k( 89) = ( 0.0893352 0.4995916 0.0000000), wk = 0.0021186 k( 90) = ( 0.0765730 0.4996500 0.0000000), wk = 0.0021186 k( 91) = ( 0.0638109 0.4997083 0.0000000), wk = 0.0021186 k( 92) = ( 0.0510487 0.4997666 0.0000000), wk = 0.0021186 k( 93) = ( 0.0382865 0.4998250 0.0000000), wk = 0.0021186 k( 94) = ( 0.0255244 0.4998833 0.0000000), wk = 0.0021186 k( 95) = ( 0.0127622 0.4999417 0.0000000), wk = 0.0021186 k( 96) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021186 k( 97) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021186 k( 98) = ( 0.0000000 0.5000000 0.0125000), wk = 0.0021186 k( 99) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0021186 k( 100) = ( 0.0000000 0.5000000 0.0375000), wk = 0.0021186 k( 101) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0021186 k( 102) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0021186 k( 103) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0021186 k( 104) = ( 0.0000000 0.5000000 0.0875000), wk = 0.0021186 k( 105) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0021186 k( 106) = ( 0.0000000 0.5000000 0.1125000), wk = 0.0021186 k( 107) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0021186 k( 108) = ( 0.0000000 0.5000000 0.1375000), wk = 0.0021186 k( 109) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0021186 k( 110) = ( 0.0000000 0.5000000 0.1625000), wk = 0.0021186 k( 111) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0021186 k( 112) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0021186 k( 113) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0021186 k( 114) = ( 0.0000000 0.5000000 0.2125000), wk = 0.0021186 k( 115) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0021186 k( 116) = ( 0.0000000 0.5000000 0.2375000), wk = 0.0021186 k( 117) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0021186 k( 118) = ( 0.0000000 0.5000000 0.2625000), wk = 0.0021186 k( 119) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0021186 k( 120) = ( 0.0000000 0.5000000 0.2875000), wk = 0.0021186 k( 121) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0021186 k( 122) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0021186 k( 123) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0021186 k( 124) = ( 0.0000000 0.5000000 0.3375000), wk = 0.0021186 k( 125) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0021186 k( 126) = ( 0.0000000 0.5000000 0.3625000), wk = 0.0021186 k( 127) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0021186 k( 128) = ( 0.0000000 0.5000000 0.3875000), wk = 0.0021186 k( 129) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0021186 k( 130) = ( 0.0000000 0.5000000 0.4125000), wk = 0.0021186 k( 131) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0021186 k( 132) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0021186 k( 133) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0021186 k( 134) = ( 0.0000000 0.5000000 0.4625000), wk = 0.0021186 k( 135) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0021186 k( 136) = ( 0.0000000 0.5000000 0.4875000), wk = 0.0021186 k( 137) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021186 k( 138) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021186 k( 139) = ( 0.0127622 0.4999417 0.5000000), wk = 0.0021186 k( 140) = ( 0.0255244 0.4998833 0.5000000), wk = 0.0021186 k( 141) = ( 0.0382865 0.4998250 0.5000000), wk = 0.0021186 k( 142) = ( 0.0510487 0.4997666 0.5000000), wk = 0.0021186 k( 143) = ( 0.0638109 0.4997083 0.5000000), wk = 0.0021186 k( 144) = ( 0.0765730 0.4996500 0.5000000), wk = 0.0021186 k( 145) = ( 0.0893352 0.4995916 0.5000000), wk = 0.0021186 k( 146) = ( 0.1020974 0.4995333 0.5000000), wk = 0.0021186 k( 147) = ( 0.1148596 0.4994749 0.5000000), wk = 0.0021186 k( 148) = ( 0.1276217 0.4994166 0.5000000), wk = 0.0021186 k( 149) = ( 0.1403839 0.4993583 0.5000000), wk = 0.0021186 k( 150) = ( 0.1531461 0.4992999 0.5000000), wk = 0.0021186 k( 151) = ( 0.1659083 0.4992416 0.5000000), wk = 0.0021186 k( 152) = ( 0.1786704 0.4991832 0.5000000), wk = 0.0021186 k( 153) = ( 0.1914326 0.4991249 0.5000000), wk = 0.0021186 k( 154) = ( 0.2041948 0.4990666 0.5000000), wk = 0.0021186 k( 155) = ( 0.2169569 0.4990082 0.5000000), wk = 0.0021186 k( 156) = ( 0.2297191 0.4989499 0.5000000), wk = 0.0021186 k( 157) = ( 0.2424813 0.4988915 0.5000000), wk = 0.0021186 k( 158) = ( 0.2552435 0.4988332 0.5000000), wk = 0.0021186 k( 159) = ( 0.2680056 0.4987749 0.5000000), wk = 0.0021186 k( 160) = ( 0.2807678 0.4987165 0.5000000), wk = 0.0021186 k( 161) = ( 0.2935300 0.4986582 0.5000000), wk = 0.0021186 k( 162) = ( 0.3062921 0.4985999 0.5000000), wk = 0.0021186 k( 163) = ( 0.3190543 0.4985415 0.5000000), wk = 0.0021186 k( 164) = ( 0.3318165 0.4984832 0.5000000), wk = 0.0021186 k( 165) = ( 0.3445787 0.4984248 0.5000000), wk = 0.0021186 k( 166) = ( 0.3573408 0.4983665 0.5000000), wk = 0.0021186 k( 167) = ( 0.3701030 0.4983082 0.5000000), wk = 0.0021186 k( 168) = ( 0.3828652 0.4982498 0.5000000), wk = 0.0021186 k( 169) = ( 0.3956274 0.4981915 0.5000000), wk = 0.0021186 k( 170) = ( 0.4083895 0.4981331 0.5000000), wk = 0.0021186 k( 171) = ( 0.4211517 0.4980748 0.5000000), wk = 0.0021186 k( 172) = ( 0.4339139 0.4980165 0.5000000), wk = 0.0021186 k( 173) = ( 0.4466761 0.4979581 0.5000000), wk = 0.0021186 k( 174) = ( 0.4594382 0.4978998 0.5000000), wk = 0.0021186 k( 175) = ( 0.4722004 0.4978414 0.5000000), wk = 0.0021186 k( 176) = ( 0.4849626 0.4977831 0.5000000), wk = 0.0021186 k( 177) = ( 0.4977247 0.4977248 0.5000000), wk = 0.0021186 k( 178) = ( 0.4977247 0.4977248 0.5000000), wk = 0.0021186 k( 179) = ( 0.4886752 0.4886752 0.5000000), wk = 0.0021186 k( 180) = ( 0.4796257 0.4796257 0.5000000), wk = 0.0021186 k( 181) = ( 0.4705761 0.4705761 0.5000000), wk = 0.0021186 k( 182) = ( 0.4615266 0.4615266 0.5000000), wk = 0.0021186 k( 183) = ( 0.4524770 0.4524770 0.5000000), wk = 0.0021186 k( 184) = ( 0.4434275 0.4434275 0.5000000), wk = 0.0021186 k( 185) = ( 0.4343780 0.4343780 0.5000000), wk = 0.0021186 k( 186) = ( 0.4253284 0.4253284 0.5000000), wk = 0.0021186 k( 187) = ( 0.4162789 0.4162789 0.5000000), wk = 0.0021186 k( 188) = ( 0.4072293 0.4072293 0.5000000), wk = 0.0021186 k( 189) = ( 0.3981798 0.3981798 0.5000000), wk = 0.0021186 k( 190) = ( 0.3891303 0.3891303 0.5000000), wk = 0.0021186 k( 191) = ( 0.3800807 0.3800807 0.5000000), wk = 0.0021186 k( 192) = ( 0.3710312 0.3710312 0.5000000), wk = 0.0021186 k( 193) = ( 0.3619816 0.3619816 0.5000000), wk = 0.0021186 k( 194) = ( 0.3529321 0.3529321 0.5000000), wk = 0.0021186 k( 195) = ( 0.3438826 0.3438826 0.5000000), wk = 0.0021186 k( 196) = ( 0.3348330 0.3348330 0.5000000), wk = 0.0021186 k( 197) = ( 0.3257835 0.3257835 0.5000000), wk = 0.0021186 k( 198) = ( 0.3167339 0.3167339 0.5000000), wk = 0.0021186 k( 199) = ( 0.3076844 0.3076844 0.5000000), wk = 0.0021186 k( 200) = ( 0.2986349 0.2986349 0.5000000), wk = 0.0021186 k( 201) = ( 0.2895853 0.2895853 0.5000000), wk = 0.0021186 k( 202) = ( 0.2805358 0.2805358 0.5000000), wk = 0.0021186 k( 203) = ( 0.2714862 0.2714862 0.5000000), wk = 0.0021186 k( 204) = ( 0.2624367 0.2624367 0.5000000), wk = 0.0021186 k( 205) = ( 0.2533871 0.2533871 0.5000000), wk = 0.0021186 k( 206) = ( 0.2443376 0.2443376 0.5000000), wk = 0.0021186 k( 207) = ( 0.2352881 0.2352881 0.5000000), wk = 0.0021186 k( 208) = ( 0.2262385 0.2262385 0.5000000), wk = 0.0021186 k( 209) = ( 0.2171890 0.2171890 0.5000000), wk = 0.0021186 k( 210) = ( 0.2081394 0.2081394 0.5000000), wk = 0.0021186 k( 211) = ( 0.1990899 0.1990899 0.5000000), wk = 0.0021186 k( 212) = ( 0.1900404 0.1900404 0.5000000), wk = 0.0021186 k( 213) = ( 0.1809908 0.1809908 0.5000000), wk = 0.0021186 k( 214) = ( 0.1719413 0.1719413 0.5000000), wk = 0.0021186 k( 215) = ( 0.1628917 0.1628917 0.5000000), wk = 0.0021186 k( 216) = ( 0.1538422 0.1538422 0.5000000), wk = 0.0021186 k( 217) = ( 0.1447926 0.1447926 0.5000000), wk = 0.0021186 k( 218) = ( 0.1357431 0.1357431 0.5000000), wk = 0.0021186 k( 219) = ( 0.1266936 0.1266936 0.5000000), wk = 0.0021186 k( 220) = ( 0.1176440 0.1176440 0.5000000), wk = 0.0021186 k( 221) = ( 0.1085945 0.1085945 0.5000000), wk = 0.0021186 k( 222) = ( 0.0995449 0.0995449 0.5000000), wk = 0.0021186 k( 223) = ( 0.0904954 0.0904954 0.5000000), wk = 0.0021186 k( 224) = ( 0.0814459 0.0814459 0.5000000), wk = 0.0021186 k( 225) = ( 0.0723963 0.0723963 0.5000000), wk = 0.0021186 k( 226) = ( 0.0633468 0.0633468 0.5000000), wk = 0.0021186 k( 227) = ( 0.0542972 0.0542973 0.5000000), wk = 0.0021186 k( 228) = ( 0.0452477 0.0452477 0.5000000), wk = 0.0021186 k( 229) = ( 0.0361982 0.0361982 0.5000000), wk = 0.0021186 k( 230) = ( 0.0271486 0.0271486 0.5000000), wk = 0.0021186 k( 231) = ( 0.0180991 0.0180991 0.5000000), wk = 0.0021186 k( 232) = ( 0.0090495 0.0090495 0.5000000), wk = 0.0021186 k( 233) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021186 k( 234) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021186 k( 235) = ( 0.0000000 0.0000000 0.4875000), wk = 0.0021186 k( 236) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0021186 k( 237) = ( 0.0000000 0.0000000 0.4625000), wk = 0.0021186 k( 238) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0021186 k( 239) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0021186 k( 240) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0021186 k( 241) = ( 0.0000000 0.0000000 0.4125000), wk = 0.0021186 k( 242) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0021186 k( 243) = ( 0.0000000 0.0000000 0.3875000), wk = 0.0021186 k( 244) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0021186 k( 245) = ( 0.0000000 0.0000000 0.3625000), wk = 0.0021186 k( 246) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0021186 k( 247) = ( 0.0000000 0.0000000 0.3375000), wk = 0.0021186 k( 248) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0021186 k( 249) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0021186 k( 250) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0021186 k( 251) = ( 0.0000000 0.0000000 0.2875000), wk = 0.0021186 k( 252) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0021186 k( 253) = ( 0.0000000 0.0000000 0.2625000), wk = 0.0021186 k( 254) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0021186 k( 255) = ( 0.0000000 0.0000000 0.2375000), wk = 0.0021186 k( 256) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0021186 k( 257) = ( 0.0000000 0.0000000 0.2125000), wk = 0.0021186 k( 258) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0021186 k( 259) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0021186 k( 260) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0021186 k( 261) = ( 0.0000000 0.0000000 0.1625000), wk = 0.0021186 k( 262) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0021186 k( 263) = ( 0.0000000 0.0000000 0.1375000), wk = 0.0021186 k( 264) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0021186 k( 265) = ( 0.0000000 0.0000000 0.1125000), wk = 0.0021186 k( 266) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0021186 k( 267) = ( 0.0000000 0.0000000 0.0875000), wk = 0.0021186 k( 268) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0021186 k( 269) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0021186 k( 270) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0021186 k( 271) = ( 0.0000000 0.0000000 0.0375000), wk = 0.0021186 k( 272) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0021186 k( 273) = ( 0.0000000 0.0000000 0.0125000), wk = 0.0021186 k( 274) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 275) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 276) = ( -0.0090909 0.0090909 0.0000000), wk = 0.0021186 k( 277) = ( -0.0181818 0.0181818 0.0000000), wk = 0.0021186 k( 278) = ( -0.0272727 0.0272727 -0.0000000), wk = 0.0021186 k( 279) = ( -0.0363636 0.0363636 0.0000000), wk = 0.0021186 k( 280) = ( -0.0454546 0.0454546 -0.0000000), wk = 0.0021186 k( 281) = ( -0.0545455 0.0545455 0.0000000), wk = 0.0021186 k( 282) = ( -0.0636364 0.0636364 -0.0000000), wk = 0.0021186 k( 283) = ( -0.0727273 0.0727273 -0.0000000), wk = 0.0021186 k( 284) = ( -0.0818182 0.0818182 -0.0000000), wk = 0.0021186 k( 285) = ( -0.0909091 0.0909091 0.0000000), wk = 0.0021186 k( 286) = ( -0.1000000 0.1000000 -0.0000000), wk = 0.0021186 k( 287) = ( -0.1090909 0.1090909 -0.0000000), wk = 0.0021186 k( 288) = ( -0.1181818 0.1181818 -0.0000000), wk = 0.0021186 k( 289) = ( -0.1272727 0.1272727 -0.0000000), wk = 0.0021186 k( 290) = ( -0.1363636 0.1363636 -0.0000000), wk = 0.0021186 k( 291) = ( -0.1454545 0.1454545 -0.0000000), wk = 0.0021186 k( 292) = ( -0.1545455 0.1545455 0.0000000), wk = 0.0021186 k( 293) = ( -0.1636364 0.1636364 -0.0000000), wk = 0.0021186 k( 294) = ( -0.1727273 0.1727273 -0.0000000), wk = 0.0021186 k( 295) = ( -0.1818182 0.1818182 0.0000000), wk = 0.0021186 k( 296) = ( -0.1909091 0.1909091 -0.0000000), wk = 0.0021186 k( 297) = ( -0.2000000 0.2000000 -0.0000000), wk = 0.0021186 k( 298) = ( -0.2090909 0.2090909 -0.0000000), wk = 0.0021186 k( 299) = ( -0.2181818 0.2181818 -0.0000000), wk = 0.0021186 k( 300) = ( -0.2272727 0.2272727 -0.0000000), wk = 0.0021186 k( 301) = ( -0.2363636 0.2363636 -0.0000000), wk = 0.0021186 k( 302) = ( -0.2454545 0.2454546 -0.0000000), wk = 0.0021186 k( 303) = ( -0.2545455 0.2545454 -0.0000000), wk = 0.0021186 k( 304) = ( -0.2636364 0.2636364 -0.0000000), wk = 0.0021186 k( 305) = ( -0.2727273 0.2727273 -0.0000000), wk = 0.0021186 k( 306) = ( -0.2818182 0.2818182 0.0000000), wk = 0.0021186 k( 307) = ( -0.2909091 0.2909091 0.0000000), wk = 0.0021186 k( 308) = ( -0.3000000 0.3000000 0.0000000), wk = 0.0021186 k( 309) = ( -0.3090909 0.3090909 -0.0000000), wk = 0.0021186 k( 310) = ( -0.3181818 0.3181818 -0.0000000), wk = 0.0021186 k( 311) = ( -0.3272727 0.3272727 -0.0000000), wk = 0.0021186 k( 312) = ( -0.3363636 0.3363636 0.0000000), wk = 0.0021186 k( 313) = ( -0.3454546 0.3454545 -0.0000000), wk = 0.0021186 k( 314) = ( -0.3545454 0.3545455 -0.0000000), wk = 0.0021186 k( 315) = ( -0.3636364 0.3636364 0.0000000), wk = 0.0021186 k( 316) = ( -0.3727273 0.3727273 -0.0000000), wk = 0.0021186 k( 317) = ( -0.3818182 0.3818182 -0.0000000), wk = 0.0021186 k( 318) = ( -0.3909091 0.3909091 -0.0000000), wk = 0.0021186 k( 319) = ( -0.4000000 0.4000000 -0.0000000), wk = 0.0021186 k( 320) = ( -0.4090909 0.4090909 0.0000000), wk = 0.0021186 k( 321) = ( -0.4181818 0.4181818 -0.0000000), wk = 0.0021186 k( 322) = ( -0.4272727 0.4272727 -0.0000000), wk = 0.0021186 k( 323) = ( -0.4363636 0.4363636 -0.0000000), wk = 0.0021186 k( 324) = ( -0.4454546 0.4454546 -0.0000000), wk = 0.0021186 k( 325) = ( -0.4545455 0.4545455 -0.0000000), wk = 0.0021186 k( 326) = ( -0.4636364 0.4636364 -0.0000000), wk = 0.0021186 k( 327) = ( -0.4727273 0.4727273 -0.0000000), wk = 0.0021186 k( 328) = ( -0.4818182 0.4818182 -0.0000000), wk = 0.0021186 k( 329) = ( -0.4909091 0.4909091 0.0000000), wk = 0.0021186 k( 330) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021186 k( 331) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021186 k( 332) = ( -0.4977247 0.5022752 -0.0000000), wk = 0.0021186 k( 333) = ( -0.4977247 0.5022752 -0.0000000), wk = 0.0021186 k( 334) = ( -0.4977247 0.5022752 0.0125000), wk = 0.0021186 k( 335) = ( -0.4977247 0.5022752 0.0250000), wk = 0.0021186 k( 336) = ( -0.4977247 0.5022752 0.0375000), wk = 0.0021186 k( 337) = ( -0.4977247 0.5022752 0.0500000), wk = 0.0021186 k( 338) = ( -0.4977247 0.5022752 0.0625000), wk = 0.0021186 k( 339) = ( -0.4977247 0.5022752 0.0750000), wk = 0.0021186 k( 340) = ( -0.4977247 0.5022752 0.0875000), wk = 0.0021186 k( 341) = ( -0.4977247 0.5022752 0.1000000), wk = 0.0021186 k( 342) = ( -0.4977247 0.5022752 0.1125000), wk = 0.0021186 k( 343) = ( -0.4977247 0.5022752 0.1250000), wk = 0.0021186 k( 344) = ( -0.4977247 0.5022752 0.1375000), wk = 0.0021186 k( 345) = ( -0.4977247 0.5022752 0.1500000), wk = 0.0021186 k( 346) = ( -0.4977247 0.5022752 0.1625000), wk = 0.0021186 k( 347) = ( -0.4977247 0.5022752 0.1750000), wk = 0.0021186 k( 348) = ( -0.4977247 0.5022752 0.1875000), wk = 0.0021186 k( 349) = ( -0.4977247 0.5022752 0.2000000), wk = 0.0021186 k( 350) = ( -0.4977247 0.5022752 0.2125000), wk = 0.0021186 k( 351) = ( -0.4977247 0.5022752 0.2250000), wk = 0.0021186 k( 352) = ( -0.4977247 0.5022752 0.2375000), wk = 0.0021186 k( 353) = ( -0.4977247 0.5022752 0.2500000), wk = 0.0021186 k( 354) = ( -0.4977247 0.5022752 0.2625000), wk = 0.0021186 k( 355) = ( -0.4977247 0.5022752 0.2750000), wk = 0.0021186 k( 356) = ( -0.4977247 0.5022752 0.2875000), wk = 0.0021186 k( 357) = ( -0.4977247 0.5022752 0.3000000), wk = 0.0021186 k( 358) = ( -0.4977247 0.5022752 0.3125000), wk = 0.0021186 k( 359) = ( -0.4977247 0.5022752 0.3250000), wk = 0.0021186 k( 360) = ( -0.4977247 0.5022752 0.3375000), wk = 0.0021186 k( 361) = ( -0.4977247 0.5022752 0.3500000), wk = 0.0021186 k( 362) = ( -0.4977247 0.5022752 0.3625000), wk = 0.0021186 k( 363) = ( -0.4977247 0.5022752 0.3750000), wk = 0.0021186 k( 364) = ( -0.4977247 0.5022752 0.3875000), wk = 0.0021186 k( 365) = ( -0.4977247 0.5022752 0.4000000), wk = 0.0021186 k( 366) = ( -0.4977247 0.5022752 0.4125000), wk = 0.0021186 k( 367) = ( -0.4977247 0.5022752 0.4250000), wk = 0.0021186 k( 368) = ( -0.4977247 0.5022752 0.4375000), wk = 0.0021186 k( 369) = ( -0.4977247 0.5022752 0.4500000), wk = 0.0021186 k( 370) = ( -0.4977247 0.5022752 0.4625000), wk = 0.0021186 k( 371) = ( -0.4977247 0.5022752 0.4750000), wk = 0.0021186 k( 372) = ( -0.4977247 0.5022752 0.4875000), wk = 0.0021186 k( 373) = ( -0.4977247 0.5022752 0.5000000), wk = 0.0021186 k( 374) = ( -0.4977247 0.5022752 0.5000000), wk = 0.0021186 k( 375) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021186 k( 376) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021186 k( 377) = ( -0.5000000 0.5000000 0.4875000), wk = 0.0021186 k( 378) = ( -0.5000000 0.5000000 0.4750000), wk = 0.0021186 k( 379) = ( -0.5000000 0.5000000 0.4625000), wk = 0.0021186 k( 380) = ( -0.5000000 0.5000000 0.4500000), wk = 0.0021186 k( 381) = ( -0.5000000 0.5000000 0.4375000), wk = 0.0021186 k( 382) = ( -0.5000000 0.5000000 0.4250000), wk = 0.0021186 k( 383) = ( -0.5000000 0.5000000 0.4125000), wk = 0.0021186 k( 384) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0021186 k( 385) = ( -0.5000000 0.5000000 0.3875000), wk = 0.0021186 k( 386) = ( -0.5000000 0.5000000 0.3750000), wk = 0.0021186 k( 387) = ( -0.5000000 0.5000000 0.3625000), wk = 0.0021186 k( 388) = ( -0.5000000 0.5000000 0.3500000), wk = 0.0021186 k( 389) = ( -0.5000000 0.5000000 0.3375000), wk = 0.0021186 k( 390) = ( -0.5000000 0.5000000 0.3250000), wk = 0.0021186 k( 391) = ( -0.5000000 0.5000000 0.3125000), wk = 0.0021186 k( 392) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0021186 k( 393) = ( -0.5000000 0.5000000 0.2875000), wk = 0.0021186 k( 394) = ( -0.5000000 0.5000000 0.2750000), wk = 0.0021186 k( 395) = ( -0.5000000 0.5000000 0.2625000), wk = 0.0021186 k( 396) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0021186 k( 397) = ( -0.5000000 0.5000000 0.2375000), wk = 0.0021186 k( 398) = ( -0.5000000 0.5000000 0.2250000), wk = 0.0021186 k( 399) = ( -0.5000000 0.5000000 0.2125000), wk = 0.0021186 k( 400) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0021186 k( 401) = ( -0.5000000 0.5000000 0.1875000), wk = 0.0021186 k( 402) = ( -0.5000000 0.5000000 0.1750000), wk = 0.0021186 k( 403) = ( -0.5000000 0.5000000 0.1625000), wk = 0.0021186 k( 404) = ( -0.5000000 0.5000000 0.1500000), wk = 0.0021186 k( 405) = ( -0.5000000 0.5000000 0.1375000), wk = 0.0021186 k( 406) = ( -0.5000000 0.5000000 0.1250000), wk = 0.0021186 k( 407) = ( -0.5000000 0.5000000 0.1125000), wk = 0.0021186 k( 408) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0021186 k( 409) = ( -0.5000000 0.5000000 0.0875000), wk = 0.0021186 k( 410) = ( -0.5000000 0.5000000 0.0750000), wk = 0.0021186 k( 411) = ( -0.5000000 0.5000000 0.0625000), wk = 0.0021186 k( 412) = ( -0.5000000 0.5000000 0.0500000), wk = 0.0021186 k( 413) = ( -0.5000000 0.5000000 0.0375000), wk = 0.0021186 k( 414) = ( -0.5000000 0.5000000 0.0250000), wk = 0.0021186 k( 415) = ( -0.5000000 0.5000000 0.0125000), wk = 0.0021186 k( 416) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021186 k( 417) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021186 k( 418) = ( -0.0090909 0.0090909 0.5000000), wk = 0.0021186 k( 419) = ( -0.0181818 0.0181818 0.5000000), wk = 0.0021186 k( 420) = ( -0.0272727 0.0272727 0.5000000), wk = 0.0021186 k( 421) = ( -0.0363636 0.0363636 0.5000000), wk = 0.0021186 k( 422) = ( -0.0454546 0.0454546 0.5000000), wk = 0.0021186 k( 423) = ( -0.0545455 0.0545455 0.5000000), wk = 0.0021186 k( 424) = ( -0.0636364 0.0636364 0.5000000), wk = 0.0021186 k( 425) = ( -0.0727273 0.0727273 0.5000000), wk = 0.0021186 k( 426) = ( -0.0818182 0.0818182 0.5000000), wk = 0.0021186 k( 427) = ( -0.0909091 0.0909091 0.5000000), wk = 0.0021186 k( 428) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0021186 k( 429) = ( -0.1090909 0.1090909 0.5000000), wk = 0.0021186 k( 430) = ( -0.1181818 0.1181818 0.5000000), wk = 0.0021186 k( 431) = ( -0.1272727 0.1272727 0.5000000), wk = 0.0021186 k( 432) = ( -0.1363636 0.1363636 0.5000000), wk = 0.0021186 k( 433) = ( -0.1454545 0.1454545 0.5000000), wk = 0.0021186 k( 434) = ( -0.1545455 0.1545455 0.5000000), wk = 0.0021186 k( 435) = ( -0.1636364 0.1636364 0.5000000), wk = 0.0021186 k( 436) = ( -0.1727273 0.1727273 0.5000000), wk = 0.0021186 k( 437) = ( -0.1818182 0.1818182 0.5000000), wk = 0.0021186 k( 438) = ( -0.1909091 0.1909091 0.5000000), wk = 0.0021186 k( 439) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0021186 k( 440) = ( -0.2090909 0.2090909 0.5000000), wk = 0.0021186 k( 441) = ( -0.2181818 0.2181818 0.5000000), wk = 0.0021186 k( 442) = ( -0.2272727 0.2272727 0.5000000), wk = 0.0021186 k( 443) = ( -0.2363636 0.2363636 0.5000000), wk = 0.0021186 k( 444) = ( -0.2454545 0.2454546 0.5000000), wk = 0.0021186 k( 445) = ( -0.2545455 0.2545454 0.5000000), wk = 0.0021186 k( 446) = ( -0.2636364 0.2636364 0.5000000), wk = 0.0021186 k( 447) = ( -0.2727273 0.2727273 0.5000000), wk = 0.0021186 k( 448) = ( -0.2818182 0.2818182 0.5000000), wk = 0.0021186 k( 449) = ( -0.2909091 0.2909091 0.5000000), wk = 0.0021186 k( 450) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0021186 k( 451) = ( -0.3090909 0.3090909 0.5000000), wk = 0.0021186 k( 452) = ( -0.3181818 0.3181818 0.5000000), wk = 0.0021186 k( 453) = ( -0.3272727 0.3272727 0.5000000), wk = 0.0021186 k( 454) = ( -0.3363636 0.3363636 0.5000000), wk = 0.0021186 k( 455) = ( -0.3454546 0.3454545 0.5000000), wk = 0.0021186 k( 456) = ( -0.3545454 0.3545455 0.5000000), wk = 0.0021186 k( 457) = ( -0.3636364 0.3636364 0.5000000), wk = 0.0021186 k( 458) = ( -0.3727273 0.3727273 0.5000000), wk = 0.0021186 k( 459) = ( -0.3818182 0.3818182 0.5000000), wk = 0.0021186 k( 460) = ( -0.3909091 0.3909091 0.5000000), wk = 0.0021186 k( 461) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0021186 k( 462) = ( -0.4090909 0.4090909 0.5000000), wk = 0.0021186 k( 463) = ( -0.4181818 0.4181818 0.5000000), wk = 0.0021186 k( 464) = ( -0.4272727 0.4272727 0.5000000), wk = 0.0021186 k( 465) = ( -0.4363636 0.4363636 0.5000000), wk = 0.0021186 k( 466) = ( -0.4454546 0.4454546 0.5000000), wk = 0.0021186 k( 467) = ( -0.4545455 0.4545455 0.5000000), wk = 0.0021186 k( 468) = ( -0.4636364 0.4636364 0.5000000), wk = 0.0021186 k( 469) = ( -0.4727273 0.4727273 0.5000000), wk = 0.0021186 k( 470) = ( -0.4818182 0.4818182 0.5000000), wk = 0.0021186 k( 471) = ( -0.4909091 0.4909091 0.5000000), wk = 0.0021186 k( 472) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021186 Dense grid: 43051 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 19641 G-vectors FFT dimensions: ( 36, 36, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.08 Mb ( 106, 48) NL pseudopotentials 0.09 Mb ( 53, 110) Each V/rho on FFT grid 0.03 Mb ( 2025) Each G-vector array 0.01 Mb ( 895) G-vector shells 0.00 Mb ( 463) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.31 Mb ( 106, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.16 Mb ( 110, 2, 48) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./KNbO3.save/charge-density.dat Starting wfc are 66 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.7 secs Computing kpt #: 2 total cpu time spent up to now is 47.7 secs Computing kpt #: 3 total cpu time spent up to now is 50.2 secs Computing kpt #: 4 total cpu time spent up to now is 52.6 secs Computing kpt #: 5 total cpu time spent up to now is 55.0 secs Computing kpt #: 6 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 58.1 secs Computing kpt #: 7 total cpu time spent up to now is 60.2 secs Computing kpt #: 8 total cpu time spent up to now is 61.9 secs Computing kpt #: 9 total cpu time spent up to now is 63.5 secs Computing kpt #: 10 total cpu time spent up to now is 65.2 secs Computing kpt #: 11 total cpu time spent up to now is 67.0 secs Computing kpt #: 12 total cpu time spent up to now is 68.5 secs Computing kpt #: 13 total cpu time spent up to now is 70.6 secs Computing kpt #: 14 total cpu time spent up to now is 72.2 secs Computing kpt #: 15 total cpu time spent up to now is 73.7 secs Computing kpt #: 16 total cpu time spent up to now is 75.2 secs Computing kpt #: 17 total cpu time spent up to now is 76.7 secs Computing kpt #: 18 total cpu time spent up to now is 78.2 secs Computing kpt #: 19 total cpu time spent up to now is 79.7 secs Computing kpt #: 20 total cpu time spent up to now is 81.2 secs Computing kpt #: 21 total cpu time spent up to now is 82.6 secs Computing kpt #: 22 total cpu time spent up to now is 84.1 secs Computing kpt #: 23 total cpu time spent up to now is 85.5 secs Computing kpt #: 24 total cpu time spent up to now is 86.8 secs Computing kpt #: 25 total cpu time spent up to now is 88.0 secs Computing kpt #: 26 total cpu time spent up to now is 89.4 secs Computing kpt #: 27 total cpu time spent up to now is 90.6 secs Computing kpt #: 28 total cpu time spent up to now is 91.7 secs Computing kpt #: 29 total cpu time spent up to now is 92.8 secs Computing kpt #: 30 total cpu time spent up to now is 93.9 secs Computing kpt #: 31 total cpu time spent up to now is 94.9 secs Computing kpt #: 32 total cpu time spent up to now is 96.0 secs Computing kpt #: 33 total cpu time spent up to now is 97.2 secs Computing kpt #: 34 total cpu time spent up to now is 98.2 secs Computing kpt #: 35 total cpu time spent up to now is 99.2 secs Computing kpt #: 36 total cpu time spent up to now is 100.2 secs Computing kpt #: 37 total cpu time spent up to now is 101.2 secs Computing kpt #: 38 total cpu time spent up to now is 102.3 secs Computing kpt #: 39 total cpu time spent up to now is 103.2 secs Computing kpt #: 40 total cpu time spent up to now is 104.2 secs Computing kpt #: 41 total cpu time spent up to now is 105.2 secs Computing kpt #: 42 total cpu time spent up to now is 106.2 secs Computing kpt #: 43 total cpu time spent up to now is 107.3 secs Computing kpt #: 44 total cpu time spent up to now is 108.3 secs Computing kpt #: 45 total cpu time spent up to now is 109.3 secs Computing kpt #: 46 total cpu time spent up to now is 110.3 secs Computing kpt #: 47 total cpu time spent up to now is 111.4 secs Computing kpt #: 48 total cpu time spent up to now is 112.5 secs Computing kpt #: 49 total cpu time spent up to now is 113.6 secs Computing kpt #: 50 total cpu time spent up to now is 114.7 secs Computing kpt #: 51 total cpu time spent up to now is 115.7 secs Computing kpt #: 52 total cpu time spent up to now is 116.8 secs Computing kpt #: 53 total cpu time spent up to now is 117.8 secs Computing kpt #: 54 total cpu time spent up to now is 118.8 secs Computing kpt #: 55 total cpu time spent up to now is 119.9 secs Computing kpt #: 56 total cpu time spent up to now is 121.0 secs Computing kpt #: 57 total cpu time spent up to now is 122.0 secs Computing kpt #: 58 total cpu time spent up to now is 123.0 secs Computing kpt #: 59 total cpu time spent up to now is 124.0 secs Computing kpt #: 60 total cpu time spent up to now is 125.0 secs Computing kpt #: 61 total cpu time spent up to now is 126.1 secs Computing kpt #: 62 total cpu time spent up to now is 127.1 secs Computing kpt #: 63 total cpu time spent up to now is 128.2 secs Computing kpt #: 64 total cpu time spent up to now is 129.2 secs Computing kpt #: 65 total cpu time spent up to now is 130.2 secs Computing kpt #: 66 total cpu time spent up to now is 131.2 secs Computing kpt #: 67 total cpu time spent up to now is 132.3 secs Computing kpt #: 68 total cpu time spent up to now is 133.3 secs Computing kpt #: 69 total cpu time spent up to now is 134.3 secs Computing kpt #: 70 total cpu time spent up to now is 135.4 secs Computing kpt #: 71 total cpu time spent up to now is 136.3 secs Computing kpt #: 72 total cpu time spent up to now is 137.3 secs Computing kpt #: 73 total cpu time spent up to now is 138.4 secs Computing kpt #: 74 total cpu time spent up to now is 139.4 secs Computing kpt #: 75 total cpu time spent up to now is 140.4 secs Computing kpt #: 76 total cpu time spent up to now is 141.4 secs Computing kpt #: 77 total cpu time spent up to now is 142.3 secs Computing kpt #: 78 total cpu time spent up to now is 143.3 secs Computing kpt #: 79 total cpu time spent up to now is 144.3 secs Computing kpt #: 80 total cpu time spent up to now is 145.3 secs Computing kpt #: 81 total cpu time spent up to now is 146.4 secs Computing kpt #: 82 total cpu time spent up to now is 147.6 secs Computing kpt #: 83 total cpu time spent up to now is 148.6 secs Computing kpt #: 84 total cpu time spent up to now is 149.8 secs Computing kpt #: 85 total cpu time spent up to now is 150.8 secs Computing kpt #: 86 total cpu time spent up to now is 151.8 secs Computing kpt #: 87 total cpu time spent up to now is 153.0 secs Computing kpt #: 88 total cpu time spent up to now is 154.1 secs Computing kpt #: 89 total cpu time spent up to now is 155.1 secs Computing kpt #: 90 total cpu time spent up to now is 156.0 secs Computing kpt #: 91 total cpu time spent up to now is 157.0 secs Computing kpt #: 92 total cpu time spent up to now is 158.2 secs Computing kpt #: 93 total cpu time spent up to now is 159.4 secs Computing kpt #: 94 total cpu time spent up to now is 160.4 secs Computing kpt #: 95 total cpu time spent up to now is 161.8 secs Computing kpt #: 96 total cpu time spent up to now is 162.8 secs Computing kpt #: 97 total cpu time spent up to now is 163.9 secs Computing kpt #: 98 total cpu time spent up to now is 165.0 secs Computing kpt #: 99 total cpu time spent up to now is 166.1 secs Computing kpt #: 100 total cpu time spent up to now is 167.3 secs Computing kpt #: 101 total cpu time spent up to now is 168.5 secs Computing kpt #: 102 total cpu time spent up to now is 169.5 secs Computing kpt #: 103 total cpu time spent up to now is 170.6 secs Computing kpt #: 104 total cpu time spent up to now is 171.7 secs Computing kpt #: 105 total cpu time spent up to now is 172.9 secs Computing kpt #: 106 total cpu time spent up to now is 173.9 secs Computing kpt #: 107 total cpu time spent up to now is 175.1 secs Computing kpt #: 108 total cpu time spent up to now is 176.0 secs Computing kpt #: 109 total cpu time spent up to now is 177.2 secs Computing kpt #: 110 total cpu time spent up to now is 178.2 secs Computing kpt #: 111 total cpu time spent up to now is 179.3 secs Computing kpt #: 112 total cpu time spent up to now is 180.3 secs Computing kpt #: 113 total cpu time spent up to now is 181.3 secs Computing kpt #: 114 total cpu time spent up to now is 182.3 secs Computing kpt #: 115 total cpu time spent up to now is 183.3 secs Computing kpt #: 116 total cpu time spent up to now is 184.2 secs Computing kpt #: 117 total cpu time spent up to now is 185.2 secs Computing kpt #: 118 total cpu time spent up to now is 186.1 secs Computing kpt #: 119 total cpu time spent up to now is 187.1 secs Computing kpt #: 120 total cpu time spent up to now is 188.1 secs Computing kpt #: 121 total cpu time spent up to now is 189.1 secs Computing kpt #: 122 total cpu time spent up to now is 190.1 secs Computing kpt #: 123 total cpu time spent up to now is 191.0 secs Computing kpt #: 124 total cpu time spent up to now is 192.0 secs Computing kpt #: 125 total cpu time spent up to now is 193.0 secs Computing kpt #: 126 total cpu time spent up to now is 194.0 secs Computing kpt #: 127 total cpu time spent up to now is 195.0 secs Computing kpt #: 128 total cpu time spent up to now is 195.9 secs Computing kpt #: 129 total cpu time spent up to now is 196.9 secs Computing kpt #: 130 total cpu time spent up to now is 197.9 secs Computing kpt #: 131 total cpu time spent up to now is 198.9 secs Computing kpt #: 132 total cpu time spent up to now is 200.0 secs Computing kpt #: 133 total cpu time spent up to now is 200.9 secs Computing kpt #: 134 total cpu time spent up to now is 201.9 secs Computing kpt #: 135 total cpu time spent up to now is 202.9 secs Computing kpt #: 136 total cpu time spent up to now is 203.9 secs Computing kpt #: 137 total cpu time spent up to now is 204.9 secs Computing kpt #: 138 total cpu time spent up to now is 205.8 secs Computing kpt #: 139 total cpu time spent up to now is 206.8 secs Computing kpt #: 140 total cpu time spent up to now is 207.8 secs Computing kpt #: 141 total cpu time spent up to now is 208.8 secs Computing kpt #: 142 total cpu time spent up to now is 209.8 secs Computing kpt #: 143 total cpu time spent up to now is 210.9 secs Computing kpt #: 144 total cpu time spent up to now is 211.9 secs Computing kpt #: 145 total cpu time spent up to now is 212.9 secs Computing kpt #: 146 total cpu time spent up to now is 213.9 secs Computing kpt #: 147 total cpu time spent up to now is 215.0 secs Computing kpt #: 148 total cpu time spent up to now is 216.1 secs Computing kpt #: 149 total cpu time spent up to now is 217.2 secs Computing kpt #: 150 total cpu time spent up to now is 218.3 secs Computing kpt #: 151 total cpu time spent up to now is 219.4 secs Computing kpt #: 152 total cpu time spent up to now is 220.6 secs Computing kpt #: 153 total cpu time spent up to now is 221.8 secs Computing kpt #: 154 total cpu time spent up to now is 223.0 secs Computing kpt #: 155 total cpu time spent up to now is 224.2 secs Computing kpt #: 156 total cpu time spent up to now is 225.4 secs Computing kpt #: 157 total cpu time spent up to now is 226.5 secs Computing kpt #: 158 total cpu time spent up to now is 227.8 secs Computing kpt #: 159 total cpu time spent up to now is 229.6 secs Computing kpt #: 160 total cpu time spent up to now is 231.2 secs Computing kpt #: 161 total cpu time spent up to now is 232.6 secs Computing kpt #: 162 total cpu time spent up to now is 234.0 secs Computing kpt #: 163 total cpu time spent up to now is 235.4 secs Computing kpt #: 164 total cpu time spent up to now is 236.7 secs Computing kpt #: 165 total cpu time spent up to now is 238.1 secs Computing kpt #: 166 total cpu time spent up to now is 239.6 secs Computing kpt #: 167 total cpu time spent up to now is 240.9 secs Computing kpt #: 168 total cpu time spent up to now is 242.4 secs Computing kpt #: 169 total cpu time spent up to now is 243.9 secs Computing kpt #: 170 total cpu time spent up to now is 245.5 secs Computing kpt #: 171 total cpu time spent up to now is 247.1 secs Computing kpt #: 172 total cpu time spent up to now is 248.7 secs Computing kpt #: 173 total cpu time spent up to now is 250.2 secs Computing kpt #: 174 total cpu time spent up to now is 252.1 secs Computing kpt #: 175 total cpu time spent up to now is 253.5 secs Computing kpt #: 176 total cpu time spent up to now is 255.0 secs Computing kpt #: 177 total cpu time spent up to now is 256.5 secs Computing kpt #: 178 total cpu time spent up to now is 257.8 secs Computing kpt #: 179 total cpu time spent up to now is 259.5 secs Computing kpt #: 180 total cpu time spent up to now is 261.2 secs Computing kpt #: 181 total cpu time spent up to now is 262.9 secs Computing kpt #: 182 total cpu time spent up to now is 264.5 secs Computing kpt #: 183 total cpu time spent up to now is 266.3 secs Computing kpt #: 184 total cpu time spent up to now is 267.8 secs Computing kpt #: 185 total cpu time spent up to now is 269.3 secs Computing kpt #: 186 total cpu time spent up to now is 270.9 secs Computing kpt #: 187 total cpu time spent up to now is 272.3 secs Computing kpt #: 188 total cpu time spent up to now is 273.8 secs Computing kpt #: 189 total cpu time spent up to now is 275.2 secs Computing kpt #: 190 total cpu time spent up to now is 276.8 secs Computing kpt #: 191 total cpu time spent up to now is 278.4 secs Computing kpt #: 192 total cpu time spent up to now is 279.8 secs Computing kpt #: 193 total cpu time spent up to now is 281.2 secs Computing kpt #: 194 total cpu time spent up to now is 282.5 secs Computing kpt #: 195 total cpu time spent up to now is 283.9 secs Computing kpt #: 196 total cpu time spent up to now is 285.2 secs Computing kpt #: 197 total cpu time spent up to now is 286.6 secs Computing kpt #: 198 total cpu time spent up to now is 287.9 secs Computing kpt #: 199 total cpu time spent up to now is 289.2 secs Computing kpt #: 200 total cpu time spent up to now is 290.4 secs Computing kpt #: 201 total cpu time spent up to now is 291.7 secs Computing kpt #: 202 total cpu time spent up to now is 292.9 secs Computing kpt #: 203 total cpu time spent up to now is 294.2 secs Computing kpt #: 204 total cpu time spent up to now is 295.4 secs Computing kpt #: 205 total cpu time spent up to now is 296.6 secs Computing kpt #: 206 total cpu time spent up to now is 297.8 secs Computing kpt #: 207 total cpu time spent up to now is 299.0 secs Computing kpt #: 208 total cpu time spent up to now is 300.2 secs Computing kpt #: 209 total cpu time spent up to now is 301.4 secs Computing kpt #: 210 total cpu time spent up to now is 302.5 secs Computing kpt #: 211 total cpu time spent up to now is 303.5 secs Computing kpt #: 212 total cpu time spent up to now is 304.6 secs Computing kpt #: 213 total cpu time spent up to now is 305.7 secs Computing kpt #: 214 total cpu time spent up to now is 306.8 secs Computing kpt #: 215 total cpu time spent up to now is 307.9 secs Computing kpt #: 216 total cpu time spent up to now is 308.9 secs Computing kpt #: 217 total cpu time spent up to now is 309.9 secs Computing kpt #: 218 total cpu time spent up to now is 310.9 secs Computing kpt #: 219 total cpu time spent up to now is 312.0 secs Computing kpt #: 220 total cpu time spent up to now is 313.0 secs Computing kpt #: 221 total cpu time spent up to now is 314.1 secs Computing kpt #: 222 total cpu time spent up to now is 315.1 secs Computing kpt #: 223 total cpu time spent up to now is 316.1 secs Computing kpt #: 224 total cpu time spent up to now is 317.0 secs Computing kpt #: 225 total cpu time spent up to now is 318.0 secs Computing kpt #: 226 total cpu time spent up to now is 319.0 secs Computing kpt #: 227 total cpu time spent up to now is 320.1 secs Computing kpt #: 228 total cpu time spent up to now is 321.0 secs Computing kpt #: 229 total cpu time spent up to now is 322.1 secs Computing kpt #: 230 total cpu time spent up to now is 323.1 secs Computing kpt #: 231 total cpu time spent up to now is 324.1 secs Computing kpt #: 232 total cpu time spent up to now is 325.1 secs Computing kpt #: 233 total cpu time spent up to now is 326.1 secs Computing kpt #: 234 total cpu time spent up to now is 327.0 secs Computing kpt #: 235 total cpu time spent up to now is 328.0 secs Computing kpt #: 236 total cpu time spent up to now is 329.0 secs Computing kpt #: 237 total cpu time spent up to now is 330.0 secs Computing kpt #: 238 total cpu time spent up to now is 331.0 secs Computing kpt #: 239 total cpu time spent up to now is 332.0 secs Computing kpt #: 240 total cpu time spent up to now is 333.0 secs Computing kpt #: 241 total cpu time spent up to now is 334.0 secs Computing kpt #: 242 total cpu time spent up to now is 335.0 secs Computing kpt #: 243 total cpu time spent up to now is 336.0 secs Computing kpt #: 244 total cpu time spent up to now is 337.0 secs Computing kpt #: 245 total cpu time spent up to now is 338.1 secs Computing kpt #: 246 total cpu time spent up to now is 339.1 secs Computing kpt #: 247 total cpu time spent up to now is 340.0 secs Computing kpt #: 248 total cpu time spent up to now is 341.0 secs Computing kpt #: 249 total cpu time spent up to now is 342.3 secs Computing kpt #: 250 total cpu time spent up to now is 343.3 secs Computing kpt #: 251 total cpu time spent up to now is 344.3 secs Computing kpt #: 252 total cpu time spent up to now is 345.4 secs Computing kpt #: 253 total cpu time spent up to now is 346.7 secs Computing kpt #: 254 total cpu time spent up to now is 348.1 secs Computing kpt #: 255 total cpu time spent up to now is 349.4 secs Computing kpt #: 256 total cpu time spent up to now is 350.8 secs Computing kpt #: 257 total cpu time spent up to now is 352.1 secs Computing kpt #: 258 total cpu time spent up to now is 353.6 secs Computing kpt #: 259 total cpu time spent up to now is 355.0 secs Computing kpt #: 260 total cpu time spent up to now is 356.4 secs Computing kpt #: 261 total cpu time spent up to now is 357.9 secs Computing kpt #: 262 total cpu time spent up to now is 359.5 secs Computing kpt #: 263 total cpu time spent up to now is 361.2 secs Computing kpt #: 264 total cpu time spent up to now is 362.7 secs Computing kpt #: 265 total cpu time spent up to now is 364.2 secs Computing kpt #: 266 total cpu time spent up to now is 365.8 secs Computing kpt #: 267 total cpu time spent up to now is 367.5 secs Computing kpt #: 268 total cpu time spent up to now is 369.4 secs Computing kpt #: 269 total cpu time spent up to now is 371.3 secs Computing kpt #: 270 total cpu time spent up to now is 373.9 secs Computing kpt #: 271 total cpu time spent up to now is 376.5 secs Computing kpt #: 272 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 379.6 secs Computing kpt #: 273 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 382.7 secs Computing kpt #: 274 total cpu time spent up to now is 385.2 secs Computing kpt #: 275 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 388.2 secs Computing kpt #: 276 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 391.2 secs Computing kpt #: 277 total cpu time spent up to now is 393.1 secs Computing kpt #: 278 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 396.1 secs Computing kpt #: 279 total cpu time spent up to now is 398.0 secs Computing kpt #: 280 total cpu time spent up to now is 399.8 secs Computing kpt #: 281 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 402.9 secs Computing kpt #: 282 total cpu time spent up to now is 404.5 secs Computing kpt #: 283 total cpu time spent up to now is 406.1 secs Computing kpt #: 284 total cpu time spent up to now is 407.6 secs Computing kpt #: 285 total cpu time spent up to now is 409.9 secs Computing kpt #: 286 total cpu time spent up to now is 411.9 secs Computing kpt #: 287 total cpu time spent up to now is 414.0 secs Computing kpt #: 288 total cpu time spent up to now is 415.5 secs Computing kpt #: 289 total cpu time spent up to now is 417.1 secs Computing kpt #: 290 total cpu time spent up to now is 418.6 secs Computing kpt #: 291 total cpu time spent up to now is 420.2 secs Computing kpt #: 292 total cpu time spent up to now is 421.7 secs Computing kpt #: 293 total cpu time spent up to now is 423.0 secs Computing kpt #: 294 total cpu time spent up to now is 424.4 secs Computing kpt #: 295 total cpu time spent up to now is 425.7 secs Computing kpt #: 296 total cpu time spent up to now is 427.1 secs Computing kpt #: 297 total cpu time spent up to now is 428.4 secs Computing kpt #: 298 total cpu time spent up to now is 429.7 secs Computing kpt #: 299 total cpu time spent up to now is 431.0 secs Computing kpt #: 300 total cpu time spent up to now is 432.2 secs Computing kpt #: 301 total cpu time spent up to now is 433.5 secs Computing kpt #: 302 total cpu time spent up to now is 434.8 secs Computing kpt #: 303 total cpu time spent up to now is 436.0 secs Computing kpt #: 304 total cpu time spent up to now is 436.9 secs Computing kpt #: 305 total cpu time spent up to now is 438.2 secs Computing kpt #: 306 total cpu time spent up to now is 439.2 secs Computing kpt #: 307 total cpu time spent up to now is 440.2 secs Computing kpt #: 308 total cpu time spent up to now is 441.2 secs Computing kpt #: 309 total cpu time spent up to now is 442.1 secs Computing kpt #: 310 total cpu time spent up to now is 443.1 secs Computing kpt #: 311 total cpu time spent up to now is 444.1 secs Computing kpt #: 312 total cpu time spent up to now is 445.1 secs Computing kpt #: 313 total cpu time spent up to now is 446.1 secs Computing kpt #: 314 total cpu time spent up to now is 447.1 secs Computing kpt #: 315 total cpu time spent up to now is 448.2 secs Computing kpt #: 316 total cpu time spent up to now is 449.2 secs Computing kpt #: 317 total cpu time spent up to now is 450.2 secs Computing kpt #: 318 total cpu time spent up to now is 451.2 secs Computing kpt #: 319 total cpu time spent up to now is 452.2 secs Computing kpt #: 320 total cpu time spent up to now is 453.2 secs Computing kpt #: 321 total cpu time spent up to now is 454.2 secs Computing kpt #: 322 total cpu time spent up to now is 455.2 secs Computing kpt #: 323 total cpu time spent up to now is 456.2 secs Computing kpt #: 324 total cpu time spent up to now is 457.2 secs Computing kpt #: 325 total cpu time spent up to now is 458.2 secs Computing kpt #: 326 total cpu time spent up to now is 459.3 secs Computing kpt #: 327 total cpu time spent up to now is 460.3 secs Computing kpt #: 328 total cpu time spent up to now is 461.3 secs Computing kpt #: 329 total cpu time spent up to now is 462.4 secs Computing kpt #: 330 total cpu time spent up to now is 463.6 secs Computing kpt #: 331 total cpu time spent up to now is 464.6 secs Computing kpt #: 332 total cpu time spent up to now is 465.6 secs Computing kpt #: 333 total cpu time spent up to now is 466.6 secs Computing kpt #: 334 total cpu time spent up to now is 467.6 secs Computing kpt #: 335 total cpu time spent up to now is 468.6 secs Computing kpt #: 336 total cpu time spent up to now is 469.6 secs Computing kpt #: 337 total cpu time spent up to now is 470.7 secs Computing kpt #: 338 total cpu time spent up to now is 471.7 secs Computing kpt #: 339 total cpu time spent up to now is 472.7 secs Computing kpt #: 340 total cpu time spent up to now is 473.8 secs Computing kpt #: 341 total cpu time spent up to now is 474.9 secs Computing kpt #: 342 total cpu time spent up to now is 475.9 secs Computing kpt #: 343 total cpu time spent up to now is 477.0 secs Computing kpt #: 344 total cpu time spent up to now is 478.2 secs Computing kpt #: 345 total cpu time spent up to now is 479.3 secs Computing kpt #: 346 total cpu time spent up to now is 480.5 secs Computing kpt #: 347 total cpu time spent up to now is 481.7 secs Computing kpt #: 348 total cpu time spent up to now is 482.9 secs Computing kpt #: 349 total cpu time spent up to now is 484.1 secs Computing kpt #: 350 total cpu time spent up to now is 485.2 secs Computing kpt #: 351 total cpu time spent up to now is 486.5 secs Computing kpt #: 352 total cpu time spent up to now is 487.7 secs Computing kpt #: 353 total cpu time spent up to now is 488.9 secs Computing kpt #: 354 total cpu time spent up to now is 490.3 secs Computing kpt #: 355 total cpu time spent up to now is 491.7 secs Computing kpt #: 356 total cpu time spent up to now is 493.1 secs Computing kpt #: 357 total cpu time spent up to now is 494.7 secs Computing kpt #: 358 total cpu time spent up to now is 496.3 secs Computing kpt #: 359 total cpu time spent up to now is 497.9 secs Computing kpt #: 360 total cpu time spent up to now is 499.6 secs Computing kpt #: 361 total cpu time spent up to now is 501.2 secs Computing kpt #: 362 total cpu time spent up to now is 502.9 secs Computing kpt #: 363 total cpu time spent up to now is 504.9 secs Computing kpt #: 364 total cpu time spent up to now is 506.6 secs Computing kpt #: 365 total cpu time spent up to now is 508.4 secs Computing kpt #: 366 total cpu time spent up to now is 510.2 secs Computing kpt #: 367 total cpu time spent up to now is 512.2 secs Computing kpt #: 368 total cpu time spent up to now is 514.0 secs Computing kpt #: 369 total cpu time spent up to now is 515.5 secs Computing kpt #: 370 total cpu time spent up to now is 517.4 secs Computing kpt #: 371 total cpu time spent up to now is 518.8 secs Computing kpt #: 372 total cpu time spent up to now is 520.2 secs Computing kpt #: 373 total cpu time spent up to now is 521.7 secs Computing kpt #: 374 total cpu time spent up to now is 523.2 secs Computing kpt #: 375 total cpu time spent up to now is 524.8 secs Computing kpt #: 376 total cpu time spent up to now is 526.1 secs Computing kpt #: 377 total cpu time spent up to now is 527.7 secs Computing kpt #: 378 total cpu time spent up to now is 529.8 secs Computing kpt #: 379 total cpu time spent up to now is 531.9 secs Computing kpt #: 380 total cpu time spent up to now is 533.9 secs Computing kpt #: 381 total cpu time spent up to now is 536.1 secs Computing kpt #: 382 total cpu time spent up to now is 538.0 secs Computing kpt #: 383 total cpu time spent up to now is 539.7 secs Computing kpt #: 384 total cpu time spent up to now is 542.2 secs Computing kpt #: 385 total cpu time spent up to now is 544.1 secs Computing kpt #: 386 total cpu time spent up to now is 545.9 secs Computing kpt #: 387 total cpu time spent up to now is 547.9 secs Computing kpt #: 388 total cpu time spent up to now is 549.8 secs Computing kpt #: 389 total cpu time spent up to now is 551.3 secs Computing kpt #: 390 total cpu time spent up to now is 553.0 secs Computing kpt #: 391 total cpu time spent up to now is 554.3 secs Computing kpt #: 392 total cpu time spent up to now is 555.7 secs Computing kpt #: 393 total cpu time spent up to now is 557.1 secs Computing kpt #: 394 total cpu time spent up to now is 558.5 secs Computing kpt #: 395 total cpu time spent up to now is 559.8 secs Computing kpt #: 396 total cpu time spent up to now is 561.0 secs Computing kpt #: 397 total cpu time spent up to now is 562.2 secs Computing kpt #: 398 total cpu time spent up to now is 563.4 secs Computing kpt #: 399 total cpu time spent up to now is 564.8 secs Computing kpt #: 400 total cpu time spent up to now is 566.0 secs Computing kpt #: 401 total cpu time spent up to now is 567.1 secs Computing kpt #: 402 total cpu time spent up to now is 568.3 secs Computing kpt #: 403 total cpu time spent up to now is 569.5 secs Computing kpt #: 404 total cpu time spent up to now is 570.6 secs Computing kpt #: 405 total cpu time spent up to now is 571.8 secs Computing kpt #: 406 total cpu time spent up to now is 572.9 secs Computing kpt #: 407 total cpu time spent up to now is 574.1 secs Computing kpt #: 408 total cpu time spent up to now is 575.1 secs Computing kpt #: 409 total cpu time spent up to now is 576.2 secs Computing kpt #: 410 total cpu time spent up to now is 577.3 secs Computing kpt #: 411 total cpu time spent up to now is 578.4 secs Computing kpt #: 412 total cpu time spent up to now is 579.4 secs Computing kpt #: 413 total cpu time spent up to now is 580.4 secs Computing kpt #: 414 total cpu time spent up to now is 581.4 secs Computing kpt #: 415 total cpu time spent up to now is 582.6 secs Computing kpt #: 416 total cpu time spent up to now is 583.6 secs Computing kpt #: 417 total cpu time spent up to now is 584.6 secs Computing kpt #: 418 total cpu time spent up to now is 585.6 secs Computing kpt #: 419 total cpu time spent up to now is 586.6 secs Computing kpt #: 420 total cpu time spent up to now is 587.6 secs Computing kpt #: 421 total cpu time spent up to now is 588.7 secs Computing kpt #: 422 total cpu time spent up to now is 589.7 secs Computing kpt #: 423 total cpu time spent up to now is 590.7 secs Computing kpt #: 424 total cpu time spent up to now is 591.7 secs Computing kpt #: 425 total cpu time spent up to now is 592.7 secs Computing kpt #: 426 total cpu time spent up to now is 593.7 secs Computing kpt #: 427 total cpu time spent up to now is 594.6 secs Computing kpt #: 428 total cpu time spent up to now is 595.6 secs Computing kpt #: 429 total cpu time spent up to now is 596.6 secs Computing kpt #: 430 total cpu time spent up to now is 597.5 secs Computing kpt #: 431 total cpu time spent up to now is 598.5 secs Computing kpt #: 432 total cpu time spent up to now is 599.6 secs Computing kpt #: 433 total cpu time spent up to now is 600.7 secs Computing kpt #: 434 total cpu time spent up to now is 601.8 secs Computing kpt #: 435 total cpu time spent up to now is 602.7 secs Computing kpt #: 436 total cpu time spent up to now is 603.8 secs Computing kpt #: 437 total cpu time spent up to now is 604.8 secs Computing kpt #: 438 total cpu time spent up to now is 605.9 secs Computing kpt #: 439 total cpu time spent up to now is 607.0 secs Computing kpt #: 440 total cpu time spent up to now is 608.1 secs Computing kpt #: 441 total cpu time spent up to now is 609.2 secs Computing kpt #: 442 total cpu time spent up to now is 610.4 secs Computing kpt #: 443 total cpu time spent up to now is 611.5 secs Computing kpt #: 444 total cpu time spent up to now is 612.7 secs Computing kpt #: 445 total cpu time spent up to now is 613.9 secs Computing kpt #: 446 total cpu time spent up to now is 615.0 secs Computing kpt #: 447 total cpu time spent up to now is 616.2 secs Computing kpt #: 448 total cpu time spent up to now is 617.4 secs Computing kpt #: 449 total cpu time spent up to now is 618.6 secs Computing kpt #: 450 total cpu time spent up to now is 619.8 secs Computing kpt #: 451 total cpu time spent up to now is 621.1 secs Computing kpt #: 452 total cpu time spent up to now is 622.4 secs Computing kpt #: 453 total cpu time spent up to now is 623.7 secs Computing kpt #: 454 total cpu time spent up to now is 625.2 secs Computing kpt #: 455 total cpu time spent up to now is 626.6 secs Computing kpt #: 456 total cpu time spent up to now is 628.2 secs Computing kpt #: 457 total cpu time spent up to now is 629.4 secs Computing kpt #: 458 total cpu time spent up to now is 630.8 secs Computing kpt #: 459 total cpu time spent up to now is 632.4 secs Computing kpt #: 460 total cpu time spent up to now is 633.6 secs Computing kpt #: 461 total cpu time spent up to now is 634.9 secs Computing kpt #: 462 total cpu time spent up to now is 636.5 secs Computing kpt #: 463 total cpu time spent up to now is 637.8 secs Computing kpt #: 464 total cpu time spent up to now is 639.3 secs Computing kpt #: 465 total cpu time spent up to now is 640.7 secs Computing kpt #: 466 total cpu time spent up to now is 642.2 secs Computing kpt #: 467 total cpu time spent up to now is 643.4 secs Computing kpt #: 468 total cpu time spent up to now is 644.6 secs Computing kpt #: 469 total cpu time spent up to now is 646.1 secs Computing kpt #: 470 total cpu time spent up to now is 647.6 secs Computing kpt #: 471 total cpu time spent up to now is 649.1 secs Computing kpt #: 472 total cpu time spent up to now is 650.4 secs ethr = 2.50E-11, avg # of iterations = 30.7 total cpu time spent up to now is 650.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2477 PWs) bands (ev): -46.2771 -46.2771 -23.8922 -23.8922 -21.8494 -21.8494 -21.7740 -21.7740 -19.0243 -19.0243 -8.7617 -8.7617 -8.3153 -8.3153 -8.3028 -8.3028 -2.7400 -2.7400 -2.4808 -2.4808 -2.4761 -2.4761 6.0140 6.0140 6.2073 6.2073 6.2323 6.2323 6.7175 6.7175 6.9156 6.9156 7.1460 7.1460 7.1684 7.1684 7.3463 7.3463 7.4875 7.4875 10.4478 10.4478 10.7689 10.7689 10.9675 10.9675 14.1503 14.1503 k = 0.0090 0.0091-0.0000 ( 2477 PWs) bands (ev): -46.2771 -46.2771 -23.8924 -23.8921 -21.8498 -21.8493 -21.7741 -21.7739 -19.0242 -19.0242 -8.7617 -8.7608 -8.3156 -8.3143 -8.3026 -8.3022 -2.7401 -2.7396 -2.4811 -2.4803 -2.4762 -2.4759 6.0096 6.0136 6.1983 6.2094 6.2296 6.2320 6.7150 6.7157 6.9130 6.9149 7.1435 7.1480 7.1675 7.1690 7.3469 7.3479 7.4850 7.4872 10.4486 10.4506 10.7695 10.7725 10.9652 10.9715 14.1516 14.1531 k = 0.0181 0.0182-0.0000 ( 2473 PWs) bands (ev): -46.2770 -46.2770 -23.8926 -23.8921 -21.8503 -21.8493 -21.7742 -21.7740 -19.0241 -19.0240 -8.7607 -8.7589 -8.3152 -8.3130 -8.3015 -8.3003 -2.7399 -2.7391 -2.4811 -2.4796 -2.4760 -2.4755 5.9999 6.0087 6.1818 6.2053 6.2239 6.2288 6.7091 6.7098 6.9073 6.9109 7.1410 7.1496 7.1663 7.1691 7.3495 7.3513 7.4796 7.4841 10.4530 10.4569 10.7741 10.7802 10.9649 10.9773 14.1569 14.1598 k = 0.0271 0.0273-0.0000 ( 2469 PWs) bands (ev): -46.2769 -46.2769 -23.8930 -23.8923 -21.8511 -21.8496 -21.7745 -21.7740 -19.0239 -19.0238 -8.7588 -8.7561 -8.3139 -8.3114 -8.2996 -8.2972 -2.7396 -2.7383 -2.4808 -2.4787 -2.4755 -2.4749 5.9843 5.9993 6.1575 6.1955 6.2153 6.2230 6.7001 6.7007 6.8985 6.9036 7.1387 7.1505 7.1649 7.1689 7.3533 7.3554 7.4714 7.4786 10.4609 10.4666 10.7830 10.7920 10.9667 10.9851 14.1662 14.1704 k = 0.0362 0.0364-0.0000 ( 2473 PWs) bands (ev): -46.2769 -46.2769 -23.8934 -23.8925 -21.8522 -21.8502 -21.7748 -21.7742 -19.0237 -19.0235 -8.7559 -8.7524 -8.3118 -8.3096 -8.2970 -8.2927 -2.7390 -2.7374 -2.4805 -2.4780 -2.4746 -2.4741 5.9620 5.9854 6.1255 6.1803 6.2042 6.2147 6.6877 6.6908 6.8867 6.8932 7.1368 7.1508 7.1632 7.1682 7.3570 7.3586 7.4606 7.4711 10.4722 10.4797 10.7958 10.8078 10.9710 10.9951 14.1791 14.1845 k = 0.0452 0.0455-0.0000 ( 2473 PWs) bands (ev): -46.2769 -46.2769 -23.8940 -23.8928 -21.8534 -21.8509 -21.7751 -21.7744 -19.0233 -19.0231 -8.7520 -8.7478 -8.3088 -8.3076 -8.2937 -8.2869 -2.7383 -2.7363 -2.4800 -2.4775 -2.4730 -2.4728 5.9325 5.9663 6.0862 6.1601 6.1912 6.2043 6.6734 6.6803 6.8723 6.8796 7.1353 7.1507 7.1613 7.1672 7.3594 7.3595 7.4475 7.4619 10.4871 10.4963 10.8126 10.8273 10.9782 11.0077 14.1956 14.2020 k = 0.0543 0.0545-0.0000 ( 2477 PWs) bands (ev): -46.2769 -46.2769 -23.8947 -23.8933 -21.8549 -21.8519 -21.7756 -21.7747 -19.0229 -19.0226 -8.7473 -8.7424 -8.3052 -8.3050 -8.2895 -8.2799 -2.7374 -2.7350 -2.4796 -2.4771 -2.4713 -2.4709 5.8954 5.9412 6.0411 6.1349 6.1770 6.1919 6.6583 6.6698 6.8552 6.8631 7.1343 7.1502 7.1593 7.1658 7.3569 7.3593 7.4325 7.4513 10.5055 10.5162 10.8333 10.8506 10.9888 11.0233 14.2152 14.2226 k = 0.0633 0.0636-0.0000 ( 2469 PWs) bands (ev): -46.2768 -46.2768 -23.8954 -23.8938 -21.8565 -21.8530 -21.7761 -21.7751 -19.0223 -19.0220 -8.7418 -8.7363 -8.3023 -8.3004 -8.2843 -8.2717 -2.7363 -2.7335 -2.4791 -2.4767 -2.4693 -2.4683 5.8505 5.9078 5.9931 6.1051 6.1620 6.1779 6.6429 6.6594 6.8357 6.8440 7.1338 7.1496 7.1571 7.1641 7.3500 7.3555 7.4160 7.4396 10.5273 10.5394 10.8577 10.8775 11.0033 11.0424 14.2379 14.2461 k = 0.0724 0.0727-0.0000 ( 2470 PWs) bands (ev): -46.2768 -46.2768 -23.8962 -23.8944 -21.8584 -21.8544 -21.7766 -21.7755 -19.0218 -19.0214 -8.7355 -8.7295 -8.2989 -8.2951 -8.2781 -8.2624 -2.7350 -2.7319 -2.4786 -2.4763 -2.4669 -2.4655 5.7984 5.8630 5.9461 6.0708 6.1463 6.1624 6.6272 6.6488 6.8139 6.8222 7.1336 7.1488 7.1546 7.1619 7.3389 7.3473 7.3987 7.4264 10.5523 10.5658 10.8857 10.9078 11.0220 11.0652 14.2632 14.2722 k = 0.0814 0.0818-0.0000 ( 2470 PWs) bands (ev): -46.2767 -46.2767 -23.8972 -23.8951 -21.8604 -21.8560 -21.7772 -21.7760 -19.0211 -19.0207 -8.7284 -8.7220 -8.2950 -8.2891 -8.2709 -8.2521 -2.7336 -2.7302 -2.4782 -2.4760 -2.4642 -2.4623 5.7394 5.8056 5.9022 6.0322 6.1301 6.1457 6.6113 6.6377 6.7901 6.7982 7.1337 7.1478 7.1520 7.1595 7.3242 7.3347 7.3806 7.4111 10.5806 10.5952 10.9172 10.9413 11.0453 11.0921 14.2908 14.3004 k = 0.0905 0.0909-0.0000 ( 2464 PWs) bands (ev): -46.2765 -46.2765 -23.8981 -23.8959 -21.8626 -21.8578 -21.7779 -21.7765 -19.0204 -19.0200 -8.7207 -8.7140 -8.2903 -8.2824 -8.2625 -8.2408 -2.7321 -2.7285 -2.4777 -2.4756 -2.4612 -2.4589 5.6746 5.7383 5.8596 5.9897 6.1134 6.1279 6.5946 6.6254 6.7644 6.7721 7.1339 7.1465 7.1493 7.1571 7.3069 7.3181 7.3616 7.3935 10.6121 10.6278 10.9520 10.9779 11.0733 11.1234 14.3205 14.3306 k = 0.0995 0.1000-0.0000 ( 2464 PWs) bands (ev): -46.2765 -46.2765 -23.8992 -23.8968 -21.8651 -21.8598 -21.7786 -21.7771 -19.0196 -19.0192 -8.7123 -8.7056 -8.2849 -8.2749 -8.2531 -8.2285 -2.7305 -2.7266 -2.4772 -2.4751 -2.4579 -2.4553 5.6048 5.6641 5.8162 5.9435 6.0960 6.1091 6.5765 6.6111 6.7369 6.7440 7.1340 7.1444 7.1463 7.1548 7.2878 7.2988 7.3417 7.3734 10.6465 10.6632 10.9901 11.0174 11.1061 11.1591 14.3519 14.3624 k = 0.1086 0.1091-0.0000 ( 2466 PWs) bands (ev): -46.2764 -46.2764 -23.9004 -23.8977 -21.8676 -21.8619 -21.7794 -21.7777 -19.0187 -19.0183 -8.7035 -8.6968 -8.2787 -8.2667 -8.2424 -8.2153 -2.7289 -2.7248 -2.4767 -2.4746 -2.4544 -2.4515 5.5307 5.5854 5.7707 5.8937 6.0780 6.0895 6.5563 6.5941 6.7079 6.7142 7.1337 7.1414 7.1434 7.1528 7.2674 7.2775 7.3211 7.3516 10.6839 10.7016 11.0311 11.0595 11.1436 11.1993 14.3847 14.3955 k = 0.1176 0.1182-0.0000 ( 2468 PWs) bands (ev): -46.2764 -46.2764 -23.9016 -23.8988 -21.8704 -21.8643 -21.7802 -21.7784 -19.0179 -19.0174 -8.6943 -8.6877 -8.2715 -8.2576 -8.2307 -8.2012 -2.7271 -2.7229 -2.4762 -2.4741 -2.4507 -2.4476 5.4533 5.5033 5.7225 5.8407 6.0593 6.0690 6.5331 6.5733 6.6775 6.6829 7.1325 7.1373 7.1402 7.1508 7.2461 7.2546 7.3012 7.3295 10.7240 10.7425 11.0749 11.1041 11.1859 11.2440 14.4187 14.4297 k = 0.1267 0.1273-0.0000 ( 2464 PWs) bands (ev): -46.2763 -46.2762 -23.9029 -23.8999 -21.8733 -21.8667 -21.7810 -21.7791 -19.0169 -19.0164 -8.6848 -8.6785 -8.2634 -8.2476 -8.2180 -8.1863 -2.7254 -2.7210 -2.4756 -2.4735 -2.4469 -2.4436 5.3733 5.4189 5.6716 5.7846 6.0398 6.0478 6.5062 6.5481 6.6458 6.6501 7.1301 7.1324 7.1364 7.1483 7.2234 7.2301 7.2841 7.3093 10.7668 10.7861 11.1213 11.1510 11.2327 11.2929 14.4537 14.4648 k = 0.1357 0.1364-0.0000 ( 2458 PWs) bands (ev): -46.2761 -46.2761 -23.9043 -23.9011 -21.8763 -21.8694 -21.7819 -21.7799 -19.0159 -19.0154 -8.6750 -8.6692 -8.2543 -8.2366 -8.2042 -8.1706 -2.7236 -2.7191 -2.4750 -2.4729 -2.4430 -2.4396 5.2912 5.3328 5.6178 5.7257 6.0196 6.0259 6.4748 6.5177 6.6130 6.6161 7.1264 7.1265 7.1308 7.1449 7.1984 7.2040 7.2721 7.2937 10.8122 10.8322 11.1699 11.1999 11.2840 11.3460 14.4895 14.5005 k = 0.1448 0.1455-0.0000 ( 2458 PWs) bands (ev): -46.2760 -46.2760 -23.9057 -23.9024 -21.8794 -21.8722 -21.7828 -21.7807 -19.0149 -19.0144 -8.6652 -8.6598 -8.2440 -8.2245 -8.1894 -8.1540 -2.7218 -2.7172 -2.4743 -2.4722 -2.4391 -2.4356 5.2076 5.2456 5.5615 5.6641 5.9987 6.0033 6.4382 6.4813 6.5792 6.5809 7.1197 7.1203 7.1233 7.1404 7.1709 7.1779 7.2664 7.2847 10.8598 10.8806 11.2204 11.2506 11.3394 11.4030 14.5257 14.5368 k = 0.1538 0.1545-0.0000 ( 2456 PWs) bands (ev): -46.2759 -46.2759 -23.9072 -23.9037 -21.8827 -21.8751 -21.7837 -21.7815 -19.0139 -19.0134 -8.6553 -8.6505 -8.2327 -8.2114 -8.1737 -8.1368 -2.7200 -2.7154 -2.4736 -2.4715 -2.4353 -2.4317 5.1231 5.1578 5.5027 5.6002 5.9770 5.9802 6.3960 6.4387 6.5444 6.5447 7.1070 7.1119 7.1167 7.1335 7.1431 7.1548 7.2670 7.2825 10.9097 10.9311 11.2725 11.3028 11.3988 11.4636 14.5623 14.5733 k = 0.1629 0.1636-0.0000 ( 2460 PWs) bands (ev): -46.2758 -46.2758 -23.9087 -23.9051 -21.8861 -21.8782 -21.7847 -21.7824 -19.0129 -19.0123 -8.6454 -8.6414 -8.2201 -8.1973 -8.1571 -8.1189 -2.7183 -2.7137 -2.4728 -2.4707 -2.4315 -2.4279 5.0380 5.0698 5.4417 5.5342 5.9547 5.9565 6.3479 6.3895 6.5077 6.5089 7.0869 7.1025 7.1089 7.1099 7.1314 7.1379 7.2731 7.2864 10.9617 10.9837 11.3258 11.3562 11.4619 11.5275 14.5991 14.6099 k = 0.1719 0.1727-0.0000 ( 2454 PWs) bands (ev): -46.2756 -46.2756 -23.9103 -23.9065 -21.8896 -21.8814 -21.7857 -21.7833 -19.0118 -19.0112 -8.6357 -8.6324 -8.2063 -8.1820 -8.1396 -8.1004 -2.7165 -2.7120 -2.4720 -2.4699 -2.4278 -2.4242 4.9528 4.9818 5.3788 5.4664 5.9319 5.9323 6.2938 6.3339 6.4702 6.4726 7.0624 7.0782 7.0953 7.0994 7.1257 7.1273 7.2837 7.2952 11.0156 11.0381 11.3803 11.4108 11.5282 11.5944 14.6360 14.6466 k = 0.1810 0.1818-0.0000 ( 2458 PWs) bands (ev): -46.2756 -46.2756 -23.9119 -23.9080 -21.8931 -21.8846 -21.7867 -21.7842 -19.0107 -19.0102 -8.6262 -8.6237 -8.1912 -8.1657 -8.1212 -8.0812 -2.7149 -2.7104 -2.4711 -2.4690 -2.4243 -2.4208 4.8677 4.8943 5.3142 5.3969 5.9077 5.9084 6.2340 6.2720 6.4321 6.4358 7.0363 7.0490 7.0860 7.0890 7.1203 7.1205 7.2980 7.3081 11.0712 11.0943 11.4356 11.4662 11.5976 11.6639 14.6728 14.6832 k = 0.1900 0.1909-0.0000 ( 2458 PWs) bands (ev): -46.2755 -46.2755 -23.9136 -23.9096 -21.8967 -21.8880 -21.7878 -21.7852 -19.0096 -19.0091 -8.6169 -8.6152 -8.1749 -8.1484 -8.1020 -8.0615 -2.7132 -2.7088 -2.4702 -2.4681 -2.4210 -2.4176 4.7832 4.8074 5.2480 5.3261 5.8828 5.8845 6.1686 6.2044 6.3938 6.3986 7.0107 7.0213 7.0772 7.0787 7.1150 7.1157 7.3154 7.3243 11.1284 11.1520 11.4915 11.5222 11.6695 11.7357 14.7093 14.7194 k = 0.1991 0.2000-0.0000 ( 2460 PWs) bands (ev): -46.2754 -46.2754 -23.9153 -23.9112 -21.9004 -21.8915 -21.7888 -21.7862 -19.0086 -19.0080 -8.6079 -8.6070 -8.1575 -8.1302 -8.0821 -8.0414 -2.7117 -2.7074 -2.4693 -2.4672 -2.4180 -2.4147 4.6994 4.7216 5.1807 5.2541 5.8577 5.8602 6.0984 6.1315 6.3552 6.3611 6.9865 6.9955 7.0687 7.0689 7.1104 7.1111 7.3354 7.3434 11.1871 11.2111 11.5478 11.5787 11.7436 11.8095 14.7455 14.7553 k = 0.2081 0.2091-0.0000 ( 2464 PWs) bands (ev): -46.2753 -46.2753 -23.9170 -23.9128 -21.9042 -21.8950 -21.7899 -21.7872 -19.0075 -19.0069 -8.5992 -8.5991 -8.1388 -8.1111 -8.0613 -8.0208 -2.7102 -2.7061 -2.4683 -2.4662 -2.4152 -2.4122 4.6166 4.6368 5.1124 5.1814 5.8323 5.8355 6.0240 6.0541 6.3166 6.3235 6.9641 6.9719 7.0597 7.0607 7.1063 7.1068 7.3577 7.3648 11.2469 11.2713 11.6045 11.6354 11.8196 11.8849 14.7812 14.7908 k = 0.2172 0.2182-0.0000 ( 2466 PWs) bands (ev): -46.2752 -46.2752 -23.9187 -23.9144 -21.9079 -21.8986 -21.7909 -21.7882 -19.0064 -19.0059 -8.5915 -8.5909 -8.1191 -8.0913 -8.0399 -7.9998 -2.7088 -2.7049 -2.4672 -2.4652 -2.4128 -2.4099 4.5350 4.5535 5.0435 5.1080 5.8068 5.8102 5.9461 5.9729 6.2780 6.2857 6.9438 6.9508 7.0512 7.0530 7.1025 7.1027 7.3819 7.3883 11.3079 11.3327 11.6612 11.6923 11.8970 11.9616 14.8164 14.8256 k = 0.2262 0.2273-0.0000 ( 2466 PWs) bands (ev): -46.2751 -46.2751 -23.9204 -23.9161 -21.9117 -21.9022 -21.7920 -21.7892 -19.0054 -19.0048 -8.5841 -8.5828 -8.0984 -8.0708 -8.0178 -7.9785 -2.7074 -2.7038 -2.4662 -2.4641 -2.4107 -2.4081 4.4549 4.4718 4.9740 5.0343 5.7811 5.7835 5.8664 5.8888 6.2395 6.2480 6.9257 6.9321 7.0433 7.0458 7.0988 7.0989 7.4078 7.4136 11.3697 11.3949 11.7179 11.7492 11.9757 12.0393 14.8509 14.8598 k = 0.2353 0.2364-0.0000 ( 2464 PWs) bands (ev): -46.2750 -46.2750 -23.9222 -23.9178 -21.9154 -21.9059 -21.7930 -21.7902 -19.0044 -19.0038 -8.5770 -8.5751 -8.0767 -8.0498 -7.9950 -7.9570 -2.7061 -2.7027 -2.4650 -2.4630 -2.4090 -2.4066 4.3765 4.3919 4.9043 4.9604 5.7495 5.7544 5.7916 5.8032 6.2012 6.2104 6.9099 6.9158 7.0360 7.0389 7.0952 7.0956 7.4353 7.4405 11.4322 11.4577 11.7744 11.8058 12.0551 12.1177 14.8847 14.8932 k = 0.2443 0.2455-0.0000 ( 2460 PWs) bands (ev): -46.2748 -46.2748 -23.9239 -23.9195 -21.9192 -21.9096 -21.7941 -21.7912 -19.0033 -19.0028 -8.5701 -8.5677 -8.0542 -8.0283 -7.9717 -7.9352 -2.7049 -2.7018 -2.4639 -2.4620 -2.4077 -2.4055 4.2999 4.3139 4.8347 4.8867 5.6833 5.7064 5.7370 5.7471 6.1631 6.1731 6.8964 6.9019 7.0293 7.0324 7.0917 7.0923 7.4640 7.4687 11.4953 11.5211 11.8306 11.8621 12.1352 12.1965 14.9176 14.9257 k = 0.2534 0.2545-0.0000 ( 2452 PWs) bands (ev): -46.2746 -46.2746 -23.9256 -23.9212 -21.9229 -21.9132 -21.7951 -21.7923 -19.0024 -19.0018 -8.5635 -8.5606 -8.0310 -8.0065 -7.9478 -7.9132 -2.7038 -2.7010 -2.4628 -2.4609 -2.4067 -2.4048 4.2252 4.2380 4.7653 4.8134 5.5992 5.6194 5.7088 5.7194 6.1254 6.1359 6.8852 6.8905 7.0230 7.0262 7.0885 7.0893 7.4937 7.4981 11.5588 11.5848 11.8863 11.9179 12.2154 12.2755 14.9496 14.9574 k = 0.2624 0.2636-0.0000 ( 2460 PWs) bands (ev): -46.2745 -46.2745 -23.9274 -23.9229 -21.9266 -21.9170 -21.7962 -21.7933 -19.0014 -19.0009 -8.5570 -8.5537 -8.0072 -7.9844 -7.9235 -7.8912 -2.7028 -2.7004 -2.4616 -2.4599 -2.4061 -2.4046 4.1527 4.1643 4.6963 4.7406 5.5116 5.5287 5.6839 5.6944 6.0881 6.0992 6.8761 6.8813 7.0172 7.0203 7.0855 7.0864 7.5244 7.5284 11.6223 11.6486 11.9414 11.9730 12.2956 12.3542 14.9807 14.9881 k = 0.2715 0.2727-0.0000 ( 2462 PWs) bands (ev): -46.2744 -46.2744 -23.9291 -23.9247 -21.9303 -21.9206 -21.7972 -21.7943 -19.0005 -19.0000 -8.5508 -8.5471 -7.9830 -7.9623 -7.8989 -7.8691 -2.7020 -2.6998 -2.4605 -2.4589 -2.4059 -2.4046 4.0825 4.0930 4.6280 4.6686 5.4230 5.4371 5.6597 5.6704 6.0513 6.0628 6.8692 6.8744 7.0119 7.0148 7.0826 7.0837 7.5559 7.5595 11.6858 11.7123 11.9957 12.0273 12.3756 12.4326 15.0107 15.0178 k = 0.2805 0.2818-0.0000 ( 2462 PWs) bands (ev): -46.2743 -46.2743 -23.9308 -23.9264 -21.9339 -21.9243 -21.7982 -21.7953 -18.9996 -18.9992 -8.5447 -8.5407 -7.9585 -7.9402 -7.8740 -7.8470 -2.7012 -2.6994 -2.4595 -2.4580 -2.4060 -2.4050 4.0147 4.0243 4.5606 4.5976 5.3341 5.3455 5.6363 5.6472 6.0151 6.0270 6.8643 6.8697 7.0069 7.0094 7.0799 7.0811 7.5878 7.5911 11.7491 11.7757 12.0491 12.0807 12.4549 12.5104 15.0397 15.0464 k = 0.2896 0.2909-0.0000 ( 2458 PWs) bands (ev): -46.2742 -46.2742 -23.9324 -23.9281 -21.9374 -21.9279 -21.7991 -21.7963 -18.9988 -18.9983 -8.5388 -8.5346 -7.9338 -7.9181 -7.8489 -7.8250 -2.7005 -2.6991 -2.4585 -2.4572 -2.4064 -2.4056 3.9494 3.9582 4.4943 4.5279 5.2454 5.2543 5.6135 5.6246 5.9794 5.9917 6.8614 6.8670 7.0023 7.0044 7.0774 7.0786 7.6202 7.6232 11.8119 11.8387 12.1015 12.1331 12.5335 12.5872 15.0676 15.0739 k = 0.2986 0.3000-0.0000 ( 2446 PWs) bands (ev): -46.2739 -46.2739 -23.9340 -23.9297 -21.9409 -21.9315 -21.8001 -21.7973 -18.9980 -18.9975 -8.5330 -8.5286 -7.9091 -7.8962 -7.8238 -7.8031 -2.6999 -2.6989 -2.4575 -2.4565 -2.4070 -2.4065 3.8868 3.8948 4.4291 4.4595 5.1573 5.1639 5.5914 5.6028 5.9445 5.9571 6.8603 6.8662 6.9981 6.9996 7.0751 7.0763 7.6528 7.6555 11.8741 11.9011 12.1528 12.1843 12.6110 12.6630 15.0943 15.1002 k = 0.3077 0.3091-0.0000 ( 2452 PWs) bands (ev): -46.2739 -46.2738 -23.9356 -23.9314 -21.9442 -21.9350 -21.8010 -21.7982 -18.9972 -18.9968 -8.5274 -8.5228 -7.8845 -7.8745 -7.7987 -7.7814 -2.6994 -2.6989 -2.4568 -2.4560 -2.4079 -2.4075 3.8269 3.8342 4.3655 4.3927 5.0703 5.0746 5.5701 5.5817 5.9103 5.9232 6.8610 6.8672 6.9943 6.9950 7.0730 7.0742 7.6854 7.6879 11.9354 11.9625 12.2028 12.2342 12.6872 12.7373 15.1198 15.1254 k = 0.3167 0.3182-0.0000 ( 2448 PWs) bands (ev): -46.2737 -46.2737 -23.9371 -23.9330 -21.9475 -21.9385 -21.8019 -21.7992 -18.9965 -18.9961 -8.5219 -8.5173 -7.8602 -7.8532 -7.7738 -7.7599 -2.6991 -2.6989 -2.4562 -2.4557 -2.4088 -2.4086 3.7698 3.7766 4.3034 4.3276 4.9846 4.9868 5.5496 5.5615 5.8769 5.8900 6.8631 6.8698 6.9907 6.9908 7.0710 7.0722 7.7180 7.7202 11.9957 12.0229 12.2514 12.2827 12.7619 12.8100 15.1442 15.1493 k = 0.3258 0.3273-0.0000 ( 2452 PWs) bands (ev): -46.2736 -46.2736 -23.9386 -23.9346 -21.9507 -21.9418 -21.8027 -21.8001 -18.9958 -18.9954 -8.5166 -8.5119 -7.8364 -7.8322 -7.7493 -7.7386 -2.6991 -2.6989 -2.4558 -2.4557 -2.4098 -2.4097 3.7157 3.7220 4.2430 4.2645 4.9005 4.9007 5.5300 5.5421 5.8444 5.8577 6.8667 6.8740 6.9866 6.9877 7.0691 7.0703 7.7502 7.7522 12.0548 12.0819 12.2985 12.3296 12.8348 12.8809 15.1673 15.1721 k = 0.3348 0.3364-0.0000 ( 2460 PWs) bands (ev): -46.2736 -46.2736 -23.9401 -23.9362 -21.9537 -21.9451 -21.8035 -21.8010 -18.9952 -18.9948 -8.5114 -8.5067 -7.8130 -7.8117 -7.7251 -7.7176 -2.6994 -2.6988 -2.4560 -2.4557 -2.4109 -2.4107 3.6646 3.6705 4.1846 4.2034 4.8168 4.8183 5.5114 5.5236 5.8128 5.8262 6.8714 6.8794 6.9827 6.9849 7.0674 7.0685 7.7821 7.7838 12.1123 12.1394 12.3440 12.3749 12.9056 12.9497 15.1891 15.1936 k = 0.3439 0.3455-0.0000 ( 2456 PWs) bands (ev): -46.2734 -46.2734 -23.9415 -23.9377 -21.9566 -21.9483 -21.8043 -21.8018 -18.9946 -18.9943 -8.5063 -8.5017 -7.7917 -7.7904 -7.7015 -7.6971 -2.6998 -2.6989 -2.4566 -2.4558 -2.4118 -2.4116 3.6166 3.6222 4.1282 4.1445 4.7352 4.7384 5.4938 5.5062 5.7822 5.7958 6.8771 6.8861 6.9791 6.9826 7.0658 7.0669 7.8133 7.8149 12.1682 12.1952 12.3878 12.4185 12.9743 13.0162 15.2098 15.2139 k = 0.3529 0.3545-0.0000 ( 2456 PWs) bands (ev): -46.2733 -46.2733 -23.9428 -23.9392 -21.9594 -21.9514 -21.8051 -21.8027 -18.9940 -18.9937 -8.5014 -8.4969 -7.7723 -7.7686 -7.6786 -7.6769 -2.7004 -2.6990 -2.4575 -2.4563 -2.4126 -2.4123 3.5717 3.5770 4.0740 4.0880 4.6563 4.6610 5.4773 5.4897 5.7527 5.7663 6.8837 6.8937 6.9757 6.9806 7.0644 7.0653 7.8439 7.8453 12.2222 12.2492 12.4299 12.4602 13.0405 13.0802 15.2291 15.2329 k = 0.3620 0.3636-0.0000 ( 2456 PWs) bands (ev): -46.2733 -46.2733 -23.9441 -23.9406 -21.9620 -21.9544 -21.8058 -21.8035 -18.9935 -18.9932 -8.4967 -8.4922 -7.7536 -7.7478 -7.6572 -7.6564 -2.7010 -2.6993 -2.4587 -2.4570 -2.4132 -2.4128 3.5299 3.5351 4.0221 4.0340 4.5803 4.5863 5.4619 5.4743 5.7244 5.7380 6.8907 6.9021 6.9724 6.9792 7.0631 7.0639 7.8735 7.8747 12.2743 12.3010 12.4701 12.4999 13.1040 13.1415 15.2473 15.2508 k = 0.3710 0.3727-0.0000 ( 2456 PWs) bands (ev): -46.2732 -46.2732 -23.9452 -23.9419 -21.9645 -21.9572 -21.8064 -21.8042 -18.9930 -18.9928 -8.4921 -8.4878 -7.7356 -7.7280 -7.6381 -7.6352 -2.7016 -2.6997 -2.4602 -2.4581 -2.4136 -2.4131 3.4914 3.4963 3.9726 3.9826 4.5075 4.5147 5.4476 5.4600 5.6972 5.7107 6.8981 6.9112 6.9695 6.9783 7.0620 7.0627 7.9021 7.9032 12.3240 12.3504 12.5083 12.5376 13.1647 13.1999 15.2642 15.2674 k = 0.3801 0.3818-0.0000 ( 2460 PWs) bands (ev): -46.2732 -46.2732 -23.9464 -23.9432 -21.9668 -21.9599 -21.8070 -21.8050 -18.9926 -18.9924 -8.4878 -8.4836 -7.7184 -7.7094 -7.6196 -7.6149 -2.7024 -2.7003 -2.4620 -2.4594 -2.4138 -2.4132 3.4560 3.4609 3.9257 3.9339 4.4382 4.4463 5.4345 5.4469 5.6713 5.6847 6.9054 6.9207 6.9667 6.9780 7.0609 7.0615 7.9296 7.9305 12.3713 12.3973 12.5444 12.5731 13.2223 13.2551 15.2799 15.2828 k = 0.3891 0.3909-0.0000 ( 2460 PWs) bands (ev): -46.2731 -46.2731 -23.9474 -23.9444 -21.9690 -21.9625 -21.8076 -21.8057 -18.9922 -18.9920 -8.4836 -8.4797 -7.7021 -7.6920 -7.6018 -7.5957 -2.7032 -2.7009 -2.4638 -2.4610 -2.4137 -2.4131 3.4239 3.4286 3.8814 3.8881 4.3726 4.3814 5.4225 5.4348 5.6468 5.6600 6.9125 6.9303 6.9641 6.9785 7.0600 7.0604 7.9557 7.9565 12.4161 12.4416 12.5785 12.6064 13.2766 13.3070 15.2945 15.2970 k = 0.3982 0.4000-0.0000 ( 2458 PWs) bands (ev): -46.2730 -46.2730 -23.9483 -23.9456 -21.9709 -21.9649 -21.8081 -21.8063 -18.9918 -18.9917 -8.4797 -8.4760 -7.6867 -7.6760 -7.5849 -7.5778 -2.7040 -2.7016 -2.4658 -2.4627 -2.4136 -2.4128 3.3949 3.3996 3.8399 3.8453 4.3110 4.3202 5.4119 5.4240 5.6236 5.6366 6.9190 6.9400 6.9619 6.9798 7.0592 7.0595 7.9803 7.9810 12.4581 12.4829 12.6104 12.6374 13.3274 13.3554 15.3078 15.3101 k = 0.4072 0.4091-0.0000 ( 2452 PWs) bands (ev): -46.2728 -46.2728 -23.9492 -23.9467 -21.9727 -21.9671 -21.8086 -21.8069 -18.9915 -18.9913 -8.4760 -8.4726 -7.6723 -7.6612 -7.5688 -7.5611 -2.7049 -2.7024 -2.4677 -2.4645 -2.4132 -2.4125 3.3691 3.3737 3.8012 3.8054 4.2535 4.2631 5.4024 5.4142 5.6019 5.6146 6.9246 6.9491 6.9602 6.9821 7.0585 7.0586 8.0033 8.0039 12.4972 12.5210 12.6401 12.6660 13.3746 13.4002 15.3200 15.3220 k = 0.4163 0.4182-0.0000 ( 2448 PWs) bands (ev): -46.2727 -46.2727 -23.9500 -23.9477 -21.9743 -21.9692 -21.8090 -21.8075 -18.9912 -18.9911 -8.4726 -8.4694 -7.6589 -7.6479 -7.5538 -7.5457 -2.7057 -2.7032 -2.4696 -2.4664 -2.4128 -2.4121 3.3464 3.3508 3.7655 3.7688 4.2006 4.2102 5.3942 5.4057 5.5818 5.5941 6.9292 6.9546 6.9621 6.9853 7.0579 7.0579 8.0247 8.0252 12.5333 12.5560 12.6675 12.6920 13.4180 13.4412 15.3310 15.3327 k = 0.4253 0.4273-0.0000 ( 2448 PWs) bands (ev): -46.2726 -46.2726 -23.9507 -23.9486 -21.9758 -21.9712 -21.8094 -21.8080 -18.9910 -18.9908 -8.4694 -8.4666 -7.6466 -7.6360 -7.5399 -7.5319 -2.7065 -2.7040 -2.4714 -2.4683 -2.4124 -2.4116 3.3267 3.3309 3.7329 3.7354 4.1524 4.1618 5.3872 5.3982 5.5634 5.5751 6.9328 6.9542 6.9696 6.9891 7.0573 7.0574 8.0442 8.0446 12.5661 12.5874 12.6925 12.7155 13.4574 13.4781 15.3408 15.3423 k = 0.4344 0.4364-0.0000 ( 2452 PWs) bands (ev): -46.2727 -46.2727 -23.9513 -23.9494 -21.9770 -21.9729 -21.8097 -21.8085 -18.9907 -18.9906 -8.4666 -8.4640 -7.6355 -7.6255 -7.5272 -7.5195 -2.7072 -2.7049 -2.4731 -2.4701 -2.4119 -2.4112 3.3098 3.3139 3.7035 3.7053 4.1092 4.1182 5.3813 5.3917 5.5467 5.5577 6.9355 6.9528 6.9776 6.9934 7.0568 7.0571 8.0617 8.0620 12.5957 12.6153 12.7152 12.7363 13.4928 13.5110 15.3495 15.3508 k = 0.4434 0.4455-0.0000 ( 2448 PWs) bands (ev): -46.2726 -46.2726 -23.9518 -23.9502 -21.9781 -21.9745 -21.8100 -21.8089 -18.9905 -18.9904 -8.4640 -8.4618 -7.6256 -7.6165 -7.5158 -7.5087 -2.7079 -2.7058 -2.4745 -2.4718 -2.4114 -2.4108 3.2958 3.2995 3.6775 3.6787 4.0711 4.0794 5.3767 5.3863 5.5319 5.5421 6.9375 6.9513 6.9852 6.9978 7.0565 7.0568 8.0772 8.0775 12.6218 12.6395 12.7354 12.7543 13.5241 13.5398 15.3571 15.3582 k = 0.4525 0.4546-0.0000 ( 2452 PWs) bands (ev): -46.2726 -46.2726 -23.9522 -23.9508 -21.9789 -21.9759 -21.8102 -21.8093 -18.9904 -18.9903 -8.4618 -8.4599 -7.6169 -7.6089 -7.5059 -7.4995 -2.7085 -2.7066 -2.4757 -2.4733 -2.4109 -2.4104 3.2843 3.2876 3.6549 3.6557 4.0385 4.0459 5.3731 5.3818 5.5192 5.5282 6.9390 6.9498 6.9920 7.0019 7.0562 7.0566 8.0906 8.0908 12.6445 12.6600 12.7531 12.7696 13.5510 13.5642 15.3635 15.3644 k = 0.4615 0.4636-0.0000 ( 2456 PWs) bands (ev): -46.2726 -46.2726 -23.9525 -23.9514 -21.9796 -21.9771 -21.8103 -21.8096 -18.9903 -18.9902 -8.4599 -8.4584 -7.6095 -7.6028 -7.4974 -7.4920 -2.7090 -2.7074 -2.4767 -2.4747 -2.4105 -2.4101 3.2752 3.2781 3.6359 3.6365 4.0114 4.0177 5.3706 5.3781 5.5085 5.5163 6.9402 6.9485 6.9978 7.0055 7.0561 7.0565 8.1017 8.1019 12.6637 12.6766 12.7682 12.7820 13.5736 13.5843 15.3688 15.3695 k = 0.4706 0.4727-0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9528 -23.9519 -21.9800 -21.9782 -21.8104 -21.8099 -18.9901 -18.9901 -8.4584 -8.4572 -7.6034 -7.5982 -7.4905 -7.4862 -2.7093 -2.7080 -2.4775 -2.4759 -2.4101 -2.4098 3.2684 3.2707 3.6207 3.6211 3.9900 3.9950 5.3691 5.3751 5.5002 5.5065 6.9412 6.9473 7.0027 7.0084 7.0560 7.0564 8.1106 8.1108 12.6792 12.6894 12.7807 12.7915 13.5917 13.5999 15.3731 15.3736 k = 0.4796 0.4818-0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9523 -21.9803 -21.9790 -21.8105 -21.8101 -18.9901 -18.9900 -8.4572 -8.4563 -7.5987 -7.5950 -7.4851 -7.4821 -2.7095 -2.7086 -2.4780 -2.4768 -2.4099 -2.4096 3.2637 3.2654 3.6094 3.6096 3.9745 3.9780 5.3683 5.3727 5.4943 5.4988 6.9421 6.9462 7.0065 7.0103 7.0561 7.0563 8.1172 8.1173 12.6911 12.6982 12.7904 12.7980 13.6054 13.6111 15.3762 15.3766 k = 0.4887 0.4909-0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9526 -21.9804 -21.9796 -21.8105 -21.8103 -18.9900 -18.9900 -8.4563 -8.4559 -7.5954 -7.5933 -7.4815 -7.4798 -2.7095 -2.7090 -2.4782 -2.4775 -2.4096 -2.4095 3.2610 3.2619 3.6022 3.6023 3.9648 3.9668 5.3683 5.3708 5.4908 5.4934 6.9430 6.9452 7.0092 7.0113 7.0561 7.0563 8.1214 8.1214 12.6993 12.7033 12.7972 12.8015 13.6146 13.6178 15.3782 15.3784 k = 0.4977 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9528 -21.9802 -21.9801 -21.8104 -21.8104 -18.9900 -18.9900 -8.4559 -8.4558 -7.5935 -7.5931 -7.4795 -7.4792 -2.7094 -2.7093 -2.4781 -2.4780 -2.4095 -2.4095 3.2600 3.2602 3.5991 3.5991 3.9612 3.9616 5.3689 5.3694 5.4900 5.4905 6.9439 6.9443 7.0109 7.0113 7.0562 7.0562 8.1232 8.1232 12.7037 12.7046 12.8012 12.8020 13.6193 13.6199 15.3791 15.3792 k = 0.4977 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9528 -21.9802 -21.9801 -21.8104 -21.8104 -18.9900 -18.9900 -8.4559 -8.4558 -7.5935 -7.5931 -7.4795 -7.4792 -2.7094 -2.7093 -2.4781 -2.4780 -2.4095 -2.4095 3.2600 3.2602 3.5991 3.5991 3.9612 3.9616 5.3689 5.3694 5.4900 5.4905 6.9439 6.9443 7.0109 7.0113 7.0562 7.0562 8.1232 8.1232 12.7037 12.7046 12.8012 12.8020 13.6193 13.6199 15.3791 15.3792 k = 0.4850 0.5000-0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9527 -21.9803 -21.9797 -21.8105 -21.8103 -18.9900 -18.9900 -8.4563 -8.4559 -7.5951 -7.5935 -7.4811 -7.4798 -2.7095 -2.7091 -2.4781 -2.4776 -2.4096 -2.4095 3.2616 3.2623 3.6018 3.6019 3.9640 3.9655 5.3688 5.3707 5.4907 5.4927 6.9430 6.9447 7.0099 7.0115 7.0562 7.0563 8.1217 8.1217 12.7002 12.7032 12.7979 12.8011 13.6153 13.6177 15.3784 15.3786 k = 0.4722 0.5000-0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9528 -23.9524 -21.9802 -21.9792 -21.8105 -21.8102 -18.9901 -18.9900 -8.4570 -8.4564 -7.5983 -7.5955 -7.4842 -7.4820 -2.7094 -2.7087 -2.4779 -2.4770 -2.4098 -2.4096 3.2660 3.2672 3.6087 3.6089 3.9714 3.9741 5.3696 5.3728 5.4936 5.4970 6.9415 6.9444 7.0084 7.0112 7.0562 7.0564 8.1178 8.1179 12.6928 12.6980 12.7920 12.7975 13.6069 13.6111 15.3768 15.3771 k = 0.4594 0.5000-0.0000 ( 2456 PWs) bands (ev): -46.2726 -46.2726 -23.9527 -23.9521 -21.9798 -21.9785 -21.8104 -21.8100 -18.9901 -18.9901 -8.4581 -8.4573 -7.6032 -7.5993 -7.4886 -7.4854 -2.7092 -2.7083 -2.4774 -2.4762 -2.4101 -2.4099 3.2727 3.2745 3.6201 3.6203 3.9836 3.9874 5.3713 5.3758 5.4986 5.5033 6.9394 6.9436 7.0065 7.0105 7.0562 7.0565 8.1116 8.1117 12.6808 12.6877 12.7846 12.7920 13.5941 13.6000 15.3743 15.3747 k = 0.4467 0.5000-0.0000 ( 2454 PWs) bands (ev): -46.2726 -46.2726 -23.9524 -23.9516 -21.9793 -21.9776 -21.8102 -21.8097 -18.9902 -18.9902 -8.4596 -8.4585 -7.6103 -7.6053 -7.4938 -7.4896 -2.7088 -2.7076 -2.4767 -2.4752 -2.4105 -2.4102 3.2813 3.2836 3.6364 3.6365 4.0006 4.0056 5.3739 5.3796 5.5057 5.5116 6.9366 6.9421 7.0043 7.0094 7.0563 7.0567 8.1032 8.1033 12.6632 12.6712 12.7772 12.7857 13.5772 13.5848 15.3708 15.3713 k = 0.4339 0.5000-0.0000 ( 2454 PWs) bands (ev): -46.2726 -46.2726 -23.9521 -23.9511 -21.9786 -21.9765 -21.8101 -21.8094 -18.9904 -18.9903 -8.4615 -8.4601 -7.6200 -7.6140 -7.4991 -7.4942 -2.7083 -2.7069 -2.4757 -2.4739 -2.4110 -2.4105 3.2909 3.2937 3.6579 3.6580 4.0225 4.0288 5.3774 5.3840 5.5151 5.5220 6.9332 6.9399 7.0019 7.0081 7.0565 7.0569 8.0924 8.0925 12.6392 12.6475 12.7706 12.7796 13.5563 13.5656 15.3664 15.3671 k = 0.4212 0.5000-0.0000 ( 2454 PWs) bands (ev): -46.2727 -46.2727 -23.9516 -23.9505 -21.9777 -21.9752 -21.8098 -21.8091 -18.9905 -18.9905 -8.4638 -8.4621 -7.6325 -7.6258 -7.5041 -7.4986 -2.7077 -2.7061 -2.4745 -2.4724 -2.4115 -2.4110 3.3007 3.3040 3.6849 3.6851 4.0497 4.0572 5.3818 5.3892 5.5266 5.5344 6.9290 6.9368 6.9993 7.0065 7.0568 7.0572 8.0792 8.0793 12.6086 12.6165 12.7655 12.7742 13.5317 13.5427 15.3608 15.3617 k = 0.4084 0.5000-0.0000 ( 2456 PWs) bands (ev): -46.2727 -46.2727 -23.9511 -23.9498 -21.9766 -21.9738 -21.8095 -21.8087 -18.9907 -18.9906 -8.4664 -8.4644 -7.6480 -7.6409 -7.5083 -7.5025 -2.7070 -2.7052 -2.4731 -2.4707 -2.4121 -2.4115 3.3103 3.3139 3.7173 3.7179 4.0823 4.0912 5.3869 5.3949 5.5403 5.5488 6.9240 6.9328 6.9968 7.0049 7.0571 7.0576 8.0635 8.0637 12.5714 12.5786 12.7614 12.7696 13.5038 13.5164 15.3542 15.3553 k = 0.3956 0.5000-0.0000 ( 2455 PWs) bands (ev): -46.2728 -46.2728 -23.9505 -23.9490 -21.9754 -21.9722 -21.8091 -21.8082 -18.9909 -18.9908 -8.4694 -8.4672 -7.6666 -7.6593 -7.5115 -7.5056 -2.7061 -2.7041 -2.4715 -2.4689 -2.4127 -2.4121 3.3190 3.3230 3.7550 3.7561 4.1209 4.1312 5.3927 5.4011 5.5562 5.5652 6.9182 6.9279 6.9944 7.0032 7.0576 7.0581 8.0454 8.0456 12.5281 12.5345 12.7583 12.7657 13.4729 13.4872 15.3464 15.3477 k = 0.3829 0.5000-0.0000 ( 2451 PWs) bands (ev): -46.2728 -46.2728 -23.9498 -23.9482 -21.9740 -21.9705 -21.8087 -21.8077 -18.9911 -18.9910 -8.4729 -8.4704 -7.6882 -7.6809 -7.5137 -7.5079 -2.7052 -2.7030 -2.4696 -2.4668 -2.4133 -2.4126 3.3268 3.3309 3.7973 3.7992 4.1657 4.1774 5.3991 5.4079 5.5742 5.5836 6.9115 6.9219 6.9923 7.0017 7.0581 7.0587 8.0248 8.0250 12.4791 12.4848 12.7556 12.7623 13.4394 13.4553 15.3372 15.3388 k = 0.3701 0.5000-0.0000 ( 2451 PWs) bands (ev): -46.2728 -46.2728 -23.9490 -23.9473 -21.9725 -21.9687 -21.8082 -21.8071 -18.9914 -18.9913 -8.4768 -8.4740 -7.7123 -7.7052 -7.5151 -7.5094 -2.7041 -2.7019 -2.4676 -2.4646 -2.4139 -2.4132 3.3335 3.3377 3.8437 3.8464 4.2172 4.2304 5.4061 5.4151 5.5943 5.6039 6.9039 6.9149 6.9906 7.0004 7.0588 7.0593 8.0017 8.0018 12.4249 12.4299 12.7534 12.7593 13.4037 13.4212 15.3266 15.3285 k = 0.3573 0.5000-0.0000 ( 2449 PWs) bands (ev): -46.2729 -46.2729 -23.9482 -23.9464 -21.9708 -21.9667 -21.8077 -21.8065 -18.9916 -18.9915 -8.4811 -8.4780 -7.7388 -7.7320 -7.5156 -7.5103 -2.7030 -2.7007 -2.4654 -2.4623 -2.4146 -2.4138 3.3391 3.3433 3.8933 3.8969 4.2758 4.2904 5.4137 5.4227 5.6164 5.6261 6.8954 6.9068 6.9894 6.9993 7.0595 7.0601 7.9759 7.9760 12.3661 12.3704 12.7513 12.7566 13.3664 13.3853 15.3145 15.3168 k = 0.3446 0.5000-0.0000 ( 2453 PWs) bands (ev): -46.2730 -46.2730 -23.9473 -23.9454 -21.9690 -21.9647 -21.8070 -21.8058 -18.9919 -18.9918 -8.4859 -8.4825 -7.7672 -7.7607 -7.5156 -7.5105 -2.7019 -2.6995 -2.4630 -2.4599 -2.4151 -2.4144 3.3438 3.3480 3.9453 3.9497 4.3416 4.3576 5.4217 5.4306 5.6404 5.6501 6.8861 6.8978 6.9886 6.9985 7.0604 7.0610 7.9474 7.9476 12.3030 12.3067 12.7493 12.7540 13.3277 13.3481 15.3007 15.3033 k = 0.3318 0.5000-0.0000 ( 2457 PWs) bands (ev): -46.2731 -46.2731 -23.9464 -23.9443 -21.9671 -21.9626 -21.8063 -21.8050 -18.9922 -18.9921 -8.4911 -8.4874 -7.7971 -7.7910 -7.5151 -7.5103 -2.7007 -2.6982 -2.4606 -2.4574 -2.4156 -2.4148 3.3477 3.3518 3.9991 4.0043 4.4148 4.4319 5.4301 5.4389 5.6662 5.6758 6.8760 6.8878 6.9883 6.9982 7.0614 7.0619 7.9164 7.9165 12.2362 12.2394 12.7474 12.7516 13.2882 13.3100 15.2849 15.2880 k = 0.3191 0.5000-0.0000 ( 2455 PWs) bands (ev): -46.2732 -46.2732 -23.9453 -23.9432 -21.9652 -21.9605 -21.8056 -21.8042 -18.9925 -18.9924 -8.4969 -8.4929 -7.8281 -7.8225 -7.5142 -7.5097 -2.6994 -2.6970 -2.4581 -2.4549 -2.4159 -2.4152 3.3509 3.3549 4.0543 4.0602 4.4949 4.5131 5.4389 5.4474 5.6937 5.7032 6.8652 6.8771 6.9887 6.9984 7.0626 7.0631 7.8826 7.8827 12.1662 12.1689 12.7455 12.7493 13.2483 13.2715 15.2671 15.2707 k = 0.3063 0.5000-0.0000 ( 2452 PWs) bands (ev): -46.2732 -46.2732 -23.9443 -23.9421 -21.9631 -21.9583 -21.8047 -21.8033 -18.9928 -18.9927 -8.5032 -8.4989 -7.8600 -7.8548 -7.5129 -7.5087 -2.6981 -2.6957 -2.4556 -2.4525 -2.4160 -2.4153 3.3536 3.3575 4.1106 4.1170 4.5816 4.6006 5.4479 5.4562 5.7227 5.7321 6.8537 6.8656 6.9896 6.9991 7.0639 7.0643 7.8461 7.8462 12.0934 12.0957 12.7437 12.7469 13.2084 13.2329 15.2470 15.2511 k = 0.2935 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2732 -46.2732 -23.9432 -23.9409 -21.9610 -21.9561 -21.8038 -21.8024 -18.9931 -18.9930 -8.5101 -8.5055 -7.8923 -7.8876 -7.5115 -7.5075 -2.6968 -2.6944 -2.4532 -2.4502 -2.4159 -2.4153 3.3558 3.3595 4.1680 4.1749 4.6741 4.6937 5.4572 5.4652 5.7532 5.7625 6.8416 6.8536 6.9912 7.0004 7.0653 7.0657 7.8070 7.8071 12.0182 12.0201 12.7418 12.7446 13.1689 13.1946 15.2242 15.2290 k = 0.2808 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2733 -46.2733 -23.9421 -23.9398 -21.9589 -21.9539 -21.8028 -21.8014 -18.9935 -18.9933 -8.5175 -8.5126 -7.9247 -7.9205 -7.5098 -7.5061 -2.6955 -2.6932 -2.4510 -2.4482 -2.4154 -2.4149 3.3576 3.3612 4.2265 4.2337 4.7715 4.7918 5.4667 5.4744 5.7850 5.7941 6.8290 6.8410 6.9935 7.0024 7.0668 7.0672 7.7653 7.7653 11.9411 11.9427 12.7399 12.7423 13.1302 13.1571 15.1987 15.2042 k = 0.2680 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2734 -46.2734 -23.9409 -23.9386 -21.9568 -21.9517 -21.8018 -21.8003 -18.9938 -18.9937 -8.5257 -8.5205 -7.9568 -7.9531 -7.5080 -7.5046 -2.6942 -2.6920 -2.4490 -2.4464 -2.4144 -2.4142 3.3592 3.3626 4.2861 4.2935 4.8730 4.8938 5.4763 5.4836 5.8180 5.8268 6.8159 6.8279 6.9966 7.0052 7.0685 7.0689 7.7210 7.7211 11.8626 11.8640 12.7379 12.7400 13.0926 13.1206 15.1699 15.1762 k = 0.2552 0.5000-0.0000 ( 2450 PWs) bands (ev): -46.2735 -46.2735 -23.9398 -23.9375 -21.9546 -21.9496 -21.8007 -21.7992 -18.9942 -18.9940 -8.5344 -8.5289 -7.9884 -7.9852 -7.5061 -7.5029 -2.6930 -2.6908 -2.4473 -2.4450 -2.4131 -2.4130 3.3605 3.3638 4.3469 4.3545 4.9776 4.9988 5.4860 5.4929 5.8519 5.8605 6.8023 6.8144 7.0006 7.0089 7.0704 7.0707 7.6744 7.6744 11.7831 11.7843 12.7359 12.7376 13.0564 13.0856 15.1377 15.1449 k = 0.2425 0.5000-0.0000 ( 2452 PWs) bands (ev): -46.2736 -46.2736 -23.9386 -23.9363 -21.9525 -21.9475 -21.7995 -21.7981 -18.9945 -18.9944 -8.5439 -8.5381 -8.0191 -8.0164 -7.5041 -7.5011 -2.6918 -2.6897 -2.4460 -2.4440 -2.4114 -2.4112 3.3616 3.3647 4.4089 4.4166 5.0842 5.1058 5.4957 5.5023 5.8865 5.8949 6.7884 6.8005 7.0057 7.0136 7.0725 7.0728 7.6255 7.6255 11.7031 11.7041 12.7339 12.7352 13.0219 13.0521 15.1018 15.1099 k = 0.2297 0.5000-0.0000 ( 2456 PWs) bands (ev): -46.2737 -46.2737 -23.9375 -23.9352 -21.9504 -21.9454 -21.7983 -21.7969 -18.9948 -18.9947 -8.5540 -8.5480 -8.0487 -8.0465 -7.5021 -7.4993 -2.6906 -2.6887 -2.4450 -2.4434 -2.4094 -2.4090 3.3626 3.3655 4.4722 4.4800 5.1917 5.2139 5.5055 5.5116 5.9218 5.9300 6.7741 6.7863 7.0118 7.0194 7.0748 7.0750 7.5746 7.5746 11.6231 11.6239 12.7318 12.7327 12.9895 13.0207 15.0618 15.0710 k = 0.2170 0.5000-0.0000 ( 2455 PWs) bands (ev): -46.2738 -46.2738 -23.9363 -23.9341 -21.9483 -21.9434 -21.7971 -21.7957 -18.9952 -18.9950 -8.5648 -8.5586 -8.0769 -8.0753 -7.5000 -7.4974 -2.6895 -2.6877 -2.4443 -2.4430 -2.4069 -2.4064 3.3634 3.3661 4.5366 4.5446 5.2989 5.3218 5.5154 5.5208 5.9574 5.9654 6.7596 6.7718 7.0190 7.0262 7.0773 7.0775 7.5222 7.5222 11.5436 11.5442 12.7296 12.7302 12.9593 12.9913 15.0175 15.0279 k = 0.2042 0.5000-0.0000 ( 2461 PWs) bands (ev): -46.2740 -46.2740 -23.9352 -23.9330 -21.9463 -21.9416 -21.7958 -21.7945 -18.9955 -18.9954 -8.5763 -8.5700 -8.1035 -8.1023 -7.4980 -7.4955 -2.6885 -2.6868 -2.4440 -2.4429 -2.4042 -2.4035 3.3641 3.3667 4.6023 4.6103 5.4042 5.4283 5.5259 5.5303 5.9932 6.0010 6.7446 6.7570 7.0273 7.0342 7.0801 7.0802 7.4686 7.4686 11.4650 11.4654 12.7274 12.7277 12.9315 12.9642 14.9689 14.9804 k = 0.1914 0.5000-0.0000 ( 2457 PWs) bands (ev): -46.2740 -46.2740 -23.9341 -23.9319 -21.9444 -21.9398 -21.7945 -21.7932 -18.9958 -18.9957 -8.5884 -8.5819 -8.1284 -8.1276 -7.4959 -7.4937 -2.6875 -2.6859 -2.4438 -2.4430 -2.4013 -2.4004 3.3648 3.3671 4.6690 4.6772 5.5008 5.5253 5.5427 5.5468 6.0289 6.0366 6.7293 6.7419 7.0365 7.0428 7.0833 7.0833 7.4146 7.4146 11.3877 11.3881 12.7251 12.7251 12.9063 12.9396 14.9159 14.9287 k = 0.1787 0.5000-0.0000 ( 2455 PWs) bands (ev): -46.2740 -46.2740 -23.9330 -23.9309 -21.9426 -21.9381 -21.7932 -21.7920 -18.9961 -18.9960 -8.6009 -8.5944 -8.1513 -8.1510 -7.4939 -7.4918 -2.6866 -2.6851 -2.4438 -2.4432 -2.3982 -2.3973 3.3653 3.3675 4.7367 4.7450 5.5366 5.5451 5.6165 5.6368 6.0642 6.0719 6.7135 6.7263 7.0459 7.0516 7.0867 7.0870 7.3615 7.3616 11.3124 11.3126 12.7225 12.7227 12.8839 12.9176 14.8586 14.8726 k = 0.1659 0.5000-0.0000 ( 2449 PWs) bands (ev): -46.2740 -46.2740 -23.9319 -23.9299 -21.9408 -21.9365 -21.7918 -21.7907 -18.9964 -18.9963 -8.6138 -8.6074 -8.1724 -8.1724 -7.4920 -7.4900 -2.6857 -2.6843 -2.4439 -2.4434 -2.3950 -2.3941 3.3658 3.3679 4.8051 4.8135 5.5473 5.5538 5.7103 5.7331 6.0990 6.1066 6.6971 6.7102 7.0540 7.0590 7.0903 7.0910 7.3116 7.3117 11.2394 11.2395 12.7199 12.7203 12.8642 12.8981 14.7975 14.8127 k = 0.1531 0.5000-0.0000 ( 2446 PWs) bands (ev): -46.2741 -46.2741 -23.9309 -23.9290 -21.9391 -21.9351 -21.7905 -21.7895 -18.9967 -18.9966 -8.6269 -8.6207 -8.1917 -8.1914 -7.4901 -7.4883 -2.6849 -2.6836 -2.4441 -2.4437 -2.3919 -2.3910 3.3663 3.3682 4.8742 4.8827 5.5561 5.5617 5.8000 5.8241 6.1330 6.1406 6.6798 6.6933 7.0583 7.0622 7.0933 7.0945 7.2694 7.2695 11.1692 11.1693 12.7174 12.7178 12.8474 12.8811 14.7330 14.7494 k = 0.1404 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2742 -46.2742 -23.9300 -23.9282 -21.9375 -21.9338 -21.7892 -21.7883 -18.9970 -18.9969 -8.6401 -8.6340 -8.2090 -8.2085 -7.4883 -7.4867 -2.6842 -2.6830 -2.4444 -2.4441 -2.3888 -2.3879 3.3667 3.3684 4.9435 4.9521 5.5640 5.5692 5.8831 5.9085 6.1658 6.1736 6.6614 6.6752 7.0533 7.0562 7.0945 7.0960 7.2419 7.2421 11.1023 11.1023 12.7149 12.7152 12.8334 12.8667 14.6660 14.6833 k = 0.1276 0.5000-0.0000 ( 2445 PWs) bands (ev): -46.2742 -46.2742 -23.9290 -23.9274 -21.9361 -21.9326 -21.7880 -21.7872 -18.9972 -18.9971 -8.6530 -8.6472 -8.2243 -8.2237 -7.4866 -7.4851 -2.6835 -2.6825 -2.4447 -2.4444 -2.3858 -2.3850 3.3671 3.3686 5.0128 5.0214 5.5714 5.5761 5.9586 5.9853 6.1973 6.2054 6.6413 6.6556 7.0328 7.0349 7.0953 7.0967 7.2349 7.2354 11.0392 11.0392 12.7125 12.7128 12.8222 12.8546 14.5976 14.6156 k = 0.1149 0.5000-0.0000 ( 2445 PWs) bands (ev): -46.2742 -46.2742 -23.9282 -23.9267 -21.9347 -21.9315 -21.7868 -21.7861 -18.9975 -18.9974 -8.6655 -8.6601 -8.2378 -8.2370 -7.4850 -7.4837 -2.6829 -2.6820 -2.4449 -2.4448 -2.3830 -2.3822 3.3674 3.3687 5.0815 5.0902 5.5782 5.5825 6.0256 6.0539 6.2273 6.2357 6.6190 6.6339 6.9990 7.0005 7.0972 7.0985 7.2453 7.2461 10.9803 10.9803 12.7103 12.7105 12.8135 12.8448 14.5290 14.5474 k = 0.1021 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2743 -46.2743 -23.9274 -23.9260 -21.9335 -21.9306 -21.7857 -21.7851 -18.9977 -18.9976 -8.6774 -8.6724 -8.2494 -8.2486 -7.4836 -7.4824 -2.6824 -2.6816 -2.4452 -2.4451 -2.3804 -2.3797 3.3677 3.3689 5.1492 5.1579 5.5844 5.5883 6.0839 6.1137 6.2553 6.2643 6.5940 6.6095 6.9602 6.9613 7.0998 7.1009 7.2659 7.2668 10.9260 10.9262 12.7084 12.7084 12.8072 12.8369 14.4616 14.4800 k = 0.0893 0.5000-0.0000 ( 2445 PWs) bands (ev): -46.2743 -46.2743 -23.9267 -23.9255 -21.9323 -21.9298 -21.7847 -21.7842 -18.9979 -18.9978 -8.6883 -8.6839 -8.2594 -8.2586 -7.4823 -7.4812 -2.6819 -2.6813 -2.4455 -2.4454 -2.3780 -2.3774 3.3679 3.3690 5.2150 5.2236 5.5900 5.5936 6.1332 6.1647 6.2812 6.2907 6.5658 6.5822 6.9222 6.9230 7.1026 7.1035 7.2917 7.2925 10.8770 10.8771 12.7066 12.7068 12.8031 12.8308 14.3970 14.4150 k = 0.0766 0.5000-0.0000 ( 2444 PWs) bands (ev): -46.2744 -46.2744 -23.9260 -23.9250 -21.9313 -21.9292 -21.7838 -21.7833 -18.9980 -18.9979 -8.6982 -8.6944 -8.2677 -8.2670 -7.4811 -7.4802 -2.6816 -2.6810 -2.4457 -2.4456 -2.3759 -2.3753 3.3682 3.3691 5.2779 5.2863 5.5951 5.5984 6.1740 6.2072 6.3044 6.3147 6.5347 6.5518 6.8882 6.8887 7.1054 7.1061 7.3194 7.3201 10.8336 10.8337 12.7052 12.7054 12.8009 12.8260 14.3369 14.3539 k = 0.0638 0.5000-0.0000 ( 2442 PWs) bands (ev): -46.2744 -46.2744 -23.9255 -23.9246 -21.9305 -21.9286 -21.7830 -21.7826 -18.9982 -18.9981 -8.7069 -8.7036 -8.2746 -8.2740 -7.4801 -7.4794 -2.6812 -2.6807 -2.4459 -2.4458 -2.3740 -2.3735 3.3684 3.3691 5.3368 5.3448 5.5995 5.6025 6.2070 6.2417 6.3245 6.3357 6.5017 6.5194 6.8598 6.8600 7.1079 7.1085 7.3468 7.3473 10.7960 10.7962 12.7042 12.7044 12.8002 12.8224 14.2829 14.2983 k = 0.0510 0.5000-0.0000 ( 2444 PWs) bands (ev): -46.2744 -46.2744 -23.9250 -23.9243 -21.9297 -21.9282 -21.7824 -21.7820 -18.9983 -18.9982 -8.7141 -8.7115 -8.2801 -8.2796 -7.4792 -7.4786 -2.6809 -2.6806 -2.4460 -2.4460 -2.3725 -2.3721 3.3686 3.3692 5.3898 5.3972 5.6035 5.6061 6.2330 6.2688 6.3407 6.3533 6.4690 6.4868 6.8374 6.8374 7.1102 7.1107 7.3718 7.3722 10.7649 10.7650 12.7035 12.7037 12.8009 12.8195 14.2364 14.2498 k = 0.0383 0.5000-0.0000 ( 2441 PWs) bands (ev): -46.2744 -46.2744 -23.9246 -23.9240 -21.9291 -21.9280 -21.7818 -21.7816 -18.9984 -18.9983 -8.7198 -8.7178 -8.2843 -8.2839 -7.4785 -7.4781 -2.6807 -2.6804 -2.4461 -2.4461 -2.3712 -2.3709 3.3687 3.3692 5.4351 5.4415 5.6069 5.6091 6.2532 6.2886 6.3519 6.3667 6.4405 6.4563 6.8206 6.8206 7.1120 7.1124 7.3931 7.3934 10.7403 10.7404 12.7030 12.7032 12.8025 12.8171 14.1991 14.2097 k = 0.0255 0.5000-0.0000 ( 2443 PWs) bands (ev): -46.2745 -46.2745 -23.9243 -23.9239 -21.9286 -21.9278 -21.7814 -21.7812 -18.9984 -18.9984 -8.7239 -8.7225 -8.2872 -8.2870 -7.4780 -7.4777 -2.6805 -2.6803 -2.4462 -2.4462 -2.3703 -2.3701 3.3689 3.3691 5.4703 5.4750 5.6098 5.6115 6.2691 6.3001 6.3580 6.3750 6.4207 6.4312 6.8091 6.8092 7.1134 7.1137 7.4092 7.4094 10.7225 10.7226 12.7027 12.7028 12.8048 12.8148 14.1721 14.1795 k = 0.0128 0.5000-0.0000 ( 2446 PWs) bands (ev): -46.2745 -46.2745 -23.9241 -23.9239 -21.9282 -21.9278 -21.7812 -21.7811 -18.9985 -18.9984 -8.7262 -8.7255 -8.2889 -8.2888 -7.4777 -7.4775 -2.6804 -2.6803 -2.4463 -2.4463 -2.3697 -2.3697 3.3690 3.3691 5.4930 5.4956 5.6120 5.6130 6.2822 6.3011 6.3626 6.3760 6.4116 6.4152 6.8024 6.8025 7.1143 7.1145 7.4193 7.4194 10.7118 10.7118 12.7026 12.7026 12.8073 12.8124 14.1563 14.1601 k = 0.0000 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2745 -46.2745 -23.9239 -23.9239 -21.9280 -21.9280 -21.7810 -21.7810 -18.9985 -18.9985 -8.7267 -8.7267 -8.2895 -8.2895 -7.4775 -7.4775 -2.6804 -2.6804 -2.4463 -2.4463 -2.3695 -2.3695 3.3690 3.3690 5.5017 5.5017 5.6132 5.6132 6.2935 6.2935 6.3697 6.3697 6.4099 6.4099 6.8003 6.8003 7.1147 7.1147 7.4227 7.4227 10.7082 10.7082 12.7026 12.7026 12.8099 12.8099 14.1522 14.1522 k = 0.0000 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2745 -46.2745 -23.9239 -23.9239 -21.9280 -21.9280 -21.7810 -21.7810 -18.9985 -18.9985 -8.7267 -8.7267 -8.2895 -8.2895 -7.4775 -7.4775 -2.6804 -2.6804 -2.4463 -2.4463 -2.3695 -2.3695 3.3690 3.3690 5.5017 5.5017 5.6132 5.6132 6.2935 6.2935 6.3697 6.3697 6.4099 6.4099 6.8003 6.8003 7.1147 7.1147 7.4227 7.4227 10.7082 10.7082 12.7026 12.7026 12.8099 12.8099 14.1522 14.1522 k = 0.0000 0.5000 0.0127 ( 2450 PWs) bands (ev): -46.2746 -46.2746 -23.9241 -23.9238 -21.9281 -21.9279 -21.7815 -21.7809 -18.9985 -18.9984 -8.7265 -8.7251 -8.2898 -8.2879 -7.4777 -7.4775 -2.6811 -2.6797 -2.4472 -2.4455 -2.3699 -2.3695 3.3690 3.3691 5.4984 5.5033 5.6027 5.6081 6.2798 6.3053 6.3546 6.3869 6.4039 6.4184 6.8037 6.8045 7.0969 7.1156 7.4180 7.4372 10.7064 10.7132 12.6979 12.7068 12.8060 12.8141 14.1557 14.1591 k = 0.0000 0.5000 0.0254 ( 2448 PWs) bands (ev): -46.2745 -46.2745 -23.9244 -23.9238 -21.9283 -21.9277 -21.7822 -21.7811 -18.9984 -18.9984 -8.7244 -8.7216 -8.2887 -8.2849 -7.4781 -7.4776 -2.6819 -2.6792 -2.4480 -2.4447 -2.3706 -2.3699 3.3688 3.3691 5.4921 5.5036 5.5772 5.5895 6.2660 6.3106 6.3428 6.3968 6.4065 6.4322 6.8150 6.8163 7.0667 7.0995 7.4232 7.4574 10.7079 10.7213 12.6932 12.7105 12.8025 12.8185 14.1695 14.1761 k = 0.0000 0.5000 0.0381 ( 2444 PWs) bands (ev): -46.2744 -46.2744 -23.9248 -23.9239 -21.9284 -21.9277 -21.7833 -21.7816 -18.9983 -18.9983 -8.7205 -8.7164 -8.2863 -8.2806 -7.4786 -7.4778 -2.6827 -2.6788 -2.4489 -2.4439 -2.3717 -2.3707 3.3687 3.3691 5.4790 5.5031 5.5389 5.5631 6.2515 6.3042 6.3352 6.3880 6.4275 6.4514 6.8342 6.8355 7.0295 7.0707 7.4350 7.4790 10.7130 10.7328 12.6886 12.7137 12.7996 12.8230 14.1928 14.2024 k = 0.0000 0.5000 0.0508 ( 2448 PWs) bands (ev): -46.2745 -46.2745 -23.9252 -23.9241 -21.9286 -21.9276 -21.7847 -21.7824 -18.9982 -18.9982 -8.7149 -8.7094 -8.2825 -8.2750 -7.4793 -7.4782 -2.6837 -2.6784 -2.4498 -2.4432 -2.3732 -2.3718 3.3684 3.3691 5.4521 5.4901 5.5019 5.5390 6.2352 6.2878 6.3282 6.3747 6.4504 6.4732 6.8599 6.8613 6.9915 7.0354 7.4487 7.4989 10.7222 10.7481 12.6845 12.7168 12.7974 12.8276 14.2247 14.2367 k = 0.0000 0.5000 0.0635 ( 2450 PWs) bands (ev): -46.2745 -46.2745 -23.9258 -23.9244 -21.9288 -21.9275 -21.7863 -21.7835 -18.9981 -18.9980 -8.7078 -8.7008 -8.2773 -8.2678 -7.4801 -7.4787 -2.6847 -2.6782 -2.4506 -2.4424 -2.3751 -2.3733 3.3682 3.3690 5.4074 5.4336 5.4999 5.5238 6.2156 6.2645 6.3186 6.3562 6.4733 6.4950 6.8821 6.8918 6.9648 7.0013 7.4610 7.5150 10.7359 10.7675 12.6814 12.7201 12.7959 12.8324 14.2639 14.2779 k = 0.0000 0.5000 0.0762 ( 2450 PWs) bands (ev): -46.2744 -46.2744 -23.9264 -23.9247 -21.9290 -21.9275 -21.7883 -21.7850 -18.9979 -18.9978 -8.6991 -8.6908 -8.2704 -8.2591 -7.4811 -7.4794 -2.6858 -2.6781 -2.4515 -2.4418 -2.3772 -2.3751 3.3679 3.3689 5.3505 5.3712 5.4972 5.5146 6.1907 6.2343 6.3058 6.3319 6.4947 6.5152 6.8763 6.9094 6.9765 6.9885 7.4699 7.5262 10.7548 10.7917 12.6796 12.7240 12.7951 12.8375 14.3087 14.3241 k = 0.0000 0.5000 0.0889 ( 2456 PWs) bands (ev): -46.2745 -46.2745 -23.9271 -23.9252 -21.9292 -21.9275 -21.7904 -21.7866 -18.9977 -18.9976 -8.6892 -8.6796 -8.2620 -8.2487 -7.4822 -7.4802 -2.6869 -2.6782 -2.4523 -2.4411 -2.3797 -2.3772 3.3676 3.3687 5.2867 5.3047 5.4940 5.5078 6.1579 6.1960 6.2896 6.3037 6.5140 6.5335 6.8510 6.8923 7.0190 7.0198 7.4744 7.5319 10.7793 10.8209 12.6793 12.7291 12.7949 12.8430 14.3575 14.3740 k = 0.0000 0.5000 0.1016 ( 2458 PWs) bands (ev): -46.2744 -46.2744 -23.9279 -23.9257 -21.9295 -21.9274 -21.7929 -21.7886 -18.9975 -18.9974 -8.6783 -8.6673 -8.2517 -8.2365 -7.4834 -7.4811 -2.6881 -2.6783 -2.4532 -2.4406 -2.3825 -2.3796 3.3672 3.3685 5.2188 5.2353 5.4902 5.5019 6.1146 6.1485 6.2665 6.2779 6.5313 6.5500 6.8260 6.8648 7.0709 7.0728 7.4740 7.5319 10.8098 10.8556 12.6807 12.7358 12.7953 12.8492 14.4087 14.4259 k = 0.0000 0.5000 0.1143 ( 2462 PWs) bands (ev): -46.2744 -46.2744 -23.9288 -23.9264 -21.9297 -21.9275 -21.7955 -21.7908 -18.9972 -18.9971 -8.6664 -8.6542 -8.2395 -8.2225 -7.4848 -7.4822 -2.6894 -2.6786 -2.4539 -2.4400 -2.3855 -2.3823 3.3668 3.3682 5.1485 5.1641 5.4858 5.4963 6.0591 6.0902 6.2371 6.2569 6.5469 6.5651 6.8058 6.8393 7.1291 7.1317 7.4689 7.5266 10.8465 10.8960 12.6839 12.7443 12.7962 12.8563 14.4609 14.4785 k = 0.0000 0.5000 0.1270 ( 2462 PWs) bands (ev): -46.2744 -46.2744 -23.9297 -23.9271 -21.9300 -21.9275 -21.7984 -21.7932 -18.9969 -18.9968 -8.6540 -8.6406 -8.2252 -8.2066 -7.4862 -7.4833 -2.6908 -2.6791 -2.4547 -2.4396 -2.3887 -2.3852 3.3663 3.3680 5.0768 5.0918 5.4809 5.4906 5.9922 6.0210 6.2082 6.2355 6.5612 6.5792 6.7909 6.8184 7.1903 7.1934 7.4596 7.5163 10.8895 10.9421 12.6888 12.7548 12.7978 12.8645 14.5127 14.5305 k = 0.0000 0.5000 0.1397 ( 2460 PWs) bands (ev): -46.2742 -46.2742 -23.9307 -23.9278 -21.9304 -21.9276 -21.8014 -21.7958 -18.9966 -18.9965 -8.6411 -8.6267 -8.2088 -8.1885 -7.4878 -7.4846 -2.6921 -2.6797 -2.4554 -2.4392 -2.3921 -2.3883 3.3658 3.3676 5.0045 5.0191 5.4755 5.4847 5.9153 5.9418 6.1804 6.2128 6.5747 6.5926 6.7806 6.8025 7.2522 7.2561 7.4473 7.5021 10.9387 10.9939 12.6952 12.7670 12.8006 12.8742 14.5630 14.5808 k = 0.0000 0.5000 0.1524 ( 2466 PWs) bands (ev): -46.2742 -46.2742 -23.9317 -23.9287 -21.9307 -21.9278 -21.8046 -21.7986 -18.9963 -18.9962 -8.6281 -8.6128 -8.1901 -8.1683 -7.4895 -7.4859 -2.6936 -2.6804 -2.4561 -2.4389 -2.3956 -2.3915 3.3652 3.3672 4.9321 4.9463 5.4695 5.4785 5.8300 5.8546 6.1533 6.1885 6.5878 6.6056 6.7740 6.7909 7.3114 7.3178 7.4349 7.4854 10.9937 11.0511 12.7028 12.7792 12.8062 12.8857 14.6110 14.6287 k = 0.0000 0.5000 0.1651 ( 2468 PWs) bands (ev): -46.2742 -46.2742 -23.9328 -23.9296 -21.9311 -21.9279 -21.8079 -21.8016 -18.9959 -18.9958 -8.6151 -8.5991 -8.1690 -8.1460 -7.4913 -7.4873 -2.6951 -2.6813 -2.4567 -2.4388 -2.3992 -2.3949 3.3645 3.3667 4.8600 4.8739 5.4628 5.4721 5.7383 5.7612 6.1263 6.1629 6.6005 6.6184 6.7704 6.7832 7.3557 7.3736 7.4344 7.4715 11.0542 11.1134 12.7113 12.7882 12.8182 12.8994 14.6559 14.6736 k = 0.0000 0.5000 0.1778 ( 2464 PWs) bands (ev): -46.2740 -46.2740 -23.9339 -23.9306 -21.9315 -21.9282 -21.8112 -21.8046 -18.9956 -18.9954 -8.6023 -8.5858 -8.1456 -8.1214 -7.4931 -7.4887 -2.6967 -2.6824 -2.4574 -2.4389 -2.4027 -2.3983 3.3638 3.3662 4.7884 4.8022 5.4549 5.4652 5.6418 5.6631 6.0989 6.1359 6.6131 6.6311 6.7689 6.7788 7.3604 7.4013 7.4705 7.4824 11.1199 11.1804 12.7203 12.7931 12.8373 12.9157 14.6974 14.7152 k = 0.0000 0.5000 0.1905 ( 2462 PWs) bands (ev): -46.2739 -46.2739 -23.9351 -23.9316 -21.9320 -21.9284 -21.8147 -21.8078 -18.9952 -18.9950 -8.5899 -8.5731 -8.1199 -8.0947 -7.4950 -7.4902 -2.6982 -2.6836 -2.4581 -2.4392 -2.4061 -2.4017 3.3629 3.3655 4.7177 4.7314 5.4434 5.4575 5.5440 5.5627 6.0711 6.1077 6.6255 6.6438 6.7689 6.7771 7.3431 7.3894 7.5259 7.5299 11.1900 11.2515 12.7293 12.7960 12.8614 12.9348 14.7352 14.7531 k = 0.0000 0.5000 0.2032 ( 2458 PWs) bands (ev): -46.2738 -46.2738 -23.9362 -23.9327 -21.9325 -21.9288 -21.8182 -21.8111 -18.9947 -18.9946 -8.5779 -8.5610 -8.0919 -8.0660 -7.4969 -7.4917 -2.6999 -2.6849 -2.4587 -2.4398 -2.4092 -2.4051 3.3619 3.3648 4.6480 4.6617 5.4067 5.4398 5.4600 5.4777 6.0426 6.0785 6.6380 6.6565 6.7699 6.7778 7.3203 7.3655 7.5843 7.5867 11.2641 11.3264 12.7381 12.7983 12.8892 12.9569 14.7693 14.7874 k = 0.0000 0.5000 0.2159 ( 2456 PWs) bands (ev): -46.2737 -46.2737 -23.9375 -23.9338 -21.9331 -21.9292 -21.8216 -21.8144 -18.9943 -18.9942 -8.5665 -8.5497 -8.0618 -8.0354 -7.4989 -7.4932 -2.7015 -2.6864 -2.4595 -2.4410 -2.4120 -2.4083 3.3608 3.3639 4.5795 4.5931 5.3159 5.3448 5.4438 5.4525 6.0137 6.0483 6.6503 6.6692 6.7720 6.7802 7.2958 7.3385 7.6421 7.6440 11.3416 11.4042 12.7464 12.8002 12.9200 12.9823 14.7996 14.8180 k = 0.0000 0.5000 0.2286 ( 2460 PWs) bands (ev): -46.2736 -46.2736 -23.9387 -23.9350 -21.9337 -21.9296 -21.8251 -21.8177 -18.9939 -18.9938 -8.5557 -8.5392 -8.0298 -8.0031 -7.5008 -7.4946 -2.7032 -2.6880 -2.4604 -2.4426 -2.4143 -2.4114 3.3596 3.3629 4.5123 4.5258 5.2115 5.2386 5.4353 5.4425 5.9842 6.0174 6.6627 6.6818 6.7749 6.7839 7.2707 7.3105 7.6984 7.7000 11.4217 11.4846 12.7540 12.8020 12.9536 13.0108 14.8264 14.8451 k = 0.0000 0.5000 0.2413 ( 2464 PWs) bands (ev): -46.2736 -46.2736 -23.9399 -23.9362 -21.9344 -21.9302 -21.8285 -21.8211 -18.9935 -18.9933 -8.5456 -8.5294 -7.9962 -7.9692 -7.5028 -7.4960 -2.7049 -2.6897 -2.4614 -2.4449 -2.4161 -2.4141 3.3582 3.3616 4.4463 4.4600 5.1051 5.1316 5.4275 5.4345 5.9544 5.9859 6.6749 6.6944 6.7787 6.7886 7.2457 7.2825 7.7525 7.7539 11.5039 11.5668 12.7609 12.8037 12.9898 13.0424 14.8498 14.8689 k = 0.0000 0.5000 0.2540 ( 2464 PWs) bands (ev): -46.2735 -46.2735 -23.9412 -23.9374 -21.9352 -21.9308 -21.8318 -21.8244 -18.9931 -18.9929 -8.5361 -8.5204 -7.9613 -7.9342 -7.5047 -7.4973 -2.7066 -2.6915 -2.4627 -2.4476 -2.4177 -2.4163 3.3565 3.3602 4.3818 4.3955 4.9992 5.0254 5.4199 5.4270 5.9243 5.9541 6.6870 6.7068 6.7833 6.7940 7.2212 7.2549 7.8042 7.8055 11.5878 11.6505 12.7672 12.8054 13.0283 13.0766 14.8699 14.8895 k = 0.0000 0.5000 0.2667 ( 2462 PWs) bands (ev): -46.2733 -46.2733 -23.9424 -23.9387 -21.9359 -21.9315 -21.8351 -21.8276 -18.9926 -18.9925 -8.5272 -8.5121 -7.9254 -7.8982 -7.5066 -7.4984 -2.7083 -2.6935 -2.4641 -2.4507 -2.4194 -2.4174 3.3546 3.3585 4.3186 4.3323 4.8948 4.9208 5.4126 5.4197 5.8942 5.9222 6.6989 6.7191 6.7886 6.8000 7.1975 7.2280 7.8533 7.8544 11.6725 11.7348 12.7728 12.8071 13.0689 13.1134 14.8872 14.9071 k = 0.0000 0.5000 0.2794 ( 2446 PWs) bands (ev): -46.2730 -46.2730 -23.9436 -23.9399 -21.9368 -21.9323 -21.8381 -21.8308 -18.9922 -18.9920 -8.5189 -8.5045 -7.8887 -7.8616 -7.5083 -7.4994 -2.7100 -2.6954 -2.4658 -2.4541 -2.4210 -2.4179 3.3524 3.3565 4.2568 4.2706 4.7931 4.8188 5.4055 5.4127 5.8641 5.8904 6.7105 6.7312 6.7944 6.8064 7.1748 7.2021 7.8997 7.9007 11.7576 11.8194 12.7779 12.8088 13.1111 13.1522 14.9018 14.9221 k = 0.0000 0.5000 0.2921 ( 2456 PWs) bands (ev): -46.2730 -46.2730 -23.9448 -23.9411 -21.9376 -21.9332 -21.8411 -21.8338 -18.9918 -18.9916 -8.5112 -8.4976 -7.8518 -7.8247 -7.5099 -7.5001 -2.7116 -2.6975 -2.4678 -2.4577 -2.4223 -2.4180 3.3497 3.3541 4.1962 4.2101 4.6949 4.7201 5.3985 5.4059 5.8344 5.8588 6.7219 6.7430 6.8007 6.8131 7.1531 7.1772 7.9432 7.9442 11.8424 11.9035 12.7824 12.8104 13.1547 13.1927 14.9138 14.9344 k = 0.0000 0.5000 0.3048 ( 2458 PWs) bands (ev): -46.2730 -46.2730 -23.9459 -23.9424 -21.9386 -21.9341 -21.8438 -21.8368 -18.9913 -18.9912 -8.5041 -8.4912 -7.8150 -7.7878 -7.5113 -7.5005 -2.7133 -2.6996 -2.4700 -2.4614 -2.4232 -2.4179 3.3466 3.3512 4.1369 4.1509 4.6011 4.6256 5.3919 5.3993 5.8051 5.8278 6.7330 6.7544 6.8074 6.8202 7.1325 7.1536 7.9840 7.9849 11.9265 11.9867 12.7864 12.8121 13.1992 13.2344 14.9237 14.9445 k = 0.0000 0.5000 0.3175 ( 2460 PWs) bands (ev): -46.2729 -46.2729 -23.9470 -23.9436 -21.9395 -21.9351 -21.8464 -21.8396 -18.9909 -18.9908 -8.4974 -8.4853 -7.7788 -7.7515 -7.5125 -7.5004 -2.7149 -2.7017 -2.4723 -2.4650 -2.4237 -2.4177 3.3429 3.3477 4.0789 4.0928 4.5125 4.5362 5.3855 5.3931 5.7764 5.7975 6.7438 6.7655 6.8144 6.8274 7.1130 7.1312 8.0218 8.0227 12.0093 12.0684 12.7900 12.8138 13.2444 13.2769 14.9315 14.9525 k = 0.0000 0.5000 0.3302 ( 2460 PWs) bands (ev): -46.2728 -46.2728 -23.9481 -23.9448 -21.9405 -21.9362 -21.8488 -21.8422 -18.9905 -18.9904 -8.4913 -8.4800 -7.7435 -7.7160 -7.5132 -7.4997 -2.7164 -2.7039 -2.4748 -2.4686 -2.4240 -2.4174 3.3385 3.3435 4.0222 4.0360 4.4300 4.4524 5.3795 5.3871 5.7486 5.7680 6.7542 6.7762 6.8216 6.8348 7.0946 7.1100 8.0569 8.0577 12.0903 12.1482 12.7933 12.8155 13.2897 13.3198 14.9376 14.9585 k = 0.0000 0.5000 0.3429 ( 2454 PWs) bands (ev): -46.2726 -46.2726 -23.9491 -23.9460 -21.9415 -21.9373 -21.8510 -21.8447 -18.9901 -18.9900 -8.4856 -8.4752 -7.7099 -7.6820 -7.5133 -7.4982 -2.7178 -2.7060 -2.4773 -2.4720 -2.4239 -2.4170 3.3333 3.3384 3.9670 3.9806 4.3540 4.3750 5.3739 5.3815 5.7217 5.7397 6.7644 6.7864 6.8289 6.8422 7.0773 7.0900 8.0891 8.0899 12.1688 12.2253 12.7961 12.8173 13.3349 13.3625 14.9421 14.9629 k = 0.0000 0.5000 0.3556 ( 2456 PWs) bands (ev): -46.2726 -46.2726 -23.9501 -23.9471 -21.9425 -21.9384 -21.8529 -21.8470 -18.9898 -18.9897 -8.4805 -8.4708 -7.6784 -7.6501 -7.5123 -7.4954 -2.7191 -2.7080 -2.4799 -2.4753 -2.4236 -2.4166 3.3271 3.3322 3.9137 3.9269 4.2849 4.3043 5.3687 5.3763 5.6961 5.7126 6.7742 6.7963 6.8362 6.8496 7.0610 7.0712 8.1186 8.1193 12.2444 12.2994 12.7986 12.8192 13.3792 13.4046 14.9452 14.9657 k = 0.0000 0.5000 0.3683 ( 2454 PWs) bands (ev): -46.2725 -46.2725 -23.9510 -23.9482 -21.9434 -21.9396 -21.8547 -21.8492 -18.9894 -18.9893 -8.4757 -8.4669 -7.6499 -7.6212 -7.5098 -7.4911 -2.7204 -2.7100 -2.4823 -2.4784 -2.4232 -2.4162 3.3197 3.3248 3.8628 3.8756 4.2229 4.2406 5.3641 5.3715 5.6717 5.6869 6.7838 6.8057 6.8434 6.8568 7.0457 7.0535 8.1454 8.1461 12.3165 12.3698 12.8009 12.8211 13.4223 13.4456 14.9472 14.9671 k = 0.0000 0.5000 0.3810 ( 2454 PWs) bands (ev): -46.2724 -46.2724 -23.9518 -23.9492 -21.9444 -21.9408 -21.8563 -21.8512 -18.9891 -18.9890 -8.4713 -8.4634 -7.6252 -7.5967 -7.5046 -7.4846 -2.7215 -2.7120 -2.4847 -2.4812 -2.4226 -2.4159 3.3111 3.3160 3.8151 3.8272 4.1679 4.1837 5.3599 5.3672 5.6489 5.6627 6.7930 6.8147 6.8503 6.8639 7.0314 7.0369 8.1695 8.1701 12.3847 12.4361 12.8027 12.8231 13.4638 13.4849 14.9482 14.9673 k = 0.0000 0.5000 0.3937 ( 2456 PWs) bands (ev): -46.2724 -46.2724 -23.9526 -23.9501 -21.9453 -21.9420 -21.8576 -21.8530 -18.9888 -18.9887 -8.4674 -8.4602 -7.6049 -7.5780 -7.4954 -7.4757 -2.7225 -2.7139 -2.4870 -2.4839 -2.4220 -2.4156 3.3010 3.3058 3.7714 3.7826 4.1196 4.1335 5.3563 5.3634 5.6276 5.6403 6.8021 6.8234 6.8568 6.8706 7.0179 7.0214 8.1910 8.1916 12.4482 12.4977 12.8043 12.8252 13.5032 13.5221 14.9484 14.9666 k = 0.0000 0.5000 0.4064 ( 2460 PWs) bands (ev): -46.2724 -46.2723 -23.9533 -23.9511 -21.9461 -21.9431 -21.8588 -21.8546 -18.9885 -18.9885 -8.4639 -8.4575 -7.5893 -7.5658 -7.4820 -7.4643 -2.7234 -2.7156 -2.4890 -2.4864 -2.4212 -2.4153 3.2897 3.2941 3.7324 3.7426 4.0776 4.0896 5.3532 5.3600 5.6082 5.6196 6.8109 6.8317 6.8629 6.8770 7.0051 7.0071 8.2101 8.2106 12.5068 12.5542 12.8057 12.8274 13.5399 13.5567 14.9480 14.9651 k = 0.0000 0.5000 0.4191 ( 2462 PWs) bands (ev): -46.2723 -46.2723 -23.9538 -23.9519 -21.9469 -21.9442 -21.8597 -21.8561 -18.9883 -18.9882 -8.4607 -8.4552 -7.5780 -7.5588 -7.4657 -7.4510 -2.7242 -2.7173 -2.4909 -2.4886 -2.4205 -2.4151 3.2773 3.2812 3.6986 3.7077 4.0416 4.0518 5.3507 5.3571 5.5906 5.6008 6.8194 6.8396 6.8685 6.8829 6.9925 6.9943 8.2267 8.2272 12.5598 12.6050 12.8070 12.8297 13.5736 13.5884 14.9473 14.9629 k = 0.0000 0.5000 0.4318 ( 2462 PWs) bands (ev): -46.2723 -46.2723 -23.9543 -23.9526 -21.9475 -21.9452 -21.8605 -21.8574 -18.9881 -18.9880 -8.4579 -8.4532 -7.5701 -7.5551 -7.4488 -7.4372 -2.7248 -2.7188 -2.4925 -2.4905 -2.4197 -2.4150 3.2643 3.2677 3.6703 3.6782 4.0111 4.0197 5.3488 5.3546 5.5752 5.5841 6.8277 6.8471 6.8736 6.8884 6.9802 6.9831 8.2410 8.2414 12.6067 12.6496 12.8082 12.8321 13.6039 13.6166 14.9465 14.9604 k = 0.0000 0.5000 0.4445 ( 2466 PWs) bands (ev): -46.2723 -46.2723 -23.9547 -23.9533 -21.9481 -21.9461 -21.8611 -21.8585 -18.9879 -18.9879 -8.4555 -8.4516 -7.5647 -7.5532 -7.4328 -7.4239 -2.7252 -2.7202 -2.4938 -2.4922 -2.4190 -2.4150 3.2513 3.2542 3.6475 3.6540 3.9858 3.9928 5.3474 5.3525 5.5619 5.5695 6.8357 6.8539 6.8781 6.8932 6.9688 6.9730 8.2529 8.2533 12.6472 12.6873 12.8098 12.8344 13.6305 13.6410 14.9455 14.9576 k = 0.0000 0.5000 0.4572 ( 2464 PWs) bands (ev): -46.2722 -46.2722 -23.9550 -23.9539 -21.9485 -21.9469 -21.8616 -21.8594 -18.9877 -18.9877 -8.4535 -8.4503 -7.5609 -7.5524 -7.4188 -7.4120 -2.7255 -2.7214 -2.4949 -2.4936 -2.4183 -2.4150 3.2392 3.2415 3.6299 3.6350 3.9656 3.9711 5.3465 5.3508 5.5510 5.5573 6.8432 6.8598 6.8823 6.8973 6.9586 6.9637 8.2627 8.2629 12.6810 12.7173 12.8122 12.8365 13.6528 13.6613 14.9448 14.9547 k = 0.0000 0.5000 0.4699 ( 2466 PWs) bands (ev): -46.2722 -46.2722 -23.9552 -23.9544 -21.9488 -21.9476 -21.8619 -21.8602 -18.9876 -18.9876 -8.4518 -8.4495 -7.5582 -7.5522 -7.4073 -7.4024 -2.7256 -2.7225 -2.4958 -2.4947 -2.4176 -2.4151 3.2288 3.2305 3.6169 3.6207 3.9501 3.9542 5.3460 5.3494 5.5426 5.5474 6.8502 6.8643 6.8864 6.9005 6.9499 6.9555 8.2702 8.2704 12.7080 12.7387 12.8160 12.8381 13.6707 13.6771 14.9445 14.9521 k = 0.0000 0.5000 0.4825 ( 2464 PWs) bands (ev): -46.2722 -46.2722 -23.9553 -23.9548 -21.9490 -21.9481 -21.8620 -21.8609 -18.9875 -18.9875 -8.4505 -8.4490 -7.5563 -7.5524 -7.3986 -7.3955 -2.7255 -2.7235 -2.4963 -2.4956 -2.4170 -2.4153 3.2208 3.2219 3.6082 3.6108 3.9393 3.9420 5.3459 5.3483 5.5367 5.5400 6.8565 6.8668 6.8908 6.9023 6.9434 6.9485 8.2755 8.2757 12.7285 12.7509 12.8217 12.8385 13.6840 13.6883 14.9445 14.9496 k = 0.0000 0.5000 0.4952 ( 2470 PWs) bands (ev): -46.2723 -46.2723 -23.9554 -23.9551 -21.9490 -21.9486 -21.8619 -21.8614 -18.9875 -18.9875 -8.4496 -8.4488 -7.5548 -7.5529 -7.3931 -7.3915 -2.7252 -2.7242 -2.4966 -2.4962 -2.4165 -2.4156 3.2159 3.2164 3.6034 3.6047 3.9332 3.9345 5.3461 5.3473 5.5335 5.5351 6.8616 6.8671 6.8954 6.9020 6.9399 6.9432 8.2787 8.2788 12.7430 12.7547 12.8282 12.8372 13.6925 13.6946 14.9450 14.9476 k = 0.0000 0.5000 0.5079 ( 2468 PWs) bands (ev): -46.2722 -46.2722 -23.9553 -23.9553 -21.9488 -21.9488 -21.8617 -21.8617 -18.9875 -18.9875 -8.4490 -8.4490 -7.5537 -7.5537 -7.3907 -7.3907 -2.7248 -2.7248 -2.4965 -2.4965 -2.4160 -2.4160 3.2144 3.2144 3.6023 3.6023 3.9316 3.9316 5.3466 5.3466 5.5330 5.5330 6.8653 6.8653 6.8995 6.8995 6.9400 6.9400 8.2798 8.2798 12.7518 12.7518 12.8337 12.8337 13.6960 13.6960 14.9460 14.9460 k = 0.0000 0.5000 0.5079 ( 2468 PWs) bands (ev): -46.2722 -46.2722 -23.9553 -23.9553 -21.9488 -21.9488 -21.8617 -21.8617 -18.9875 -18.9875 -8.4490 -8.4490 -7.5537 -7.5537 -7.3907 -7.3907 -2.7248 -2.7248 -2.4965 -2.4965 -2.4160 -2.4160 3.2144 3.2144 3.6023 3.6023 3.9316 3.9316 5.3466 5.3466 5.5330 5.5330 6.8653 6.8653 6.8995 6.8995 6.9400 6.9400 8.2798 8.2798 12.7518 12.7518 12.8337 12.8337 13.6960 13.6960 14.9460 14.9460 k = 0.0128 0.5000 0.5079 ( 2464 PWs) bands (ev): -46.2722 -46.2722 -23.9554 -23.9552 -21.9489 -21.9488 -21.8619 -21.8618 -18.9874 -18.9874 -8.4480 -8.4472 -7.5539 -7.5534 -7.3906 -7.3905 -2.7258 -2.7245 -2.4970 -2.4968 -2.4173 -2.4157 3.2144 3.2144 3.6022 3.6023 3.9325 3.9325 5.3434 5.3440 5.5295 5.5296 6.8663 6.8667 6.9031 6.9032 6.9360 6.9367 8.2799 8.2799 12.7510 12.7542 12.8337 12.8349 13.6960 13.6963 14.9520 14.9560 k = 0.0255 0.5000 0.5079 ( 2462 PWs) bands (ev): -46.2721 -46.2721 -23.9556 -23.9552 -21.9490 -21.9487 -21.8624 -21.8621 -18.9874 -18.9874 -8.4442 -8.4426 -7.5537 -7.5528 -7.3903 -7.3902 -2.7276 -2.7250 -2.4982 -2.4978 -2.4196 -2.4164 3.2144 3.2145 3.6022 3.6023 3.9352 3.9354 5.3343 5.3355 5.5193 5.5194 6.8656 6.8667 6.9130 6.9131 6.9297 6.9307 8.2800 8.2800 12.7519 12.7583 12.8350 12.8371 13.6964 13.6969 14.9737 14.9815 k = 0.0383 0.5000 0.5079 ( 2462 PWs) bands (ev): -46.2721 -46.2721 -23.9559 -23.9554 -21.9491 -21.9487 -21.8631 -21.8627 -18.9873 -18.9873 -8.4376 -8.4352 -7.5534 -7.5519 -7.3898 -7.3896 -2.7301 -2.7262 -2.5001 -2.4995 -2.4228 -2.4181 3.2145 3.2146 3.6021 3.6023 3.9398 3.9401 5.3197 5.3215 5.5029 5.5030 6.8499 6.8522 6.9235 6.9243 6.9398 6.9400 8.2803 8.2803 12.7544 12.7641 12.8377 12.8404 13.6970 13.6978 15.0109 15.0222 k = 0.0510 0.5000 0.5079 ( 2460 PWs) bands (ev): -46.2720 -46.2720 -23.9563 -23.9556 -21.9493 -21.9486 -21.8641 -21.8636 -18.9871 -18.9871 -8.4283 -8.4251 -7.5528 -7.5509 -7.3891 -7.3888 -2.7333 -2.7282 -2.5028 -2.5019 -2.4271 -2.4208 3.2147 3.2148 3.6019 3.6023 3.9463 3.9466 5.3001 5.3024 5.4807 5.4809 6.8131 6.8166 6.9411 6.9420 6.9648 6.9649 8.2806 8.2807 12.7586 12.7716 12.8422 12.8451 13.6979 13.6991 15.0626 15.0771 k = 0.0638 0.5000 0.5079 ( 2460 PWs) bands (ev): -46.2720 -46.2720 -23.9567 -23.9559 -21.9494 -21.9486 -21.8653 -21.8647 -18.9869 -18.9869 -8.4162 -8.4123 -7.5520 -7.5495 -7.3882 -7.3878 -2.7373 -2.7309 -2.5061 -2.5050 -2.4322 -2.4244 3.2149 3.2151 3.6018 3.6022 3.9545 3.9549 5.2758 5.2787 5.4536 5.4539 6.7609 6.7655 6.9673 6.9683 6.9973 6.9975 8.2811 8.2812 12.7644 12.7809 12.8486 12.8512 13.6991 13.7006 15.1280 15.1452 k = 0.0766 0.5000 0.5079 ( 2456 PWs) bands (ev): -46.2719 -46.2719 -23.9573 -23.9562 -21.9496 -21.9486 -21.8667 -21.8660 -18.9867 -18.9867 -8.4015 -8.3968 -7.5510 -7.5480 -7.3871 -7.3866 -2.7419 -2.7343 -2.5101 -2.5087 -2.4383 -2.4290 3.2151 3.2153 3.6015 3.6020 3.9644 3.9649 5.2475 5.2509 5.4224 5.4227 6.6967 6.7022 6.9997 7.0007 7.0356 7.0358 8.2816 8.2817 12.7720 12.7919 12.8572 12.8590 13.7007 13.7024 15.2058 15.2253 k = 0.0893 0.5000 0.5079 ( 2456 PWs) bands (ev): -46.2719 -46.2719 -23.9579 -23.9567 -21.9498 -21.9487 -21.8684 -21.8676 -18.9864 -18.9864 -8.3843 -8.3787 -7.5497 -7.5462 -7.3858 -7.3851 -2.7471 -2.7384 -2.5147 -2.5132 -2.4451 -2.4344 3.2154 3.2156 3.6012 3.6018 3.9760 3.9766 5.2158 5.2197 5.3878 5.3881 6.6223 6.6287 7.0367 7.0378 7.0785 7.0788 8.2823 8.2824 12.7815 12.8047 12.8682 12.8688 13.7025 13.7045 15.2948 15.3160 k = 0.1021 0.5000 0.5079 ( 2458 PWs) bands (ev): -46.2719 -46.2719 -23.9586 -23.9572 -21.9500 -21.9487 -21.8703 -21.8694 -18.9861 -18.9861 -8.3645 -8.3582 -7.5483 -7.5443 -7.3842 -7.3835 -2.7530 -2.7432 -2.5200 -2.5182 -2.4528 -2.4407 3.2157 3.2160 3.6008 3.6015 3.9892 3.9898 5.1812 5.1855 5.3506 5.3510 6.5389 6.5463 7.0777 7.0787 7.1254 7.1256 8.2830 8.2832 12.7929 12.8191 12.8808 12.8814 13.7046 13.7069 15.3935 15.4159 k = 0.1149 0.5000 0.5079 ( 2458 PWs) bands (ev): -46.2718 -46.2718 -23.9593 -23.9578 -21.9503 -21.9488 -21.8723 -21.8714 -18.9858 -18.9858 -8.3424 -8.3353 -7.5467 -7.5421 -7.3825 -7.3818 -2.7595 -2.7486 -2.5258 -2.5238 -2.4613 -2.4478 3.2161 3.2164 3.6003 3.6010 4.0038 4.0045 5.1442 5.1490 5.3115 5.3118 6.4477 6.4560 7.1217 7.1227 7.1753 7.1756 8.2838 8.2840 12.8065 12.8354 12.8951 12.8971 13.7070 13.7095 15.5004 15.5235 k = 0.1276 0.5000 0.5079 ( 2462 PWs) bands (ev): -46.2718 -46.2718 -23.9601 -23.9585 -21.9506 -21.9489 -21.8745 -21.8736 -18.9854 -18.9854 -8.3180 -8.3101 -7.5448 -7.5397 -7.3807 -7.3798 -2.7665 -2.7546 -2.5322 -2.5300 -2.4704 -2.4556 3.2165 3.2168 3.5996 3.6004 4.0198 4.0205 5.1052 5.1104 5.2709 5.2713 6.3500 6.3592 7.1681 7.1692 7.2277 7.2279 8.2847 8.2849 12.8223 12.8534 12.9117 12.9151 13.7096 13.7124 15.6139 15.6371 k = 0.1404 0.5000 0.5079 ( 2462 PWs) bands (ev): -46.2717 -46.2717 -23.9610 -23.9593 -21.9509 -21.9491 -21.8769 -21.8759 -18.9851 -18.9851 -8.2915 -8.2828 -7.5428 -7.5371 -7.3787 -7.3777 -2.7740 -2.7611 -2.5391 -2.5366 -2.4801 -2.4641 3.2169 3.2173 3.5988 3.5997 4.0371 4.0378 5.0647 5.0703 5.2295 5.2300 6.2467 6.2568 7.2165 7.2175 7.2818 7.2821 8.2857 8.2860 12.8404 12.8733 12.9308 12.9354 13.7125 13.7156 15.7323 15.7554 k = 0.1531 0.5000 0.5079 ( 2456 PWs) bands (ev): -46.2716 -46.2716 -23.9619 -23.9601 -21.9513 -21.9493 -21.8793 -21.8783 -18.9846 -18.9846 -8.2630 -8.2534 -7.5406 -7.5343 -7.3765 -7.3755 -2.7819 -2.7681 -2.5465 -2.5438 -2.4903 -2.4731 3.2174 3.2178 3.5977 3.5987 4.0555 4.0563 5.0229 5.0289 5.1877 5.1882 6.1391 6.1501 7.2662 7.2671 7.3372 7.3375 8.2868 8.2870 12.8609 12.8951 12.9523 12.9579 13.7156 13.7190 15.8542 15.8765 k = 0.1659 0.5000 0.5079 ( 2456 PWs) bands (ev): -46.2715 -46.2715 -23.9629 -23.9609 -21.9517 -21.9495 -21.8818 -21.8809 -18.9842 -18.9842 -8.2326 -8.2223 -7.5383 -7.5313 -7.3742 -7.3731 -2.7902 -2.7757 -2.5543 -2.5513 -2.5010 -2.4828 3.2179 3.2183 3.5964 3.5974 4.0749 4.0757 4.9801 4.9865 5.1458 5.1463 6.0283 6.0401 7.3169 7.3177 7.3934 7.3937 8.2879 8.2882 12.8837 12.9188 12.9760 12.9825 13.7189 13.7227 15.9775 15.9987 k = 0.1787 0.5000 0.5079 ( 2454 PWs) bands (ev): -46.2714 -46.2714 -23.9639 -23.9618 -21.9523 -21.9498 -21.8844 -21.8835 -18.9837 -18.9837 -8.2005 -8.1894 -7.5358 -7.5281 -7.3717 -7.3705 -2.7988 -2.7836 -2.5624 -2.5592 -2.5121 -2.4929 3.2184 3.2188 3.5947 3.5958 4.0952 4.0960 4.9364 4.9432 5.1041 5.1046 5.9154 5.9280 7.3681 7.3688 7.4500 7.4502 8.2890 8.2894 12.9088 12.9444 13.0019 13.0090 13.7225 13.7266 16.1006 16.1201 k = 0.1914 0.5000 0.5079 ( 2452 PWs) bands (ev): -46.2713 -46.2713 -23.9649 -23.9628 -21.9528 -21.9502 -21.8870 -21.8862 -18.9832 -18.9832 -8.1670 -8.1551 -7.5332 -7.5248 -7.3692 -7.3679 -2.8078 -2.7919 -2.5708 -2.5674 -2.5235 -2.5034 3.2189 3.2194 3.5926 3.5938 4.1163 4.1171 4.8919 4.8991 5.0629 5.0635 5.8016 5.8150 7.4194 7.4200 7.5065 7.5068 8.2902 8.2906 12.9361 12.9719 13.0298 13.0375 13.7264 13.7307 16.2215 16.2390 k = 0.2042 0.5000 0.5079 ( 2452 PWs) bands (ev): -46.2712 -46.2712 -23.9659 -23.9638 -21.9535 -21.9507 -21.8896 -21.8889 -18.9827 -18.9827 -8.1322 -8.1194 -7.5304 -7.5213 -7.3666 -7.3652 -2.8169 -2.8005 -2.5795 -2.5758 -2.5351 -2.5142 3.2194 3.2199 3.5901 3.5914 4.1380 4.1388 4.8467 4.8542 5.0225 5.0231 5.6880 5.7021 7.4705 7.4710 7.5627 7.5630 8.2915 8.2919 12.9656 13.0012 13.0595 13.0677 13.7304 13.7351 16.3383 16.3533 k = 0.2170 0.5000 0.5079 ( 2450 PWs) bands (ev): -46.2711 -46.2711 -23.9670 -23.9648 -21.9542 -21.9512 -21.8922 -21.8916 -18.9822 -18.9822 -8.0962 -8.0826 -7.5275 -7.5176 -7.3639 -7.3624 -2.8262 -2.8094 -2.5884 -2.5845 -2.5469 -2.5254 3.2200 3.2205 3.5870 3.5883 4.1601 4.1609 4.8005 4.8084 4.9830 4.9836 5.5757 5.5905 7.5211 7.5216 7.6182 7.6185 8.2928 8.2932 12.9970 13.0322 13.0910 13.0995 13.7347 13.7397 16.4488 16.4609 k = 0.2297 0.5000 0.5079 ( 2450 PWs) bands (ev): -46.2710 -46.2710 -23.9681 -23.9659 -21.9551 -21.9519 -21.8947 -21.8943 -18.9817 -18.9817 -8.0595 -8.0450 -7.5246 -7.5137 -7.3611 -7.3595 -2.8357 -2.8185 -2.5974 -2.5933 -2.5587 -2.5367 3.2205 3.2211 3.5832 3.5846 4.1825 4.1833 4.7534 4.7615 4.9447 4.9452 5.4662 5.4814 7.5710 7.5713 7.6727 7.6731 8.2941 8.2946 13.0303 13.0648 13.1241 13.1327 13.7393 13.7445 16.5512 16.5598 k = 0.2425 0.5000 0.5079 ( 2446 PWs) bands (ev): -46.2709 -46.2709 -23.9692 -23.9670 -21.9560 -21.9526 -21.8971 -21.8969 -18.9812 -18.9812 -8.0221 -8.0067 -7.5215 -7.5097 -7.3583 -7.3566 -2.8451 -2.8278 -2.6066 -2.6022 -2.5706 -2.5481 3.2211 3.2217 3.5787 3.5801 4.2051 4.2059 4.7049 4.7132 4.9075 4.9081 5.3605 5.3762 7.6198 7.6201 7.7261 7.7265 8.2954 8.2960 13.0652 13.0988 13.1585 13.1671 13.7441 13.7496 16.6435 16.6484 k = 0.2552 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2708 -46.2708 -23.9703 -23.9681 -21.9570 -21.9535 -21.8994 -21.8994 -18.9806 -18.9806 -7.9844 -7.9681 -7.5183 -7.5056 -7.3554 -7.3537 -2.8545 -2.8371 -2.6157 -2.6111 -2.5824 -2.5595 3.2216 3.2222 3.5732 3.5747 4.2277 4.2284 4.6549 4.6632 4.8718 4.8724 5.2600 5.2759 7.6675 7.6676 7.7780 7.7785 8.2967 8.2974 13.1015 13.1339 13.1940 13.2026 13.7492 13.7551 16.7243 16.7252 k = 0.2680 0.5000 0.5079 ( 2440 PWs) bands (ev): -46.2706 -46.2706 -23.9714 -23.9692 -21.9582 -21.9544 -21.9017 -21.9016 -18.9801 -18.9801 -7.9465 -7.9293 -7.5149 -7.5012 -7.3525 -7.3507 -2.8639 -2.8465 -2.6248 -2.6200 -2.5940 -2.5710 3.2222 3.2228 3.5665 3.5681 4.2501 4.2508 4.6030 4.6112 4.8375 4.8381 5.1660 5.1819 7.7136 7.7137 7.8284 7.8288 8.2981 8.2987 13.1390 13.1700 13.2305 13.2389 13.7546 13.7608 16.7898 16.7930 k = 0.2808 0.5000 0.5079 ( 2440 PWs) bands (ev): -46.2705 -46.2705 -23.9725 -23.9703 -21.9594 -21.9555 -21.9039 -21.9037 -18.9796 -18.9796 -7.9089 -7.8907 -7.5115 -7.4967 -7.3497 -7.3478 -2.8731 -2.8558 -2.6338 -2.6287 -2.6054 -2.5823 3.2227 3.2233 3.5586 3.5602 4.2722 4.2729 4.5491 4.5569 4.8049 4.8055 5.0796 5.0952 7.7582 7.7582 7.8768 7.8774 8.2994 8.3001 13.1773 13.2067 13.2677 13.2757 13.7604 13.7669 16.8421 16.8494 k = 0.2935 0.5000 0.5079 ( 2440 PWs) bands (ev): -46.2704 -46.2704 -23.9735 -23.9714 -21.9606 -21.9568 -21.9060 -21.9056 -18.9791 -18.9791 -7.8718 -7.8525 -7.5079 -7.4919 -7.3468 -7.3448 -2.8821 -2.8650 -2.6426 -2.6374 -2.6166 -2.5935 3.2232 3.2239 3.5492 3.5508 4.2938 4.2944 4.4933 4.5004 4.7739 4.7746 5.0016 5.0165 7.8009 7.8009 7.9233 7.9239 8.3007 8.3015 13.2162 13.2437 13.3053 13.3128 13.7666 13.7734 16.8830 16.8941 k = 0.3063 0.5000 0.5079 ( 2438 PWs) bands (ev): -46.2703 -46.2703 -23.9746 -23.9724 -21.9620 -21.9581 -21.9079 -21.9074 -18.9785 -18.9785 -7.8354 -7.8151 -7.5042 -7.4869 -7.3440 -7.3419 -2.8908 -2.8741 -2.6513 -2.6458 -2.6273 -2.6044 3.2237 3.2243 3.5380 3.5396 4.3148 4.3153 4.4361 4.4423 4.7447 4.7454 4.9323 4.9463 7.8416 7.8417 7.9676 7.9683 8.3020 8.3029 13.2552 13.2806 13.3430 13.3499 13.7733 13.7804 16.9138 16.9285 k = 0.3191 0.5000 0.5079 ( 2438 PWs) bands (ev): -46.2703 -46.2703 -23.9756 -23.9735 -21.9634 -21.9595 -21.9096 -21.9089 -18.9781 -18.9781 -7.8002 -7.7789 -7.5002 -7.4817 -7.3412 -7.3390 -2.8992 -2.8830 -2.6596 -2.6540 -2.6377 -2.6151 3.2241 3.2248 3.5249 3.5265 4.3348 4.3354 4.3784 4.3836 4.7174 4.7181 4.8716 4.8844 7.8803 7.8804 8.0096 8.0104 8.3032 8.3043 13.2940 13.3171 13.3807 13.3867 13.7806 13.7879 16.9361 16.9540 k = 0.3318 0.5000 0.5079 ( 2436 PWs) bands (ev): -46.2702 -46.2702 -23.9765 -23.9745 -21.9648 -21.9610 -21.9111 -21.9104 -18.9776 -18.9776 -7.7665 -7.7441 -7.4959 -7.4761 -7.3385 -7.3362 -2.9072 -2.8916 -2.6676 -2.6618 -2.6475 -2.6254 3.2244 3.2251 3.5097 3.5112 4.3214 4.3253 4.3542 4.3545 4.6921 4.6928 4.8188 4.8303 7.9167 7.9169 8.0492 8.0501 8.3045 8.3056 13.3322 13.3527 13.4179 13.4228 13.7886 13.7961 16.9515 16.9723 k = 0.3446 0.5000 0.5079 ( 2438 PWs) bands (ev): -46.2701 -46.2701 -23.9774 -23.9755 -21.9663 -21.9625 -21.9124 -21.9116 -18.9771 -18.9771 -7.7346 -7.7112 -7.4912 -7.4701 -7.3358 -7.3335 -2.9149 -2.8999 -2.6753 -2.6694 -2.6568 -2.6353 3.2247 3.2254 3.4923 3.4937 4.2666 4.2695 4.3721 4.3724 4.6688 4.6695 4.7731 4.7833 7.9509 7.9511 8.0862 8.0873 8.3056 8.3069 13.3692 13.3869 13.4544 13.4580 13.7973 13.8049 16.9615 16.9849 k = 0.3573 0.5000 0.5079 ( 2442 PWs) bands (ev): -46.2701 -46.2701 -23.9783 -23.9765 -21.9677 -21.9641 -21.9135 -21.9128 -18.9767 -18.9767 -7.7049 -7.6805 -7.4860 -7.4637 -7.3332 -7.3308 -2.9220 -2.9079 -2.6825 -2.6765 -2.6655 -2.6447 3.2249 3.2256 3.4727 3.4739 4.2152 4.2172 4.3887 4.3889 4.6476 4.6484 4.7336 4.7425 7.9827 7.9829 8.1206 8.1218 8.3068 8.3082 13.4045 13.4193 13.4899 13.4920 13.8068 13.8144 16.9675 16.9931 k = 0.3701 0.5000 0.5079 ( 2442 PWs) bands (ev): -46.2700 -46.2700 -23.9791 -23.9774 -21.9691 -21.9657 -21.9145 -21.9138 -18.9763 -18.9763 -7.6776 -7.6527 -7.4801 -7.4569 -7.3306 -7.3282 -2.9286 -2.9154 -2.6892 -2.6833 -2.6734 -2.6536 3.2249 3.2257 3.4511 3.4521 4.1683 4.1696 4.4038 4.4038 4.6288 4.6296 4.6995 4.7071 8.0120 8.0123 8.1522 8.1536 8.3079 8.3095 13.4376 13.4494 13.5239 13.5245 13.8172 13.8247 16.9706 16.9981 k = 0.3829 0.5000 0.5079 ( 2438 PWs) bands (ev): -46.2699 -46.2699 -23.9798 -23.9783 -21.9704 -21.9672 -21.9154 -21.9146 -18.9759 -18.9759 -7.6531 -7.6280 -7.4733 -7.4497 -7.3281 -7.3258 -2.9347 -2.9224 -2.6955 -2.6896 -2.6806 -2.6619 3.2249 3.2257 3.4280 3.4289 4.1266 4.1273 4.4170 4.4170 4.6123 4.6131 4.6700 4.6766 8.0388 8.0390 8.1810 8.1826 8.3090 8.3108 13.4680 13.4769 13.5553 13.5563 13.8283 13.8355 16.9718 17.0008 k = 0.3956 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2700 -46.2700 -23.9805 -23.9791 -21.9717 -21.9687 -21.9161 -21.9154 -18.9756 -18.9756 -7.6314 -7.6069 -7.4655 -7.4422 -7.3257 -7.3234 -2.9401 -2.9289 -2.7011 -2.6955 -2.6870 -2.6697 3.2246 3.2254 3.4041 3.4047 4.0904 4.0908 4.4282 4.4284 4.5983 4.5992 4.6446 4.6502 8.0629 8.0632 8.2068 8.2087 8.3100 8.3120 13.4951 13.5014 13.5842 13.5866 13.8400 13.8468 16.9718 17.0019 k = 0.4084 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2700 -46.2700 -23.9810 -23.9798 -21.9728 -21.9701 -21.9166 -21.9160 -18.9753 -18.9753 -7.6128 -7.5896 -7.4568 -7.4345 -7.3234 -7.3212 -2.9449 -2.9349 -2.7062 -2.7010 -2.6925 -2.6768 3.2241 3.2249 3.3802 3.3806 4.0597 4.0598 4.4373 4.4375 4.5870 4.5879 4.6229 4.6276 8.0844 8.0847 8.2296 8.2317 8.3111 8.3134 13.5187 13.5229 13.6110 13.6145 13.8521 13.8583 16.9713 17.0019 k = 0.4212 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2699 -46.2699 -23.9815 -23.9804 -21.9738 -21.9714 -21.9171 -21.9165 -18.9750 -18.9750 -7.5970 -7.5760 -7.4474 -7.4269 -7.3212 -7.3191 -2.9491 -2.9403 -2.7106 -2.7060 -2.6970 -2.6831 3.2232 3.2241 3.3573 3.3575 4.0342 4.0343 4.4442 4.4445 4.5783 4.5792 4.6046 4.6085 8.1032 8.1034 8.2492 8.2517 8.3123 8.3149 13.5387 13.5412 13.6355 13.6396 13.8641 13.8697 16.9708 17.0012 k = 0.4339 0.5000 0.5079 ( 2446 PWs) bands (ev): -46.2698 -46.2698 -23.9820 -23.9810 -21.9746 -21.9726 -21.9175 -21.9170 -18.9748 -18.9748 -7.5841 -7.5658 -7.4377 -7.4199 -7.3191 -7.3172 -2.9525 -2.9450 -2.7144 -2.7103 -2.7007 -2.6888 3.2220 3.2228 3.3364 3.3365 4.0136 4.0137 4.4490 4.4493 4.5720 4.5729 4.5895 4.5926 8.1192 8.1194 8.2656 8.2683 8.3137 8.3166 13.5551 13.5563 13.6573 13.6615 13.8757 13.8805 16.9708 17.0000 k = 0.4467 0.5000 0.5079 ( 2450 PWs) bands (ev): -46.2699 -46.2699 -23.9823 -23.9815 -21.9753 -21.9736 -21.9178 -21.9174 -18.9746 -18.9746 -7.5736 -7.5585 -7.4285 -7.4137 -7.3172 -7.3155 -2.9553 -2.9491 -2.7174 -2.7141 -2.7035 -2.6937 3.2204 3.2212 3.3183 3.3185 3.9974 3.9976 4.4519 4.4522 4.5675 4.5685 4.5776 4.5799 8.1325 8.1326 8.2785 8.2815 8.3154 8.3185 13.5680 13.5685 13.6760 13.6800 13.8862 13.8902 16.9715 16.9984 k = 0.4594 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9825 -23.9819 -21.9758 -21.9745 -21.9180 -21.9177 -18.9745 -18.9745 -7.5654 -7.5537 -7.4203 -7.4088 -7.3155 -7.3141 -2.9573 -2.9525 -2.7198 -2.7172 -2.7055 -2.6979 3.2184 3.2191 3.3039 3.3042 3.9852 3.9854 4.4535 4.4538 4.5636 4.5650 4.5697 4.5709 8.1429 8.1431 8.2879 8.2908 8.3178 8.3208 13.5777 13.5778 13.6913 13.6948 13.8953 13.8983 16.9732 16.9963 k = 0.4722 0.5000 0.5079 ( 2450 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9823 -21.9761 -21.9752 -21.9181 -21.9179 -18.9743 -18.9743 -7.5592 -7.5510 -7.4136 -7.4054 -7.3140 -7.3131 -2.9586 -2.9552 -2.7214 -2.7196 -2.7066 -2.7012 3.2164 3.2170 3.2937 3.2939 3.9767 3.9768 4.4542 4.4544 4.5588 4.5601 4.5666 4.5670 8.1505 8.1506 8.2942 8.2965 8.3208 8.3231 13.5845 13.5846 13.7030 13.7056 13.9024 13.9045 16.9759 16.9936 k = 0.4850 0.5000 0.5079 ( 2446 PWs) bands (ev): -46.2697 -46.2697 -23.9827 -23.9825 -21.9762 -21.9757 -21.9182 -21.9180 -18.9743 -18.9743 -7.5548 -7.5501 -7.4086 -7.4039 -7.3130 -7.3125 -2.9591 -2.9571 -2.7223 -2.7213 -2.7068 -2.7037 3.2149 3.2152 3.2875 3.2877 3.9714 3.9715 4.4545 4.4547 4.5551 4.5559 4.5656 4.5658 8.1553 8.1554 8.2978 8.2992 8.3234 8.3249 13.5886 13.5887 13.7106 13.7122 13.9072 13.9084 16.9796 16.9904 k = 0.4977 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9762 -21.9760 -21.9182 -21.9181 -18.9742 -18.9742 -7.5520 -7.5508 -7.4055 -7.4043 -7.3125 -7.3123 -2.9589 -2.9584 -2.7224 -2.7222 -2.7062 -2.7054 3.2142 3.2143 3.2851 3.2852 3.9693 3.9693 4.4547 4.4548 4.5537 4.5539 4.5652 4.5653 8.1573 8.1573 8.2994 8.2998 8.3250 8.3254 13.5903 13.5903 13.7141 13.7145 13.9095 13.9098 16.9839 16.9868 k = 0.4977 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9762 -21.9760 -21.9182 -21.9181 -18.9742 -18.9742 -7.5520 -7.5508 -7.4055 -7.4043 -7.3125 -7.3123 -2.9589 -2.9584 -2.7224 -2.7222 -2.7062 -2.7054 3.2142 3.2143 3.2851 3.2852 3.9693 3.9693 4.4547 4.4548 4.5537 4.5539 4.5652 4.5653 8.1573 8.1573 8.2994 8.2998 8.3250 8.3254 13.5903 13.5903 13.7141 13.7145 13.9095 13.9098 16.9839 16.9868 k = 0.4887 0.4909 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9828 -23.9825 -21.9763 -21.9756 -21.9182 -21.9180 -18.9743 -18.9743 -7.5556 -7.5494 -7.4095 -7.4034 -7.3132 -7.3124 -2.9594 -2.9568 -2.7224 -2.7210 -2.7073 -2.7032 3.2150 3.2155 3.2873 3.2876 3.9718 3.9719 4.4540 4.4542 4.5554 4.5565 4.5661 4.5663 8.1551 8.1552 8.2977 8.2995 8.3228 8.3247 13.5885 13.5887 13.7100 13.7120 13.9066 13.9082 16.9767 16.9907 k = 0.4796 0.4818 0.5079 ( 2450 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9822 -21.9762 -21.9750 -21.9182 -21.9178 -18.9744 -18.9744 -7.5606 -7.5496 -7.4155 -7.4045 -7.3144 -7.3131 -2.9591 -2.9544 -2.7216 -2.7190 -2.7076 -2.7002 3.2171 3.2179 3.2925 3.2930 3.9775 3.9776 4.4524 4.4526 4.5600 4.5618 4.5683 4.5688 8.1501 8.1502 8.2945 8.2980 8.3187 8.3223 13.5846 13.5847 13.7016 13.7052 13.9007 13.9036 16.9690 16.9917 k = 0.4706 0.4727 0.5079 ( 2450 PWs) bands (ev): -46.2698 -46.2698 -23.9826 -23.9818 -21.9760 -21.9742 -21.9180 -21.9176 -18.9745 -18.9745 -7.5671 -7.5513 -7.4234 -7.4079 -7.3160 -7.3142 -2.9581 -2.9514 -2.7200 -2.7162 -2.7071 -2.6963 3.2205 3.2216 3.3008 3.3016 3.9865 3.9867 4.4499 4.4503 4.5665 4.5684 4.5727 4.5742 8.1423 8.1425 8.2898 8.2951 8.3127 8.3181 13.5783 13.5784 13.6892 13.6940 13.8919 13.8962 16.9619 16.9908 k = 0.4615 0.4636 0.5079 ( 2446 PWs) bands (ev): -46.2698 -46.2698 -23.9824 -23.9813 -21.9755 -21.9732 -21.9179 -21.9173 -18.9746 -18.9746 -7.5750 -7.5546 -7.4332 -7.4133 -7.3181 -7.3159 -2.9563 -2.9476 -2.7178 -2.7127 -2.7057 -2.6916 3.2248 3.2264 3.3121 3.3133 3.9988 3.9990 4.4467 4.4471 4.5725 4.5739 4.5819 4.5849 8.1317 8.1319 8.2834 8.2909 8.3048 8.3125 13.5693 13.5700 13.6730 13.6785 13.8803 13.8860 16.9563 16.9890 k = 0.4525 0.4546 0.5079 ( 2446 PWs) bands (ev): -46.2698 -46.2698 -23.9821 -23.9808 -21.9749 -21.9721 -21.9176 -21.9169 -18.9748 -18.9748 -7.5843 -7.5596 -7.4447 -7.4209 -7.3204 -7.3180 -2.9538 -2.9432 -2.7150 -2.7089 -2.7032 -2.6860 3.2301 3.2321 3.3266 3.3282 4.0144 4.0144 4.4428 4.4433 4.5780 4.5793 4.5958 4.5998 8.1184 8.1187 8.2752 8.2850 8.2955 8.3054 13.5573 13.5594 13.6534 13.6589 13.8661 13.8732 16.9529 16.9876 k = 0.4434 0.4455 0.5079 ( 2446 PWs) bands (ev): -46.2699 -46.2699 -23.9817 -23.9801 -21.9741 -21.9707 -21.9173 -21.9165 -18.9751 -18.9751 -7.5951 -7.5663 -7.4579 -7.4305 -7.3231 -7.3205 -2.9507 -2.9382 -2.7116 -2.7053 -2.6989 -2.6796 3.2361 3.2385 3.3443 3.3464 4.0330 4.0331 4.4384 4.4389 4.5841 4.5855 4.6135 4.6182 8.1025 8.1029 8.2651 8.2766 8.2855 8.2972 13.5417 13.5462 13.6311 13.6355 13.8493 13.8579 16.9520 16.9876 k = 0.4344 0.4364 0.5079 ( 2448 PWs) bands (ev): -46.2700 -46.2700 -23.9812 -23.9794 -21.9730 -21.9692 -21.9169 -21.9160 -18.9753 -18.9753 -7.6073 -7.5750 -7.4725 -7.4422 -7.3259 -7.3233 -2.9469 -2.9326 -2.7076 -2.7018 -2.6930 -2.6723 3.2426 3.2454 3.3651 3.3680 4.0547 4.0549 4.4335 4.4341 4.5911 4.5925 4.6347 4.6401 8.0840 8.0845 8.2529 8.2647 8.2760 8.2880 13.5217 13.5303 13.6070 13.6085 13.8301 13.8404 16.9537 16.9894 k = 0.4253 0.4273 0.5079 ( 2440 PWs) bands (ev): -46.2699 -46.2699 -23.9806 -23.9786 -21.9718 -21.9675 -21.9164 -21.9154 -18.9756 -18.9756 -7.6208 -7.5857 -7.4883 -7.4559 -7.3289 -7.3263 -2.9425 -2.9265 -2.7031 -2.6982 -2.6857 -2.6641 3.2495 3.2527 3.3892 3.3928 4.0793 4.0797 4.4284 4.4290 4.5990 4.6005 4.6596 4.6655 8.0632 8.0638 8.2386 8.2498 8.2664 8.2779 13.4964 13.5110 13.5790 13.5825 13.8090 13.8210 16.9580 16.9933 k = 0.4163 0.4182 0.5079 ( 2432 PWs) bands (ev): -46.2698 -46.2698 -23.9800 -23.9777 -21.9704 -21.9657 -21.9159 -21.9148 -18.9760 -18.9760 -7.6357 -7.5985 -7.5051 -7.4715 -7.3320 -7.3296 -2.9375 -2.9199 -2.6982 -2.6942 -2.6775 -2.6552 3.2565 3.2601 3.4165 3.4210 4.1068 4.1074 4.4230 4.4236 4.6077 4.6094 4.6882 4.6946 8.0400 8.0407 8.2224 8.2327 8.2562 8.2667 13.4648 13.4871 13.5481 13.5584 13.7858 13.7996 16.9650 16.9995 k = 0.4072 0.4091 0.5079 ( 2432 PWs) bands (ev): -46.2699 -46.2699 -23.9792 -23.9768 -21.9689 -21.9637 -21.9153 -21.9141 -18.9764 -18.9764 -7.6521 -7.6138 -7.5226 -7.4888 -7.3352 -7.3331 -2.9320 -2.9128 -2.6928 -2.6898 -2.6685 -2.6456 3.2636 3.2674 3.4471 3.4525 4.1370 4.1378 4.4176 4.4182 4.6175 4.6192 4.7207 4.7273 8.0147 8.0156 8.2042 8.2136 8.2449 8.2546 13.4270 13.4569 13.5178 13.5348 13.7609 13.7766 16.9743 17.0077 k = 0.3982 0.4000 0.5079 ( 2432 PWs) bands (ev): -46.2700 -46.2700 -23.9784 -23.9757 -21.9671 -21.9616 -21.9146 -21.9133 -18.9768 -18.9768 -7.6698 -7.6315 -7.5407 -7.5078 -7.3384 -7.3366 -2.9260 -2.9054 -2.6870 -2.6849 -2.6587 -2.6353 3.2705 3.2747 3.4810 3.4873 4.1698 4.1706 4.4123 4.4129 4.6281 4.6299 4.7571 4.7638 7.9874 7.9884 8.1841 8.1929 8.2325 8.2415 13.3834 13.4194 13.4893 13.5116 13.7346 13.7523 16.9856 17.0178 k = 0.3891 0.3909 0.5079 ( 2432 PWs) bands (ev): -46.2700 -46.2700 -23.9775 -23.9746 -21.9652 -21.9594 -21.9138 -21.9126 -18.9772 -18.9772 -7.6888 -7.6517 -7.5590 -7.5283 -7.3416 -7.3402 -2.9195 -2.8976 -2.6807 -2.6796 -2.6483 -2.6244 3.2774 3.2818 3.5180 3.5253 4.2050 4.2058 4.4073 4.4079 4.6397 4.6416 4.7976 4.8041 7.9582 7.9594 8.1624 8.1706 8.2188 8.2272 13.3349 13.3752 13.4623 13.4882 13.7069 13.7267 16.9987 17.0294 k = 0.3801 0.3818 0.5079 ( 2432 PWs) bands (ev): -46.2701 -46.2701 -23.9765 -23.9735 -21.9632 -21.9570 -21.9130 -21.9117 -18.9777 -18.9777 -7.7091 -7.6744 -7.5775 -7.5500 -7.3449 -7.3438 -2.9127 -2.8895 -2.6741 -2.6739 -2.6373 -2.6131 3.2839 3.2885 3.5582 3.5664 4.2424 4.2432 4.4026 4.4032 4.6523 4.6543 4.8422 4.8483 7.9273 7.9287 8.1390 8.1467 8.2039 8.2118 13.2820 13.3255 13.4358 13.4644 13.6782 13.7000 17.0129 17.0421 k = 0.3710 0.3727 0.5079 ( 2438 PWs) bands (ev): -46.2703 -46.2703 -23.9755 -23.9723 -21.9610 -21.9545 -21.9121 -21.9108 -18.9782 -18.9782 -7.7308 -7.6994 -7.5962 -7.5730 -7.3481 -7.3474 -2.9055 -2.8812 -2.6677 -2.6670 -2.6258 -2.6013 3.2901 3.2949 3.6014 3.6106 4.2820 4.2824 4.3986 4.3991 4.6659 4.6679 4.8909 4.8964 7.8949 7.8964 8.1141 8.1214 8.1877 8.1952 13.2251 13.2713 13.4090 13.4399 13.6486 13.6726 17.0278 17.0552 k = 0.3620 0.3636 0.5079 ( 2438 PWs) bands (ev): -46.2704 -46.2704 -23.9744 -23.9710 -21.9587 -21.9520 -21.9111 -21.9098 -18.9787 -18.9787 -7.7538 -7.7265 -7.6152 -7.5970 -7.3513 -7.3509 -2.8980 -2.8727 -2.6612 -2.6597 -2.6140 -2.5893 3.2960 3.3009 3.6477 3.6578 4.3233 4.3236 4.3953 4.3959 4.6804 4.6825 4.9437 4.9483 7.8611 7.8629 8.0878 8.0948 8.1702 8.1774 13.1646 13.2134 13.3816 13.4145 13.6183 13.6444 17.0423 17.0679 k = 0.3529 0.3545 0.5079 ( 2438 PWs) bands (ev): -46.2705 -46.2705 -23.9732 -23.9697 -21.9562 -21.9494 -21.9100 -21.9088 -18.9793 -18.9793 -7.7781 -7.7554 -7.6345 -7.6217 -7.3543 -7.3543 -2.8902 -2.8640 -2.6543 -2.6520 -2.6018 -2.5770 3.3016 3.3065 3.6970 3.7079 4.3655 4.3666 4.3934 4.3939 4.6959 4.6981 5.0006 5.0039 7.8261 7.8281 8.0601 8.0669 8.1514 8.1583 13.1009 13.1521 13.3536 13.3884 13.5875 13.6157 17.0558 17.0793 k = 0.3439 0.3455 0.5079 ( 2438 PWs) bands (ev): -46.2706 -46.2706 -23.9719 -23.9683 -21.9537 -21.9467 -21.9088 -21.9077 -18.9799 -18.9799 -7.8036 -7.7859 -7.6541 -7.6472 -7.3575 -7.3573 -2.8822 -2.8552 -2.6470 -2.6440 -2.5895 -2.5646 3.3068 3.3116 3.7490 3.7607 4.3902 4.3905 4.4118 4.4138 4.7124 4.7147 5.0614 5.0632 7.7902 7.7924 8.0312 8.0377 8.1313 8.1379 13.0342 13.0877 13.3248 13.3614 13.5564 13.5866 17.0668 17.0881 k = 0.3348 0.3364 0.5079 ( 2436 PWs) bands (ev): -46.2707 -46.2707 -23.9707 -23.9669 -21.9510 -21.9440 -21.9075 -21.9066 -18.9804 -18.9804 -7.8303 -7.8177 -7.6743 -7.6731 -7.3606 -7.3601 -2.8740 -2.8463 -2.6394 -2.6357 -2.5771 -2.5522 3.3116 3.3164 3.8039 3.8161 4.3907 4.3912 4.4566 4.4603 4.7300 4.7324 5.1259 5.1260 7.7534 7.7559 8.0009 8.0073 8.1097 8.1161 12.9648 13.0205 13.2954 13.3337 13.5251 13.5572 17.0739 17.0928 k = 0.3258 0.3273 0.5079 ( 2432 PWs) bands (ev): -46.2707 -46.2707 -23.9693 -23.9654 -21.9482 -21.9412 -21.9061 -21.9054 -18.9810 -18.9810 -7.8582 -7.8507 -7.6994 -7.6948 -7.3635 -7.3628 -2.8656 -2.8373 -2.6315 -2.6271 -2.5647 -2.5398 3.3160 3.3208 3.8613 3.8740 4.3922 4.3926 4.5034 4.5090 4.7486 4.7510 5.1920 5.1939 7.7160 7.7188 7.9695 7.9757 8.0868 8.0930 12.8929 12.9508 13.2655 13.3054 13.4937 13.5276 17.0754 17.0915 k = 0.3167 0.3182 0.5079 ( 2422 PWs) bands (ev): -46.2707 -46.2707 -23.9679 -23.9639 -21.9454 -21.9385 -21.9046 -21.9041 -18.9816 -18.9816 -7.8871 -7.8845 -7.7258 -7.7158 -7.3662 -7.3653 -2.8571 -2.8283 -2.6234 -2.6183 -2.5524 -2.5277 3.3201 3.3248 3.9213 3.9343 4.3951 4.3956 4.5517 4.5594 4.7682 4.7707 5.2609 5.2651 7.6782 7.6813 7.9369 7.9430 8.0624 8.0685 12.8188 12.8789 13.2352 13.2765 13.4625 13.4981 17.0691 17.0821 k = 0.3077 0.3091 0.5079 ( 2426 PWs) bands (ev): -46.2709 -46.2709 -23.9664 -23.9623 -21.9425 -21.9358 -21.9029 -21.9027 -18.9822 -18.9822 -7.9191 -7.9171 -7.7523 -7.7372 -7.3687 -7.3677 -2.8486 -2.8193 -2.6151 -2.6093 -2.5404 -2.5159 3.3239 3.3285 3.9837 3.9967 4.3998 4.4003 4.6013 4.6116 4.7889 4.7914 5.3325 5.3393 7.6401 7.6436 7.9032 7.9092 8.0367 8.0427 12.7427 12.8048 13.2046 13.2472 13.4315 13.4685 17.0526 17.0621 k = 0.2986 0.3000 0.5079 ( 2426 PWs) bands (ev): -46.2710 -46.2710 -23.9650 -23.9608 -21.9396 -21.9331 -21.9013 -21.9011 -18.9829 -18.9829 -7.9543 -7.9481 -7.7788 -7.7589 -7.3710 -7.3698 -2.8400 -2.8104 -2.6065 -2.6002 -2.5287 -2.5045 3.3274 3.3319 4.0483 4.0612 4.4064 4.4069 4.6522 4.6653 4.8106 4.8132 5.4064 5.4159 7.6021 7.6058 7.8683 7.8744 8.0095 8.0154 12.6647 12.7289 13.1738 13.2175 13.4008 13.4391 17.0238 17.0297 k = 0.2896 0.2909 0.5079 ( 2434 PWs) bands (ev): -46.2712 -46.2712 -23.9635 -23.9592 -21.9367 -21.9305 -21.8998 -21.8992 -18.9835 -18.9835 -7.9900 -7.9798 -7.8051 -7.7809 -7.3731 -7.3718 -2.8315 -2.8015 -2.5979 -2.5909 -2.5174 -2.4935 3.3306 3.3349 4.1151 4.1276 4.4150 4.4155 4.7044 4.7207 4.8335 4.8361 5.4823 5.4947 7.5642 7.5683 7.8324 7.8384 7.9809 7.9867 12.5852 12.6513 13.1430 13.1876 13.3705 13.4098 16.9812 16.9832 k = 0.2805 0.2818 0.5079 ( 2442 PWs) bands (ev): -46.2714 -46.2714 -23.9619 -23.9577 -21.9338 -21.9280 -21.8983 -21.8972 -18.9841 -18.9841 -8.0259 -8.0123 -7.8311 -7.8032 -7.3749 -7.3735 -2.8229 -2.7928 -2.5891 -2.5816 -2.5066 -2.4831 3.3335 3.3377 4.1839 4.1958 4.4259 4.4264 4.7577 4.7777 4.8575 4.8601 5.5598 5.5752 7.5267 7.5312 7.7954 7.8014 7.9509 7.9566 12.5044 12.5724 13.1124 13.1577 13.3407 13.3809 16.9224 16.9243 k = 0.2715 0.2727 0.5079 ( 2442 PWs) bands (ev): -46.2716 -46.2716 -23.9604 -23.9561 -21.9309 -21.9255 -21.8966 -21.8950 -18.9848 -18.9848 -8.0619 -8.0453 -7.8569 -7.8257 -7.3764 -7.3750 -2.8144 -2.7841 -2.5803 -2.5721 -2.4963 -2.4733 3.3362 3.3403 4.2546 4.2655 4.4391 4.4396 4.8120 4.8361 4.8828 4.8853 5.6383 5.6570 7.4898 7.4948 7.7572 7.7633 7.9194 7.9251 12.4226 12.4924 13.0820 13.1278 13.3116 13.3524 16.8482 16.8537 k = 0.2624 0.2636 0.5079 ( 2450 PWs) bands (ev): -46.2718 -46.2718 -23.9588 -23.9545 -21.9280 -21.9232 -21.8948 -21.8926 -18.9854 -18.9854 -8.0980 -8.0787 -7.8823 -7.8483 -7.3777 -7.3763 -2.8060 -2.7756 -2.5714 -2.5626 -2.4867 -2.4642 3.3386 3.3426 4.3270 4.3366 4.4548 4.4553 4.8668 4.8949 4.9099 4.9126 5.7175 5.7395 7.4539 7.4592 7.7180 7.7241 7.8865 7.8922 12.3400 12.4116 13.0520 13.0981 13.2831 13.3244 16.7621 16.7709 k = 0.2534 0.2545 0.5079 ( 2450 PWs) bands (ev): -46.2719 -46.2719 -23.9572 -23.9529 -21.9252 -21.9210 -21.8929 -21.8902 -18.9860 -18.9860 -8.1339 -8.1125 -7.9073 -7.8710 -7.3788 -7.3773 -2.7978 -2.7673 -2.5626 -2.5532 -2.4776 -2.4558 3.3409 3.3447 4.4008 4.4087 4.4733 4.4737 4.9187 4.9362 4.9420 4.9600 5.7968 5.8222 7.4191 7.4249 7.6778 7.6839 7.8523 7.8579 12.2568 12.3301 13.0225 13.0687 13.2554 13.2969 16.6663 16.6780 k = 0.2443 0.2455 0.5079 ( 2454 PWs) bands (ev): -46.2721 -46.2721 -23.9556 -23.9513 -21.9225 -21.9189 -21.8910 -21.8876 -18.9867 -18.9867 -8.1697 -8.1463 -7.9318 -7.8936 -7.3796 -7.3781 -2.7897 -2.7593 -2.5538 -2.5437 -2.4693 -2.4481 3.3430 3.3467 4.4743 4.4785 4.4965 4.4980 4.9571 4.9651 4.9899 5.0222 5.8757 5.9045 7.3857 7.3920 7.6364 7.6426 7.8167 7.8223 12.1736 12.2484 12.9935 13.0398 13.2285 13.2701 16.5628 16.5769 k = 0.2353 0.2364 0.5079 ( 2454 PWs) bands (ev): -46.2722 -46.2722 -23.9540 -23.9497 -21.9199 -21.9170 -21.8888 -21.8849 -18.9873 -18.9873 -8.2050 -8.1802 -7.9559 -7.9162 -7.3801 -7.3787 -2.7817 -2.7514 -2.5450 -2.5343 -2.4616 -2.4412 3.3450 3.3484 4.5142 4.5154 4.5558 4.5604 4.9881 4.9944 5.0470 5.0863 5.9535 5.9857 7.3541 7.3610 7.5939 7.6002 7.7798 7.7853 12.0904 12.1667 12.9654 13.0113 13.2025 13.2440 16.4532 16.4694 k = 0.2262 0.2273 0.5079 ( 2458 PWs) bands (ev): -46.2724 -46.2724 -23.9524 -23.9481 -21.9174 -21.9151 -21.8866 -21.8821 -18.9879 -18.9879 -8.2399 -8.2139 -7.9793 -7.9386 -7.3805 -7.3790 -2.7740 -2.7439 -2.5365 -2.5251 -2.4546 -2.4352 3.3468 3.3501 4.5409 4.5422 4.6334 4.6355 5.0188 5.0245 5.1064 5.1517 6.0296 6.0652 7.3247 7.3322 7.5503 7.5567 7.7416 7.7471 12.0076 12.0853 12.9380 12.9836 13.1775 13.2186 16.3390 16.3572 k = 0.2172 0.2182 0.5079 ( 2458 PWs) bands (ev): -46.2725 -46.2725 -23.9508 -23.9466 -21.9151 -21.9134 -21.8843 -21.8792 -18.9884 -18.9884 -8.2743 -8.2474 -8.0022 -7.9607 -7.3806 -7.3791 -2.7665 -2.7366 -2.5281 -2.5159 -2.4482 -2.4298 3.3485 3.3516 4.5698 4.5711 4.7121 4.7127 5.0499 5.0556 5.1670 5.2181 6.1032 6.1422 7.2977 7.3059 7.5056 7.5121 7.7021 7.7077 11.9256 12.0045 12.9115 12.9565 13.1534 13.1941 16.2217 16.2414 k = 0.2081 0.2091 0.5079 ( 2462 PWs) bands (ev): -46.2727 -46.2727 -23.9492 -23.9451 -21.9129 -21.9117 -21.8818 -21.8763 -18.9890 -18.9890 -8.3079 -8.2805 -8.0245 -7.9826 -7.3804 -7.3791 -2.7592 -2.7296 -2.5200 -2.5069 -2.4425 -2.4252 3.3501 3.3530 4.6011 4.6026 4.7895 4.7931 5.0819 5.0877 5.2283 5.2853 6.1735 6.2157 7.2736 7.2828 7.4597 7.4664 7.6615 7.6672 11.8448 11.9248 12.8859 12.9303 13.1304 13.1704 16.1019 16.1230 k = 0.1991 0.2000 0.5079 ( 2466 PWs) bands (ev): -46.2729 -46.2729 -23.9476 -23.9436 -21.9109 -21.9102 -21.8793 -21.8734 -18.9896 -18.9896 -8.3408 -8.3131 -8.0461 -8.0041 -7.3801 -7.3788 -2.7523 -2.7231 -2.5122 -2.4982 -2.4374 -2.4214 3.3515 3.3543 4.6351 4.6367 4.8677 4.8745 5.1147 5.1206 5.2900 5.3530 6.2397 6.2849 7.2530 7.2634 7.4128 7.4195 7.6198 7.6255 11.7656 11.8465 12.8614 12.9049 13.1085 13.1477 15.9808 16.0030 k = 0.1900 0.1909 0.5079 ( 2462 PWs) bands (ev): -46.2729 -46.2729 -23.9461 -23.9421 -21.9090 -21.9087 -21.8766 -21.8705 -18.9901 -18.9901 -8.3728 -8.3450 -8.0670 -8.0252 -7.3796 -7.3783 -2.7456 -2.7168 -2.5047 -2.4897 -2.4327 -2.4183 3.3529 3.3556 4.6717 4.6735 4.9464 4.9567 5.1484 5.1545 5.3520 5.4211 6.3009 6.3486 7.2362 7.2481 7.3647 7.3715 7.5772 7.5829 11.6884 11.7700 12.8380 12.8805 13.0877 13.1260 15.8589 15.8821 k = 0.1810 0.1818 0.5079 ( 2462 PWs) bands (ev): -46.2730 -46.2730 -23.9445 -23.9407 -21.9073 -21.9072 -21.8739 -21.8676 -18.9906 -18.9906 -8.4039 -8.3763 -8.0871 -8.0458 -7.3789 -7.3776 -2.7393 -2.7110 -2.4976 -2.4815 -2.4285 -2.4158 3.3542 3.3567 4.7108 4.7128 5.0255 5.0394 5.1828 5.1891 5.4139 5.4892 6.3563 6.4060 7.2236 7.2376 7.3156 7.3225 7.5336 7.5393 11.6136 11.6958 12.8157 12.8571 13.0680 13.1053 15.7369 15.7609 k = 0.1719 0.1727 0.5079 ( 2466 PWs) bands (ev): -46.2732 -46.2732 -23.9431 -23.9393 -21.9060 -21.9056 -21.8712 -21.8647 -18.9911 -18.9911 -8.4340 -8.4066 -8.1064 -8.0659 -7.3780 -7.3768 -2.7333 -2.7056 -2.4910 -2.4736 -2.4248 -2.4139 3.3554 3.3578 4.7524 4.7547 5.1049 5.1227 5.2179 5.2245 5.4757 5.5571 6.4050 6.4561 7.2153 7.2323 7.2658 7.2723 7.4892 7.4950 11.5418 11.6242 12.7946 12.8347 13.0495 13.0856 15.6154 15.6399 k = 0.1629 0.1636 0.5079 ( 2464 PWs) bands (ev): -46.2733 -46.2733 -23.9416 -23.9380 -21.9047 -21.9041 -21.8684 -21.8619 -18.9916 -18.9916 -8.4629 -8.4361 -8.1249 -8.0853 -7.3770 -7.3759 -2.7277 -2.7007 -2.4848 -2.4661 -2.4212 -2.4124 3.3566 3.3588 4.7964 4.7989 5.1844 5.2061 5.2539 5.2607 5.5369 5.6244 6.4467 6.4982 7.2053 7.2211 7.2213 7.2322 7.4441 7.4500 11.4733 11.5558 12.7746 12.8133 13.0322 13.0670 15.4949 15.5198 k = 0.1538 0.1545 0.5079 ( 2460 PWs) bands (ev): -46.2733 -46.2733 -23.9402 -23.9367 -21.9035 -21.9027 -21.8657 -21.8592 -18.9920 -18.9920 -8.4906 -8.4645 -8.1426 -8.1042 -7.3759 -7.3748 -2.7224 -2.6962 -2.4792 -2.4590 -2.4179 -2.4113 3.3577 3.3598 4.8426 4.8455 5.2638 5.2855 5.2944 5.2974 5.5973 5.6909 6.4812 6.5322 7.1594 7.1688 7.2160 7.2372 7.3985 7.4044 11.4088 11.4909 12.7559 12.7931 13.0161 13.0495 15.3759 15.4011 k = 0.1448 0.1455 0.5079 ( 2464 PWs) bands (ev): -46.2735 -46.2735 -23.9388 -23.9355 -21.9024 -21.9015 -21.8630 -21.8566 -18.9925 -18.9925 -8.5171 -8.4918 -8.1593 -8.1223 -7.3746 -7.3736 -2.7175 -2.6922 -2.4742 -2.4525 -2.4147 -2.4105 3.3588 3.3607 4.8909 4.8942 5.3260 5.3344 5.3431 5.3741 5.6567 5.7560 6.5087 6.5583 7.1066 7.1156 7.2205 7.2463 7.3524 7.3585 11.3485 11.4299 12.7383 12.7740 13.0011 13.0331 15.2589 15.2841 k = 0.1357 0.1364 0.5079 ( 2468 PWs) bands (ev): -46.2736 -46.2736 -23.9375 -23.9344 -21.9014 -21.9003 -21.8603 -21.8541 -18.9929 -18.9929 -8.5422 -8.5179 -8.1752 -8.1396 -7.3733 -7.3724 -2.7130 -2.6886 -2.4698 -2.4467 -2.4116 -2.4098 3.3597 3.3615 4.9412 4.9449 5.3632 5.3721 5.4216 5.4570 5.7149 5.8195 6.5300 6.5773 7.0524 7.0615 7.2281 7.2584 7.3062 7.3123 11.2930 11.3732 12.7220 12.7560 12.9874 13.0177 15.1445 15.1695 k = 0.1267 0.1273 0.5079 ( 2464 PWs) bands (ev): -46.2737 -46.2737 -23.9363 -23.9333 -21.9004 -21.8993 -21.8577 -21.8517 -18.9932 -18.9932 -8.5660 -8.5428 -8.1900 -8.1562 -7.3719 -7.3711 -2.7088 -2.6856 -2.4660 -2.4417 -2.4090 -2.4084 3.3607 3.3623 4.9933 4.9974 5.4004 5.4099 5.4994 5.5393 5.7715 5.8809 6.5462 6.5904 6.9974 7.0067 7.2371 7.2599 7.2660 7.2719 11.2427 11.3213 12.7070 12.7392 12.9748 13.0034 15.0331 15.0578 k = 0.1176 0.1182 0.5079 ( 2456 PWs) bands (ev): -46.2736 -46.2736 -23.9351 -23.9323 -21.8995 -21.8983 -21.8552 -21.8494 -18.9936 -18.9936 -8.5883 -8.5663 -8.2039 -8.1719 -7.3705 -7.3697 -2.7051 -2.6830 -2.4627 -2.4376 -2.4078 -2.4053 3.3615 3.3631 5.0469 5.0515 5.4375 5.4477 5.5760 5.6203 5.8265 5.9396 6.5588 6.5989 6.9417 6.9512 7.2138 7.2199 7.2461 7.2852 11.1978 11.2743 12.6932 12.7235 12.9634 12.9903 14.9253 14.9495 k = 0.1086 0.1091 0.5079 ( 2460 PWs) bands (ev): -46.2738 -46.2738 -23.9340 -23.9313 -21.8986 -21.8974 -21.8528 -21.8473 -18.9939 -18.9939 -8.6091 -8.5884 -8.2167 -8.1867 -7.3691 -7.3684 -2.7016 -2.6808 -2.4599 -2.4347 -2.4061 -2.4022 3.3624 3.3638 5.1018 5.1070 5.4743 5.4853 5.6511 5.6995 5.8797 5.9950 6.5690 6.6041 6.8855 6.8952 7.1682 7.1743 7.2535 7.2965 11.1586 11.2325 12.6806 12.7089 12.9532 12.9781 14.8215 14.8451 k = 0.0995 0.1000 0.5079 ( 2460 PWs) bands (ev): -46.2738 -46.2738 -23.9329 -23.9305 -21.8978 -21.8966 -21.8505 -21.8453 -18.9942 -18.9942 -8.6283 -8.6090 -8.2285 -8.2006 -7.3677 -7.3670 -2.6986 -2.6792 -2.4575 -2.4330 -2.4038 -2.3991 3.3631 3.3644 5.1577 5.1636 5.5105 5.5225 5.7241 5.7759 5.9311 6.0466 6.5785 6.6073 6.8291 6.8390 7.1233 7.1294 7.2581 7.3047 11.1252 11.1958 12.6691 12.6954 12.9440 12.9670 14.7226 14.7452 k = 0.0905 0.0909 0.5079 ( 2460 PWs) bands (ev): -46.2739 -46.2739 -23.9319 -23.9297 -21.8970 -21.8959 -21.8483 -21.8436 -18.9945 -18.9945 -8.6459 -8.6282 -8.2393 -8.2135 -7.3664 -7.3657 -2.6958 -2.6779 -2.4555 -2.4322 -2.4011 -2.3961 3.3638 3.3650 5.2144 5.2211 5.5457 5.5588 5.7946 5.8484 5.9811 6.0936 6.5887 6.6098 6.7728 6.7828 7.0794 7.0855 7.2591 7.3086 11.0975 11.1643 12.6589 12.6830 12.9359 12.9570 14.6290 14.6506 k = 0.0814 0.0818 0.5079 ( 2460 PWs) bands (ev): -46.2739 -46.2739 -23.9310 -23.9289 -21.8963 -21.8953 -21.8463 -21.8419 -18.9948 -18.9948 -8.6619 -8.6457 -8.2489 -8.2254 -7.3651 -7.3645 -2.6934 -2.6770 -2.4537 -2.4322 -2.3981 -2.3933 3.3645 3.3655 5.2713 5.2790 5.5795 5.5938 5.8620 5.9154 6.0302 6.1351 6.6008 6.6126 6.7171 6.7270 7.0370 7.0429 7.2557 7.3077 11.0754 11.1378 12.6499 12.6718 12.9288 12.9478 14.5415 14.5617 k = 0.0724 0.0727 0.5079 ( 2454 PWs) bands (ev): -46.2739 -46.2739 -23.9301 -23.9283 -21.8957 -21.8948 -21.8444 -21.8405 -18.9950 -18.9950 -8.6762 -8.6616 -8.2574 -8.2363 -7.3638 -7.3633 -2.6912 -2.6764 -2.4522 -2.4327 -2.3951 -2.3907 3.3651 3.3660 5.3282 5.3370 5.6113 5.6271 5.9254 5.9749 6.0788 6.1706 6.6148 6.6168 6.6637 6.6720 6.9965 7.0022 7.2477 7.3015 11.0586 11.1159 12.6420 12.6616 12.9227 12.9397 14.4606 14.4794 k = 0.0633 0.0636 0.5079 ( 2454 PWs) bands (ev): -46.2740 -46.2740 -23.9294 -23.9278 -21.8952 -21.8943 -21.8427 -21.8392 -18.9952 -18.9952 -8.6887 -8.6759 -8.2648 -8.2462 -7.3627 -7.3622 -2.6893 -2.6762 -2.4508 -2.4336 -2.3922 -2.3883 3.3656 3.3664 5.3845 5.3945 5.6406 5.6580 5.9843 6.0258 6.1267 6.1995 6.6032 6.6170 6.6253 6.6412 6.9584 6.9639 7.2352 7.2899 11.0465 11.0982 12.6352 12.6525 12.9176 12.9325 14.3872 14.4042 k = 0.0543 0.0545 0.5079 ( 2458 PWs) bands (ev): -46.2741 -46.2741 -23.9287 -23.9273 -21.8947 -21.8939 -21.8412 -21.8381 -18.9954 -18.9954 -8.6996 -8.6885 -8.2711 -8.2550 -7.3616 -7.3613 -2.6875 -2.6763 -2.4495 -2.4346 -2.3895 -2.3862 3.3661 3.3668 5.4394 5.4509 5.6665 5.6855 6.0378 6.0680 6.1721 6.2221 6.5547 6.5668 6.6348 6.6617 6.9233 6.9284 7.2187 7.2735 11.0386 11.0841 12.6295 12.6445 12.9133 12.9261 14.3219 14.3370 k = 0.0452 0.0455 0.5079 ( 2462 PWs) bands (ev): -46.2742 -46.2742 -23.9281 -23.9269 -21.8942 -21.8936 -21.8398 -21.8373 -18.9955 -18.9955 -8.7086 -8.6993 -8.2762 -8.2627 -7.3607 -7.3604 -2.6860 -2.6765 -2.4483 -2.4358 -2.3871 -2.3844 3.3665 3.3671 5.4922 5.5054 5.6882 5.7089 6.0850 6.1026 6.2121 6.2388 6.5075 6.5188 6.6502 6.6870 6.8919 6.8965 7.1992 7.2527 11.0342 11.0730 12.6250 12.6375 12.9100 12.9206 14.2654 14.2783 k = 0.0362 0.0364 0.5079 ( 2450 PWs) bands (ev): -46.2740 -46.2740 -23.9275 -23.9266 -21.8938 -21.8933 -21.8386 -21.8366 -18.9956 -18.9956 -8.7159 -8.7084 -8.2801 -8.2692 -7.3600 -7.3597 -2.6846 -2.6770 -2.4470 -2.4371 -2.3851 -2.3829 3.3669 3.3673 5.5420 5.5570 5.7045 5.7268 6.1250 6.1309 6.2440 6.2509 6.4651 6.4753 6.6705 6.7132 6.8649 6.8689 7.1784 7.2287 11.0326 11.0642 12.6215 12.6316 12.9075 12.9160 14.2185 14.2291 k = 0.0271 0.0273 0.5079 ( 2442 PWs) bands (ev): -46.2739 -46.2739 -23.9271 -23.9264 -21.8935 -21.8931 -21.8377 -21.8361 -18.9957 -18.9957 -8.7213 -8.7157 -8.2828 -8.2747 -7.3593 -7.3592 -2.6833 -2.6776 -2.4458 -2.4383 -2.3834 -2.3817 3.3672 3.3675 5.5874 5.6042 5.7147 5.7379 6.1537 6.1563 6.2601 6.2664 6.4294 6.4379 6.6947 6.7371 6.8430 6.8463 7.1589 7.2031 11.0332 11.0573 12.6191 12.6267 12.9059 12.9123 14.1816 14.1897 k = 0.0181 0.0182 0.5079 ( 2446 PWs) bands (ev): -46.2740 -46.2740 -23.9268 -23.9263 -21.8933 -21.8930 -21.8369 -21.8359 -18.9958 -18.9958 -8.7250 -8.7212 -8.2844 -8.2789 -7.3589 -7.3588 -2.6821 -2.6783 -2.4446 -2.4396 -2.3821 -2.3810 3.3674 3.3676 5.6270 5.6450 5.7180 5.7410 6.1712 6.1776 6.2681 6.2793 6.4024 6.4087 6.7202 6.7549 6.8269 6.8293 7.1442 7.1780 11.0353 11.0516 12.6178 12.6229 12.9050 12.9092 14.1552 14.1607 k = 0.0090 0.0091 0.5079 ( 2444 PWs) bands (ev): -46.2740 -46.2740 -23.9265 -23.9263 -21.8931 -21.8930 -21.8363 -21.8358 -18.9958 -18.9958 -8.7268 -8.7249 -8.2848 -8.2821 -7.3586 -7.3585 -2.6810 -2.6791 -2.4434 -2.4409 -2.3812 -2.3807 3.3675 3.3676 5.6587 5.6744 5.7170 5.7354 6.1834 6.1883 6.2757 6.2838 6.3861 6.3894 6.7430 6.7627 6.8172 6.8186 7.1379 7.1566 11.0385 11.0466 12.6175 12.6201 12.9049 12.9071 14.1397 14.1425 k = 0.0000 0.0000 0.5079 ( 2436 PWs) bands (ev): -46.2739 -46.2739 -23.9263 -23.9263 -21.8930 -21.8930 -21.8360 -21.8360 -18.9958 -18.9958 -8.7267 -8.7267 -8.2840 -8.2840 -7.3585 -7.3585 -2.6800 -2.6800 -2.4421 -2.4421 -2.3807 -2.3807 3.3676 3.3676 5.6787 5.6787 5.7235 5.7235 6.1896 6.1896 6.2818 6.2818 6.3816 6.3816 6.7584 6.7584 6.8145 6.8145 7.1422 7.1422 11.0423 11.0423 12.6183 12.6183 12.9056 12.9056 14.1355 14.1355 k = 0.0000 0.0000 0.5079 ( 2436 PWs) bands (ev): -46.2739 -46.2739 -23.9263 -23.9263 -21.8930 -21.8930 -21.8360 -21.8360 -18.9958 -18.9958 -8.7267 -8.7267 -8.2840 -8.2840 -7.3585 -7.3585 -2.6800 -2.6800 -2.4421 -2.4421 -2.3807 -2.3807 3.3676 3.3676 5.6787 5.6787 5.7235 5.7235 6.1896 6.1896 6.2818 6.2818 6.3816 6.3816 6.7584 6.7584 6.8145 6.8145 7.1422 7.1422 11.0423 11.0423 12.6183 12.6183 12.9056 12.9056 14.1355 14.1355 k = 0.0000 0.0000 0.4952 ( 2442 PWs) bands (ev): -46.2740 -46.2740 -23.9264 -23.9262 -21.8930 -21.8928 -21.8361 -21.8359 -18.9959 -18.9959 -8.7268 -8.7264 -8.2841 -8.2840 -7.3611 -7.3596 -2.6803 -2.6799 -2.4422 -2.4422 -2.3811 -2.3806 3.3709 3.3725 5.6789 5.6803 5.7238 5.7252 6.1871 6.1924 6.2804 6.2825 6.3822 6.3850 6.7588 6.7591 6.8149 6.8155 7.1422 7.1425 11.0416 11.0425 12.6127 12.6162 12.9003 12.9032 14.1347 14.1370 k = 0.0000 0.0000 0.4825 ( 2454 PWs) bands (ev): -46.2741 -46.2741 -23.9264 -23.9259 -21.8926 -21.8922 -21.8362 -21.8357 -18.9961 -18.9960 -8.7267 -8.7259 -8.2842 -8.2841 -7.3675 -7.3645 -2.6808 -2.6800 -2.4424 -2.4424 -2.3819 -2.3809 3.3823 3.3856 5.6811 5.6839 5.7262 5.7290 6.1850 6.1956 6.2786 6.2824 6.3868 6.3920 6.7604 6.7609 6.8168 6.8180 7.1425 7.1431 11.0405 11.0423 12.5994 12.6064 12.8873 12.8931 14.1345 14.1390 k = 0.0000 0.0000 0.4699 ( 2458 PWs) bands (ev): -46.2742 -46.2742 -23.9263 -23.9255 -21.8920 -21.8914 -21.8363 -21.8356 -18.9963 -18.9962 -8.7263 -8.7251 -8.2844 -8.2843 -7.3775 -7.3731 -2.6814 -2.6803 -2.4428 -2.4427 -2.3829 -2.3814 3.4018 3.4068 5.6851 5.6894 5.7307 5.7349 6.1832 6.1991 6.2769 6.2818 6.3952 6.4020 6.7631 6.7639 6.8202 6.8219 7.1431 7.1440 11.0390 11.0416 12.5786 12.5891 12.8668 12.8755 14.1350 14.1416 k = 0.0000 0.0000 0.4572 ( 2460 PWs) bands (ev): -46.2743 -46.2743 -23.9261 -23.9250 -21.8910 -21.8903 -21.8364 -21.8354 -18.9966 -18.9965 -8.7257 -8.7241 -8.2847 -8.2846 -7.3912 -7.3854 -2.6822 -2.6807 -2.4432 -2.4431 -2.3842 -2.3822 3.4293 3.4359 5.6910 5.6967 5.7372 5.7427 6.1820 6.2030 6.2757 6.2811 6.4067 6.4147 6.7670 6.7681 6.8250 6.8273 7.1439 7.1452 11.0370 11.0405 12.5505 12.5643 12.8391 12.8503 14.1361 14.1446 k = 0.0000 0.0000 0.4445 ( 2456 PWs) bands (ev): -46.2743 -46.2743 -23.9257 -23.9243 -21.8898 -21.8889 -21.8365 -21.8352 -18.9970 -18.9968 -8.7249 -8.7229 -8.2850 -8.2849 -7.4083 -7.4011 -2.6832 -2.6813 -2.4438 -2.4437 -2.3858 -2.3834 3.4646 3.4728 5.6986 5.7060 5.7458 5.7525 6.1813 6.2074 6.2753 6.2806 6.4209 6.4293 6.7723 6.7739 6.8312 6.8340 7.1451 7.1467 11.0345 11.0390 12.5154 12.5324 12.8044 12.8180 14.1378 14.1481 k = 0.0000 0.0000 0.4318 ( 2456 PWs) bands (ev): -46.2743 -46.2743 -23.9252 -23.9236 -21.8883 -21.8873 -21.8365 -21.8350 -18.9975 -18.9973 -8.7239 -8.7215 -8.2854 -8.2853 -7.4287 -7.4202 -2.6843 -2.6821 -2.4444 -2.4443 -2.3877 -2.3848 3.5074 3.5172 5.7079 5.7170 5.7563 5.7642 6.1812 6.2123 6.2758 6.2808 6.4372 6.4457 6.7791 6.7812 6.8388 6.8421 7.1466 7.1485 11.0316 11.0371 12.4736 12.4936 12.7631 12.7787 14.1399 14.1517 k = 0.0000 0.0000 0.4191 ( 2456 PWs) bands (ev): -46.2744 -46.2744 -23.9247 -23.9228 -21.8865 -21.8854 -21.8366 -21.8348 -18.9981 -18.9978 -8.7228 -8.7199 -8.2859 -8.2857 -7.4522 -7.4424 -2.6855 -2.6831 -2.4452 -2.4451 -2.3898 -2.3865 3.5577 3.5689 5.7188 5.7297 5.7686 5.7777 6.1818 6.2177 6.2775 6.2819 6.4550 6.4634 6.7876 6.7903 6.8477 6.8515 7.1483 7.1506 11.0282 11.0348 12.4256 12.4483 12.7155 12.7330 14.1424 14.1554 k = 0.0000 0.0000 0.4064 ( 2444 PWs) bands (ev): -46.2743 -46.2743 -23.9240 -23.9219 -21.8844 -21.8833 -21.8366 -21.8344 -18.9987 -18.9984 -8.7215 -8.7182 -8.2865 -8.2862 -7.4786 -7.4676 -2.6869 -2.6841 -2.4461 -2.4460 -2.3922 -2.3884 3.6150 3.6276 5.7311 5.7440 5.7828 5.7928 6.1832 6.2237 6.2802 6.2841 6.4739 6.4820 6.7981 6.8016 6.8578 6.8621 7.1505 7.1531 11.0244 11.0321 12.3718 12.3970 12.6619 12.6810 14.1452 14.1592 k = 0.0000 0.0000 0.3937 ( 2444 PWs) bands (ev): -46.2743 -46.2743 -23.9233 -23.9209 -21.8821 -21.8810 -21.8366 -21.8341 -18.9994 -18.9990 -8.7200 -8.7163 -8.2871 -8.2868 -7.5077 -7.4955 -2.6885 -2.6854 -2.4471 -2.4470 -2.3948 -2.3906 3.6790 3.6930 5.7447 5.7598 5.7986 5.8095 6.1857 6.2304 6.2842 6.2875 6.4934 6.5011 6.8108 6.8154 6.8691 6.8739 7.1529 7.1559 11.0201 11.0290 12.3126 12.3401 12.6029 12.6233 14.1481 14.1629 k = 0.0000 0.0000 0.3810 ( 2452 PWs) bands (ev): -46.2745 -46.2745 -23.9225 -23.9199 -21.8796 -21.8786 -21.8365 -21.8336 -19.0001 -18.9998 -8.7185 -8.7144 -8.2877 -8.2875 -7.5391 -7.5259 -2.6902 -2.6868 -2.4482 -2.4480 -2.3976 -2.3931 3.7494 3.7646 5.7595 5.7769 5.8160 5.8276 6.1891 6.2379 6.2893 6.2922 6.5130 6.5204 6.8261 6.8319 6.8815 6.8867 7.1557 7.1591 11.0154 11.0255 12.2485 12.2779 12.5387 12.5602 14.1510 14.1664 k = 0.0000 0.0000 0.3683 ( 2456 PWs) bands (ev): -46.2746 -46.2746 -23.9215 -23.9188 -21.8769 -21.8761 -21.8364 -21.8331 -19.0010 -19.0006 -8.7168 -8.7123 -8.2885 -8.2882 -7.5727 -7.5585 -2.6920 -2.6884 -2.4493 -2.4492 -2.4007 -2.3958 3.8258 3.8421 5.7753 5.7952 5.8349 5.8470 6.1938 6.2462 6.2957 6.2982 6.5323 6.5395 6.8443 6.8516 6.8950 6.9006 7.1588 7.1627 11.0101 11.0218 12.1801 12.2113 12.4698 12.4922 14.1540 14.1698 k = 0.0000 0.0000 0.3556 ( 2464 PWs) bands (ev): -46.2748 -46.2748 -23.9206 -23.9177 -21.8741 -21.8735 -21.8363 -21.8324 -19.0019 -19.0014 -8.7152 -8.7102 -8.2893 -8.2889 -7.6082 -7.5930 -2.6939 -2.6900 -2.4506 -2.4504 -2.4039 -2.3987 3.9077 3.9250 5.7919 5.8143 5.8550 5.8674 6.1997 6.2554 6.3034 6.3058 6.5508 6.5579 6.8657 6.8748 6.9093 6.9152 7.1624 7.1668 11.0044 11.0176 12.1081 12.1406 12.3966 12.4198 14.1570 14.1731 k = 0.0000 0.0000 0.3429 ( 2460 PWs) bands (ev): -46.2749 -46.2749 -23.9195 -23.9164 -21.8711 -21.8708 -21.8360 -21.8316 -19.0028 -19.0023 -8.7135 -8.7081 -8.2901 -8.2897 -7.6452 -7.6291 -2.6959 -2.6918 -2.4519 -2.4518 -2.4072 -2.4018 3.9946 4.0130 5.8091 5.8342 5.8762 5.8887 6.2072 6.2655 6.3124 6.3149 6.5682 6.5753 6.8905 6.9016 6.9245 6.9307 7.1663 7.1714 10.9981 11.0132 12.0330 12.0666 12.3197 12.3434 14.1599 14.1760 k = 0.0000 0.0000 0.3302 ( 2452 PWs) bands (ev): -46.2748 -46.2748 -23.9184 -23.9152 -21.8682 -21.8681 -21.8356 -21.8306 -19.0037 -19.0033 -8.7119 -8.7061 -8.2909 -8.2905 -7.6834 -7.6666 -2.6980 -2.6937 -2.4532 -2.4531 -2.4106 -2.4050 4.0862 4.1054 5.8267 5.8545 5.8983 5.9106 6.2162 6.2767 6.3230 6.3258 6.5844 6.5916 6.9187 6.9318 6.9407 6.9468 7.1708 7.1765 10.9913 11.0084 11.9555 11.9897 12.2394 12.2635 14.1627 14.1787 k = 0.0000 0.0000 0.3175 ( 2444 PWs) bands (ev): -46.2748 -46.2748 -23.9172 -23.9138 -21.8656 -21.8651 -21.8350 -21.8293 -19.0047 -19.0042 -8.7104 -8.7041 -8.2918 -8.2913 -7.7226 -7.7050 -2.7002 -2.6957 -2.4546 -2.4545 -2.4142 -2.4083 4.1820 4.2019 5.8446 5.8749 5.9209 5.9329 6.2270 6.2890 6.3351 6.3385 6.5992 6.6067 6.9500 6.9558 6.9636 6.9673 7.1758 7.1824 10.9838 11.0033 11.8762 11.9107 12.1560 12.1806 14.1654 14.1813 k = 0.0000 0.0000 0.3048 ( 2448 PWs) bands (ev): -46.2750 -46.2750 -23.9159 -23.9125 -21.8632 -21.8622 -21.8342 -21.8278 -19.0058 -19.0053 -8.7089 -8.7023 -8.2927 -8.2922 -7.7624 -7.7442 -2.7024 -2.6978 -2.4561 -2.4560 -2.4178 -2.4118 4.2813 4.3018 5.8624 5.8952 5.9438 5.9552 6.2396 6.3025 6.3490 6.3533 6.6127 6.6204 6.9727 6.9784 6.9867 7.0047 7.1814 7.1890 10.9755 10.9978 11.7958 11.8300 12.0701 12.0950 14.1679 14.1835 k = 0.0000 0.0000 0.2921 ( 2452 PWs) bands (ev): -46.2751 -46.2751 -23.9147 -23.9112 -21.8610 -21.8594 -21.8331 -21.8261 -19.0069 -19.0064 -8.7077 -8.7007 -8.2937 -8.2931 -7.8025 -7.7838 -2.7047 -2.6999 -2.4576 -2.4575 -2.4215 -2.4154 4.3837 4.4047 5.8800 5.9149 5.9668 5.9774 6.2543 6.3171 6.3647 6.3701 6.6249 6.6331 6.9895 6.9961 7.0235 7.0454 7.1878 7.1967 10.9665 10.9920 11.7151 11.7485 11.9822 12.0073 14.1703 14.1855 k = 0.0000 0.0000 0.2794 ( 2449 PWs) bands (ev): -46.2752 -46.2752 -23.9134 -23.9098 -21.8591 -21.8570 -21.8315 -21.8240 -19.0080 -19.0074 -8.7067 -8.6993 -8.2947 -8.2940 -7.8426 -7.8235 -2.7070 -2.7022 -2.4590 -2.4590 -2.4253 -2.4191 4.4887 4.5100 5.8972 5.9339 5.9896 5.9991 6.2711 6.3331 6.3825 6.3892 6.6361 6.6447 7.0062 7.0128 7.0631 7.0889 7.1949 7.2056 10.9564 10.9858 11.6349 11.6670 11.8925 11.9180 14.1725 14.1872 k = 0.0000 0.0000 0.2667 ( 2445 PWs) bands (ev): -46.2752 -46.2752 -23.9120 -23.9085 -21.8573 -21.8548 -21.8296 -21.8215 -19.0091 -19.0085 -8.7060 -8.6982 -8.2956 -8.2949 -7.8824 -7.8630 -2.7094 -2.7044 -2.4606 -2.4605 -2.4290 -2.4228 4.5957 4.6172 5.9140 5.9518 6.0117 6.0202 6.2900 6.3504 6.4024 6.4105 6.6464 6.6554 7.0225 7.0290 7.1042 7.1344 7.2031 7.2164 10.9450 10.9791 11.5561 11.5860 11.8016 11.8276 14.1745 14.1888 k = 0.0000 0.0000 0.2540 ( 2445 PWs) bands (ev): -46.2753 -46.2753 -23.9107 -23.9071 -21.8559 -21.8531 -21.8272 -21.8189 -19.0102 -19.0096 -8.7056 -8.6975 -8.2966 -8.2959 -7.9216 -7.9021 -2.7117 -2.7068 -2.4621 -2.4620 -2.4327 -2.4265 4.7040 4.7256 5.9300 5.9686 6.0330 6.0403 6.3111 6.3692 6.4245 6.4340 6.6559 6.6655 7.0383 7.0446 7.1452 7.1814 7.2124 7.2299 10.9321 10.9718 11.4796 11.5064 11.7099 11.7365 14.1763 14.1900 k = 0.0000 0.0000 0.2413 ( 2449 PWs) bands (ev): -46.2755 -46.2755 -23.9094 -23.9058 -21.8547 -21.8518 -21.8244 -21.8159 -19.0113 -19.0108 -8.7056 -8.6972 -8.2976 -8.2968 -7.9599 -7.9403 -2.7141 -2.7091 -2.4636 -2.4636 -2.4365 -2.4303 4.8132 4.8347 5.9454 5.9840 6.0532 6.0593 6.3342 6.3895 6.4488 6.4596 6.6648 6.6750 7.0532 7.0593 7.1835 7.2211 7.2311 7.2483 10.9174 10.9638 11.4065 11.4292 11.6179 11.6453 14.1780 14.1911 k = 0.0000 0.0000 0.2286 ( 2449 PWs) bands (ev): -46.2756 -46.2756 -23.9080 -23.9045 -21.8537 -21.8508 -21.8212 -21.8128 -19.0124 -19.0119 -8.7060 -8.6974 -8.2987 -8.2977 -7.9970 -7.9775 -2.7164 -2.7115 -2.4651 -2.4651 -2.4401 -2.4340 4.9226 4.9438 5.9599 5.9982 6.0721 6.0770 6.3593 6.4114 6.4752 6.4872 6.6731 6.6841 7.0672 7.0729 7.2151 7.2338 7.2750 7.2784 10.9003 10.9548 11.3377 11.3553 11.5260 11.5547 14.1795 14.1920 k = 0.0000 0.0000 0.2159 ( 2461 PWs) bands (ev): -46.2758 -46.2758 -23.9067 -23.9032 -21.8528 -21.8501 -21.8178 -21.8096 -19.0135 -19.0130 -8.7070 -8.6981 -8.2997 -8.2986 -8.0327 -8.0134 -2.7187 -2.7138 -2.4666 -2.4666 -2.4437 -2.4377 5.0315 5.0523 5.9737 6.0112 6.0897 6.0935 6.3861 6.4350 6.5035 6.5166 6.6812 6.6929 7.0799 7.0852 7.2390 7.2470 7.3102 7.3259 10.8806 10.9445 11.2740 11.2858 11.4347 11.4656 14.1809 14.1928 k = 0.0000 0.0000 0.2032 ( 2459 PWs) bands (ev): -46.2759 -46.2759 -23.9054 -23.9020 -21.8522 -21.8496 -21.8142 -21.8062 -19.0146 -19.0141 -8.7084 -8.6995 -8.3007 -8.2995 -8.0667 -8.0477 -2.7209 -2.7162 -2.4681 -2.4680 -2.4472 -2.4413 5.1394 5.1595 5.9867 6.0231 6.1058 6.1086 6.4145 6.4602 6.5334 6.5474 6.6889 6.7016 7.0913 7.0962 7.2589 7.2614 7.3494 7.3720 10.8580 10.9324 11.2158 11.2220 11.3446 11.3791 14.1821 14.1933 k = 0.0000 0.0000 0.1905 ( 2453 PWs) bands (ev): -46.2759 -46.2759 -23.9041 -23.9008 -21.8517 -21.8492 -21.8105 -21.8029 -19.0156 -19.0151 -8.7105 -8.7014 -8.3016 -8.3004 -8.0988 -8.0802 -2.7231 -2.7184 -2.4695 -2.4694 -2.4505 -2.4448 5.2454 5.2646 5.9991 6.0341 6.1204 6.1224 6.4444 6.4869 6.5647 6.5793 6.6966 6.7105 7.1014 7.1060 7.2771 7.2776 7.3886 7.4157 10.8328 10.9180 11.1620 11.1651 11.2562 11.2972 14.1832 14.1938 k = 0.0000 0.0000 0.1778 ( 2453 PWs) bands (ev): -46.2760 -46.2760 -23.9028 -23.8996 -21.8512 -21.8490 -21.8068 -21.7995 -19.0166 -19.0161 -8.7131 -8.7041 -8.3026 -8.3012 -8.1288 -8.1109 -2.7252 -2.7207 -2.4708 -2.4708 -2.4537 -2.4482 5.3488 5.3669 6.0108 6.0443 6.1336 6.1348 6.4756 6.5151 6.5969 6.6120 6.7044 6.7196 7.1103 7.1145 7.2938 7.2962 7.4257 7.4560 10.8057 10.9006 11.1093 11.1160 11.1705 11.2240 14.1842 14.1941 k = 0.0000 0.0000 0.1651 ( 2459 PWs) bands (ev): -46.2762 -46.2762 -23.9016 -23.8986 -21.8509 -21.8488 -21.8031 -21.7963 -19.0176 -19.0171 -8.7162 -8.7074 -8.3036 -8.3020 -8.1565 -8.1394 -2.7272 -2.7229 -2.4722 -2.4721 -2.4567 -2.4515 5.4487 5.4654 6.0222 6.0542 6.1454 6.1461 6.5077 6.5446 6.6295 6.6450 6.7125 6.7296 7.1179 7.1218 7.3113 7.3149 7.4591 7.4918 10.7781 10.8800 11.0518 11.0709 11.0926 11.1652 14.1851 14.1943 k = 0.0000 0.0000 0.1524 ( 2463 PWs) bands (ev): -46.2763 -46.2763 -23.9004 -23.8975 -21.8506 -21.8487 -21.7995 -21.7931 -19.0185 -19.0181 -8.7199 -8.7114 -8.3045 -8.3028 -8.1817 -8.1656 -2.7291 -2.7250 -2.4734 -2.4733 -2.4596 -2.4547 5.5440 5.5591 6.0334 6.0639 6.1560 6.1561 6.5405 6.5750 6.6621 6.6779 6.7216 6.7409 7.1244 7.1281 7.3295 7.3338 7.4877 7.5221 10.7516 10.8567 10.9868 11.0021 11.0508 11.1231 14.1859 14.1944 k = 0.0000 0.0000 0.1397 ( 2467 PWs) bands (ev): -46.2765 -46.2764 -23.8993 -23.8966 -21.8504 -21.8487 -21.7961 -21.7901 -19.0194 -19.0190 -8.7241 -8.7159 -8.3054 -8.3035 -8.2045 -8.1896 -2.7309 -2.7270 -2.4746 -2.4745 -2.4623 -2.4577 5.6337 5.6468 6.0448 6.0738 6.1651 6.1654 6.5733 6.6057 6.6941 6.7103 6.7326 6.7544 7.1300 7.1335 7.3480 7.3525 7.5104 7.5459 10.7277 10.8315 10.9181 10.9286 11.0265 11.0933 14.1866 14.1944 k = 0.0000 0.0000 0.1270 ( 2471 PWs) bands (ev): -46.2766 -46.2766 -23.8983 -23.8958 -21.8503 -21.8487 -21.7928 -21.7873 -19.0202 -19.0198 -8.7286 -8.7209 -8.3064 -8.3042 -8.2247 -8.2112 -2.7326 -2.7290 -2.4757 -2.4755 -2.4648 -2.4605 5.7164 5.7272 6.0569 6.0844 6.1731 6.1738 6.6048 6.6349 6.7252 6.7416 6.7474 6.7717 7.1346 7.1379 7.3665 7.3709 7.5264 7.5624 10.7074 10.8021 10.8503 10.8645 11.0087 11.0712 14.1872 14.1943 k = 0.0000 0.0000 0.1143 ( 2477 PWs) bands (ev): -46.2767 -46.2767 -23.8973 -23.8950 -21.8501 -21.8488 -21.7897 -21.7847 -19.0210 -19.0206 -8.7334 -8.7263 -8.3073 -8.3048 -8.2424 -8.2305 -2.7341 -2.7308 -2.4767 -2.4765 -2.4670 -2.4632 5.7905 5.7988 6.0703 6.0966 6.1802 6.1811 6.6333 6.6603 6.7555 6.7677 6.7723 6.7941 7.1385 7.1416 7.3847 7.3886 7.5349 7.5709 10.6902 10.7583 10.7875 10.8226 10.9950 11.0538 14.1878 14.1942 k = 0.0000 0.0000 0.1016 ( 2477 PWs) bands (ev): -46.2768 -46.2768 -23.8964 -23.8943 -21.8500 -21.8488 -21.7868 -21.7823 -19.0217 -19.0213 -8.7383 -8.7318 -8.3083 -8.3054 -8.2576 -8.2474 -2.7355 -2.7325 -2.4776 -2.4774 -2.4691 -2.4656 5.8541 5.8599 6.0862 6.1110 6.1864 6.1875 6.6570 6.6797 6.7852 6.7974 6.8008 6.8231 7.1416 7.1446 7.4025 7.4054 7.5358 7.5709 10.6711 10.7027 10.7365 10.8021 10.9842 11.0395 14.1884 14.1940 k = 0.0000 0.0000 0.0889 ( 2477 PWs) bands (ev): -46.2768 -46.2768 -23.8955 -23.8937 -21.8499 -21.8489 -21.7841 -21.7802 -19.0223 -19.0220 -8.7431 -8.7374 -8.3094 -8.3059 -8.2702 -8.2621 -2.7367 -2.7340 -2.4784 -2.4782 -2.4709 -2.4678 5.9055 5.9093 6.1053 6.1283 6.1917 6.1931 6.6753 6.6930 6.8134 6.8258 6.8370 6.8597 7.1441 7.1468 7.4193 7.4206 7.5289 7.5623 10.6378 10.6475 10.7108 10.7914 10.9756 11.0274 14.1888 14.1937 k = 0.0000 0.0000 0.0762 ( 2477 PWs) bands (ev): -46.2769 -46.2769 -23.8948 -23.8932 -21.8498 -21.8489 -21.7817 -21.7783 -19.0228 -19.0226 -8.7478 -8.7428 -8.3105 -8.3064 -8.2805 -8.2746 -2.7377 -2.7354 -2.4791 -2.4789 -2.4724 -2.4697 5.9441 5.9466 6.1280 6.1484 6.1963 6.1980 6.6886 6.7020 6.8388 6.8492 6.8826 6.9041 7.1461 7.1485 7.4334 7.4350 7.5152 7.5452 10.5942 10.5969 10.7064 10.7862 10.9687 11.0166 14.1893 14.1934 k = 0.0000 0.0000 0.0635 ( 2477 PWs) bands (ev): -46.2769 -46.2769 -23.8941 -23.8928 -21.8497 -21.8490 -21.7796 -21.7768 -19.0233 -19.0231 -8.7520 -8.7478 -8.3119 -8.3070 -8.2885 -8.2849 -2.7386 -2.7366 -2.4796 -2.4795 -2.4737 -2.4715 5.9711 5.9730 6.1525 6.1698 6.2003 6.2023 6.6983 6.7081 6.8608 6.8695 6.9332 6.9545 7.1477 7.1496 7.4411 7.4491 7.4972 7.5202 10.5523 10.5527 10.7113 10.7843 10.9634 11.0069 14.1897 14.1931 k = 0.0000 0.0000 0.0508 ( 2477 PWs) bands (ev): -46.2770 -46.2770 -23.8935 -23.8924 -21.8497 -21.8491 -21.7778 -21.7755 -19.0236 -19.0235 -8.7556 -8.7522 -8.3133 -8.3078 -8.2943 -8.2930 -2.7392 -2.7376 -2.4801 -2.4800 -2.4747 -2.4729 5.9891 5.9907 6.1758 6.1900 6.2039 6.2063 6.7053 6.7124 6.8793 6.8864 6.9866 7.0085 7.1489 7.1502 7.4357 7.4614 7.4840 7.4882 10.5155 10.5160 10.7210 10.7841 10.9600 10.9979 14.1900 14.1926 k = 0.0000 0.0000 0.0381 ( 2477 PWs) bands (ev): -46.2770 -46.2770 -23.8930 -23.8922 -21.8496 -21.8492 -21.7764 -21.7746 -19.0239 -19.0238 -8.7585 -8.7560 -8.3147 -8.3091 -8.2987 -8.2982 -2.7397 -2.7385 -2.4804 -2.4804 -2.4755 -2.4742 6.0009 6.0022 6.1941 6.2031 6.2109 6.2115 6.7103 6.7153 6.8943 6.8997 7.0408 7.0632 7.1500 7.1506 7.4112 7.4502 7.4719 7.4827 10.4861 10.4868 10.7332 10.7836 10.9586 10.9893 14.1900 14.1915 k = 0.0000 0.0000 0.0254 ( 2481 PWs) bands (ev): -46.2771 -46.2771 -23.8927 -23.8921 -21.8495 -21.8492 -21.7752 -21.7741 -19.0241 -19.0240 -8.7606 -8.7589 -8.3157 -8.3112 -8.3018 -8.3007 -2.7400 -2.7392 -2.4807 -2.4806 -2.4760 -2.4751 6.0083 6.0093 6.2032 6.2061 6.2202 6.2228 6.7139 6.7170 6.9054 6.9091 7.0923 7.1142 7.1509 7.1515 7.3788 7.4095 7.4796 7.4856 10.4648 10.4654 10.7462 10.7815 10.9594 10.9813 14.1749 14.1805 k = 0.0000 0.0000 0.0127 ( 2473 PWs) bands (ev): -46.2770 -46.2770 -23.8924 -23.8921 -21.8495 -21.8493 -21.7744 -21.7738 -19.0242 -19.0242 -8.7617 -8.7608 -8.3160 -8.3136 -8.3028 -8.3021 -2.7401 -2.7397 -2.4808 -2.4808 -2.4762 -2.4757 6.0125 6.0130 6.2063 6.2072 6.2286 6.2304 6.7162 6.7177 6.9125 6.9144 7.1330 7.1456 7.1561 7.1585 7.3513 7.3708 7.4849 7.4876 10.4520 10.4524 10.7585 10.7767 10.9625 10.9739 14.1562 14.1595 k = 0.0000 0.0000 0.0000 ( 2477 PWs) bands (ev): -46.2771 -46.2771 -23.8922 -23.8922 -21.8494 -21.8494 -21.7740 -21.7740 -19.0243 -19.0243 -8.7617 -8.7617 -8.3153 -8.3153 -8.3028 -8.3028 -2.7400 -2.7400 -2.4808 -2.4808 -2.4761 -2.4761 6.0140 6.0140 6.2073 6.2073 6.2323 6.2323 6.7175 6.7175 6.9156 6.9156 7.1460 7.1460 7.1684 7.1684 7.3463 7.3463 7.4875 7.4875 10.4478 10.4478 10.7689 10.7689 10.9675 10.9675 14.1503 14.1503 k = 0.0000 0.0000 0.0000 ( 2477 PWs) bands (ev): -46.2771 -46.2771 -23.8922 -23.8922 -21.8494 -21.8494 -21.7740 -21.7740 -19.0243 -19.0243 -8.7617 -8.7617 -8.3153 -8.3153 -8.3028 -8.3028 -2.7400 -2.7400 -2.4808 -2.4808 -2.4761 -2.4761 6.0140 6.0140 6.2073 6.2073 6.2323 6.2323 6.7175 6.7175 6.9156 6.9156 7.1460 7.1460 7.1684 7.1684 7.3463 7.3463 7.4875 7.4875 10.4478 10.4478 10.7689 10.7689 10.9675 10.9675 14.1503 14.1505 k =-0.0091 0.0090 0.0000 ( 2473 PWs) bands (ev): -46.2770 -46.2770 -23.8922 -23.8922 -21.8495 -21.8495 -21.7740 -21.7740 -19.0242 -19.0242 -8.7613 -8.7613 -8.3149 -8.3149 -8.3024 -8.3024 -2.7398 -2.7398 -2.4807 -2.4807 -2.4761 -2.4761 6.0123 6.0123 6.2050 6.2050 6.2313 6.2313 6.7144 6.7144 6.9137 6.9137 7.1458 7.1458 7.1682 7.1682 7.3452 7.3452 7.4860 7.4860 10.4503 10.4503 10.7706 10.7706 10.9697 10.9697 14.1524 14.1524 k =-0.0182 0.0181 0.0000 ( 2477 PWs) bands (ev): -46.2770 -46.2770 -23.8924 -23.8924 -21.8498 -21.8498 -21.7741 -21.7741 -19.0241 -19.0241 -8.7598 -8.7598 -8.3140 -8.3140 -8.3010 -8.3010 -2.7395 -2.7395 -2.4803 -2.4803 -2.4758 -2.4758 6.0072 6.0072 6.1982 6.1982 6.2281 6.2281 6.7052 6.7052 6.9082 6.9082 7.1452 7.1452 7.1677 7.1677 7.3420 7.3420 7.4816 7.4816 10.4577 10.4577 10.7754 10.7754 10.9764 10.9764 14.1586 14.1586 k =-0.0273 0.0271 0.0000 ( 2473 PWs) bands (ev): -46.2770 -46.2770 -23.8926 -23.8926 -21.8504 -21.8504 -21.7743 -21.7743 -19.0239 -19.0239 -8.7575 -8.7575 -8.3124 -8.3124 -8.2985 -8.2985 -2.7390 -2.7390 -2.4798 -2.4798 -2.4753 -2.4753 5.9984 5.9984 6.1869 6.1869 6.2230 6.2230 6.6902 6.6902 6.8992 6.8992 7.1442 7.1442 7.1667 7.1667 7.3366 7.3367 7.4745 7.4745 10.4699 10.4699 10.7836 10.7836 10.9874 10.9874 14.1689 14.1689 k =-0.0364 0.0362 0.0000 ( 2469 PWs) bands (ev): -46.2769 -46.2769 -23.8930 -23.8930 -21.8511 -21.8511 -21.7745 -21.7745 -19.0236 -19.0236 -8.7542 -8.7542 -8.3103 -8.3103 -8.2950 -8.2950 -2.7383 -2.7383 -2.4791 -2.4791 -2.4746 -2.4746 5.9858 5.9858 6.1712 6.1712 6.2158 6.2158 6.6694 6.6694 6.8866 6.8866 7.1430 7.1430 7.1654 7.1654 7.3290 7.3290 7.4649 7.4649 10.4869 10.4869 10.7950 10.7950 11.0029 11.0029 14.1830 14.1830 k =-0.0455 0.0452 0.0000 ( 2474 PWs) bands (ev): -46.2769 -46.2769 -23.8934 -23.8934 -21.8521 -21.8521 -21.7748 -21.7748 -19.0232 -19.0232 -8.7500 -8.7500 -8.3078 -8.3078 -8.2902 -8.2902 -2.7374 -2.7374 -2.4785 -2.4785 -2.4734 -2.4734 5.9692 5.9692 6.1511 6.1512 6.2067 6.2068 6.6431 6.6431 6.8707 6.8707 7.1414 7.1414 7.1637 7.1637 7.3191 7.3191 7.4534 7.4534 10.5085 10.5085 10.8095 10.8095 11.0228 11.0228 14.2007 14.2007 k =-0.0545 0.0543 0.0000 ( 2474 PWs) bands (ev): -46.2769 -46.2769 -23.8940 -23.8940 -21.8533 -21.8533 -21.7752 -21.7752 -19.0228 -19.0228 -8.7450 -8.7450 -8.3048 -8.3048 -8.2843 -8.2843 -2.7363 -2.7363 -2.4779 -2.4779 -2.4718 -2.4718 5.9482 5.9482 6.1269 6.1269 6.1960 6.1960 6.6118 6.6118 6.8516 6.8516 7.1397 7.1397 7.1617 7.1617 7.3069 7.3069 7.4403 7.4403 10.5345 10.5345 10.8271 10.8271 11.0469 11.0469 14.2218 14.2218 k =-0.0636 0.0633 0.0000 ( 2478 PWs) bands (ev): -46.2769 -46.2769 -23.8946 -23.8946 -21.8547 -21.8547 -21.7757 -21.7757 -19.0223 -19.0223 -8.7392 -8.7392 -8.3014 -8.3014 -8.2772 -8.2772 -2.7351 -2.7351 -2.4774 -2.4774 -2.4698 -2.4698 5.9227 5.9227 6.0985 6.0985 6.1837 6.1837 6.5756 6.5756 6.8295 6.8295 7.1378 7.1378 7.1594 7.1594 7.2924 7.2924 7.4263 7.4263 10.5646 10.5646 10.8477 10.8477 11.0751 11.0751 14.2460 14.2460 k =-0.0727 0.0724 0.0000 ( 2478 PWs) bands (ev): -46.2769 -46.2769 -23.8953 -23.8953 -21.8563 -21.8563 -21.7762 -21.7762 -19.0217 -19.0217 -8.7327 -8.7327 -8.2974 -8.2974 -8.2689 -8.2689 -2.7337 -2.7337 -2.4769 -2.4769 -2.4674 -2.4674 5.8925 5.8925 6.0658 6.0658 6.1700 6.1700 6.5350 6.5350 6.8046 6.8046 7.1358 7.1358 7.1568 7.1568 7.2757 7.2757 7.4120 7.4120 10.5988 10.5988 10.8713 10.8713 11.1075 11.1075 14.2731 14.2731 k =-0.0818 0.0814 0.0000 ( 2476 PWs) bands (ev): -46.2768 -46.2768 -23.8962 -23.8962 -21.8581 -21.8581 -21.7768 -21.7768 -19.0210 -19.0210 -8.7254 -8.7254 -8.2928 -8.2928 -8.2594 -8.2594 -2.7322 -2.7322 -2.4764 -2.4764 -2.4647 -2.4647 5.8575 5.8575 6.0288 6.0288 6.1552 6.1552 6.4902 6.4902 6.7771 6.7771 7.1338 7.1338 7.1539 7.1539 7.2570 7.2570 7.3978 7.3978 10.6367 10.6367 10.8978 10.8978 11.1438 11.1438 14.3026 14.3026 k =-0.0909 0.0905 0.0000 ( 2472 PWs) bands (ev): -46.2767 -46.2767 -23.8971 -23.8971 -21.8601 -21.8601 -21.7774 -21.7774 -19.0203 -19.0203 -8.7176 -8.7176 -8.2876 -8.2876 -8.2489 -8.2489 -2.7306 -2.7306 -2.4759 -2.4759 -2.4617 -2.4617 5.8179 5.8179 5.9873 5.9873 6.1395 6.1395 6.4415 6.4415 6.7473 6.7473 7.1318 7.1318 7.1508 7.1508 7.2365 7.2365 7.3844 7.3844 10.6780 10.6780 10.9271 10.9271 11.1839 11.1839 14.3342 14.3342 k =-0.1000 0.0995 0.0000 ( 2462 PWs) bands (ev): -46.2764 -46.2764 -23.8980 -23.8980 -21.8623 -21.8623 -21.7780 -21.7780 -19.0195 -19.0195 -8.7093 -8.7093 -8.2816 -8.2816 -8.2373 -8.2373 -2.7289 -2.7289 -2.4754 -2.4754 -2.4585 -2.4585 5.7738 5.7738 5.9412 5.9412 6.1230 6.1230 6.3891 6.3891 6.7154 6.7154 7.1297 7.1297 7.1474 7.1474 7.2146 7.2146 7.3724 7.3724 10.7225 10.7225 10.9590 10.9590 11.2277 11.2277 14.3678 14.3678 k =-0.1091 0.1086 0.0000 ( 2462 PWs) bands (ev): -46.2764 -46.2764 -23.8991 -23.8991 -21.8646 -21.8646 -21.7788 -21.7788 -19.0186 -19.0186 -8.7005 -8.7005 -8.2748 -8.2748 -8.2246 -8.2246 -2.7272 -2.7272 -2.4749 -2.4749 -2.4551 -2.4551 5.7256 5.7257 5.8904 5.8905 6.1058 6.1058 6.3334 6.3334 6.6816 6.6816 7.1271 7.1271 7.1439 7.1439 7.1918 7.1918 7.3620 7.3620 10.7700 10.7700 10.9936 10.9936 11.2749 11.2749 14.4029 14.4029 k =-0.1182 0.1176 0.0000 ( 2452 PWs) bands (ev): -46.2762 -46.2762 -23.9002 -23.9002 -21.8671 -21.8671 -21.7795 -21.7795 -19.0178 -19.0178 -8.6914 -8.6914 -8.2671 -8.2671 -8.2110 -8.2110 -2.7254 -2.7254 -2.4743 -2.4743 -2.4516 -2.4516 5.6738 5.6738 5.8351 5.8352 6.0878 6.0878 6.2746 6.2746 6.6462 6.6462 7.1230 7.1231 7.1402 7.1402 7.1694 7.1694 7.3538 7.3538 10.8201 10.8201 11.0307 11.0307 11.3253 11.3253 14.4393 14.4393 k =-0.1273 0.1267 0.0000 ( 2450 PWs) bands (ev): -46.2760 -46.2760 -23.9014 -23.9014 -21.8698 -21.8698 -21.7803 -21.7803 -19.0168 -19.0168 -8.6820 -8.6820 -8.2585 -8.2585 -8.1964 -8.1964 -2.7236 -2.7236 -2.4736 -2.4736 -2.4481 -2.4481 5.6185 5.6185 5.7754 5.7754 6.0690 6.0690 6.2131 6.2131 6.6094 6.6094 7.1146 7.1146 7.1366 7.1366 7.1504 7.1504 7.3481 7.3481 10.8725 10.8725 11.0701 11.0701 11.3788 11.3788 14.4767 14.4767 k =-0.1364 0.1357 0.0000 ( 2450 PWs) bands (ev): -46.2759 -46.2759 -23.9027 -23.9027 -21.8727 -21.8727 -21.7812 -21.7812 -19.0159 -19.0159 -8.6724 -8.6724 -8.2489 -8.2489 -8.1809 -8.1809 -2.7218 -2.7218 -2.4730 -2.4730 -2.4445 -2.4445 5.5603 5.5604 5.7114 5.7114 6.0489 6.0489 6.1494 6.1494 6.5714 6.5714 7.0977 7.0977 7.1333 7.1333 7.1388 7.1388 7.3452 7.3452 10.9270 10.9270 11.1118 11.1118 11.4350 11.4350 14.5148 14.5148 k =-0.1455 0.1448 0.0000 ( 2456 PWs) bands (ev): -46.2759 -46.2759 -23.9041 -23.9041 -21.8756 -21.8756 -21.7821 -21.7821 -19.0149 -19.0149 -8.6628 -8.6628 -8.2382 -8.2382 -8.1645 -8.1645 -2.7200 -2.7200 -2.4723 -2.4723 -2.4409 -2.4409 5.4995 5.4996 5.6435 5.6435 6.0262 6.0262 6.0853 6.0853 6.5324 6.5324 7.0749 7.0749 7.1304 7.1304 7.1323 7.1323 7.3452 7.3452 10.9834 10.9834 11.1557 11.1557 11.4939 11.4939 14.5535 14.5535 k =-0.1545 0.1538 0.0000 ( 2460 PWs) bands (ev): -46.2759 -46.2759 -23.9055 -23.9055 -21.8787 -21.8787 -21.7830 -21.7830 -19.0139 -19.0139 -8.6532 -8.6532 -8.2264 -8.2264 -8.1473 -8.1473 -2.7183 -2.7183 -2.4715 -2.4715 -2.4373 -2.4373 5.4365 5.4365 5.5722 5.5722 5.9910 5.9910 6.0308 6.0308 6.4926 6.4926 7.0499 7.0499 7.1267 7.1267 7.1284 7.1284 7.3484 7.3484 11.0413 11.0413 11.2015 11.2015 11.5551 11.5551 14.5925 14.5925 k =-0.1636 0.1629 0.0000 ( 2460 PWs) bands (ev): -46.2758 -46.2758 -23.9070 -23.9070 -21.8820 -21.8820 -21.7840 -21.7840 -19.0128 -19.0128 -8.6437 -8.6437 -8.2134 -8.2134 -8.1293 -8.1293 -2.7165 -2.7165 -2.4707 -2.4707 -2.4339 -2.4339 5.3715 5.3715 5.4978 5.4978 5.9298 5.9298 5.9996 5.9996 6.4523 6.4523 7.0246 7.0246 7.1224 7.1224 7.1256 7.1256 7.3547 7.3547 11.1006 11.1006 11.2493 11.2493 11.6184 11.6184 14.6317 14.6317 k =-0.1727 0.1719 0.0000 ( 2460 PWs) bands (ev): -46.2757 -46.2757 -23.9085 -23.9085 -21.8853 -21.8853 -21.7849 -21.7849 -19.0118 -19.0118 -8.6343 -8.6343 -8.1993 -8.1993 -8.1105 -8.1105 -2.7149 -2.7149 -2.4698 -2.4698 -2.4306 -2.4306 5.3048 5.3048 5.4209 5.4209 5.8586 5.8586 5.9760 5.9760 6.4115 6.4115 6.9996 6.9996 7.1181 7.1181 7.1227 7.1227 7.3640 7.3640 11.1609 11.1609 11.2989 11.2989 11.6837 11.6837 14.6708 14.6708 k =-0.1818 0.1810 0.0000 ( 2460 PWs) bands (ev): -46.2756 -46.2756 -23.9101 -23.9101 -21.8887 -21.8887 -21.7859 -21.7859 -19.0107 -19.0107 -8.6251 -8.6251 -8.1841 -8.1841 -8.0911 -8.0911 -2.7132 -2.7132 -2.4689 -2.4689 -2.4275 -2.4275 5.2364 5.2365 5.3421 5.3421 5.7841 5.7841 5.9536 5.9536 6.3705 6.3705 6.9754 6.9754 7.1138 7.1138 7.1195 7.1195 7.3763 7.3763 11.2222 11.2222 11.3500 11.3500 11.7507 11.7507 14.7097 14.7097 k =-0.1909 0.1900 0.0000 ( 2462 PWs) bands (ev): -46.2755 -46.2755 -23.9117 -23.9117 -21.8922 -21.8922 -21.7869 -21.7869 -19.0096 -19.0096 -8.6161 -8.6161 -8.1677 -8.1677 -8.0710 -8.0710 -2.7117 -2.7117 -2.4680 -2.4680 -2.4247 -2.4247 5.1666 5.1666 5.2620 5.2620 5.7078 5.7078 5.9313 5.9313 6.3294 6.3294 6.9523 6.9523 7.1094 7.1094 7.1160 7.1160 7.3912 7.3912 11.2840 11.2840 11.4027 11.4027 11.8192 11.8192 14.7483 14.7483 k =-0.2000 0.1991 0.0000 ( 2466 PWs) bands (ev): -46.2754 -46.2754 -23.9133 -23.9133 -21.8958 -21.8958 -21.7879 -21.7879 -19.0086 -19.0086 -8.6075 -8.6075 -8.1502 -8.1502 -8.0503 -8.0503 -2.7102 -2.7102 -2.4670 -2.4670 -2.4221 -2.4221 5.0952 5.0952 5.1813 5.1813 5.6301 5.6301 5.9087 5.9087 6.2883 6.2883 6.9307 6.9307 7.1050 7.1050 7.1124 7.1124 7.4087 7.4087 11.3463 11.3463 11.4567 11.4567 11.8891 11.8891 14.7863 14.7863 k =-0.2091 0.2081 0.0000 ( 2470 PWs) bands (ev): -46.2754 -46.2754 -23.9150 -23.9150 -21.8995 -21.8995 -21.7890 -21.7890 -19.0075 -19.0075 -8.5991 -8.5991 -8.1316 -8.1316 -8.0290 -8.0290 -2.7088 -2.7088 -2.4660 -2.4660 -2.4198 -2.4198 5.0219 5.0219 5.1010 5.1010 5.5514 5.5514 5.8860 5.8860 6.2475 6.2475 6.9105 6.9105 7.1005 7.1005 7.1087 7.1087 7.4283 7.4283 11.4088 11.4088 11.5118 11.5118 11.9600 11.9600 14.8237 14.8237 k =-0.2182 0.2172 0.0000 ( 2466 PWs) bands (ev): -46.2752 -46.2752 -23.9167 -23.9167 -21.9031 -21.9031 -21.7900 -21.7900 -19.0065 -19.0065 -8.5910 -8.5910 -8.1121 -8.1121 -8.0073 -8.0073 -2.7075 -2.7075 -2.4649 -2.4649 -2.4178 -2.4178 4.9465 4.9465 5.0219 5.0219 5.4722 5.4722 5.8630 5.8630 6.2069 6.2069 6.8921 6.8921 7.0960 7.0960 7.1051 7.1051 7.4499 7.4499 11.4714 11.4714 11.5680 11.5680 12.0318 12.0318 14.8604 14.8604 k =-0.2273 0.2262 0.0000 ( 2456 PWs) bands (ev): -46.2750 -46.2750 -23.9184 -23.9184 -21.9068 -21.9068 -21.7910 -21.7910 -19.0054 -19.0054 -8.5832 -8.5832 -8.0916 -8.0916 -7.9851 -7.9851 -2.7063 -2.7063 -2.4639 -2.4639 -2.4160 -2.4160 4.8687 4.8687 4.9448 4.9448 5.3926 5.3926 5.8398 5.8398 6.1667 6.1667 6.8756 6.8756 7.0913 7.0913 7.1016 7.1016 7.4733 7.4733 11.5339 11.5339 11.6250 11.6250 12.1043 12.1043 14.8962 14.8962 k =-0.2364 0.2353 0.0000 ( 2456 PWs) bands (ev): -46.2749 -46.2749 -23.9201 -23.9201 -21.9106 -21.9106 -21.7921 -21.7921 -19.0044 -19.0044 -8.5758 -8.5758 -8.0704 -8.0704 -7.9626 -7.9626 -2.7051 -2.7051 -2.4628 -2.4628 -2.4147 -2.4147 4.7887 4.7887 4.8701 4.8701 5.3130 5.3130 5.8165 5.8165 6.1271 6.1271 6.8610 6.8610 7.0865 7.0865 7.0982 7.0982 7.4982 7.4982 11.5961 11.5961 11.6826 11.6826 12.1774 12.1774 14.9311 14.9311 k =-0.2455 0.2443 0.0000 ( 2456 PWs) bands (ev): -46.2747 -46.2747 -23.9218 -23.9218 -21.9143 -21.9143 -21.7931 -21.7931 -19.0034 -19.0034 -8.5685 -8.5685 -8.0484 -8.0484 -7.9397 -7.9397 -2.7041 -2.7041 -2.4617 -2.4617 -2.4137 -2.4137 4.7071 4.7071 4.7977 4.7977 5.2336 5.2336 5.7931 5.7931 6.0881 6.0881 6.8483 6.8483 7.0818 7.0818 7.0949 7.0949 7.5243 7.5243 11.6579 11.6579 11.7407 11.7407 12.2507 12.2507 14.9648 14.9648 k =-0.2545 0.2534 0.0000 ( 2462 PWs) bands (ev): -46.2747 -46.2747 -23.9236 -23.9236 -21.9181 -21.9181 -21.7942 -21.7942 -19.0024 -19.0024 -8.5616 -8.5616 -8.0259 -8.0259 -7.9166 -7.9166 -2.7032 -2.7032 -2.4607 -2.4607 -2.4131 -2.4131 4.6245 4.6245 4.7273 4.7273 5.1548 5.1548 5.7697 5.7697 6.0499 6.0499 6.8377 6.8377 7.0770 7.0770 7.0918 7.0918 7.5516 7.5516 11.7190 11.7190 11.7989 11.7989 12.3242 12.3242 14.9975 14.9975 k =-0.2636 0.2624 0.0000 ( 2456 PWs) bands (ev): -46.2745 -46.2745 -23.9253 -23.9253 -21.9218 -21.9218 -21.7952 -21.7952 -19.0015 -19.0015 -8.5549 -8.5549 -8.0029 -8.0029 -7.8934 -7.8934 -2.7024 -2.7024 -2.4597 -2.4597 -2.4127 -2.4127 4.5418 4.5418 4.6587 4.6587 5.0768 5.0768 5.7463 5.7463 6.0124 6.0124 6.8291 6.8291 7.0723 7.0723 7.0889 7.0889 7.5798 7.5798 11.7796 11.7796 11.8572 11.8572 12.3976 12.3976 15.0289 15.0289 k =-0.2727 0.2715 0.0000 ( 2454 PWs) bands (ev): -46.2744 -46.2744 -23.9270 -23.9270 -21.9255 -21.9255 -21.7962 -21.7962 -19.0006 -19.0006 -8.5484 -8.5484 -7.9795 -7.9795 -7.8700 -7.8700 -2.7017 -2.7017 -2.4587 -2.4587 -2.4126 -2.4126 4.4594 4.4594 4.5916 4.5916 5.0000 5.0000 5.7230 5.7230 5.9758 5.9758 6.8225 6.8225 7.0676 7.0676 7.0861 7.0861 7.6087 7.6087 11.8393 11.8393 11.9153 11.9153 12.4709 12.4709 15.0591 15.0591 k =-0.2818 0.2805 0.0000 ( 2454 PWs) bands (ev): -46.2742 -46.2742 -23.9287 -23.9287 -21.9292 -21.9292 -21.7972 -21.7972 -18.9997 -18.9997 -8.5421 -8.5421 -7.9559 -7.9559 -7.8465 -7.8465 -2.7011 -2.7011 -2.4579 -2.4579 -2.4128 -2.4128 4.3779 4.3779 4.5260 4.5260 4.9245 4.9245 5.6999 5.6999 5.9402 5.9402 6.8178 6.8178 7.0631 7.0631 7.0835 7.0835 7.6381 7.6381 11.8981 11.8981 11.9730 11.9730 12.5436 12.5436 15.0879 15.0879 k =-0.2909 0.2896 0.0000 ( 2458 PWs) bands (ev): -46.2742 -46.2742 -23.9304 -23.9304 -21.9328 -21.9328 -21.7981 -21.7981 -18.9989 -18.9989 -8.5360 -8.5360 -7.9322 -7.9322 -7.8232 -7.8232 -2.7006 -2.7006 -2.4571 -2.4571 -2.4132 -2.4132 4.2976 4.2976 4.4618 4.4618 4.8506 4.8506 5.6771 5.6771 5.9056 5.9056 6.8150 6.8150 7.0587 7.0587 7.0810 7.0810 7.6679 7.6679 11.9558 11.9558 12.0300 12.0300 12.6156 12.6156 15.1152 15.1152 k =-0.3000 0.2986 0.0000 ( 2458 PWs) bands (ev): -46.2741 -46.2741 -23.9321 -23.9321 -21.9363 -21.9363 -21.7991 -21.7991 -18.9981 -18.9981 -8.5301 -8.5301 -7.9086 -7.9086 -7.7999 -7.7999 -2.7002 -2.7002 -2.4565 -2.4565 -2.4137 -2.4137 4.2188 4.2188 4.3990 4.3990 4.7787 4.7787 5.6546 5.6546 5.8721 5.8721 6.8140 6.8140 7.0545 7.0545 7.0786 7.0786 7.6979 7.6979 12.0124 12.0124 12.0862 12.0862 12.6869 12.6869 15.1412 15.1412 k =-0.3091 0.3077 0.0000 ( 2462 PWs) bands (ev): -46.2740 -46.2740 -23.9337 -23.9337 -21.9398 -21.9398 -21.8000 -21.8000 -18.9973 -18.9973 -8.5244 -8.5244 -7.8851 -7.8851 -7.7767 -7.7767 -2.7000 -2.7000 -2.4562 -2.4562 -2.4143 -2.4143 4.1419 4.1419 4.3378 4.3378 4.7089 4.7089 5.6325 5.6325 5.8398 5.8398 6.8148 6.8148 7.0504 7.0504 7.0764 7.0764 7.7280 7.7280 12.0676 12.0676 12.1414 12.1414 12.7570 12.7570 15.1657 15.1657 k =-0.3182 0.3167 0.0000 ( 2460 PWs) bands (ev): -46.2739 -46.2739 -23.9353 -23.9353 -21.9432 -21.9432 -21.8009 -21.8009 -18.9966 -18.9966 -8.5188 -8.5188 -7.8618 -7.8618 -7.7539 -7.7539 -2.6999 -2.6999 -2.4560 -2.4560 -2.4149 -2.4149 4.0670 4.0670 4.2780 4.2780 4.6414 4.6414 5.6109 5.6109 5.8086 5.8086 6.8170 6.8170 7.0465 7.0465 7.0744 7.0744 7.7579 7.7579 12.1213 12.1213 12.1955 12.1955 12.8260 12.8260 15.1888 15.1888 k =-0.3273 0.3258 0.0000 ( 2456 PWs) bands (ev): -46.2737 -46.2737 -23.9368 -23.9368 -21.9465 -21.9465 -21.8018 -21.8018 -18.9959 -18.9959 -8.5134 -8.5134 -7.8390 -7.8390 -7.7313 -7.7313 -2.6999 -2.6999 -2.4561 -2.4561 -2.4154 -2.4154 3.9945 3.9945 4.2199 4.2199 4.5765 4.5765 5.5898 5.5898 5.7787 5.7787 6.8208 6.8208 7.0429 7.0429 7.0724 7.0724 7.7876 7.7876 12.1735 12.1735 12.2481 12.2481 12.8934 12.8934 15.2104 15.2104 k =-0.3364 0.3348 0.0000 ( 2456 PWs) bands (ev): -46.2736 -46.2736 -23.9383 -23.9383 -21.9496 -21.9496 -21.8026 -21.8026 -18.9952 -18.9952 -8.5082 -8.5082 -7.8166 -7.8166 -7.7092 -7.7092 -2.7000 -2.7000 -2.4565 -2.4565 -2.4159 -2.4159 3.9245 3.9245 4.1635 4.1635 4.5144 4.5144 5.5693 5.5693 5.7501 5.7501 6.8258 6.8258 7.0393 7.0393 7.0706 7.0706 7.8168 7.8168 12.2239 12.2239 12.2993 12.2993 12.9592 12.9592 15.2304 15.2304 k =-0.3455 0.3439 0.0000 ( 2452 PWs) bands (ev): -46.2734 -46.2734 -23.9398 -23.9398 -21.9527 -21.9527 -21.8034 -21.8034 -18.9946 -18.9946 -8.5032 -8.5032 -7.7949 -7.7949 -7.6876 -7.6876 -2.7002 -2.7002 -2.4572 -2.4572 -2.4161 -2.4161 3.8571 3.8571 4.1088 4.1088 4.4553 4.4553 5.5495 5.5495 5.7228 5.7228 6.8319 6.8319 7.0360 7.0361 7.0689 7.0689 7.8455 7.8455 12.2725 12.2725 12.3487 12.3487 13.0230 13.0230 15.2490 15.2490 k =-0.3545 0.3529 0.0000 ( 2452 PWs) bands (ev): -46.2733 -46.2733 -23.9412 -23.9412 -21.9556 -21.9556 -21.8042 -21.8042 -18.9941 -18.9941 -8.4983 -8.4983 -7.7738 -7.7738 -7.6666 -7.6666 -2.7006 -2.7006 -2.4582 -2.4582 -2.4162 -2.4162 3.7927 3.7927 4.0562 4.0562 4.3992 4.3992 5.5304 5.5304 5.6969 5.6969 6.8390 6.8390 7.0330 7.0330 7.0674 7.0674 7.8735 7.8735 12.3190 12.3190 12.3963 12.3963 13.0847 13.0847 15.2661 15.2661 k =-0.3636 0.3620 0.0000 ( 2456 PWs) bands (ev): -46.2733 -46.2733 -23.9425 -23.9425 -21.9584 -21.9584 -21.8049 -21.8049 -18.9935 -18.9935 -8.4936 -8.4936 -7.7536 -7.7536 -7.6463 -7.6463 -2.7010 -2.7010 -2.4595 -2.4595 -2.4162 -2.4162 3.7313 3.7313 4.0055 4.0055 4.3462 4.3462 5.5122 5.5122 5.6724 5.6724 6.8469 6.8469 7.0301 7.0301 7.0659 7.0659 7.9006 7.9006 12.3633 12.3633 12.4419 12.4419 13.1441 13.1441 15.2817 15.2817 k =-0.3727 0.3710 0.0000 ( 2456 PWs) bands (ev): -46.2732 -46.2732 -23.9438 -23.9438 -21.9611 -21.9611 -21.8056 -21.8056 -18.9930 -18.9930 -8.4892 -8.4892 -7.7343 -7.7343 -7.6267 -7.6267 -2.7016 -2.7016 -2.4610 -2.4610 -2.4159 -2.4159 3.6730 3.6730 3.9571 3.9571 4.2966 4.2966 5.4948 5.4948 5.6494 5.6494 6.8554 6.8554 7.0274 7.0274 7.0646 7.0646 7.9267 7.9267 12.4054 12.4054 12.4854 12.4854 13.2009 13.2009 15.2960 15.2960 k =-0.3818 0.3801 0.0000 ( 2460 PWs) bands (ev): -46.2732 -46.2732 -23.9450 -23.9450 -21.9636 -21.9636 -21.8062 -21.8062 -18.9926 -18.9926 -8.4849 -8.4849 -7.7159 -7.7159 -7.6080 -7.6080 -2.7022 -2.7022 -2.4626 -2.4626 -2.4155 -2.4155 3.6182 3.6182 3.9111 3.9111 4.2503 4.2503 5.4783 5.4783 5.6278 5.6278 6.8644 6.8644 7.0249 7.0249 7.0634 7.0634 7.9516 7.9516 12.4451 12.4451 12.5267 12.5267 13.2549 13.2549 15.3089 15.3089 k =-0.3909 0.3891 0.0000 ( 2460 PWs) bands (ev): -46.2731 -46.2731 -23.9461 -23.9461 -21.9660 -21.9660 -21.8068 -21.8068 -18.9922 -18.9922 -8.4809 -8.4809 -7.6986 -7.6986 -7.5903 -7.5903 -2.7029 -2.7029 -2.4643 -2.4643 -2.4150 -2.4150 3.5668 3.5668 3.8676 3.8676 4.2074 4.2074 5.4628 5.4628 5.6077 5.6077 6.8735 6.8735 7.0227 7.0227 7.0622 7.0622 7.9753 7.9753 12.4822 12.4822 12.5655 12.5655 13.3059 13.3059 15.3205 15.3205 k =-0.4000 0.3982 0.0000 ( 2456 PWs) bands (ev): -46.2730 -46.2730 -23.9471 -23.9471 -21.9682 -21.9682 -21.8074 -21.8074 -18.9918 -18.9918 -8.4771 -8.4771 -7.6824 -7.6824 -7.5736 -7.5736 -2.7036 -2.7036 -2.4661 -2.4661 -2.4144 -2.4144 3.5191 3.5191 3.8268 3.8268 4.1680 4.1680 5.4484 5.4484 5.5891 5.5891 6.8828 6.8828 7.0206 7.0206 7.0612 7.0612 7.9976 7.9976 12.5168 12.5168 12.6017 12.6017 13.3537 13.3537 15.3308 15.3308 k =-0.4091 0.4072 0.0000 ( 2454 PWs) bands (ev): -46.2729 -46.2729 -23.9481 -23.9481 -21.9702 -21.9702 -21.8079 -21.8079 -18.9915 -18.9915 -8.4736 -8.4736 -7.6674 -7.6674 -7.5580 -7.5580 -2.7043 -2.7043 -2.4679 -2.4679 -2.4138 -2.4138 3.4751 3.4751 3.7889 3.7889 4.1320 4.1320 5.4351 5.4351 5.5721 5.5721 6.8918 6.8918 7.0188 7.0188 7.0603 7.0603 8.0184 8.0184 12.5486 12.5486 12.6353 12.6353 13.3981 13.3981 15.3400 15.3400 k =-0.4182 0.4163 0.0000 ( 2458 PWs) bands (ev): -46.2729 -46.2729 -23.9490 -23.9490 -21.9721 -21.9721 -21.8084 -21.8084 -18.9912 -18.9912 -8.4703 -8.4703 -7.6537 -7.6537 -7.5436 -7.5436 -2.7051 -2.7051 -2.4696 -2.4696 -2.4132 -2.4132 3.4349 3.4349 3.7540 3.7540 4.0994 4.0994 5.4228 5.4228 5.5567 5.5567 6.9006 6.9006 7.0172 7.0172 7.0595 7.0595 8.0376 8.0376 12.5777 12.5777 12.6661 12.6661 13.4389 13.4389 15.3480 15.3480 k =-0.4273 0.4253 0.0000 ( 2454 PWs) bands (ev): -46.2728 -46.2728 -23.9498 -23.9498 -21.9737 -21.9737 -21.8088 -21.8088 -18.9909 -18.9909 -8.4674 -8.4674 -7.6413 -7.6413 -7.5305 -7.5305 -2.7058 -2.7058 -2.4712 -2.4712 -2.4125 -2.4125 3.3987 3.3987 3.7223 3.7223 4.0703 4.0703 5.4118 5.4118 5.5428 5.5428 6.9090 6.9090 7.0158 7.0158 7.0588 7.0588 8.0550 8.0550 12.6039 12.6039 12.6939 12.6939 13.4760 13.4760 15.3550 15.3550 k =-0.4364 0.4344 0.0000 ( 2458 PWs) bands (ev): -46.2728 -46.2728 -23.9505 -23.9505 -21.9752 -21.9752 -21.8092 -21.8092 -18.9907 -18.9907 -8.4647 -8.4647 -7.6302 -7.6302 -7.5188 -7.5188 -2.7066 -2.7066 -2.4728 -2.4728 -2.4119 -2.4119 3.3666 3.3666 3.6940 3.6940 4.0447 4.0447 5.4019 5.4019 5.5305 5.5305 6.9167 6.9167 7.0146 7.0146 7.0582 7.0582 8.0707 8.0707 12.6272 12.6272 12.7188 12.7188 13.5090 13.5090 15.3609 15.3609 k =-0.4455 0.4434 0.0000 ( 2458 PWs) bands (ev): -46.2727 -46.2727 -23.9511 -23.9511 -21.9765 -21.9765 -21.8095 -21.8095 -18.9905 -18.9905 -8.4624 -8.4624 -7.6205 -7.6205 -7.5085 -7.5085 -2.7073 -2.7073 -2.4741 -2.4741 -2.4113 -2.4113 3.3385 3.3385 3.6692 3.6692 4.0225 4.0225 5.3933 5.3933 5.5198 5.5198 6.9236 6.9236 7.0136 7.0136 7.0576 7.0576 8.0844 8.0844 12.6475 12.6475 12.7405 12.7405 13.5380 13.5380 15.3660 15.3660 k =-0.4545 0.4525 0.0000 ( 2458 PWs) bands (ev): -46.2727 -46.2727 -23.9516 -23.9516 -21.9776 -21.9776 -21.8098 -21.8098 -18.9904 -18.9904 -8.4604 -8.4604 -7.6122 -7.6122 -7.4997 -7.4997 -2.7079 -2.7079 -2.4753 -2.4753 -2.4108 -2.4108 3.3147 3.3147 3.6479 3.6479 4.0037 4.0037 5.3860 5.3860 5.5108 5.5108 6.9297 6.9297 7.0128 7.0128 7.0572 7.0572 8.0961 8.0961 12.6647 12.6647 12.7590 12.7590 13.5627 13.5627 15.3701 15.3701 k =-0.4636 0.4615 0.0000 ( 2456 PWs) bands (ev): -46.2726 -46.2726 -23.9521 -23.9521 -21.9785 -21.9785 -21.8100 -21.8100 -18.9902 -18.9902 -8.4588 -8.4588 -7.6054 -7.6054 -7.4924 -7.4924 -2.7084 -2.7084 -2.4763 -2.4763 -2.4103 -2.4103 3.2951 3.2951 3.6304 3.6304 3.9884 3.9884 5.3799 5.3799 5.5034 5.5034 6.9348 6.9348 7.0121 7.0121 7.0568 7.0568 8.1058 8.1058 12.6789 12.6789 12.7743 12.7743 13.5831 13.5831 15.3734 15.3734 k =-0.4727 0.4706 0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9524 -23.9524 -21.9792 -21.9792 -21.8102 -21.8102 -18.9901 -18.9901 -8.4575 -8.4575 -7.6001 -7.6001 -7.4867 -7.4867 -2.7088 -2.7088 -2.4770 -2.4770 -2.4100 -2.4100 3.2798 3.2798 3.6167 3.6167 3.9765 3.9765 5.3752 5.3752 5.4976 5.4976 6.9388 6.9388 7.0117 7.0117 7.0566 7.0566 8.1135 8.1135 12.6900 12.6900 12.7863 12.7863 13.5991 13.5991 15.3760 15.3760 k =-0.4818 0.4796 0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9526 -23.9526 -21.9797 -21.9797 -21.8103 -21.8103 -18.9900 -18.9900 -8.4566 -8.4566 -7.5963 -7.5963 -7.4826 -7.4826 -2.7091 -2.7091 -2.4776 -2.4776 -2.4097 -2.4097 3.2688 3.2688 3.6069 3.6069 3.9680 3.9680 5.3719 5.3719 5.4935 5.4935 6.9417 6.9417 7.0114 7.0114 7.0564 7.0564 8.1189 8.1189 12.6979 12.6979 12.7948 12.7948 13.6105 13.6105 15.3778 15.3778 k =-0.4909 0.4887 0.0000 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9528 -23.9528 -21.9801 -21.9801 -21.8104 -21.8104 -18.9900 -18.9900 -8.4560 -8.4560 -7.5940 -7.5940 -7.4801 -7.4801 -2.7093 -2.7093 -2.4779 -2.4779 -2.4096 -2.4096 3.2623 3.2623 3.6009 3.6009 3.9629 3.9629 5.3698 5.3698 5.4910 5.4910 6.9435 6.9435 7.0112 7.0112 7.0563 7.0563 8.1222 8.1222 12.7027 12.7027 12.8000 12.8000 13.6174 13.6174 15.3788 15.3788 k =-0.5000 0.4977 0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9528 -23.9528 -21.9802 -21.9802 -21.8104 -21.8104 -18.9900 -18.9900 -8.4558 -8.4558 -7.5933 -7.5933 -7.4793 -7.4793 -2.7094 -2.7094 -2.4780 -2.4780 -2.4095 -2.4095 3.2601 3.2601 3.5990 3.5990 3.9612 3.9612 5.3692 5.3692 5.4902 5.4902 6.9441 6.9441 7.0111 7.0111 7.0562 7.0562 8.1233 8.1233 12.7043 12.7043 12.8017 12.8017 13.6198 13.6198 15.3792 15.3792 k =-0.5000 0.4977 0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9528 -23.9528 -21.9802 -21.9802 -21.8104 -21.8104 -18.9900 -18.9900 -8.4558 -8.4558 -7.5933 -7.5933 -7.4793 -7.4793 -2.7094 -2.7094 -2.4780 -2.4780 -2.4095 -2.4095 3.2601 3.2601 3.5990 3.5990 3.9612 3.9612 5.3692 5.3692 5.4902 5.4902 6.9441 6.9441 7.0111 7.0111 7.0562 7.0562 8.1233 8.1233 12.7043 12.7043 12.8017 12.8017 13.6198 13.6198 15.3792 15.3792 k =-0.4977 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9528 -21.9802 -21.9801 -21.8104 -21.8104 -18.9900 -18.9900 -8.4559 -8.4558 -7.5935 -7.5931 -7.4795 -7.4792 -2.7094 -2.7093 -2.4781 -2.4780 -2.4095 -2.4095 3.2600 3.2602 3.5991 3.5991 3.9612 3.9616 5.3689 5.3694 5.4900 5.4905 6.9439 6.9443 7.0109 7.0113 7.0562 7.0562 8.1232 8.1232 12.7037 12.7046 12.8012 12.8020 13.6193 13.6199 15.3791 15.3792 k =-0.4977 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9529 -23.9528 -21.9802 -21.9801 -21.8104 -21.8104 -18.9900 -18.9900 -8.4559 -8.4558 -7.5935 -7.5931 -7.4795 -7.4792 -2.7094 -2.7093 -2.4781 -2.4780 -2.4095 -2.4095 3.2600 3.2602 3.5991 3.5991 3.9612 3.9616 5.3689 5.3694 5.4900 5.4905 6.9439 6.9443 7.0109 7.0113 7.0562 7.0562 8.1232 8.1232 12.7037 12.7046 12.8012 12.8020 13.6193 13.6199 15.3791 15.3792 k =-0.4977 0.5000 0.0127 ( 2451 PWs) bands (ev): -46.2725 -46.2725 -23.9530 -23.9527 -21.9802 -21.9801 -21.8109 -21.8103 -18.9900 -18.9899 -8.4550 -8.4537 -7.5936 -7.5927 -7.4794 -7.4790 -2.7107 -2.7088 -2.4785 -2.4783 -2.4110 -2.4091 3.2601 3.2603 3.5990 3.5992 3.9620 3.9624 5.3651 5.3664 5.4869 5.4874 6.9473 6.9483 7.0140 7.0144 7.0505 7.0516 8.1233 8.1233 12.7037 12.7065 12.7995 12.8032 13.6192 13.6203 15.3847 15.3893 k =-0.4977 0.5000 0.0254 ( 2456 PWs) bands (ev): -46.2725 -46.2725 -23.9533 -23.9527 -21.9802 -21.9800 -21.8117 -21.8106 -18.9899 -18.9899 -8.4512 -8.4485 -7.5936 -7.5920 -7.4790 -7.4787 -2.7129 -2.7090 -2.4796 -2.4794 -2.4135 -2.4096 3.2602 3.2604 3.5990 3.5994 3.9647 3.9651 5.3543 5.3568 5.4776 5.4781 6.9575 6.9597 7.0194 7.0201 7.0388 7.0399 8.1234 8.1235 12.7051 12.7108 12.7973 12.8042 13.6193 13.6213 15.4058 15.4148 k =-0.4977 0.5000 0.0381 ( 2454 PWs) bands (ev): -46.2725 -46.2725 -23.9537 -23.9528 -21.9802 -21.9799 -21.8129 -21.8112 -18.9898 -18.9898 -8.4444 -8.4403 -7.5934 -7.5910 -7.4785 -7.4781 -2.7157 -2.7100 -2.4815 -2.4812 -2.4169 -2.4112 3.2603 3.2606 3.5991 3.5997 3.9691 3.9695 5.3372 5.3408 5.4625 5.4630 6.9707 6.9761 7.0038 7.0043 7.0474 7.0478 8.1237 8.1237 12.7080 12.7171 12.7956 12.8048 13.6198 13.6226 15.4421 15.4551 k =-0.4977 0.5000 0.0508 ( 2454 PWs) bands (ev): -46.2725 -46.2725 -23.9541 -23.9530 -21.9802 -21.9798 -21.8144 -21.8121 -18.9896 -18.9896 -8.4346 -8.4292 -7.5929 -7.5897 -7.4777 -7.4773 -2.7193 -2.7117 -2.4841 -2.4837 -2.4213 -2.4138 3.2605 3.2608 3.5992 3.6000 3.9752 3.9756 5.3142 5.3189 5.4421 5.4426 6.9519 6.9602 7.0077 7.0082 7.0701 7.0707 8.1241 8.1241 12.7119 12.7254 12.7953 12.8056 13.6207 13.6243 15.4927 15.5093 k =-0.4977 0.5000 0.0635 ( 2452 PWs) bands (ev): -46.2724 -46.2724 -23.9547 -23.9532 -21.9801 -21.9797 -21.8162 -21.8134 -18.9894 -18.9894 -8.4220 -8.4152 -7.5923 -7.5882 -7.4767 -7.4762 -2.7236 -2.7141 -2.4874 -2.4870 -2.4267 -2.4174 3.2608 3.2611 3.5994 3.6003 3.9829 3.9835 5.2860 5.2916 5.4170 5.4174 6.9033 6.9119 7.0369 7.0380 7.0995 7.1002 8.1245 8.1246 12.7164 12.7355 12.7974 12.8070 13.6218 13.6263 15.5565 15.5762 k =-0.4977 0.5000 0.0762 ( 2452 PWs) bands (ev): -46.2724 -46.2724 -23.9553 -23.9536 -21.9801 -21.9796 -21.8183 -21.8150 -18.9891 -18.9891 -8.4065 -8.3984 -7.5913 -7.5864 -7.4754 -7.4750 -2.7286 -2.7173 -2.4914 -2.4909 -2.4329 -2.4219 3.2612 3.2615 3.5995 3.6007 3.9924 3.9929 5.2533 5.2598 5.3877 5.3882 6.8428 6.8525 7.0727 7.0744 7.1341 7.1349 8.1251 8.1252 12.7211 12.7469 12.8029 12.8100 13.6234 13.6286 15.6323 15.6545 k =-0.4977 0.5000 0.0889 ( 2444 PWs) bands (ev): -46.2722 -46.2722 -23.9559 -23.9540 -21.9800 -21.9794 -21.8207 -21.8169 -18.9888 -18.9888 -8.3883 -8.3788 -7.5902 -7.5844 -7.4740 -7.4735 -2.7342 -2.7212 -2.4961 -2.4954 -2.4400 -2.4273 3.2616 3.2620 3.5996 3.6009 4.0034 4.0040 5.2167 5.2240 5.3551 5.3555 6.7727 6.7837 7.1134 7.1154 7.1731 7.1740 8.1258 8.1259 12.7258 12.7591 12.8122 12.8159 13.6253 13.6313 15.7185 15.7426 k =-0.4977 0.5000 0.1016 ( 2440 PWs) bands (ev): -46.2721 -46.2721 -23.9567 -23.9545 -21.9799 -21.9793 -21.8235 -21.8192 -18.9885 -18.9885 -8.3674 -8.3565 -7.5889 -7.5821 -7.4723 -7.4718 -2.7405 -2.7258 -2.5014 -2.5006 -2.4478 -2.4336 3.2621 3.2625 3.5996 3.6012 4.0159 4.0165 5.1769 5.1849 5.3196 5.3201 6.6940 6.7063 7.1580 7.1602 7.2157 7.2167 8.1265 8.1267 12.7309 12.7712 12.8247 12.8266 13.6274 13.6342 15.8137 15.8391 k =-0.4977 0.5000 0.1143 ( 2441 PWs) bands (ev): -46.2720 -46.2720 -23.9575 -23.9550 -21.9798 -21.9791 -21.8264 -21.8217 -18.9881 -18.9881 -8.3439 -8.3316 -7.5873 -7.5796 -7.4705 -7.4700 -2.7474 -2.7310 -2.5074 -2.5063 -2.4564 -2.4407 3.2627 3.2631 3.5996 3.6012 4.0299 4.0306 5.1346 5.1432 5.2820 5.2824 6.6078 6.6213 7.2057 7.2080 7.2613 7.2624 8.1274 8.1276 12.7370 12.7829 12.8396 12.8435 13.6299 13.6374 15.9162 15.9422 k =-0.4977 0.5000 0.1270 ( 2436 PWs) bands (ev): -46.2719 -46.2719 -23.9584 -23.9557 -21.9797 -21.9789 -21.8296 -21.8245 -18.9877 -18.9877 -8.3179 -8.3043 -7.5856 -7.5769 -7.4685 -7.4679 -2.7548 -2.7369 -2.5139 -2.5127 -2.4656 -2.4485 3.2633 3.2637 3.5993 3.6012 4.0452 4.0459 5.0901 5.0993 5.2428 5.2432 6.5150 6.5298 7.2558 7.2581 7.3093 7.3104 8.1283 8.1286 12.7447 12.7945 12.8589 12.8642 13.6327 13.6408 16.0244 16.0504 k =-0.4977 0.5000 0.1397 ( 2432 PWs) bands (ev): -46.2718 -46.2718 -23.9593 -23.9564 -21.9796 -21.9787 -21.8331 -21.8275 -18.9872 -18.9872 -8.2897 -8.2746 -7.5837 -7.5739 -7.4663 -7.4657 -2.7627 -2.7434 -2.5210 -2.5195 -2.4754 -2.4571 3.2639 3.2644 3.5989 3.6009 4.0617 4.0625 5.0440 5.0537 5.2023 5.2028 6.4165 6.4326 7.3078 7.3100 7.3590 7.3602 8.1293 8.1296 12.7545 12.8069 12.8821 12.8882 13.6356 13.6445 16.1364 16.1618 k =-0.4977 0.5000 0.1524 ( 2434 PWs) bands (ev): -46.2717 -46.2717 -23.9603 -23.9572 -21.9794 -21.9785 -21.8367 -21.8308 -18.9867 -18.9867 -8.2593 -8.2428 -7.5816 -7.5707 -7.4640 -7.4633 -2.7710 -2.7504 -2.5286 -2.5268 -2.4857 -2.4663 3.2646 3.2651 3.5982 3.6004 4.0794 4.0802 4.9967 5.0069 5.1612 5.1616 6.3135 6.3307 7.3610 7.3631 7.4099 7.4112 8.1304 8.1307 12.7669 12.8210 12.9088 12.9150 13.6388 13.6484 16.2505 16.2747 k =-0.4977 0.5000 0.1651 ( 2438 PWs) bands (ev): -46.2717 -46.2717 -23.9613 -23.9581 -21.9793 -21.9783 -21.8406 -21.8343 -18.9862 -18.9862 -8.2269 -8.2089 -7.5793 -7.5673 -7.4615 -7.4607 -2.7798 -2.7579 -2.5367 -2.5346 -2.4964 -2.4762 3.2654 3.2659 3.5971 3.5995 4.0981 4.0989 4.9485 4.9590 5.1197 5.1201 6.2069 6.2252 7.4150 7.4169 7.4617 7.4630 8.1315 8.1319 12.7820 12.8372 12.9383 12.9444 13.6422 13.6525 16.3647 16.3871 k =-0.4977 0.5000 0.1778 ( 2442 PWs) bands (ev): -46.2716 -46.2716 -23.9624 -23.9591 -21.9791 -21.9781 -21.8446 -21.8379 -18.9857 -18.9857 -8.1926 -8.1731 -7.5770 -7.5636 -7.4589 -7.4580 -2.7889 -2.7659 -2.5452 -2.5427 -2.5075 -2.4865 3.2661 3.2667 3.5957 3.5982 4.1176 4.1185 4.8995 4.9104 5.0781 5.0786 6.0977 6.1170 7.4693 7.4710 7.5138 7.5152 8.1328 8.1332 12.8000 12.8559 12.9704 12.9763 13.6458 13.6567 16.4771 16.4969 k =-0.4977 0.5000 0.1905 ( 2442 PWs) bands (ev): -46.2715 -46.2715 -23.9635 -23.9600 -21.9790 -21.9779 -21.8486 -21.8418 -18.9851 -18.9851 -8.1567 -8.1357 -7.5744 -7.5597 -7.4562 -7.4552 -2.7982 -2.7743 -2.5541 -2.5512 -2.5188 -2.4972 3.2670 3.2676 3.5938 3.5964 4.1379 4.1388 4.8501 4.8612 5.0368 5.0373 5.9870 6.0072 7.5235 7.5251 7.5660 7.5674 8.1340 8.1346 12.8209 12.8772 13.0049 13.0105 13.6495 13.6612 16.5854 16.6021 k =-0.4977 0.5000 0.2032 ( 2442 PWs) bands (ev): -46.2714 -46.2714 -23.9647 -23.9611 -21.9788 -21.9777 -21.8528 -21.8457 -18.9845 -18.9845 -8.1194 -8.0967 -7.5718 -7.5556 -7.4534 -7.4523 -2.8078 -2.7831 -2.5633 -2.5599 -2.5303 -2.5084 3.2678 3.2685 3.5913 3.5941 4.1587 4.1596 4.8004 4.8117 4.9960 4.9965 5.8757 5.8967 7.5774 7.5787 7.6178 7.6193 8.1353 8.1359 12.8448 12.9012 13.0415 13.0468 13.6534 13.6658 16.6873 16.7003 k =-0.4977 0.5000 0.2159 ( 2446 PWs) bands (ev): -46.2714 -46.2714 -23.9658 -23.9622 -21.9787 -21.9774 -21.8571 -21.8498 -18.9840 -18.9839 -8.0810 -8.0565 -7.5690 -7.5512 -7.4506 -7.4493 -2.8176 -2.7922 -2.5728 -2.5689 -2.5418 -2.5198 3.2687 3.2694 3.5881 3.5911 4.1799 4.1808 4.7505 4.7619 4.9559 4.9564 5.7650 5.7867 7.6306 7.6316 7.6690 7.6706 8.1367 8.1374 12.8714 12.9278 13.0800 13.0851 13.6573 13.6705 16.7806 16.7892 k =-0.4977 0.5000 0.2286 ( 2444 PWs) bands (ev): -46.2712 -46.2712 -23.9670 -23.9633 -21.9785 -21.9772 -21.8614 -21.8539 -18.9833 -18.9833 -8.0415 -8.0152 -7.5661 -7.5465 -7.4476 -7.4462 -2.8275 -2.8015 -2.5825 -2.5781 -2.5534 -2.5314 3.2697 3.2704 3.5841 3.5873 4.2012 4.2020 4.7006 4.7120 4.9166 4.9172 5.6558 5.6779 7.6828 7.6836 7.7194 7.7210 8.1381 8.1389 12.9006 12.9569 13.1204 13.1251 13.6612 13.6753 16.8631 16.8670 k =-0.4977 0.5000 0.2413 ( 2450 PWs) bands (ev): -46.2712 -46.2712 -23.9682 -23.9644 -21.9783 -21.9770 -21.8657 -21.8581 -18.9827 -18.9827 -8.0015 -7.9732 -7.5631 -7.5415 -7.4446 -7.4431 -2.8374 -2.8111 -2.5924 -2.5873 -2.5649 -2.5432 3.2706 3.2713 3.5792 3.5825 4.2224 4.2232 4.6508 4.6622 4.8784 4.8790 5.5491 5.5716 7.7337 7.7343 7.7686 7.7703 8.1395 8.1404 12.9322 12.9883 13.1624 13.1667 13.6653 13.6802 16.9320 16.9331 k =-0.4977 0.5000 0.2540 ( 2442 PWs) bands (ev): -46.2710 -46.2710 -23.9693 -23.9656 -21.9782 -21.9768 -21.8700 -21.8624 -18.9821 -18.9821 -7.9610 -7.9305 -7.5600 -7.5361 -7.4416 -7.4399 -2.8473 -2.8208 -2.6024 -2.5966 -2.5762 -2.5550 3.2716 3.2723 3.5732 3.5766 4.2430 4.2437 4.6014 4.6126 4.8413 4.8420 5.4460 5.4686 7.7833 7.7835 7.8165 7.8182 8.1409 8.1420 12.9662 13.0218 13.2057 13.2097 13.6694 13.6852 16.9841 16.9901 k =-0.4977 0.5000 0.2667 ( 2436 PWs) bands (ev): -46.2708 -46.2708 -23.9705 -23.9667 -21.9780 -21.9766 -21.8742 -21.8666 -18.9815 -18.9815 -7.9205 -7.8877 -7.5568 -7.5303 -7.4386 -7.4367 -2.8571 -2.8305 -2.6124 -2.6059 -2.5873 -2.5668 3.2726 3.2733 3.5658 3.5694 4.2625 4.2632 4.5530 4.5638 4.8056 4.8062 5.3473 5.3698 7.8311 7.8312 7.8628 7.8647 8.1423 8.1436 13.0021 13.0573 13.2502 13.2538 13.6735 13.6902 17.0237 17.0342 k =-0.4977 0.5000 0.2794 ( 2438 PWs) bands (ev): -46.2708 -46.2708 -23.9717 -23.9679 -21.9779 -21.9764 -21.8784 -21.8708 -18.9809 -18.9809 -7.8804 -7.8449 -7.5534 -7.5240 -7.4356 -7.4335 -2.8668 -2.8404 -2.6224 -2.6152 -2.5982 -2.5786 3.2735 3.2743 3.5569 3.5606 4.2797 4.2803 4.5066 4.5168 4.7712 4.7718 5.2539 5.2760 7.8770 7.8773 7.9075 7.9094 8.1437 8.1452 13.0397 13.0943 13.2956 13.2987 13.6776 13.6954 17.0521 17.0667 k =-0.4977 0.5000 0.2921 ( 2442 PWs) bands (ev): -46.2707 -46.2707 -23.9728 -23.9691 -21.9777 -21.9762 -21.8825 -21.8749 -18.9803 -18.9803 -7.8410 -7.8024 -7.5499 -7.5170 -7.4326 -7.4302 -2.8762 -2.8501 -2.6323 -2.6243 -2.6087 -2.5902 3.2745 3.2752 3.5463 3.5500 4.2922 4.2928 4.4648 4.4742 4.7383 4.7390 5.1665 5.1879 7.9208 7.9214 7.9502 7.9523 8.1452 8.1470 13.0787 13.1326 13.3416 13.3442 13.6818 13.7006 17.0712 17.0895 k =-0.4977 0.5000 0.3048 ( 2446 PWs) bands (ev): -46.2707 -46.2707 -23.9739 -23.9703 -21.9776 -21.9760 -21.8865 -21.8790 -18.9797 -18.9797 -7.8028 -7.7608 -7.5460 -7.5093 -7.4297 -7.4270 -2.8854 -2.8598 -2.6420 -2.6333 -2.6189 -2.6016 3.2755 3.2762 3.5336 3.5374 4.2948 4.2957 4.4330 4.4411 4.7069 4.7076 5.0857 5.1062 7.9626 7.9634 7.9909 7.9932 8.1466 8.1488 13.1187 13.1718 13.3878 13.3900 13.6860 13.7059 17.0831 17.1046 k =-0.4977 0.5000 0.3175 ( 2447 PWs) bands (ev): -46.2706 -46.2706 -23.9750 -23.9715 -21.9775 -21.9759 -21.8903 -21.8830 -18.9791 -18.9791 -7.7663 -7.7206 -7.5416 -7.5005 -7.4268 -7.4237 -2.8943 -2.8693 -2.6514 -2.6421 -2.6287 -2.6127 3.2764 3.2771 3.5187 3.5225 4.2806 4.2823 4.4184 4.4245 4.6772 4.6779 5.0117 5.0311 8.0021 8.0032 8.0293 8.0320 8.1481 8.1509 13.1594 13.2117 13.4339 13.4355 13.6902 13.7115 17.0896 17.1139 k =-0.4977 0.5000 0.3302 ( 2448 PWs) bands (ev): -46.2705 -46.2705 -23.9760 -23.9726 -21.9773 -21.9758 -21.8939 -21.8868 -18.9785 -18.9785 -7.7321 -7.6823 -7.5363 -7.4905 -7.4241 -7.4205 -2.9027 -2.8786 -2.6605 -2.6507 -2.6380 -2.6234 3.2774 3.2781 3.5013 3.5052 4.2511 4.2533 4.4201 4.4245 4.6492 4.6499 4.9447 4.9627 8.0392 8.0408 8.0651 8.0684 8.1497 8.1534 13.2005 13.2519 13.4794 13.4804 13.6947 13.7173 17.0922 17.1191 k =-0.4977 0.5000 0.3429 ( 2450 PWs) bands (ev): -46.2705 -46.2705 -23.9770 -23.9737 -21.9772 -21.9757 -21.8974 -21.8905 -18.9780 -18.9780 -7.7007 -7.6471 -7.5295 -7.4789 -7.4214 -7.4173 -2.9108 -2.8877 -2.6691 -2.6589 -2.6469 -2.6338 3.2783 3.2789 3.4814 3.4852 4.2145 4.2166 4.4304 4.4338 4.6229 4.6236 4.8846 4.9011 8.0737 8.0759 8.0979 8.1023 8.1516 8.1569 13.2415 13.2918 13.5236 13.5243 13.6997 13.7236 17.0924 17.1217 k =-0.4977 0.5000 0.3556 ( 2452 PWs) bands (ev): -46.2704 -46.2704 -23.9779 -23.9748 -21.9771 -21.9756 -21.9006 -21.8941 -18.9775 -18.9775 -7.6727 -7.6165 -7.5199 -7.4656 -7.4189 -7.4139 -2.9184 -2.8964 -2.6773 -2.6667 -2.6553 -2.6436 3.2792 3.2798 3.4590 3.4626 4.1768 4.1784 4.4440 4.4468 4.5984 4.5991 4.8310 4.8460 8.1050 8.1085 8.1261 8.1322 8.1551 8.1635 13.2819 13.3312 13.5655 13.5664 13.7055 13.7308 17.0910 17.1228 k =-0.4977 0.5000 0.3683 ( 2452 PWs) bands (ev): -46.2703 -46.2703 -23.9787 -23.9758 -21.9770 -21.9755 -21.9036 -21.8974 -18.9770 -18.9770 -7.6484 -7.5924 -7.5060 -7.4506 -7.4165 -7.4104 -2.9254 -2.9047 -2.6849 -2.6742 -2.6631 -2.6529 3.2800 3.2806 3.4343 3.4376 4.1408 4.1418 4.4585 4.4611 4.5757 4.5764 4.7836 4.7971 8.1303 8.1379 8.1478 8.1492 8.1700 8.1776 13.3215 13.3696 13.6041 13.6052 13.7132 13.7394 17.0890 17.1233 k =-0.4977 0.5000 0.3810 ( 2456 PWs) bands (ev): -46.2703 -46.2703 -23.9795 -23.9768 -21.9769 -21.9755 -21.9064 -21.9006 -18.9766 -18.9766 -7.6279 -7.5759 -7.4874 -7.4339 -7.4142 -7.4065 -2.9319 -2.9126 -2.6919 -2.6813 -2.6704 -2.6616 3.2808 3.2814 3.4078 3.4108 4.1078 4.1083 4.4731 4.4753 4.5549 4.5555 4.7419 4.7540 8.1431 8.1505 8.1676 8.1699 8.1948 8.1989 13.3598 13.4064 13.6379 13.6383 13.7248 13.7507 17.0868 17.1239 k =-0.4977 0.5000 0.3937 ( 2448 PWs) bands (ev): -46.2701 -46.2701 -23.9802 -23.9778 -21.9768 -21.9755 -21.9089 -21.9035 -18.9761 -18.9761 -7.6110 -7.5655 -7.4663 -7.4169 -7.4113 -7.4017 -2.9377 -2.9200 -2.6983 -2.6879 -2.6771 -2.6696 3.2815 3.2821 3.3800 3.3826 4.0785 4.0786 4.4869 4.4891 4.5361 4.5366 4.7056 4.7163 8.1481 8.1525 8.1923 8.1934 8.2190 8.2214 13.3963 13.4413 13.6625 13.6654 13.7429 13.7659 17.0846 17.1253 k =-0.4977 0.5000 0.4064 ( 2445 PWs) bands (ev): -46.2700 -46.2700 -23.9808 -23.9786 -21.9768 -21.9755 -21.9111 -21.9062 -18.9757 -18.9757 -7.5973 -7.5590 -7.4462 -7.4109 -7.3972 -7.3951 -2.9429 -2.9269 -2.7040 -2.6940 -2.6831 -2.6769 3.2822 3.2827 3.3518 3.3541 4.0529 4.0531 4.4998 4.5019 4.5192 4.5197 4.6741 4.6835 8.1508 8.1538 8.2147 8.2153 8.2410 8.2426 13.4306 13.4738 13.6775 13.6853 13.7674 13.7858 17.0815 17.1278 k =-0.4977 0.5000 0.4191 ( 2440 PWs) bands (ev): -46.2699 -46.2699 -23.9814 -23.9794 -21.9767 -21.9755 -21.9130 -21.9087 -18.9754 -18.9754 -7.5863 -7.5547 -7.4304 -7.4091 -7.3851 -7.3794 -2.9475 -2.9332 -2.7089 -2.6996 -2.6885 -2.6834 3.2829 3.2833 3.3242 3.3260 4.0313 4.0317 4.5037 4.5044 4.5120 4.5138 4.6471 4.6554 8.1525 8.1547 8.2345 8.2349 8.2605 8.2617 13.4624 13.5034 13.6864 13.6985 13.7950 13.8088 17.0748 17.1183 k =-0.4977 0.5000 0.4318 ( 2438 PWs) bands (ev): -46.2698 -46.2698 -23.9818 -23.9801 -21.9766 -21.9756 -21.9147 -21.9108 -18.9751 -18.9751 -7.5775 -7.5519 -7.4203 -7.4076 -7.3715 -7.3625 -2.9513 -2.9389 -2.7132 -2.7047 -2.6932 -2.6891 3.2834 3.2837 3.2980 3.2995 4.0135 4.0140 4.4909 4.4914 4.5222 4.5241 4.6243 4.6315 8.1539 8.1555 8.2517 8.2520 8.2776 8.2784 13.4913 13.5294 13.6923 13.7071 13.8221 13.8324 17.0605 17.0852 k =-0.4977 0.5000 0.4445 ( 2436 PWs) bands (ev): -46.2697 -46.2697 -23.9822 -23.9808 -21.9765 -21.9756 -21.9160 -21.9128 -18.9748 -18.9748 -7.5704 -7.5501 -7.4144 -7.4064 -7.3564 -7.3474 -2.9544 -2.9439 -2.7166 -2.7092 -2.6972 -2.6940 3.2740 3.2752 3.2839 3.2843 3.9991 3.9996 4.4799 4.4803 4.5312 4.5331 4.6054 4.6116 8.1549 8.1561 8.2662 8.2666 8.2920 8.2927 13.5171 13.5516 13.6967 13.7125 13.8469 13.8547 17.0408 17.0562 k =-0.4977 0.5000 0.4572 ( 2440 PWs) bands (ev): -46.2697 -46.2697 -23.9825 -23.9813 -21.9765 -21.9757 -21.9171 -21.9144 -18.9746 -18.9746 -7.5646 -7.5491 -7.4108 -7.4055 -7.3422 -7.3346 -2.9568 -2.9483 -2.7194 -2.7132 -2.7005 -2.6981 3.2534 3.2543 3.2843 3.2846 3.9879 3.9884 4.4708 4.4711 4.5387 4.5407 4.5902 4.5956 8.1557 8.1566 8.2782 8.2785 8.3039 8.3045 13.5393 13.5692 13.7005 13.7158 13.8683 13.8741 17.0215 17.0319 k =-0.4977 0.5000 0.4699 ( 2438 PWs) bands (ev): -46.2696 -46.2696 -23.9827 -23.9818 -21.9764 -21.9758 -21.9178 -21.9158 -18.9744 -18.9744 -7.5600 -7.5488 -7.4084 -7.4048 -7.3302 -7.3244 -2.9584 -2.9520 -2.7213 -2.7165 -2.7031 -2.7012 3.2366 3.2372 3.2847 3.2849 3.9795 3.9799 4.4638 4.4640 4.5446 4.5467 4.5786 4.5831 8.1563 8.1570 8.2875 8.2878 8.3131 8.3136 13.5580 13.5820 13.7041 13.7174 13.8856 13.8897 17.0052 17.0126 k =-0.4977 0.5000 0.4825 ( 2436 PWs) bands (ev): -46.2696 -46.2696 -23.9828 -23.9822 -21.9763 -21.9759 -21.9182 -21.9169 -18.9743 -18.9743 -7.5564 -7.5490 -7.4068 -7.4044 -7.3210 -7.3172 -2.9592 -2.9549 -2.7224 -2.7191 -2.7048 -2.7035 3.2243 3.2247 3.2849 3.2851 3.9738 3.9740 4.4587 4.4589 4.5490 4.5511 4.5704 4.5741 8.1568 8.1572 8.2941 8.2945 8.3197 8.3202 13.5729 13.5897 13.7078 13.7176 13.8984 13.9011 16.9933 16.9985 k =-0.4977 0.5000 0.4952 ( 2444 PWs) bands (ev): -46.2697 -46.2697 -23.9828 -23.9825 -21.9762 -21.9760 -21.9183 -21.9177 -18.9743 -18.9743 -7.5536 -7.5498 -7.4058 -7.4043 -7.3151 -7.3131 -2.9593 -2.9571 -2.7227 -2.7211 -2.7059 -2.7049 3.2167 3.2169 3.2851 3.2852 3.9704 3.9705 4.4557 4.4558 4.5521 4.5536 4.5658 4.5682 8.1571 8.1573 8.2981 8.2985 8.3237 8.3241 13.5837 13.5924 13.7113 13.7165 13.9065 13.9078 16.9862 16.9898 k =-0.4977 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9762 -21.9760 -21.9182 -21.9181 -18.9742 -18.9742 -7.5520 -7.5508 -7.4055 -7.4043 -7.3125 -7.3123 -2.9589 -2.9584 -2.7224 -2.7222 -2.7062 -2.7054 3.2142 3.2143 3.2851 3.2852 3.9693 3.9693 4.4547 4.4548 4.5537 4.5539 4.5652 4.5653 8.1573 8.1573 8.2994 8.2998 8.3250 8.3254 13.5903 13.5903 13.7141 13.7145 13.9095 13.9098 16.9839 16.9868 k =-0.4977 0.5000 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9762 -21.9760 -21.9182 -21.9181 -18.9742 -18.9742 -7.5520 -7.5508 -7.4055 -7.4043 -7.3125 -7.3123 -2.9589 -2.9584 -2.7224 -2.7222 -2.7062 -2.7054 3.2142 3.2143 3.2851 3.2852 3.9693 3.9693 4.4547 4.4548 4.5537 4.5539 4.5652 4.5653 8.1573 8.1573 8.2994 8.2998 8.3250 8.3254 13.5903 13.5903 13.7141 13.7145 13.9095 13.9098 16.9839 16.9868 k =-0.5000 0.4977 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9761 -21.9761 -21.9182 -21.9182 -18.9742 -18.9742 -7.5513 -7.5513 -7.4048 -7.4048 -7.3124 -7.3124 -2.9587 -2.9587 -2.7223 -2.7223 -2.7058 -2.7058 3.2142 3.2142 3.2851 3.2851 3.9692 3.9692 4.4548 4.4548 4.5537 4.5537 4.5652 4.5652 8.1574 8.1574 8.2996 8.2996 8.3253 8.3253 13.5904 13.5904 13.7144 13.7144 13.9097 13.9097 16.9854 16.9854 k =-0.5000 0.4977 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9761 -21.9761 -21.9182 -21.9182 -18.9742 -18.9742 -7.5513 -7.5513 -7.4048 -7.4048 -7.3124 -7.3124 -2.9587 -2.9587 -2.7223 -2.7223 -2.7058 -2.7058 3.2142 3.2142 3.2851 3.2851 3.9692 3.9692 4.4548 4.4548 4.5537 4.5537 4.5652 4.5652 8.1574 8.1574 8.2996 8.2996 8.3253 8.3253 13.5904 13.5904 13.7144 13.7144 13.9097 13.9097 16.9854 16.9854 k =-0.5000 0.4977 0.4952 ( 2446 PWs) bands (ev): -46.2697 -46.2697 -23.9828 -23.9825 -21.9762 -21.9760 -21.9183 -21.9177 -18.9743 -18.9743 -7.5535 -7.5499 -7.4055 -7.4045 -7.3150 -7.3131 -2.9593 -2.9572 -2.7228 -2.7211 -2.7057 -2.7052 3.2167 3.2169 3.2850 3.2851 3.9703 3.9704 4.4558 4.4558 4.5520 4.5535 4.5658 4.5681 8.1572 8.1574 8.2983 8.2983 8.3239 8.3240 13.5837 13.5925 13.7114 13.7166 13.9066 13.9079 16.9871 16.9891 k =-0.5000 0.4977 0.4825 ( 2436 PWs) bands (ev): -46.2696 -46.2696 -23.9828 -23.9822 -21.9763 -21.9759 -21.9182 -21.9169 -18.9743 -18.9743 -7.5563 -7.5490 -7.4066 -7.4045 -7.3210 -7.3171 -2.9592 -2.9550 -2.7224 -2.7191 -2.7047 -2.7037 3.2242 3.2246 3.2848 3.2850 3.9737 3.9739 4.4588 4.4589 4.5490 4.5510 4.5704 4.5741 8.1569 8.1573 8.2943 8.2944 8.3199 8.3201 13.5729 13.5898 13.7079 13.7178 13.8985 13.9012 16.9939 16.9981 k =-0.5000 0.4977 0.4699 ( 2436 PWs) bands (ev): -46.2696 -46.2696 -23.9827 -23.9818 -21.9764 -21.9758 -21.9178 -21.9158 -18.9744 -18.9744 -7.5600 -7.5487 -7.4082 -7.4049 -7.3302 -7.3244 -2.9584 -2.9520 -2.7213 -2.7165 -2.7030 -2.7013 3.2366 3.2372 3.2846 3.2848 3.9794 3.9798 4.4638 4.4640 4.5445 4.5466 4.5786 4.5831 8.1564 8.1571 8.2876 8.2877 8.3133 8.3136 13.5581 13.5821 13.7043 13.7176 13.8857 13.8898 17.0057 17.0123 k =-0.5000 0.4977 0.4572 ( 2440 PWs) bands (ev): -46.2697 -46.2697 -23.9825 -23.9813 -21.9765 -21.9757 -21.9171 -21.9144 -18.9746 -18.9746 -7.5646 -7.5491 -7.4106 -7.4055 -7.3422 -7.3346 -2.9568 -2.9483 -2.7194 -2.7132 -2.7004 -2.6982 3.2534 3.2542 3.2842 3.2845 3.9878 3.9883 4.4709 4.4712 4.5386 4.5406 4.5902 4.5955 8.1558 8.1567 8.2784 8.2784 8.3040 8.3044 13.5394 13.5692 13.7006 13.7159 13.8684 13.8742 17.0219 17.0317 k =-0.5000 0.4977 0.4445 ( 2432 PWs) bands (ev): -46.2696 -46.2696 -23.9822 -23.9808 -21.9765 -21.9756 -21.9160 -21.9128 -18.9748 -18.9748 -7.5703 -7.5501 -7.4143 -7.4064 -7.3564 -7.3474 -2.9544 -2.9439 -2.7167 -2.7093 -2.6972 -2.6941 3.2740 3.2752 3.2839 3.2842 3.9990 3.9995 4.4799 4.4803 4.5311 4.5330 4.6054 4.6116 8.1550 8.1562 8.2664 8.2665 8.2921 8.2927 13.5172 13.5516 13.6968 13.7127 13.8470 13.8548 17.0412 17.0560 k =-0.5000 0.4977 0.4318 ( 2438 PWs) bands (ev): -46.2698 -46.2698 -23.9818 -23.9801 -21.9766 -21.9756 -21.9147 -21.9108 -18.9751 -18.9751 -7.5774 -7.5519 -7.4202 -7.4076 -7.3714 -7.3625 -2.9513 -2.9389 -2.7132 -2.7047 -2.6932 -2.6892 3.2833 3.2837 3.2980 3.2994 4.0134 4.0139 4.4910 4.4914 4.5221 4.5240 4.6243 4.6314 8.1540 8.1556 8.2519 8.2519 8.2777 8.2785 13.4914 13.5295 13.6924 13.7072 13.8222 13.8325 17.0608 17.0850 k =-0.5000 0.4977 0.4191 ( 2438 PWs) bands (ev): -46.2698 -46.2698 -23.9814 -23.9794 -21.9767 -21.9755 -21.9130 -21.9087 -18.9754 -18.9754 -7.5863 -7.5547 -7.4303 -7.4090 -7.3851 -7.3793 -2.9475 -2.9332 -2.7090 -2.6996 -2.6885 -2.6835 3.2828 3.2832 3.3241 3.3260 4.0312 4.0316 4.5040 4.5045 4.5117 4.5136 4.6471 4.6553 8.1526 8.1548 8.2346 8.2348 8.2606 8.2617 13.4625 13.5034 13.6866 13.6987 13.7951 13.8089 17.0750 17.1181 k =-0.5000 0.4977 0.4064 ( 2446 PWs) bands (ev): -46.2700 -46.2700 -23.9809 -23.9786 -21.9768 -21.9755 -21.9111 -21.9062 -18.9757 -18.9757 -7.5973 -7.5589 -7.4461 -7.4109 -7.3971 -7.3951 -2.9429 -2.9269 -2.7040 -2.6941 -2.6831 -2.6769 3.2821 3.2826 3.3518 3.3540 4.0529 4.0531 4.4998 4.5018 4.5191 4.5196 4.6741 4.6835 8.1508 8.1539 8.2148 8.2152 8.2411 8.2426 13.4307 13.4739 13.6776 13.6854 13.7676 13.7859 17.0815 17.1279 k =-0.5000 0.4977 0.3937 ( 2448 PWs) bands (ev): -46.2701 -46.2701 -23.9802 -23.9778 -21.9768 -21.9755 -21.9089 -21.9035 -18.9761 -18.9761 -7.6110 -7.5655 -7.4663 -7.4168 -7.4113 -7.4017 -2.9377 -2.9200 -2.6983 -2.6879 -2.6770 -2.6696 3.2814 3.2820 3.3799 3.3826 4.0784 4.0785 4.4869 4.4890 4.5360 4.5366 4.7056 4.7163 8.1482 8.1526 8.1923 8.1933 8.2191 8.2214 13.3963 13.4414 13.6626 13.6655 13.7430 13.7661 17.0845 17.1253 k =-0.5000 0.4977 0.3810 ( 2456 PWs) bands (ev): -46.2703 -46.2703 -23.9795 -23.9768 -21.9769 -21.9755 -21.9064 -21.9006 -18.9766 -18.9766 -7.6279 -7.5759 -7.4874 -7.4339 -7.4141 -7.4065 -2.9319 -2.9126 -2.6919 -2.6813 -2.6704 -2.6617 3.2807 3.2813 3.4077 3.4107 4.1077 4.1082 4.4730 4.4753 4.5549 4.5555 4.7419 4.7540 8.1432 8.1506 8.1676 8.1699 8.1949 8.1989 13.3598 13.4065 13.6381 13.6383 13.7249 13.7508 17.0867 17.1238 k =-0.5000 0.4977 0.3683 ( 2452 PWs) bands (ev): -46.2703 -46.2703 -23.9787 -23.9758 -21.9770 -21.9755 -21.9036 -21.8974 -18.9770 -18.9770 -7.6484 -7.5924 -7.5060 -7.4505 -7.4164 -7.4104 -2.9254 -2.9047 -2.6849 -2.6743 -2.6631 -2.6530 3.2799 3.2805 3.4342 3.4376 4.1407 4.1417 4.4585 4.4610 4.5757 4.5764 4.7836 4.7971 8.1304 8.1380 8.1479 8.1491 8.1700 8.1776 13.3216 13.3696 13.6042 13.6053 13.7134 13.7396 17.0889 17.1231 k =-0.5000 0.4977 0.3556 ( 2452 PWs) bands (ev): -46.2704 -46.2704 -23.9779 -23.9748 -21.9771 -21.9756 -21.9006 -21.8941 -18.9775 -18.9775 -7.6727 -7.6165 -7.5198 -7.4656 -7.4188 -7.4139 -2.9184 -2.8964 -2.6773 -2.6668 -2.6553 -2.6437 3.2791 3.2797 3.4589 3.4625 4.1768 4.1784 4.4439 4.4467 4.5984 4.5990 4.8310 4.8460 8.1051 8.1086 8.1262 8.1323 8.1552 8.1636 13.2820 13.3313 13.5657 13.5664 13.7056 13.7309 17.0909 17.1226 k =-0.5000 0.4977 0.3429 ( 2448 PWs) bands (ev): -46.2704 -46.2704 -23.9770 -23.9737 -21.9772 -21.9757 -21.8974 -21.8905 -18.9780 -18.9780 -7.7007 -7.6471 -7.5294 -7.4789 -7.4214 -7.4172 -2.9108 -2.8877 -2.6691 -2.6589 -2.6469 -2.6338 3.2782 3.2789 3.4813 3.4851 4.2145 4.2166 4.4303 4.4337 4.6229 4.6236 4.8845 4.9011 8.0738 8.0759 8.0980 8.1024 8.1516 8.1570 13.2416 13.2919 13.5240 13.5241 13.6998 13.7237 17.0922 17.1216 k =-0.5000 0.4977 0.3302 ( 2448 PWs) bands (ev): -46.2705 -46.2705 -23.9760 -23.9726 -21.9773 -21.9758 -21.8939 -21.8868 -18.9785 -18.9785 -7.7321 -7.6823 -7.5363 -7.4904 -7.4240 -7.4205 -2.9028 -2.8787 -2.6605 -2.6507 -2.6380 -2.6235 3.2773 3.2780 3.5012 3.5050 4.2511 4.2533 4.4200 4.4244 4.6492 4.6498 4.9447 4.9627 8.0393 8.0408 8.0652 8.0685 8.1498 8.1535 13.2006 13.2519 13.4797 13.4804 13.6949 13.7174 17.0921 17.1190 k =-0.5000 0.4977 0.3175 ( 2448 PWs) bands (ev): -46.2706 -46.2706 -23.9750 -23.9715 -21.9775 -21.9759 -21.8903 -21.8830 -18.9791 -18.9791 -7.7663 -7.7205 -7.5415 -7.5005 -7.4268 -7.4237 -2.8943 -2.8693 -2.6514 -2.6422 -2.6287 -2.6128 3.2763 3.2770 3.5186 3.5224 4.2806 4.2823 4.4183 4.4244 4.6772 4.6779 5.0117 5.0310 8.0021 8.0033 8.0293 8.0320 8.1482 8.1510 13.1595 13.2118 13.4341 13.4355 13.6904 13.7116 17.0895 17.1138 k =-0.5000 0.4977 0.3048 ( 2446 PWs) bands (ev): -46.2707 -46.2707 -23.9739 -23.9703 -21.9776 -21.9761 -21.8865 -21.8790 -18.9797 -18.9797 -7.8028 -7.7608 -7.5459 -7.5092 -7.4296 -7.4269 -2.8854 -2.8598 -2.6420 -2.6334 -2.6189 -2.6016 3.2754 3.2761 3.5335 3.5373 4.2948 4.2956 4.4329 4.4410 4.7069 4.7076 5.0856 5.1061 7.9626 7.9634 7.9909 7.9932 8.1467 8.1489 13.1188 13.1719 13.3880 13.3900 13.6861 13.7061 17.0830 17.1045 k =-0.5000 0.4977 0.2921 ( 2444 PWs) bands (ev): -46.2707 -46.2707 -23.9728 -23.9691 -21.9777 -21.9762 -21.8825 -21.8749 -18.9803 -18.9803 -7.8410 -7.8024 -7.5498 -7.5170 -7.4325 -7.4302 -2.8762 -2.8502 -2.6323 -2.6244 -2.6087 -2.5902 3.2744 3.2751 3.5461 3.5499 4.2922 4.2927 4.4647 4.4741 4.7382 4.7389 5.1665 5.1879 7.9208 7.9214 7.9502 7.9523 8.1453 8.1470 13.0788 13.1326 13.3417 13.3443 13.6819 13.7007 17.0711 17.0894 k =-0.5000 0.4977 0.2794 ( 2436 PWs) bands (ev): -46.2707 -46.2707 -23.9717 -23.9679 -21.9779 -21.9764 -21.8784 -21.8708 -18.9809 -18.9809 -7.8804 -7.8448 -7.5534 -7.5239 -7.4355 -7.4334 -2.8668 -2.8404 -2.6224 -2.6152 -2.5982 -2.5786 3.2735 3.2742 3.5568 3.5605 4.2797 4.2802 4.5066 4.5168 4.7712 4.7718 5.2539 5.2759 7.8770 7.8773 7.9075 7.9094 8.1438 8.1453 13.0398 13.0944 13.2958 13.2988 13.6778 13.6955 17.0520 17.0666 k =-0.5000 0.4977 0.2667 ( 2436 PWs) bands (ev): -46.2708 -46.2708 -23.9705 -23.9667 -21.9780 -21.9766 -21.8742 -21.8666 -18.9815 -18.9815 -7.9205 -7.8877 -7.5568 -7.5302 -7.4385 -7.4367 -2.8571 -2.8306 -2.6124 -2.6060 -2.5873 -2.5669 3.2725 3.2732 3.5657 3.5692 4.2624 4.2630 4.5530 4.5637 4.8055 4.8062 5.3473 5.3697 7.8312 7.8312 7.8629 7.8647 8.1424 8.1436 13.0022 13.0574 13.2504 13.2538 13.6736 13.6904 17.0236 17.0341 k =-0.5000 0.4977 0.2540 ( 2440 PWs) bands (ev): -46.2710 -46.2710 -23.9693 -23.9656 -21.9782 -21.9768 -21.8700 -21.8624 -18.9821 -18.9821 -7.9610 -7.9305 -7.5600 -7.5360 -7.4415 -7.4399 -2.8473 -2.8208 -2.6023 -2.5967 -2.5762 -2.5550 3.2715 3.2722 3.5730 3.5764 4.2429 4.2436 4.6014 4.6125 4.8413 4.8419 5.4460 5.4686 7.7833 7.7835 7.8165 7.8183 8.1410 8.1420 12.9663 13.0220 13.2059 13.2097 13.6695 13.6853 16.9840 16.9900 k =-0.5000 0.4977 0.2413 ( 2448 PWs) bands (ev): -46.2712 -46.2712 -23.9682 -23.9644 -21.9783 -21.9770 -21.8657 -21.8581 -18.9827 -18.9827 -8.0014 -7.9731 -7.5631 -7.5414 -7.4445 -7.4431 -2.8374 -2.8111 -2.5923 -2.5874 -2.5649 -2.5432 3.2705 3.2712 3.5791 3.5823 4.2223 4.2230 4.6508 4.6621 4.8784 4.8790 5.5491 5.5716 7.7338 7.7343 7.7686 7.7703 8.1395 8.1405 12.9323 12.9884 13.1625 13.1667 13.6654 13.6803 16.9320 16.9331 k =-0.5000 0.4977 0.2286 ( 2444 PWs) bands (ev): -46.2712 -46.2712 -23.9670 -23.9633 -21.9785 -21.9772 -21.8614 -21.8539 -18.9833 -18.9833 -8.0415 -8.0152 -7.5661 -7.5464 -7.4475 -7.4462 -2.8275 -2.8016 -2.5824 -2.5781 -2.5534 -2.5314 3.2696 3.2703 3.5840 3.5871 4.2011 4.2019 4.7006 4.7120 4.9166 4.9171 5.6558 5.6779 7.6828 7.6836 7.7194 7.7210 8.1381 8.1389 12.9007 12.9570 13.1206 13.1251 13.6614 13.6754 16.8630 16.8669 k =-0.5000 0.4977 0.2159 ( 2444 PWs) bands (ev): -46.2714 -46.2714 -23.9658 -23.9622 -21.9787 -21.9774 -21.8571 -21.8498 -18.9839 -18.9839 -8.0809 -8.0565 -7.5690 -7.5511 -7.4504 -7.4493 -2.8176 -2.7922 -2.5727 -2.5690 -2.5418 -2.5198 3.2687 3.2693 3.5880 3.5909 4.1798 4.1806 4.7505 4.7619 4.9558 4.9563 5.7650 5.7866 7.6306 7.6316 7.6691 7.6706 8.1368 8.1375 12.8715 12.9279 13.0802 13.0851 13.6574 13.6706 16.7806 16.7892 k =-0.5000 0.4977 0.2032 ( 2444 PWs) bands (ev): -46.2715 -46.2715 -23.9647 -23.9611 -21.9788 -21.9777 -21.8528 -21.8457 -18.9845 -18.9845 -8.1194 -8.0967 -7.5717 -7.5555 -7.4533 -7.4523 -2.8079 -2.7831 -2.5632 -2.5600 -2.5303 -2.5084 3.2678 3.2684 3.5912 3.5940 4.1586 4.1594 4.8004 4.8117 4.9960 4.9964 5.8757 5.8967 7.5774 7.5787 7.6178 7.6193 8.1354 8.1360 12.8449 12.9013 13.0416 13.0468 13.6535 13.6659 16.6873 16.7003 k =-0.5000 0.4977 0.1905 ( 2442 PWs) bands (ev): -46.2715 -46.2715 -23.9635 -23.9600 -21.9790 -21.9779 -21.8487 -21.8418 -18.9851 -18.9851 -8.1567 -8.1356 -7.5744 -7.5597 -7.4561 -7.4552 -2.7983 -2.7743 -2.5540 -2.5512 -2.5188 -2.4973 3.2669 3.2675 3.5936 3.5963 4.1378 4.1386 4.8501 4.8612 5.0368 5.0372 5.9869 6.0072 7.5236 7.5251 7.5660 7.5674 8.1341 8.1346 12.8210 12.8773 13.0050 13.0105 13.6497 13.6613 16.5854 16.6021 k =-0.5000 0.4977 0.1778 ( 2442 PWs) bands (ev): -46.2716 -46.2716 -23.9624 -23.9591 -21.9791 -21.9781 -21.8446 -21.8379 -18.9857 -18.9857 -8.1926 -8.1731 -7.5769 -7.5636 -7.4588 -7.4580 -2.7889 -2.7659 -2.5451 -2.5428 -2.5075 -2.4865 3.2661 3.2667 3.5956 3.5980 4.1175 4.1183 4.8995 4.9104 5.0781 5.0785 6.0977 6.1170 7.4693 7.4710 7.5139 7.5152 8.1328 8.1333 12.8001 12.8560 12.9706 12.9763 13.6459 13.6569 16.4771 16.4970 k =-0.5000 0.4977 0.1651 ( 2438 PWs) bands (ev): -46.2717 -46.2717 -23.9613 -23.9581 -21.9793 -21.9783 -21.8406 -21.8343 -18.9862 -18.9862 -8.2269 -8.2089 -7.5793 -7.5673 -7.4614 -7.4607 -2.7798 -2.7579 -2.5366 -2.5346 -2.4964 -2.4762 3.2653 3.2658 3.5970 3.5993 4.0980 4.0987 4.9484 4.9590 5.1197 5.1200 6.2069 6.2252 7.4150 7.4169 7.4617 7.4630 8.1316 8.1320 12.7821 12.8373 12.9385 12.9445 13.6424 13.6526 16.3647 16.3871 k =-0.5000 0.4977 0.1524 ( 2434 PWs) bands (ev): -46.2717 -46.2717 -23.9603 -23.9573 -21.9794 -21.9785 -21.8367 -21.8308 -18.9867 -18.9867 -8.2593 -8.2428 -7.5815 -7.5707 -7.4639 -7.4633 -2.7710 -2.7504 -2.5286 -2.5269 -2.4857 -2.4663 3.2645 3.2651 3.5980 3.6002 4.0793 4.0800 4.9967 5.0068 5.1612 5.1615 6.3135 6.3307 7.3610 7.3631 7.4100 7.4112 8.1305 8.1308 12.7670 12.8211 12.9090 12.9150 13.6390 13.6485 16.2505 16.2747 k =-0.5000 0.4977 0.1397 ( 2430 PWs) bands (ev): -46.2717 -46.2717 -23.9593 -23.9564 -21.9796 -21.9787 -21.8331 -21.8275 -18.9872 -18.9872 -8.2897 -8.2746 -7.5836 -7.5739 -7.4662 -7.4657 -2.7627 -2.7434 -2.5210 -2.5195 -2.4754 -2.4571 3.2638 3.2643 3.5988 3.6008 4.0616 4.0623 5.0440 5.0537 5.2024 5.2026 6.4165 6.4326 7.3078 7.3100 7.3590 7.3602 8.1294 8.1297 12.7546 12.8070 12.8824 12.8882 13.6358 13.6446 16.1364 16.1618 k =-0.5000 0.4977 0.1270 ( 2438 PWs) bands (ev): -46.2719 -46.2719 -23.9584 -23.9557 -21.9797 -21.9789 -21.8296 -21.8245 -18.9877 -18.9877 -8.3179 -8.3043 -7.5855 -7.5769 -7.4684 -7.4679 -2.7548 -2.7369 -2.5139 -2.5127 -2.4656 -2.4486 3.2632 3.2636 3.5992 3.6010 4.0451 4.0457 5.0901 5.0993 5.2428 5.2430 6.5149 6.5298 7.2558 7.2581 7.3093 7.3104 8.1284 8.1286 12.7448 12.7946 12.8591 12.8642 13.6328 13.6409 16.0244 16.0504 k =-0.5000 0.4977 0.1143 ( 2438 PWs) bands (ev): -46.2720 -46.2720 -23.9575 -23.9550 -21.9798 -21.9791 -21.8264 -21.8217 -18.9881 -18.9881 -8.3439 -8.3316 -7.5873 -7.5796 -7.4704 -7.4700 -2.7474 -2.7310 -2.5073 -2.5064 -2.4564 -2.4407 3.2626 3.2630 3.5994 3.6011 4.0298 4.0303 5.1346 5.1432 5.2821 5.2822 6.6078 6.6213 7.2057 7.2080 7.2614 7.2624 8.1274 8.1277 12.7371 12.7830 12.8399 12.8434 13.6301 13.6375 15.9162 15.9422 k =-0.5000 0.4977 0.1016 ( 2440 PWs) bands (ev): -46.2721 -46.2721 -23.9567 -23.9545 -21.9799 -21.9793 -21.8235 -21.8192 -18.9885 -18.9885 -8.3673 -8.3565 -7.5888 -7.5821 -7.4722 -7.4719 -2.7405 -2.7258 -2.5014 -2.5006 -2.4478 -2.4336 3.2621 3.2624 3.5995 3.6010 4.0158 4.0163 5.1769 5.1849 5.3197 5.3198 6.6940 6.7063 7.1580 7.1602 7.2158 7.2167 8.1266 8.1268 12.7310 12.7713 12.8255 12.8260 13.6276 13.6343 15.8138 15.8391 k =-0.5000 0.4977 0.0889 ( 2444 PWs) bands (ev): -46.2722 -46.2722 -23.9559 -23.9540 -21.9800 -21.9795 -21.8207 -21.8169 -18.9888 -18.9888 -8.3883 -8.3788 -7.5902 -7.5844 -7.4738 -7.4735 -2.7342 -2.7212 -2.4961 -2.4954 -2.4400 -2.4273 3.2616 3.2619 3.5995 3.6008 4.0033 4.0037 5.2167 5.2240 5.3552 5.3553 6.7727 6.7837 7.1134 7.1154 7.1731 7.1740 8.1258 8.1260 12.7259 12.7592 12.8125 12.8158 13.6254 13.6314 15.7186 15.7427 k =-0.5000 0.4977 0.0762 ( 2452 PWs) bands (ev): -46.2724 -46.2724 -23.9553 -23.9536 -21.9801 -21.9796 -21.8183 -21.8150 -18.9891 -18.9891 -8.4065 -8.3984 -7.5913 -7.5864 -7.4753 -7.4750 -2.7286 -2.7173 -2.4914 -2.4909 -2.4329 -2.4219 3.2612 3.2614 3.5994 3.6005 3.9923 3.9927 5.2533 5.2598 5.3879 5.3879 6.8428 6.8525 7.0727 7.0743 7.1341 7.1349 8.1252 8.1253 12.7212 12.7470 12.8031 12.8100 13.6235 13.6288 15.6323 15.6545 k =-0.5000 0.4977 0.0635 ( 2452 PWs) bands (ev): -46.2724 -46.2724 -23.9547 -23.9532 -21.9801 -21.9797 -21.8162 -21.8134 -18.9894 -18.9894 -8.4220 -8.4152 -7.5922 -7.5881 -7.4765 -7.4763 -2.7236 -2.7141 -2.4874 -2.4870 -2.4267 -2.4174 3.2608 3.2610 3.5992 3.6002 3.9829 3.9832 5.2860 5.2916 5.4171 5.4171 6.9033 6.9119 7.0369 7.0379 7.0995 7.1002 8.1246 8.1247 12.7166 12.7356 12.7976 12.8070 13.6220 13.6264 15.5565 15.5762 k =-0.5000 0.4977 0.0508 ( 2452 PWs) bands (ev): -46.2724 -46.2724 -23.9541 -23.9530 -21.9802 -21.9799 -21.8144 -21.8121 -18.9896 -18.9896 -8.4346 -8.4292 -7.5929 -7.5897 -7.4775 -7.4773 -2.7193 -2.7117 -2.4841 -2.4838 -2.4213 -2.4138 3.2605 3.2607 3.5991 3.5999 3.9751 3.9753 5.3142 5.3188 5.4423 5.4423 6.9519 6.9602 7.0077 7.0081 7.0702 7.0707 8.1241 8.1242 12.7121 12.7255 12.7955 12.8056 13.6208 13.6244 15.4927 15.5093 k =-0.5000 0.4977 0.0381 ( 2452 PWs) bands (ev): -46.2725 -46.2725 -23.9537 -23.9528 -21.9802 -21.9800 -21.8129 -21.8112 -18.9898 -18.9898 -8.4444 -8.4403 -7.5933 -7.5909 -7.4783 -7.4782 -2.7157 -2.7100 -2.4815 -2.4812 -2.4169 -2.4112 3.2603 3.2605 3.5990 3.5996 3.9690 3.9692 5.3372 5.3408 5.4627 5.4627 6.9708 6.9761 7.0038 7.0043 7.0475 7.0477 8.1238 8.1238 12.7081 12.7172 12.7958 12.8049 13.6200 13.6227 15.4421 15.4551 k =-0.5000 0.4977 0.0254 ( 2456 PWs) bands (ev): -46.2725 -46.2725 -23.9533 -23.9527 -21.9802 -21.9800 -21.8117 -21.8106 -18.9899 -18.9899 -8.4512 -8.4485 -7.5936 -7.5920 -7.4788 -7.4788 -2.7129 -2.7090 -2.4796 -2.4795 -2.4135 -2.4096 3.2602 3.2603 3.5989 3.5993 3.9646 3.9648 5.3544 5.3568 5.4778 5.4778 6.9575 6.9596 7.0195 7.0201 7.0388 7.0399 8.1235 8.1235 12.7052 12.7109 12.7974 12.8042 13.6195 13.6214 15.4059 15.4148 k =-0.5000 0.4977 0.0127 ( 2450 PWs) bands (ev): -46.2725 -46.2725 -23.9530 -23.9527 -21.9802 -21.9801 -21.8109 -21.8103 -18.9899 -18.9899 -8.4550 -8.4536 -7.5935 -7.5927 -7.4792 -7.4791 -2.7107 -2.7088 -2.4784 -2.4784 -2.4110 -2.4091 3.2601 3.2601 3.5989 3.5991 3.9620 3.9621 5.3651 5.3663 5.4870 5.4870 6.9473 6.9482 7.0142 7.0142 7.0505 7.0516 8.1233 8.1234 12.7039 12.7066 12.7996 12.8033 13.6195 13.6204 15.3848 15.3893 k =-0.5000 0.4977 0.0000 ( 2448 PWs) bands (ev): -46.2725 -46.2725 -23.9528 -23.9528 -21.9802 -21.9802 -21.8104 -21.8104 -18.9900 -18.9900 -8.4558 -8.4558 -7.5933 -7.5933 -7.4793 -7.4793 -2.7094 -2.7094 -2.4780 -2.4780 -2.4095 -2.4095 3.2601 3.2601 3.5990 3.5990 3.9612 3.9612 5.3692 5.3692 5.4902 5.4902 6.9441 6.9441 7.0111 7.0111 7.0562 7.0562 8.1233 8.1233 12.7043 12.7043 12.8017 12.8017 13.6198 13.6198 15.3792 15.3792 k = 0.0000 0.0000 0.5079 ( 2436 PWs) bands (ev): -46.2739 -46.2739 -23.9263 -23.9263 -21.8930 -21.8930 -21.8360 -21.8360 -18.9958 -18.9958 -8.7267 -8.7267 -8.2840 -8.2840 -7.3585 -7.3585 -2.6800 -2.6800 -2.4421 -2.4421 -2.3807 -2.3807 3.3676 3.3676 5.6787 5.6787 5.7235 5.7235 6.1896 6.1896 6.2818 6.2818 6.3816 6.3816 6.7584 6.7584 6.8145 6.8145 7.1422 7.1422 11.0423 11.0423 12.6183 12.6183 12.9056 12.9056 14.1355 14.1355 k =-0.0091 0.0090 0.5079 ( 2442 PWs) bands (ev): -46.2740 -46.2740 -23.9264 -23.9264 -21.8930 -21.8930 -21.8361 -21.8361 -18.9958 -18.9958 -8.7258 -8.7258 -8.2834 -8.2834 -7.3586 -7.3586 -2.6801 -2.6801 -2.4422 -2.4422 -2.3809 -2.3809 3.3676 3.3676 5.6753 5.6753 5.7168 5.7168 6.1878 6.1878 6.2790 6.2790 6.3886 6.3886 6.7570 6.7570 6.8178 6.8178 7.1404 7.1404 11.0447 11.0447 12.6187 12.6187 12.9061 12.9061 14.1403 14.1403 k =-0.0182 0.0181 0.5079 ( 2442 PWs) bands (ev): -46.2739 -46.2739 -23.9265 -23.9265 -21.8931 -21.8931 -21.8364 -21.8364 -18.9958 -18.9958 -8.7232 -8.7232 -8.2816 -8.2816 -7.3588 -7.3588 -2.6802 -2.6802 -2.4422 -2.4422 -2.3815 -2.3815 3.3674 3.3674 5.6647 5.6647 5.6980 5.6980 6.1822 6.1822 6.2708 6.2708 6.4089 6.4089 6.7530 6.7530 6.8276 6.8276 7.1352 7.1352 11.0519 11.0519 12.6201 12.6201 12.9076 12.9076 14.1545 14.1545 k =-0.0273 0.0271 0.5079 ( 2446 PWs) bands (ev): -46.2740 -46.2740 -23.9268 -23.9268 -21.8933 -21.8933 -21.8369 -21.8369 -18.9957 -18.9957 -8.7187 -8.7187 -8.2785 -8.2785 -7.3592 -7.3592 -2.6805 -2.6805 -2.4422 -2.4422 -2.3824 -2.3824 3.3672 3.3672 5.6450 5.6450 5.6719 5.6719 6.1723 6.1723 6.2577 6.2578 6.4402 6.4402 6.7460 6.7460 6.8437 6.8437 7.1267 7.1267 11.0639 11.0639 12.6222 12.6222 12.9102 12.9102 14.1781 14.1781 k =-0.0364 0.0362 0.5079 ( 2446 PWs) bands (ev): -46.2740 -46.2740 -23.9271 -23.9271 -21.8936 -21.8936 -21.8377 -21.8377 -18.9956 -18.9956 -8.7125 -8.7125 -8.2743 -8.2743 -7.3597 -7.3597 -2.6809 -2.6809 -2.4423 -2.4423 -2.3837 -2.3837 3.3668 3.3668 5.6123 5.6123 5.6453 5.6453 6.1572 6.1573 6.2406 6.2407 6.4799 6.4799 6.7359 6.7359 6.8654 6.8654 7.1155 7.1155 11.0805 11.0805 12.6253 12.6253 12.9138 12.9138 14.2109 14.2109 k =-0.0455 0.0452 0.5079 ( 2446 PWs) bands (ev): -46.2739 -46.2739 -23.9275 -23.9275 -21.8939 -21.8939 -21.8386 -21.8386 -18.9955 -18.9955 -8.7045 -8.7045 -8.2688 -8.2688 -7.3604 -7.3604 -2.6815 -2.6815 -2.4424 -2.4424 -2.3853 -2.3853 3.3664 3.3664 5.5689 5.5689 5.6191 5.6191 6.1364 6.1364 6.2203 6.2204 6.5257 6.5257 6.7223 6.7223 6.8921 6.8921 7.1023 7.1023 11.1018 11.1018 12.6293 12.6293 12.9185 12.9185 14.2525 14.2525 k =-0.0545 0.0543 0.5079 ( 2448 PWs) bands (ev): -46.2739 -46.2739 -23.9280 -23.9280 -21.8942 -21.8942 -21.8397 -21.8397 -18.9954 -18.9954 -8.6948 -8.6948 -8.2622 -8.2622 -7.3612 -7.3612 -2.6823 -2.6823 -2.4427 -2.4427 -2.3872 -2.3872 3.3658 3.3658 5.5196 5.5196 5.5908 5.5908 6.1092 6.1092 6.1973 6.1973 6.5756 6.5756 6.7050 6.7050 6.9233 6.9233 7.0880 7.0880 11.1277 11.1277 12.6342 12.6342 12.9242 12.9242 14.3026 14.3026 k =-0.0636 0.0633 0.5079 ( 2448 PWs) bands (ev): -46.2739 -46.2739 -23.9286 -23.9286 -21.8947 -21.8947 -21.8410 -21.8410 -18.9952 -18.9952 -8.6833 -8.6833 -8.2544 -8.2544 -7.3621 -7.3621 -2.6832 -2.6832 -2.4430 -2.4430 -2.3894 -2.3894 3.3652 3.3652 5.4670 5.4670 5.5602 5.5602 6.0760 6.0760 6.1714 6.1714 6.6280 6.6280 6.6840 6.6840 6.9582 6.9582 7.0733 7.0733 11.1580 11.1580 12.6401 12.6401 12.9310 12.9310 14.3608 14.3608 k =-0.0727 0.0724 0.5079 ( 2456 PWs) bands (ev): -46.2740 -46.2740 -23.9292 -23.9292 -21.8952 -21.8952 -21.8426 -21.8426 -18.9950 -18.9950 -8.6702 -8.6702 -8.2454 -8.2454 -7.3631 -7.3631 -2.6845 -2.6845 -2.4435 -2.4435 -2.3918 -2.3918 3.3644 3.3644 5.4126 5.4126 5.5273 5.5273 6.0373 6.0373 6.1419 6.1419 6.6563 6.6563 6.6846 6.6846 6.9962 6.9962 7.0593 7.0593 11.1926 11.1926 12.6469 12.6469 12.9389 12.9389 14.4267 14.4267 k =-0.0818 0.0814 0.5079 ( 2456 PWs) bands (ev): -46.2739 -46.2739 -23.9300 -23.9300 -21.8957 -21.8957 -21.8443 -21.8443 -18.9948 -18.9948 -8.6555 -8.6555 -8.2353 -8.2353 -7.3642 -7.3642 -2.6859 -2.6859 -2.4443 -2.4443 -2.3945 -2.3945 3.3636 3.3636 5.3572 5.3572 5.4926 5.4926 5.9940 5.9940 6.1080 6.1081 6.6273 6.6273 6.7391 6.7391 7.0367 7.0367 7.0471 7.0471 11.2313 11.2313 12.6548 12.6548 12.9478 12.9478 14.4999 14.4999 k =-0.0909 0.0905 0.5079 ( 2456 PWs) bands (ev): -46.2738 -46.2738 -23.9308 -23.9308 -21.8964 -21.8964 -21.8461 -21.8461 -18.9945 -18.9945 -8.6391 -8.6391 -8.2241 -8.2241 -7.3653 -7.3653 -2.6877 -2.6877 -2.4453 -2.4453 -2.3972 -2.3972 3.3627 3.3627 5.3016 5.3016 5.4566 5.4566 5.9468 5.9469 6.0691 6.0691 6.5930 6.5930 6.7950 6.7950 7.0371 7.0371 7.0795 7.0795 11.2740 11.2740 12.6638 12.6638 12.9579 12.9579 14.5798 14.5798 k =-0.1000 0.0995 0.5079 ( 2456 PWs) bands (ev): -46.2738 -46.2738 -23.9317 -23.9317 -21.8971 -21.8971 -21.8481 -21.8481 -18.9942 -18.9942 -8.6211 -8.6211 -8.2118 -8.2118 -7.3665 -7.3665 -2.6898 -2.6898 -2.4468 -2.4468 -2.4001 -2.4001 3.3618 3.3618 5.2462 5.2462 5.4195 5.4195 5.8966 5.8966 6.0246 6.0246 6.5541 6.5542 6.8511 6.8511 7.0305 7.0305 7.1236 7.1236 11.3205 11.3205 12.6738 12.6738 12.9692 12.9692 14.6659 14.6659 k =-0.1091 0.1086 0.5079 ( 2460 PWs) bands (ev): -46.2738 -46.2738 -23.9327 -23.9327 -21.8979 -21.8979 -21.8503 -21.8503 -18.9939 -18.9939 -8.6016 -8.6016 -8.1985 -8.1985 -7.3677 -7.3677 -2.6923 -2.6923 -2.4487 -2.4487 -2.4030 -2.4030 3.3607 3.3607 5.1915 5.1915 5.3817 5.3817 5.8437 5.8437 5.9744 5.9744 6.5110 6.5110 6.9069 6.9069 7.0276 7.0276 7.1690 7.1690 11.3704 11.3704 12.6849 12.6849 12.9815 12.9815 14.7576 14.7576 k =-0.1182 0.1176 0.5079 ( 2460 PWs) bands (ev): -46.2737 -46.2737 -23.9337 -23.9337 -21.8987 -21.8987 -21.8526 -21.8526 -18.9936 -18.9936 -8.5806 -8.5806 -8.1841 -8.1841 -7.3690 -7.3690 -2.6952 -2.6952 -2.4512 -2.4512 -2.4058 -2.4058 3.3596 3.3596 5.1379 5.1379 5.3435 5.3435 5.7887 5.7887 5.9186 5.9186 6.4636 6.4636 6.9618 6.9618 7.0290 7.0290 7.2152 7.2152 11.4237 11.4237 12.6972 12.6972 12.9951 12.9951 14.8545 14.8545 k =-0.1273 0.1267 0.5079 ( 2464 PWs) bands (ev): -46.2736 -46.2736 -23.9349 -23.9349 -21.8996 -21.8996 -21.8551 -21.8551 -18.9932 -18.9932 -8.5582 -8.5582 -8.1688 -8.1688 -7.3702 -7.3702 -2.6984 -2.6984 -2.4544 -2.4544 -2.4086 -2.4086 3.3584 3.3584 5.0855 5.0855 5.3052 5.3052 5.7319 5.7319 5.8574 5.8574 6.4123 6.4123 7.0135 7.0135 7.0370 7.0370 7.2620 7.2620 11.4800 11.4800 12.7105 12.7105 13.0098 13.0098 14.9559 14.9559 k =-0.1364 0.1357 0.5079 ( 2464 PWs) bands (ev): -46.2736 -46.2736 -23.9360 -23.9360 -21.9006 -21.9006 -21.8576 -21.8576 -18.9928 -18.9928 -8.5344 -8.5344 -8.1525 -8.1525 -7.3714 -7.3714 -2.7021 -2.7021 -2.4582 -2.4582 -2.4113 -2.4113 3.3571 3.3571 5.0347 5.0347 5.2669 5.2669 5.6735 5.6736 5.7914 5.7914 6.3574 6.3574 7.0385 7.0385 7.0749 7.0749 7.3090 7.3090 11.5390 11.5390 12.7250 12.7250 13.0257 13.0257 15.0614 15.0614 k =-0.1455 0.1448 0.5079 ( 2466 PWs) bands (ev): -46.2735 -46.2735 -23.9373 -23.9373 -21.9017 -21.9017 -21.8603 -21.8603 -18.9924 -18.9924 -8.5093 -8.5093 -8.1353 -8.1353 -7.3725 -7.3725 -2.7061 -2.7061 -2.4627 -2.4627 -2.4140 -2.4140 3.3558 3.3558 4.9857 4.9857 5.2288 5.2288 5.6139 5.6139 5.7212 5.7212 6.2991 6.2991 7.0523 7.0523 7.1269 7.1269 7.3561 7.3561 11.6005 11.6005 12.7407 12.7407 13.0427 13.0427 15.1703 15.1703 k =-0.1545 0.1538 0.5079 ( 2466 PWs) bands (ev): -46.2734 -46.2734 -23.9386 -23.9386 -21.9028 -21.9028 -21.8630 -21.8630 -18.9920 -18.9920 -8.4829 -8.4829 -8.1172 -8.1172 -7.3735 -7.3735 -2.7106 -2.7106 -2.4679 -2.4679 -2.4168 -2.4168 3.3544 3.3544 4.9387 4.9387 5.1910 5.1910 5.5529 5.5529 5.6476 5.6476 6.2377 6.2377 7.0686 7.0686 7.1790 7.1790 7.4029 7.4029 11.6644 11.6644 12.7576 12.7576 13.0610 13.0610 15.2821 15.2821 k =-0.1636 0.1629 0.5079 ( 2458 PWs) bands (ev): -46.2732 -46.2732 -23.9399 -23.9399 -21.9040 -21.9040 -21.8658 -21.8658 -18.9915 -18.9915 -8.4554 -8.4554 -8.0983 -8.0983 -7.3745 -7.3745 -2.7155 -2.7155 -2.4737 -2.4737 -2.4196 -2.4196 3.3530 3.3530 4.8937 4.8937 5.1538 5.1538 5.4902 5.4902 5.5717 5.5717 6.1737 6.1737 7.0879 7.0879 7.2302 7.2302 7.4494 7.4494 11.7302 11.7302 12.7757 12.7757 13.0804 13.0804 15.3964 15.3964 k =-0.1727 0.1719 0.5079 ( 2462 PWs) bands (ev): -46.2731 -46.2731 -23.9413 -23.9413 -21.9054 -21.9054 -21.8687 -21.8687 -18.9910 -18.9910 -8.4267 -8.4267 -8.0787 -8.0787 -7.3753 -7.3753 -2.7208 -2.7208 -2.4801 -2.4801 -2.4227 -2.4227 3.3515 3.3515 4.8510 4.8510 5.1171 5.1171 5.4250 5.4250 5.4951 5.4952 6.1074 6.1074 7.1100 7.1100 7.2805 7.2805 7.4954 7.4954 11.7977 11.7977 12.7950 12.7950 13.1009 13.1009 15.5124 15.5124 k =-0.1818 0.1810 0.5079 ( 2466 PWs) bands (ev): -46.2731 -46.2731 -23.9427 -23.9427 -21.9068 -21.9068 -21.8716 -21.8716 -18.9906 -18.9906 -8.3970 -8.3970 -8.0583 -8.0583 -7.3760 -7.3760 -2.7264 -2.7264 -2.4870 -2.4870 -2.4262 -2.4262 3.3499 3.3499 4.8107 4.8107 5.0811 5.0811 5.3557 5.3557 5.4202 5.4203 6.0392 6.0392 7.1348 7.1348 7.3298 7.3298 7.5407 7.5407 11.8667 11.8667 12.8153 12.8153 13.1226 13.1226 15.6297 15.6297 k =-0.1909 0.1900 0.5079 ( 2462 PWs) bands (ev): -46.2729 -46.2729 -23.9442 -23.9442 -21.9083 -21.9083 -21.8744 -21.8744 -18.9900 -18.9900 -8.3664 -8.3664 -8.0372 -8.0372 -7.3766 -7.3766 -2.7325 -2.7325 -2.4943 -2.4943 -2.4300 -2.4300 3.3482 3.3482 4.7728 4.7728 5.0459 5.0459 5.2806 5.2806 5.3492 5.3493 5.9694 5.9694 7.1620 7.1620 7.3780 7.3780 7.5852 7.5852 11.9369 11.9369 12.8368 12.8368 13.1454 13.1454 15.7477 15.7477 k =-0.2000 0.1991 0.5079 ( 2454 PWs) bands (ev): -46.2726 -46.2726 -23.9457 -23.9457 -21.9099 -21.9099 -21.8773 -21.8773 -18.9895 -18.9895 -8.3349 -8.3349 -8.0156 -8.0156 -7.3769 -7.3769 -2.7388 -2.7388 -2.5020 -2.5020 -2.4343 -2.4343 3.3465 3.3465 4.7375 4.7375 5.0115 5.0115 5.1999 5.1999 5.2826 5.2826 5.8985 5.8985 7.1914 7.1914 7.4251 7.4251 7.6287 7.6287 12.0081 12.0081 12.8594 12.8594 13.1692 13.1692 15.8658 15.8658 k =-0.2091 0.2081 0.5079 ( 2454 PWs) bands (ev): -46.2725 -46.2725 -23.9473 -23.9473 -21.9117 -21.9117 -21.8801 -21.8801 -18.9889 -18.9889 -8.3027 -8.3027 -7.9934 -7.9934 -7.3771 -7.3771 -2.7456 -2.7456 -2.5101 -2.5101 -2.4392 -2.4392 3.3447 3.3447 4.7048 4.7048 4.9780 4.9780 5.1154 5.1154 5.2191 5.2191 5.8269 5.8269 7.2227 7.2227 7.4711 7.4711 7.6713 7.6713 12.0800 12.0800 12.8831 12.8831 13.1940 13.1940 15.9834 15.9834 k =-0.2182 0.2172 0.5079 ( 2458 PWs) bands (ev): -46.2725 -46.2725 -23.9488 -23.9488 -21.9136 -21.9136 -21.8828 -21.8828 -18.9884 -18.9884 -8.2697 -8.2697 -7.9707 -7.9707 -7.3771 -7.3771 -2.7526 -2.7526 -2.5185 -2.5185 -2.4448 -2.4448 3.3428 3.3428 4.6746 4.6746 4.9453 4.9453 5.0286 5.0287 5.1576 5.1577 5.7548 5.7549 7.2557 7.2557 7.5159 7.5159 7.7127 7.7127 12.1525 12.1525 12.9077 12.9077 13.2198 13.2198 16.0997 16.0997 k =-0.2273 0.2262 0.5079 ( 2462 PWs) bands (ev): -46.2724 -46.2724 -23.9504 -23.9504 -21.9156 -21.9156 -21.8855 -21.8855 -18.9878 -18.9878 -8.2363 -8.2363 -7.9475 -7.9475 -7.3769 -7.3769 -2.7600 -2.7600 -2.5271 -2.5271 -2.4509 -2.4509 3.3408 3.3408 4.6471 4.6471 4.9133 4.9133 4.9412 4.9412 5.0975 5.0975 5.6828 5.6828 7.2902 7.2902 7.5597 7.5597 7.7529 7.7529 12.2252 12.2252 12.9332 12.9332 13.2464 13.2464 16.2142 16.2142 k =-0.2364 0.2353 0.5079 ( 2458 PWs) bands (ev): -46.2722 -46.2722 -23.9520 -23.9520 -21.9177 -21.9177 -21.8880 -21.8880 -18.9872 -18.9872 -8.2023 -8.2023 -7.9240 -7.9240 -7.3765 -7.3765 -2.7676 -2.7676 -2.5359 -2.5359 -2.4577 -2.4577 3.3387 3.3387 4.6221 4.6221 4.8517 4.8517 4.8839 4.8839 5.0383 5.0383 5.6112 5.6113 7.3260 7.3260 7.6024 7.6024 7.7919 7.7919 12.2981 12.2981 12.9597 12.9597 13.2739 13.2739 16.3260 16.3260 k =-0.2455 0.2443 0.5079 ( 2454 PWs) bands (ev): -46.2720 -46.2720 -23.9536 -23.9536 -21.9200 -21.9200 -21.8905 -21.8905 -18.9866 -18.9866 -8.1680 -8.1680 -7.9002 -7.9002 -7.3759 -7.3759 -2.7754 -2.7754 -2.5448 -2.5448 -2.4652 -2.4652 3.3365 3.3365 4.5996 4.5996 4.7641 4.7641 4.8540 4.8540 4.9800 4.9800 5.5404 5.5404 7.3630 7.3630 7.6440 7.6440 7.8296 7.8296 12.3710 12.3710 12.9870 12.9870 13.3021 13.3021 16.4343 16.4343 k =-0.2545 0.2534 0.5079 ( 2454 PWs) bands (ev): -46.2719 -46.2719 -23.9552 -23.9552 -21.9225 -21.9225 -21.8927 -21.8927 -18.9859 -18.9859 -8.1335 -8.1335 -7.8761 -7.8761 -7.3750 -7.3750 -2.7835 -2.7835 -2.5539 -2.5539 -2.4734 -2.4734 3.3341 3.3341 4.5792 4.5792 4.6772 4.6772 4.8253 4.8253 4.9224 4.9224 5.4707 5.4707 7.4009 7.4009 7.6845 7.6845 7.8659 7.8659 12.4436 12.4436 13.0150 13.0150 13.3309 13.3309 16.5382 16.5382 k =-0.2636 0.2624 0.5079 ( 2450 PWs) bands (ev): -46.2718 -46.2718 -23.9568 -23.9568 -21.9250 -21.9250 -21.8949 -21.8949 -18.9853 -18.9853 -8.0988 -8.0988 -7.8519 -7.8519 -7.3739 -7.3739 -2.7917 -2.7917 -2.5631 -2.5631 -2.4822 -2.4822 3.3316 3.3316 4.5579 4.5579 4.5945 4.5945 4.7978 4.7978 4.8655 4.8655 5.4025 5.4025 7.4395 7.4395 7.7239 7.7239 7.9008 7.9008 12.5157 12.5157 13.0436 13.0436 13.3603 13.3603 16.6367 16.6367 k =-0.2727 0.2715 0.5079 ( 2442 PWs) bands (ev): -46.2715 -46.2715 -23.9584 -23.9584 -21.9277 -21.9277 -21.8969 -21.8969 -18.9847 -18.9847 -8.0642 -8.0642 -7.8276 -7.8276 -7.3726 -7.3726 -2.8001 -2.8001 -2.5724 -2.5724 -2.4916 -2.4916 3.3289 3.3289 4.4988 4.4988 4.5533 4.5533 4.7713 4.7713 4.8093 4.8094 5.3361 5.3361 7.4788 7.4788 7.7622 7.7622 7.9344 7.9344 12.5873 12.5873 13.0729 13.0729 13.3901 13.3901 16.7287 16.7287 k =-0.2818 0.2805 0.5079 ( 2442 PWs) bands (ev): -46.2714 -46.2714 -23.9600 -23.9600 -21.9304 -21.9304 -21.8988 -21.8988 -18.9840 -18.9840 -8.0297 -8.0297 -7.8032 -7.8032 -7.3711 -7.3711 -2.8087 -2.8087 -2.5816 -2.5816 -2.5016 -2.5016 3.3259 3.3259 4.4166 4.4166 4.5388 4.5388 4.7456 4.7456 4.7542 4.7542 5.2719 5.2719 7.5184 7.5184 7.7995 7.7995 7.9664 7.9664 12.6580 12.6580 13.1026 13.1026 13.4202 13.4202 16.8132 16.8132 k =-0.2909 0.2896 0.5079 ( 2438 PWs) bands (ev): -46.2712 -46.2712 -23.9616 -23.9616 -21.9332 -21.9332 -21.9005 -21.9005 -18.9834 -18.9834 -7.9955 -7.9955 -7.7788 -7.7788 -7.3693 -7.3693 -2.8173 -2.8173 -2.5908 -2.5908 -2.5121 -2.5121 3.3228 3.3228 4.3345 4.3345 4.5282 4.5282 4.6988 4.6988 4.7219 4.7219 5.2099 5.2099 7.5583 7.5583 7.8358 7.8358 7.9971 7.9971 12.7278 12.7278 13.1327 13.1327 13.4505 13.4505 16.8891 16.8891 k =-0.3000 0.2986 0.5079 ( 2438 PWs) bands (ev): -46.2711 -46.2711 -23.9631 -23.9631 -21.9361 -21.9361 -21.9021 -21.9021 -18.9828 -18.9828 -7.9617 -7.9617 -7.7545 -7.7545 -7.3673 -7.3673 -2.8260 -2.8260 -2.5999 -2.5999 -2.5231 -2.5231 3.3194 3.3194 4.2540 4.2540 4.5199 4.5199 4.6449 4.6449 4.6987 4.6987 5.1506 5.1506 7.5982 7.5982 7.8709 7.8709 8.0262 8.0262 12.7964 12.7964 13.1631 13.1631 13.4808 13.4808 16.9554 16.9554 k =-0.3091 0.3077 0.5079 ( 2440 PWs) bands (ev): -46.2710 -46.2710 -23.9646 -23.9646 -21.9390 -21.9390 -21.9037 -21.9037 -18.9822 -18.9822 -7.9284 -7.9284 -7.7304 -7.7304 -7.3651 -7.3651 -2.8348 -2.8348 -2.6090 -2.6090 -2.5344 -2.5344 3.3158 3.3158 4.1755 4.1755 4.5137 4.5137 4.5919 4.5919 4.6766 4.6766 5.0941 5.0941 7.6381 7.6381 7.9050 7.9050 8.0539 8.0539 12.8637 12.8637 13.1935 13.1935 13.5111 13.5111 17.0114 17.0114 k =-0.3182 0.3167 0.5079 ( 2438 PWs) bands (ev): -46.2709 -46.2709 -23.9661 -23.9661 -21.9418 -21.9418 -21.9051 -21.9051 -18.9815 -18.9815 -7.8958 -7.8958 -7.7066 -7.7066 -7.3628 -7.3628 -2.8436 -2.8436 -2.6178 -2.6178 -2.5461 -2.5461 3.3118 3.3118 4.0993 4.0993 4.5091 4.5091 4.5401 4.5402 4.6556 4.6556 5.0404 5.0404 7.6776 7.6776 7.9380 7.9380 8.0802 8.0802 12.9296 12.9296 13.2241 13.2241 13.5412 13.5412 17.0568 17.0568 k =-0.3273 0.3258 0.5079 ( 2434 PWs) bands (ev): -46.2707 -46.2707 -23.9676 -23.9676 -21.9447 -21.9447 -21.9064 -21.9064 -18.9809 -18.9809 -7.8641 -7.8641 -7.6830 -7.6830 -7.3602 -7.3602 -2.8523 -2.8523 -2.6265 -2.6265 -2.5580 -2.5580 3.3076 3.3076 4.0255 4.0255 4.4876 4.4876 4.5082 4.5082 4.6356 4.6356 4.9898 4.9898 7.7167 7.7167 7.9699 7.9699 8.1050 8.1050 12.9937 12.9937 13.2548 13.2548 13.5710 13.5710 17.0916 17.0916 k =-0.3364 0.3348 0.5079 ( 2434 PWs) bands (ev): -46.2706 -46.2706 -23.9690 -23.9690 -21.9475 -21.9475 -21.9076 -21.9076 -18.9803 -18.9803 -7.8333 -7.8333 -7.6598 -7.6597 -7.3574 -7.3574 -2.8610 -2.8610 -2.6350 -2.6350 -2.5700 -2.5700 3.3030 3.3030 3.9544 3.9544 4.4387 4.4387 4.5066 4.5066 4.6168 4.6168 4.9422 4.9422 7.7552 7.7552 8.0007 8.0007 8.1284 8.1284 13.0560 13.0560 13.2853 13.2853 13.6003 13.6003 17.1163 17.1163 k =-0.3455 0.3439 0.5079 ( 2430 PWs) bands (ev): -46.2705 -46.2705 -23.9703 -23.9703 -21.9503 -21.9503 -21.9088 -21.9088 -18.9797 -18.9797 -7.8037 -7.8037 -7.6370 -7.6369 -7.3545 -7.3545 -2.8696 -2.8696 -2.6433 -2.6433 -2.5821 -2.5821 3.2981 3.2981 3.8862 3.8862 4.3909 4.3909 4.5068 4.5068 4.5990 4.5990 4.8977 4.8977 7.7929 7.7929 8.0303 8.0303 8.1503 8.1503 13.1162 13.1162 13.3156 13.3156 13.6290 13.6290 17.1318 17.1318 k =-0.3545 0.3529 0.5079 ( 2434 PWs) bands (ev): -46.2704 -46.2704 -23.9716 -23.9716 -21.9529 -21.9529 -21.9099 -21.9099 -18.9792 -18.9792 -7.7753 -7.7753 -7.6147 -7.6147 -7.3515 -7.3515 -2.8781 -2.8781 -2.6513 -2.6513 -2.5941 -2.5941 3.2929 3.2929 3.8210 3.8210 4.3447 4.3447 4.5083 4.5083 4.5823 4.5823 4.8563 4.8563 7.8295 7.8295 8.0586 8.0586 8.1708 8.1708 13.1739 13.1739 13.3457 13.3457 13.6569 13.6569 17.1393 17.1393 k =-0.3636 0.3620 0.5079 ( 2434 PWs) bands (ev): -46.2703 -46.2703 -23.9729 -23.9729 -21.9555 -21.9555 -21.9109 -21.9109 -18.9786 -18.9786 -7.7484 -7.7484 -7.5929 -7.5929 -7.3483 -7.3483 -2.8864 -2.8864 -2.6589 -2.6589 -2.6059 -2.6059 3.2873 3.2873 3.7589 3.7589 4.3006 4.3006 4.5109 4.5109 4.5667 4.5667 4.8178 4.8178 7.8651 7.8651 8.0858 8.0858 8.1900 8.1900 13.2290 13.2290 13.3755 13.3755 13.6841 13.6841 17.1401 17.1401 k =-0.3727 0.3710 0.5079 ( 2434 PWs) bands (ev): -46.2702 -46.2702 -23.9741 -23.9741 -21.9580 -21.9580 -21.9118 -21.9118 -18.9781 -18.9781 -7.7229 -7.7229 -7.5719 -7.5719 -7.3451 -7.3451 -2.8945 -2.8945 -2.6662 -2.6662 -2.6174 -2.6174 3.2815 3.2815 3.7002 3.7002 4.2586 4.2586 4.5142 4.5142 4.5521 4.5521 4.7823 4.7823 7.8993 7.8993 8.1116 8.1116 8.2078 8.2078 13.2810 13.2810 13.4052 13.4052 13.7102 13.7102 17.1354 17.1354 k =-0.3818 0.3801 0.5079 ( 2434 PWs) bands (ev): -46.2701 -46.2701 -23.9752 -23.9752 -21.9603 -21.9603 -21.9127 -21.9127 -18.9776 -18.9776 -7.6991 -7.6991 -7.5516 -7.5515 -7.3418 -7.3418 -2.9022 -2.9022 -2.6732 -2.6732 -2.6286 -2.6286 3.2753 3.2753 3.6449 3.6449 4.2191 4.2191 4.5182 4.5182 4.5386 4.5386 4.7496 4.7496 7.9320 7.9320 8.1360 8.1360 8.2243 8.2243 13.3295 13.3295 13.4348 13.4348 13.7352 13.7352 17.1266 17.1266 k =-0.3909 0.3891 0.5079 ( 2434 PWs) bands (ev): -46.2700 -46.2700 -23.9763 -23.9763 -21.9625 -21.9625 -21.9135 -21.9135 -18.9771 -18.9771 -7.6769 -7.6769 -7.5321 -7.5321 -7.3385 -7.3385 -2.9097 -2.9097 -2.6798 -2.6798 -2.6393 -2.6393 3.2690 3.2690 3.5931 3.5931 4.1822 4.1822 4.5222 4.5222 4.5266 4.5266 4.7197 4.7197 7.9630 7.9630 8.1591 8.1591 8.2394 8.2394 13.3738 13.3738 13.4646 13.4646 13.7590 13.7590 17.1147 17.1147 k =-0.4000 0.3982 0.5079 ( 2442 PWs) bands (ev): -46.2701 -46.2701 -23.9773 -23.9773 -21.9646 -21.9646 -21.9143 -21.9143 -18.9767 -18.9767 -7.6565 -7.6565 -7.5136 -7.5135 -7.3352 -7.3352 -2.9169 -2.9169 -2.6860 -2.6860 -2.6495 -2.6495 3.2625 3.2625 3.5451 3.5451 4.1481 4.1481 4.5144 4.5144 4.5278 4.5278 4.6925 4.6925 7.9923 7.9923 8.1806 8.1806 8.2532 8.2532 13.4133 13.4133 13.4948 13.4948 13.7814 13.7814 17.1008 17.1008 k =-0.4091 0.4072 0.5079 ( 2448 PWs) bands (ev): -46.2701 -46.2701 -23.9782 -23.9782 -21.9666 -21.9666 -21.9149 -21.9149 -18.9763 -18.9763 -7.6380 -7.6379 -7.4961 -7.4961 -7.3319 -7.3319 -2.9236 -2.9236 -2.6918 -2.6918 -2.6590 -2.6590 3.2560 3.2560 3.5008 3.5008 4.1168 4.1168 4.5040 4.5040 4.5327 4.5327 4.6680 4.6680 8.0195 8.0195 8.2005 8.2005 8.2658 8.2658 13.4478 13.4478 13.5256 13.5256 13.8023 13.8023 17.0857 17.0857 k =-0.4182 0.4163 0.5079 ( 2452 PWs) bands (ev): -46.2701 -46.2701 -23.9790 -23.9790 -21.9683 -21.9683 -21.9156 -21.9156 -18.9759 -18.9759 -7.6212 -7.6212 -7.4798 -7.4798 -7.3288 -7.3288 -2.9298 -2.9298 -2.6971 -2.6971 -2.6678 -2.6678 3.2495 3.2495 3.4605 3.4605 4.0885 4.0885 4.4946 4.4946 4.5377 4.5377 4.6460 4.6460 8.0447 8.0447 8.2189 8.2189 8.2771 8.2771 13.4772 13.4772 13.5564 13.5564 13.8217 13.8217 17.0702 17.0702 k =-0.4273 0.4253 0.5079 ( 2452 PWs) bands (ev): -46.2700 -46.2700 -23.9798 -23.9798 -21.9699 -21.9699 -21.9161 -21.9161 -18.9756 -18.9756 -7.6063 -7.6063 -7.4649 -7.4649 -7.3257 -7.3257 -2.9356 -2.9356 -2.7020 -2.7020 -2.6757 -2.6757 3.2432 3.2432 3.4241 3.4241 4.0632 4.0632 4.4862 4.4862 4.5425 4.5425 4.6265 4.6265 8.0676 8.0676 8.2355 8.2355 8.2872 8.2872 13.5023 13.5023 13.5863 13.5863 13.8394 13.8394 17.0549 17.0549 k =-0.4364 0.4344 0.5079 ( 2448 PWs) bands (ev): -46.2699 -46.2699 -23.9805 -23.9805 -21.9714 -21.9714 -21.9166 -21.9166 -18.9753 -18.9753 -7.5932 -7.5932 -7.4513 -7.4513 -7.3229 -7.3229 -2.9408 -2.9408 -2.7064 -2.7064 -2.6828 -2.6828 3.2372 3.2372 3.3918 3.3918 4.0410 4.0410 4.4789 4.4789 4.5471 4.5471 4.6095 4.6095 8.0881 8.0881 8.2503 8.2503 8.2961 8.2961 13.5236 13.5236 13.6144 13.6144 13.8554 13.8554 17.0402 17.0402 k =-0.4455 0.4434 0.5079 ( 2452 PWs) bands (ev): -46.2699 -46.2699 -23.9810 -23.9810 -21.9726 -21.9726 -21.9170 -21.9170 -18.9750 -18.9750 -7.5820 -7.5820 -7.4393 -7.4393 -7.3203 -7.3203 -2.9454 -2.9454 -2.7104 -2.7104 -2.6890 -2.6890 3.2316 3.2316 3.3637 3.3637 4.0218 4.0218 4.4724 4.4724 4.5513 4.5513 4.5948 4.5948 8.1062 8.1062 8.2632 8.2632 8.3038 8.3038 13.5415 13.5415 13.6398 13.6398 13.8694 13.8694 17.0267 17.0267 k =-0.4545 0.4525 0.5079 ( 2452 PWs) bands (ev): -46.2699 -46.2699 -23.9815 -23.9815 -21.9737 -21.9737 -21.9174 -21.9174 -18.9748 -18.9748 -7.5726 -7.5726 -7.4290 -7.4290 -7.3180 -7.3180 -2.9494 -2.9494 -2.7139 -2.7139 -2.6942 -2.6942 3.2266 3.2266 3.3398 3.3398 4.0056 4.0056 4.4670 4.4670 4.5549 4.5549 4.5826 4.5826 8.1216 8.1216 8.2743 8.2743 8.3103 8.3103 13.5565 13.5565 13.6620 13.6620 13.8815 13.8815 17.0147 17.0147 k =-0.4636 0.4615 0.5079 ( 2442 PWs) bands (ev): -46.2697 -46.2697 -23.9819 -23.9819 -21.9745 -21.9745 -21.9176 -21.9176 -18.9746 -18.9746 -7.5649 -7.5649 -7.4204 -7.4204 -7.3160 -7.3160 -2.9527 -2.9527 -2.7168 -2.7168 -2.6984 -2.6984 3.2223 3.2223 3.3202 3.3202 3.9925 3.9925 4.4626 4.4626 4.5579 4.5579 4.5728 4.5728 8.1344 8.1344 8.2834 8.2834 8.3157 8.3157 13.5687 13.5687 13.6806 13.6806 13.8915 13.8915 17.0044 17.0044 k =-0.4727 0.4706 0.5079 ( 2452 PWs) bands (ev): -46.2699 -46.2699 -23.9823 -23.9823 -21.9752 -21.9752 -21.9179 -21.9179 -18.9744 -18.9744 -7.5589 -7.5589 -7.4136 -7.4136 -7.3145 -7.3145 -2.9553 -2.9553 -2.7192 -2.7192 -2.7017 -2.7017 3.2188 3.2188 3.3048 3.3048 3.9823 3.9823 4.4592 4.4592 4.5594 4.5594 4.5661 4.5661 8.1444 8.1444 8.2905 8.2905 8.3199 8.3199 13.5782 13.5782 13.6953 13.6953 13.8994 13.8994 16.9962 16.9962 k =-0.4818 0.4796 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9825 -23.9825 -21.9757 -21.9757 -21.9180 -21.9180 -18.9743 -18.9743 -7.5547 -7.5547 -7.4087 -7.4087 -7.3133 -7.3133 -2.9571 -2.9571 -2.7209 -2.7209 -2.7040 -2.7040 3.2163 3.2163 3.2939 3.2939 3.9750 3.9750 4.4567 4.4567 4.5574 4.5574 4.5644 4.5644 8.1516 8.1516 8.2956 8.2956 8.3229 8.3229 13.5849 13.5849 13.7059 13.7059 13.9051 13.9051 16.9902 16.9902 k =-0.4909 0.4887 0.5079 ( 2444 PWs) bands (ev): -46.2697 -46.2697 -23.9826 -23.9826 -21.9760 -21.9760 -21.9181 -21.9181 -18.9743 -18.9743 -7.5522 -7.5522 -7.4058 -7.4058 -7.3126 -7.3126 -2.9583 -2.9583 -2.7220 -2.7220 -2.7054 -2.7054 3.2147 3.2147 3.2873 3.2873 3.9707 3.9707 4.4553 4.4553 4.5547 4.5547 4.5649 4.5649 8.1559 8.1559 8.2986 8.2986 8.3247 8.3247 13.5890 13.5890 13.7123 13.7123 13.9086 13.9086 16.9866 16.9866 k =-0.5000 0.4977 0.5079 ( 2448 PWs) bands (ev): -46.2698 -46.2698 -23.9827 -23.9827 -21.9761 -21.9761 -21.9182 -21.9182 -18.9742 -18.9742 -7.5513 -7.5513 -7.4048 -7.4048 -7.3124 -7.3124 -2.9587 -2.9587 -2.7223 -2.7223 -2.7058 -2.7058 3.2142 3.2142 3.2851 3.2851 3.9692 3.9692 4.4548 4.4548 4.5537 4.5537 4.5652 4.5652 8.1574 8.1574 8.2996 8.2996 8.3253 8.3253 13.5904 13.5904 13.7144 13.7144 13.9097 13.9097 16.9854 16.9854 Writing output data file KNbO3.save init_run : 2.50s CPU 13.02s WALL ( 1 calls) electrons : 603.38s CPU 610.16s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.31s CPU 1.39s WALL ( 1 calls) Called by electrons: c_bands : 603.35s CPU 609.95s WALL ( 1 calls) v_of_rho : 0.14s CPU 0.89s WALL ( 1 calls) v_h : 0.01s CPU 0.04s WALL ( 1 calls) v_xc : 0.12s CPU 0.59s WALL ( 1 calls) newd : 0.40s CPU 0.53s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.08s WALL ( 472 calls) cegterg : 570.76s CPU 574.93s WALL ( 897 calls) Called by sum_band: Called by *egterg: h_psi : 215.94s CPU 224.87s WALL ( 15841 calls) s_psi : 22.81s CPU 23.26s WALL ( 15841 calls) g_psi : 0.45s CPU 0.50s WALL ( 14472 calls) cdiaghg : 256.48s CPU 252.92s WALL ( 14944 calls) cegterg:over : 50.53s CPU 47.73s WALL ( 14472 calls) cegterg:upda : 5.82s CPU 9.01s WALL ( 14472 calls) cegterg:last : 5.95s CPU 6.91s WALL ( 2504 calls) Called by h_psi: h_psi:vloc : 169.09s CPU 176.40s WALL ( 15841 calls) h_psi:vnl : 46.71s CPU 47.91s WALL ( 15841 calls) add_vuspsi : 13.52s CPU 17.24s WALL ( 15841 calls) General routines calbec : 33.14s CPU 30.49s WALL ( 15841 calls) fft : 0.36s CPU 1.14s WALL ( 19 calls) ffts : 0.00s CPU 0.04s WALL ( 4 calls) fftw : 165.08s CPU 168.62s WALL ( 1503244 calls) interpolate : 0.06s CPU 0.12s WALL ( 4 calls) davcio : 0.03s CPU 1.14s WALL ( 944 calls) Parallel routines fft_scatter : 122.77s CPU 120.52s WALL ( 1503267 calls) PWSCF : 10m58.61s CPU 12m32.17s WALL This run was terminated on: 21: 0:33 10Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=