Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:35: 3 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./CsCuO.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 77 76 21 2833 2770 407 Max 78 77 22 2837 2790 411 Sum 2773 2737 761 102051 100107 14713 bravais-lattice index = 14 lattice parameter (alat) = 11.1644 a.u. unit-cell volume = 1036.4214 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.164381 celldm(2)= 1.000000 celldm(3)= 0.860876 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.501511 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.501511 0.865151 0.000000 ) a(3) = ( 0.000000 0.000000 0.860876 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.579681 -0.000000 ) b(2) = ( 0.000000 1.155868 -0.000000 ) b(3) = ( 0.000000 0.000000 1.161608 ) PseudoPot. # 1 for O read from file: /users/gautes/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 Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 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 Cs read from file: /users/gautes/Pseudo/Cs.rel-pbe-oncvpsp.UPF MD5 check sum: b26d75608c6aa7e713949ad9f7a49707 Pseudo is Norm-conserving, Zval = 9.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 2414 points, 14 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 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Cu 11.00 63.54600 Cu( 1.00) Cs 9.00 132.90550 Cs( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.4304380 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4304380 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 342 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029240 k( 2) = ( 0.0092499 0.0160537 -0.0000000), wk = 0.0029240 k( 3) = ( 0.0184999 0.0321074 -0.0000000), wk = 0.0029240 k( 4) = ( 0.0277498 0.0481612 -0.0000000), wk = 0.0029240 k( 5) = ( 0.0369997 0.0642149 -0.0000000), wk = 0.0029240 k( 6) = ( 0.0462497 0.0802686 -0.0000000), wk = 0.0029240 k( 7) = ( 0.0554996 0.0963223 -0.0000000), wk = 0.0029240 k( 8) = ( 0.0647496 0.1123760 -0.0000000), wk = 0.0029240 k( 9) = ( 0.0739995 0.1284297 -0.0000000), wk = 0.0029240 k( 10) = ( 0.0832495 0.1444834 -0.0000000), wk = 0.0029240 k( 11) = ( 0.0924994 0.1605372 -0.0000000), wk = 0.0029240 k( 12) = ( 0.1017493 0.1765909 -0.0000000), wk = 0.0029240 k( 13) = ( 0.1109993 0.1926446 -0.0000000), wk = 0.0029240 k( 14) = ( 0.1202492 0.2086983 -0.0000000), wk = 0.0029240 k( 15) = ( 0.1294991 0.2247520 -0.0000000), wk = 0.0029240 k( 16) = ( 0.1387491 0.2408057 -0.0000000), wk = 0.0029240 k( 17) = ( 0.1479990 0.2568595 -0.0000000), wk = 0.0029240 k( 18) = ( 0.1572490 0.2729132 -0.0000000), wk = 0.0029240 k( 19) = ( 0.1664989 0.2889669 -0.0000000), wk = 0.0029240 k( 20) = ( 0.1757488 0.3050206 -0.0000000), wk = 0.0029240 k( 21) = ( 0.1849988 0.3210743 -0.0000000), wk = 0.0029240 k( 22) = ( 0.1942487 0.3371280 -0.0000000), wk = 0.0029240 k( 23) = ( 0.2034987 0.3531818 -0.0000000), wk = 0.0029240 k( 24) = ( 0.2127486 0.3692355 -0.0000000), wk = 0.0029240 k( 25) = ( 0.2219985 0.3852892 -0.0000000), wk = 0.0029240 k( 26) = ( 0.2312485 0.4013429 -0.0000000), wk = 0.0029240 k( 27) = ( 0.2404984 0.4173966 -0.0000000), wk = 0.0029240 k( 28) = ( 0.2497484 0.4334503 -0.0000000), wk = 0.0029240 k( 29) = ( 0.2589983 0.4495040 -0.0000000), wk = 0.0029240 k( 30) = ( 0.2682482 0.4655578 -0.0000000), wk = 0.0029240 k( 31) = ( 0.2774982 0.4816115 -0.0000000), wk = 0.0029240 k( 32) = ( 0.2867481 0.4976652 -0.0000000), wk = 0.0029240 k( 33) = ( 0.2959980 0.5137189 -0.0000000), wk = 0.0029240 k( 34) = ( 0.3052480 0.5297726 -0.0000000), wk = 0.0029240 k( 35) = ( 0.3144979 0.5458264 -0.0000000), wk = 0.0029240 k( 36) = ( 0.3237479 0.5618801 -0.0000000), wk = 0.0029240 k( 37) = ( 0.3329978 0.5779338 -0.0000000), wk = 0.0029240 k( 38) = ( 0.3329978 0.5779338 -0.0000000), wk = 0.0029240 k( 39) = ( 0.3144979 0.5779338 -0.0000000), wk = 0.0029240 k( 40) = ( 0.2959980 0.5779338 -0.0000000), wk = 0.0029240 k( 41) = ( 0.2774982 0.5779338 -0.0000000), wk = 0.0029240 k( 42) = ( 0.2589983 0.5779338 -0.0000000), wk = 0.0029240 k( 43) = ( 0.2404984 0.5779338 -0.0000000), wk = 0.0029240 k( 44) = ( 0.2219985 0.5779338 -0.0000000), wk = 0.0029240 k( 45) = ( 0.2034987 0.5779338 -0.0000000), wk = 0.0029240 k( 46) = ( 0.1849988 0.5779338 -0.0000000), wk = 0.0029240 k( 47) = ( 0.1664989 0.5779338 -0.0000000), wk = 0.0029240 k( 48) = ( 0.1479990 0.5779338 -0.0000000), wk = 0.0029240 k( 49) = ( 0.1294991 0.5779338 -0.0000000), wk = 0.0029240 k( 50) = ( 0.1109993 0.5779338 -0.0000000), wk = 0.0029240 k( 51) = ( 0.0924994 0.5779338 -0.0000000), wk = 0.0029240 k( 52) = ( 0.0739995 0.5779338 -0.0000000), wk = 0.0029240 k( 53) = ( 0.0554996 0.5779338 -0.0000000), wk = 0.0029240 k( 54) = ( 0.0369997 0.5779338 -0.0000000), wk = 0.0029240 k( 55) = ( 0.0184999 0.5779338 -0.0000000), wk = 0.0029240 k( 56) = ( 0.0000000 0.5779338 -0.0000000), wk = 0.0029240 k( 57) = ( 0.0000000 0.5779338 -0.0000000), wk = 0.0029240 k( 58) = ( 0.0000000 0.5779338 0.0187356), wk = 0.0029240 k( 59) = ( 0.0000000 0.5779338 0.0374712), wk = 0.0029240 k( 60) = ( 0.0000000 0.5779338 0.0562068), wk = 0.0029240 k( 61) = ( 0.0000000 0.5779338 0.0749424), wk = 0.0029240 k( 62) = ( 0.0000000 0.5779338 0.0936780), wk = 0.0029240 k( 63) = ( 0.0000000 0.5779338 0.1124136), wk = 0.0029240 k( 64) = ( 0.0000000 0.5779338 0.1311493), wk = 0.0029240 k( 65) = ( 0.0000000 0.5779338 0.1498849), wk = 0.0029240 k( 66) = ( 0.0000000 0.5779338 0.1686205), wk = 0.0029240 k( 67) = ( 0.0000000 0.5779338 0.1873561), wk = 0.0029240 k( 68) = ( 0.0000000 0.5779338 0.2060917), wk = 0.0029240 k( 69) = ( 0.0000000 0.5779338 0.2248273), wk = 0.0029240 k( 70) = ( 0.0000000 0.5779338 0.2435629), wk = 0.0029240 k( 71) = ( 0.0000000 0.5779338 0.2622985), wk = 0.0029240 k( 72) = ( 0.0000000 0.5779338 0.2810341), wk = 0.0029240 k( 73) = ( 0.0000000 0.5779338 0.2997697), wk = 0.0029240 k( 74) = ( 0.0000000 0.5779338 0.3185053), wk = 0.0029240 k( 75) = ( 0.0000000 0.5779338 0.3372409), wk = 0.0029240 k( 76) = ( 0.0000000 0.5779338 0.3559765), wk = 0.0029240 k( 77) = ( 0.0000000 0.5779338 0.3747121), wk = 0.0029240 k( 78) = ( 0.0000000 0.5779338 0.3934477), wk = 0.0029240 k( 79) = ( 0.0000000 0.5779338 0.4121833), wk = 0.0029240 k( 80) = ( 0.0000000 0.5779338 0.4309189), wk = 0.0029240 k( 81) = ( 0.0000000 0.5779338 0.4496546), wk = 0.0029240 k( 82) = ( 0.0000000 0.5779338 0.4683902), wk = 0.0029240 k( 83) = ( 0.0000000 0.5779338 0.4871258), wk = 0.0029240 k( 84) = ( 0.0000000 0.5779338 0.5058614), wk = 0.0029240 k( 85) = ( 0.0000000 0.5779338 0.5245970), wk = 0.0029240 k( 86) = ( 0.0000000 0.5779338 0.5433326), wk = 0.0029240 k( 87) = ( 0.0000000 0.5779338 0.5620682), wk = 0.0029240 k( 88) = ( 0.0000000 0.5779338 0.5808038), wk = 0.0029240 k( 89) = ( 0.0000000 0.5779338 0.5808038), wk = 0.0029240 k( 90) = ( 0.0184999 0.5779338 0.5808038), wk = 0.0029240 k( 91) = ( 0.0369997 0.5779338 0.5808038), wk = 0.0029240 k( 92) = ( 0.0554996 0.5779338 0.5808038), wk = 0.0029240 k( 93) = ( 0.0739995 0.5779338 0.5808038), wk = 0.0029240 k( 94) = ( 0.0924994 0.5779338 0.5808038), wk = 0.0029240 k( 95) = ( 0.1109993 0.5779338 0.5808038), wk = 0.0029240 k( 96) = ( 0.1294991 0.5779338 0.5808038), wk = 0.0029240 k( 97) = ( 0.1479990 0.5779338 0.5808038), wk = 0.0029240 k( 98) = ( 0.1664989 0.5779338 0.5808038), wk = 0.0029240 k( 99) = ( 0.1849988 0.5779338 0.5808038), wk = 0.0029240 k( 100) = ( 0.2034987 0.5779338 0.5808038), wk = 0.0029240 k( 101) = ( 0.2219985 0.5779338 0.5808038), wk = 0.0029240 k( 102) = ( 0.2404984 0.5779338 0.5808038), wk = 0.0029240 k( 103) = ( 0.2589983 0.5779338 0.5808038), wk = 0.0029240 k( 104) = ( 0.2774982 0.5779338 0.5808038), wk = 0.0029240 k( 105) = ( 0.2959980 0.5779338 0.5808038), wk = 0.0029240 k( 106) = ( 0.3144979 0.5779338 0.5808038), wk = 0.0029240 k( 107) = ( 0.3329978 0.5779338 0.5808038), wk = 0.0029240 k( 108) = ( 0.3329978 0.5779338 0.5808038), wk = 0.0029240 k( 109) = ( 0.3237479 0.5618801 0.5808038), wk = 0.0029240 k( 110) = ( 0.3144979 0.5458264 0.5808038), wk = 0.0029240 k( 111) = ( 0.3052480 0.5297726 0.5808038), wk = 0.0029240 k( 112) = ( 0.2959980 0.5137189 0.5808038), wk = 0.0029240 k( 113) = ( 0.2867481 0.4976652 0.5808038), wk = 0.0029240 k( 114) = ( 0.2774982 0.4816115 0.5808038), wk = 0.0029240 k( 115) = ( 0.2682482 0.4655578 0.5808038), wk = 0.0029240 k( 116) = ( 0.2589983 0.4495040 0.5808038), wk = 0.0029240 k( 117) = ( 0.2497484 0.4334503 0.5808038), wk = 0.0029240 k( 118) = ( 0.2404984 0.4173966 0.5808038), wk = 0.0029240 k( 119) = ( 0.2312485 0.4013429 0.5808038), wk = 0.0029240 k( 120) = ( 0.2219985 0.3852892 0.5808038), wk = 0.0029240 k( 121) = ( 0.2127486 0.3692355 0.5808038), wk = 0.0029240 k( 122) = ( 0.2034987 0.3531818 0.5808038), wk = 0.0029240 k( 123) = ( 0.1942487 0.3371280 0.5808038), wk = 0.0029240 k( 124) = ( 0.1849988 0.3210743 0.5808038), wk = 0.0029240 k( 125) = ( 0.1757488 0.3050206 0.5808038), wk = 0.0029240 k( 126) = ( 0.1664989 0.2889669 0.5808038), wk = 0.0029240 k( 127) = ( 0.1572490 0.2729132 0.5808038), wk = 0.0029240 k( 128) = ( 0.1479990 0.2568595 0.5808038), wk = 0.0029240 k( 129) = ( 0.1387491 0.2408057 0.5808038), wk = 0.0029240 k( 130) = ( 0.1294991 0.2247520 0.5808038), wk = 0.0029240 k( 131) = ( 0.1202492 0.2086983 0.5808038), wk = 0.0029240 k( 132) = ( 0.1109993 0.1926446 0.5808038), wk = 0.0029240 k( 133) = ( 0.1017493 0.1765909 0.5808038), wk = 0.0029240 k( 134) = ( 0.0924994 0.1605372 0.5808038), wk = 0.0029240 k( 135) = ( 0.0832495 0.1444834 0.5808038), wk = 0.0029240 k( 136) = ( 0.0739995 0.1284297 0.5808038), wk = 0.0029240 k( 137) = ( 0.0647496 0.1123760 0.5808038), wk = 0.0029240 k( 138) = ( 0.0554996 0.0963223 0.5808038), wk = 0.0029240 k( 139) = ( 0.0462497 0.0802686 0.5808038), wk = 0.0029240 k( 140) = ( 0.0369997 0.0642149 0.5808038), wk = 0.0029240 k( 141) = ( 0.0277498 0.0481612 0.5808038), wk = 0.0029240 k( 142) = ( 0.0184999 0.0321074 0.5808038), wk = 0.0029240 k( 143) = ( 0.0092499 0.0160537 0.5808038), wk = 0.0029240 k( 144) = ( 0.0000000 0.0000000 0.5808038), wk = 0.0029240 k( 145) = ( 0.0000000 0.0000000 0.5808038), wk = 0.0029240 k( 146) = ( 0.0000000 0.0000000 0.5620682), wk = 0.0029240 k( 147) = ( 0.0000000 0.0000000 0.5433326), wk = 0.0029240 k( 148) = ( 0.0000000 0.0000000 0.5245970), wk = 0.0029240 k( 149) = ( 0.0000000 0.0000000 0.5058614), wk = 0.0029240 k( 150) = ( 0.0000000 0.0000000 0.4871258), wk = 0.0029240 k( 151) = ( 0.0000000 0.0000000 0.4683902), wk = 0.0029240 k( 152) = ( 0.0000000 0.0000000 0.4496546), wk = 0.0029240 k( 153) = ( 0.0000000 0.0000000 0.4309189), wk = 0.0029240 k( 154) = ( 0.0000000 0.0000000 0.4121833), wk = 0.0029240 k( 155) = ( 0.0000000 0.0000000 0.3934477), wk = 0.0029240 k( 156) = ( 0.0000000 0.0000000 0.3747121), wk = 0.0029240 k( 157) = ( 0.0000000 0.0000000 0.3559765), wk = 0.0029240 k( 158) = ( 0.0000000 0.0000000 0.3372409), wk = 0.0029240 k( 159) = ( 0.0000000 0.0000000 0.3185053), wk = 0.0029240 k( 160) = ( 0.0000000 0.0000000 0.2997697), wk = 0.0029240 k( 161) = ( 0.0000000 0.0000000 0.2810341), wk = 0.0029240 k( 162) = ( 0.0000000 0.0000000 0.2622985), wk = 0.0029240 k( 163) = ( 0.0000000 0.0000000 0.2435629), wk = 0.0029240 k( 164) = ( 0.0000000 0.0000000 0.2248273), wk = 0.0029240 k( 165) = ( 0.0000000 0.0000000 0.2060917), wk = 0.0029240 k( 166) = ( 0.0000000 0.0000000 0.1873561), wk = 0.0029240 k( 167) = ( 0.0000000 0.0000000 0.1686205), wk = 0.0029240 k( 168) = ( 0.0000000 0.0000000 0.1498849), wk = 0.0029240 k( 169) = ( 0.0000000 0.0000000 0.1311493), wk = 0.0029240 k( 170) = ( 0.0000000 0.0000000 0.1124136), wk = 0.0029240 k( 171) = ( 0.0000000 0.0000000 0.0936780), wk = 0.0029240 k( 172) = ( 0.0000000 0.0000000 0.0749424), wk = 0.0029240 k( 173) = ( 0.0000000 0.0000000 0.0562068), wk = 0.0029240 k( 174) = ( 0.0000000 0.0000000 0.0374712), wk = 0.0029240 k( 175) = ( 0.0000000 0.0000000 0.0187356), wk = 0.0029240 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029240 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029240 k( 178) = ( -0.0161290 0.0092933 0.0000000), wk = 0.0029240 k( 179) = ( -0.0322581 0.0185867 0.0000000), wk = 0.0029240 k( 180) = ( -0.0483871 0.0278800 0.0000000), wk = 0.0029240 k( 181) = ( -0.0645161 0.0371733 0.0000000), wk = 0.0029240 k( 182) = ( -0.0806452 0.0464667 0.0000000), wk = 0.0029240 k( 183) = ( -0.0967742 0.0557600 0.0000000), wk = 0.0029240 k( 184) = ( -0.1129032 0.0650533 0.0000000), wk = 0.0029240 k( 185) = ( -0.1290323 0.0743467 0.0000000), wk = 0.0029240 k( 186) = ( -0.1451613 0.0836400 0.0000000), wk = 0.0029240 k( 187) = ( -0.1612903 0.0929333 0.0000000), wk = 0.0029240 k( 188) = ( -0.1774194 0.1022267 0.0000000), wk = 0.0029240 k( 189) = ( -0.1935484 0.1115200 0.0000000), wk = 0.0029240 k( 190) = ( -0.2096774 0.1208134 0.0000000), wk = 0.0029240 k( 191) = ( -0.2258064 0.1301067 0.0000000), wk = 0.0029240 k( 192) = ( -0.2419355 0.1394000 0.0000000), wk = 0.0029240 k( 193) = ( -0.2580645 0.1486934 0.0000000), wk = 0.0029240 k( 194) = ( -0.2741936 0.1579867 0.0000000), wk = 0.0029240 k( 195) = ( -0.2903226 0.1672800 0.0000000), wk = 0.0029240 k( 196) = ( -0.3064516 0.1765734 0.0000000), wk = 0.0029240 k( 197) = ( -0.3225807 0.1858667 0.0000000), wk = 0.0029240 k( 198) = ( -0.3387097 0.1951600 0.0000000), wk = 0.0029240 k( 199) = ( -0.3548387 0.2044534 0.0000000), wk = 0.0029240 k( 200) = ( -0.3709677 0.2137467 0.0000000), wk = 0.0029240 k( 201) = ( -0.3870968 0.2230400 0.0000000), wk = 0.0029240 k( 202) = ( -0.4032258 0.2323334 0.0000000), wk = 0.0029240 k( 203) = ( -0.4193548 0.2416267 0.0000000), wk = 0.0029240 k( 204) = ( -0.4354839 0.2509200 0.0000000), wk = 0.0029240 k( 205) = ( -0.4516129 0.2602134 0.0000000), wk = 0.0029240 k( 206) = ( -0.4677419 0.2695067 0.0000000), wk = 0.0029240 k( 207) = ( -0.4838710 0.2788000 0.0000000), wk = 0.0029240 k( 208) = ( -0.5000000 0.2880934 0.0000000), wk = 0.0029240 k( 209) = ( -0.5000000 0.2880934 0.0000000), wk = 0.0029240 k( 210) = ( -0.4907221 0.3041956 -0.0000000), wk = 0.0029240 k( 211) = ( -0.4814442 0.3202979 -0.0000000), wk = 0.0029240 k( 212) = ( -0.4721663 0.3364001 -0.0000000), wk = 0.0029240 k( 213) = ( -0.4628884 0.3525024 -0.0000000), wk = 0.0029240 k( 214) = ( -0.4536105 0.3686046 -0.0000000), wk = 0.0029240 k( 215) = ( -0.4443326 0.3847068 -0.0000000), wk = 0.0029240 k( 216) = ( -0.4350547 0.4008091 -0.0000000), wk = 0.0029240 k( 217) = ( -0.4257768 0.4169113 -0.0000000), wk = 0.0029240 k( 218) = ( -0.4164989 0.4330136 -0.0000000), wk = 0.0029240 k( 219) = ( -0.4072210 0.4491158 -0.0000000), wk = 0.0029240 k( 220) = ( -0.3979431 0.4652181 -0.0000000), wk = 0.0029240 k( 221) = ( -0.3886652 0.4813203 -0.0000000), wk = 0.0029240 k( 222) = ( -0.3793873 0.4974226 -0.0000000), wk = 0.0029240 k( 223) = ( -0.3701094 0.5135248 -0.0000000), wk = 0.0029240 k( 224) = ( -0.3608315 0.5296270 -0.0000000), wk = 0.0029240 k( 225) = ( -0.3515536 0.5457293 -0.0000000), wk = 0.0029240 k( 226) = ( -0.3422757 0.5618316 -0.0000000), wk = 0.0029240 k( 227) = ( -0.3329978 0.5779338 -0.0000000), wk = 0.0029240 k( 228) = ( -0.3329978 0.5779338 -0.0000000), wk = 0.0029240 k( 229) = ( -0.3329978 0.5779338 0.0187356), wk = 0.0029240 k( 230) = ( -0.3329978 0.5779338 0.0374712), wk = 0.0029240 k( 231) = ( -0.3329978 0.5779338 0.0562068), wk = 0.0029240 k( 232) = ( -0.3329978 0.5779338 0.0749424), wk = 0.0029240 k( 233) = ( -0.3329978 0.5779338 0.0936780), wk = 0.0029240 k( 234) = ( -0.3329978 0.5779338 0.1124136), wk = 0.0029240 k( 235) = ( -0.3329978 0.5779338 0.1311493), wk = 0.0029240 k( 236) = ( -0.3329978 0.5779338 0.1498849), wk = 0.0029240 k( 237) = ( -0.3329978 0.5779338 0.1686205), wk = 0.0029240 k( 238) = ( -0.3329978 0.5779338 0.1873561), wk = 0.0029240 k( 239) = ( -0.3329978 0.5779338 0.2060917), wk = 0.0029240 k( 240) = ( -0.3329978 0.5779338 0.2248273), wk = 0.0029240 k( 241) = ( -0.3329978 0.5779338 0.2435629), wk = 0.0029240 k( 242) = ( -0.3329978 0.5779338 0.2622985), wk = 0.0029240 k( 243) = ( -0.3329978 0.5779338 0.2810341), wk = 0.0029240 k( 244) = ( -0.3329978 0.5779338 0.2997697), wk = 0.0029240 k( 245) = ( -0.3329978 0.5779338 0.3185053), wk = 0.0029240 k( 246) = ( -0.3329978 0.5779338 0.3372409), wk = 0.0029240 k( 247) = ( -0.3329978 0.5779338 0.3559765), wk = 0.0029240 k( 248) = ( -0.3329978 0.5779338 0.3747121), wk = 0.0029240 k( 249) = ( -0.3329978 0.5779338 0.3934477), wk = 0.0029240 k( 250) = ( -0.3329978 0.5779338 0.4121833), wk = 0.0029240 k( 251) = ( -0.3329978 0.5779338 0.4309189), wk = 0.0029240 k( 252) = ( -0.3329978 0.5779338 0.4496546), wk = 0.0029240 k( 253) = ( -0.3329978 0.5779338 0.4683902), wk = 0.0029240 k( 254) = ( -0.3329978 0.5779338 0.4871258), wk = 0.0029240 k( 255) = ( -0.3329978 0.5779338 0.5058614), wk = 0.0029240 k( 256) = ( -0.3329978 0.5779338 0.5245970), wk = 0.0029240 k( 257) = ( -0.3329978 0.5779338 0.5433326), wk = 0.0029240 k( 258) = ( -0.3329978 0.5779338 0.5620682), wk = 0.0029240 k( 259) = ( -0.3329978 0.5779338 0.5808038), wk = 0.0029240 k( 260) = ( -0.3329978 0.5779338 0.5808038), wk = 0.0029240 k( 261) = ( -0.3422757 0.5618316 0.5808038), wk = 0.0029240 k( 262) = ( -0.3515536 0.5457293 0.5808038), wk = 0.0029240 k( 263) = ( -0.3608315 0.5296270 0.5808038), wk = 0.0029240 k( 264) = ( -0.3701094 0.5135248 0.5808038), wk = 0.0029240 k( 265) = ( -0.3793873 0.4974226 0.5808038), wk = 0.0029240 k( 266) = ( -0.3886652 0.4813203 0.5808038), wk = 0.0029240 k( 267) = ( -0.3979431 0.4652181 0.5808038), wk = 0.0029240 k( 268) = ( -0.4072210 0.4491158 0.5808038), wk = 0.0029240 k( 269) = ( -0.4164989 0.4330136 0.5808038), wk = 0.0029240 k( 270) = ( -0.4257768 0.4169113 0.5808038), wk = 0.0029240 k( 271) = ( -0.4350547 0.4008091 0.5808038), wk = 0.0029240 k( 272) = ( -0.4443326 0.3847068 0.5808038), wk = 0.0029240 k( 273) = ( -0.4536105 0.3686046 0.5808038), wk = 0.0029240 k( 274) = ( -0.4628884 0.3525024 0.5808038), wk = 0.0029240 k( 275) = ( -0.4721663 0.3364001 0.5808038), wk = 0.0029240 k( 276) = ( -0.4814442 0.3202979 0.5808038), wk = 0.0029240 k( 277) = ( -0.4907221 0.3041956 0.5808038), wk = 0.0029240 k( 278) = ( -0.5000000 0.2880934 0.5808038), wk = 0.0029240 k( 279) = ( -0.5000000 0.2880934 0.5808038), wk = 0.0029240 k( 280) = ( -0.5000000 0.2880934 0.5620682), wk = 0.0029240 k( 281) = ( -0.5000000 0.2880934 0.5433326), wk = 0.0029240 k( 282) = ( -0.5000000 0.2880934 0.5245970), wk = 0.0029240 k( 283) = ( -0.5000000 0.2880934 0.5058614), wk = 0.0029240 k( 284) = ( -0.5000000 0.2880934 0.4871258), wk = 0.0029240 k( 285) = ( -0.5000000 0.2880934 0.4683902), wk = 0.0029240 k( 286) = ( -0.5000000 0.2880934 0.4496546), wk = 0.0029240 k( 287) = ( -0.5000000 0.2880934 0.4309189), wk = 0.0029240 k( 288) = ( -0.5000000 0.2880934 0.4121833), wk = 0.0029240 k( 289) = ( -0.5000000 0.2880934 0.3934477), wk = 0.0029240 k( 290) = ( -0.5000000 0.2880934 0.3747121), wk = 0.0029240 k( 291) = ( -0.5000000 0.2880934 0.3559765), wk = 0.0029240 k( 292) = ( -0.5000000 0.2880934 0.3372409), wk = 0.0029240 k( 293) = ( -0.5000000 0.2880934 0.3185053), wk = 0.0029240 k( 294) = ( -0.5000000 0.2880934 0.2997697), wk = 0.0029240 k( 295) = ( -0.5000000 0.2880934 0.2810341), wk = 0.0029240 k( 296) = ( -0.5000000 0.2880934 0.2622985), wk = 0.0029240 k( 297) = ( -0.5000000 0.2880934 0.2435629), wk = 0.0029240 k( 298) = ( -0.5000000 0.2880934 0.2248273), wk = 0.0029240 k( 299) = ( -0.5000000 0.2880934 0.2060917), wk = 0.0029240 k( 300) = ( -0.5000000 0.2880934 0.1873561), wk = 0.0029240 k( 301) = ( -0.5000000 0.2880934 0.1686205), wk = 0.0029240 k( 302) = ( -0.5000000 0.2880934 0.1498849), wk = 0.0029240 k( 303) = ( -0.5000000 0.2880934 0.1311493), wk = 0.0029240 k( 304) = ( -0.5000000 0.2880934 0.1124136), wk = 0.0029240 k( 305) = ( -0.5000000 0.2880934 0.0936780), wk = 0.0029240 k( 306) = ( -0.5000000 0.2880934 0.0749424), wk = 0.0029240 k( 307) = ( -0.5000000 0.2880934 0.0562068), wk = 0.0029240 k( 308) = ( -0.5000000 0.2880934 0.0374712), wk = 0.0029240 k( 309) = ( -0.5000000 0.2880934 0.0187356), wk = 0.0029240 k( 310) = ( -0.5000000 0.2880934 0.0000000), wk = 0.0029240 k( 311) = ( 0.0000000 0.0000000 0.5808038), wk = 0.0029240 k( 312) = ( -0.0161290 0.0092933 0.5808038), wk = 0.0029240 k( 313) = ( -0.0322581 0.0185867 0.5808038), wk = 0.0029240 k( 314) = ( -0.0483871 0.0278800 0.5808038), wk = 0.0029240 k( 315) = ( -0.0645161 0.0371733 0.5808038), wk = 0.0029240 k( 316) = ( -0.0806452 0.0464667 0.5808038), wk = 0.0029240 k( 317) = ( -0.0967742 0.0557600 0.5808038), wk = 0.0029240 k( 318) = ( -0.1129032 0.0650533 0.5808038), wk = 0.0029240 k( 319) = ( -0.1290323 0.0743467 0.5808038), wk = 0.0029240 k( 320) = ( -0.1451613 0.0836400 0.5808038), wk = 0.0029240 k( 321) = ( -0.1612903 0.0929333 0.5808038), wk = 0.0029240 k( 322) = ( -0.1774194 0.1022267 0.5808038), wk = 0.0029240 k( 323) = ( -0.1935484 0.1115200 0.5808038), wk = 0.0029240 k( 324) = ( -0.2096774 0.1208134 0.5808038), wk = 0.0029240 k( 325) = ( -0.2258064 0.1301067 0.5808038), wk = 0.0029240 k( 326) = ( -0.2419355 0.1394000 0.5808038), wk = 0.0029240 k( 327) = ( -0.2580645 0.1486934 0.5808038), wk = 0.0029240 k( 328) = ( -0.2741936 0.1579867 0.5808038), wk = 0.0029240 k( 329) = ( -0.2903226 0.1672800 0.5808038), wk = 0.0029240 k( 330) = ( -0.3064516 0.1765734 0.5808038), wk = 0.0029240 k( 331) = ( -0.3225807 0.1858667 0.5808038), wk = 0.0029240 k( 332) = ( -0.3387097 0.1951600 0.5808038), wk = 0.0029240 k( 333) = ( -0.3548387 0.2044534 0.5808038), wk = 0.0029240 k( 334) = ( -0.3709677 0.2137467 0.5808038), wk = 0.0029240 k( 335) = ( -0.3870968 0.2230400 0.5808038), wk = 0.0029240 k( 336) = ( -0.4032258 0.2323334 0.5808038), wk = 0.0029240 k( 337) = ( -0.4193548 0.2416267 0.5808038), wk = 0.0029240 k( 338) = ( -0.4354839 0.2509200 0.5808038), wk = 0.0029240 k( 339) = ( -0.4516129 0.2602134 0.5808038), wk = 0.0029240 k( 340) = ( -0.4677419 0.2695067 0.5808038), wk = 0.0029240 k( 341) = ( -0.4838710 0.2788000 0.5808038), wk = 0.0029240 k( 342) = ( -0.5000000 0.2880934 0.5808038), wk = 0.0029240 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029240 k( 2) = ( 0.0092499 0.0092499 -0.0000000), wk = 0.0029240 k( 3) = ( 0.0184999 0.0184999 -0.0000000), wk = 0.0029240 k( 4) = ( 0.0277498 0.0277498 -0.0000000), wk = 0.0029240 k( 5) = ( 0.0369997 0.0369997 0.0000000), wk = 0.0029240 k( 6) = ( 0.0462497 0.0462497 0.0000000), wk = 0.0029240 k( 7) = ( 0.0554996 0.0554996 0.0000000), wk = 0.0029240 k( 8) = ( 0.0647496 0.0647496 -0.0000000), wk = 0.0029240 k( 9) = ( 0.0739995 0.0739995 -0.0000000), wk = 0.0029240 k( 10) = ( 0.0832495 0.0832495 -0.0000000), wk = 0.0029240 k( 11) = ( 0.0924994 0.0924994 0.0000000), wk = 0.0029240 k( 12) = ( 0.1017493 0.1017493 -0.0000000), wk = 0.0029240 k( 13) = ( 0.1109993 0.1109993 0.0000000), wk = 0.0029240 k( 14) = ( 0.1202492 0.1202492 -0.0000000), wk = 0.0029240 k( 15) = ( 0.1294991 0.1294991 -0.0000000), wk = 0.0029240 k( 16) = ( 0.1387491 0.1387491 0.0000000), wk = 0.0029240 k( 17) = ( 0.1479990 0.1479990 -0.0000000), wk = 0.0029240 k( 18) = ( 0.1572490 0.1572490 -0.0000000), wk = 0.0029240 k( 19) = ( 0.1664989 0.1664989 -0.0000000), wk = 0.0029240 k( 20) = ( 0.1757488 0.1757488 0.0000000), wk = 0.0029240 k( 21) = ( 0.1849988 0.1849988 -0.0000000), wk = 0.0029240 k( 22) = ( 0.1942487 0.1942487 -0.0000000), wk = 0.0029240 k( 23) = ( 0.2034987 0.2034987 0.0000000), wk = 0.0029240 k( 24) = ( 0.2127486 0.2127486 -0.0000000), wk = 0.0029240 k( 25) = ( 0.2219985 0.2219985 -0.0000000), wk = 0.0029240 k( 26) = ( 0.2312485 0.2312485 0.0000000), wk = 0.0029240 k( 27) = ( 0.2404984 0.2404984 -0.0000000), wk = 0.0029240 k( 28) = ( 0.2497484 0.2497484 -0.0000000), wk = 0.0029240 k( 29) = ( 0.2589983 0.2589983 -0.0000000), wk = 0.0029240 k( 30) = ( 0.2682482 0.2682482 0.0000000), wk = 0.0029240 k( 31) = ( 0.2774982 0.2774982 0.0000000), wk = 0.0029240 k( 32) = ( 0.2867481 0.2867481 0.0000000), wk = 0.0029240 k( 33) = ( 0.2959980 0.2959980 -0.0000000), wk = 0.0029240 k( 34) = ( 0.3052480 0.3052480 0.0000000), wk = 0.0029240 k( 35) = ( 0.3144979 0.3144979 -0.0000000), wk = 0.0029240 k( 36) = ( 0.3237479 0.3237479 -0.0000000), wk = 0.0029240 k( 37) = ( 0.3329978 0.3329978 -0.0000000), wk = 0.0029240 k( 38) = ( 0.3329978 0.3329978 -0.0000000), wk = 0.0029240 k( 39) = ( 0.3144979 0.3422757 0.0000000), wk = 0.0029240 k( 40) = ( 0.2959980 0.3515536 0.0000000), wk = 0.0029240 k( 41) = ( 0.2774982 0.3608315 0.0000000), wk = 0.0029240 k( 42) = ( 0.2589983 0.3701094 -0.0000000), wk = 0.0029240 k( 43) = ( 0.2404984 0.3793873 0.0000000), wk = 0.0029240 k( 44) = ( 0.2219985 0.3886652 -0.0000000), wk = 0.0029240 k( 45) = ( 0.2034987 0.3979431 -0.0000000), wk = 0.0029240 k( 46) = ( 0.1849988 0.4072210 0.0000000), wk = 0.0029240 k( 47) = ( 0.1664989 0.4164989 -0.0000000), wk = 0.0029240 k( 48) = ( 0.1479990 0.4257768 -0.0000000), wk = 0.0029240 k( 49) = ( 0.1294991 0.4350547 0.0000000), wk = 0.0029240 k( 50) = ( 0.1109993 0.4443326 -0.0000000), wk = 0.0029240 k( 51) = ( 0.0924994 0.4536105 -0.0000000), wk = 0.0029240 k( 52) = ( 0.0739995 0.4628884 -0.0000000), wk = 0.0029240 k( 53) = ( 0.0554996 0.4721663 0.0000000), wk = 0.0029240 k( 54) = ( 0.0369997 0.4814442 -0.0000000), wk = 0.0029240 k( 55) = ( 0.0184999 0.4907221 0.0000000), wk = 0.0029240 k( 56) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029240 k( 57) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029240 k( 58) = ( 0.0000000 0.5000000 0.0161290), wk = 0.0029240 k( 59) = ( 0.0000000 0.5000000 0.0322581), wk = 0.0029240 k( 60) = ( 0.0000000 0.5000000 0.0483871), wk = 0.0029240 k( 61) = ( 0.0000000 0.5000000 0.0645161), wk = 0.0029240 k( 62) = ( 0.0000000 0.5000000 0.0806452), wk = 0.0029240 k( 63) = ( 0.0000000 0.5000000 0.0967742), wk = 0.0029240 k( 64) = ( 0.0000000 0.5000000 0.1129032), wk = 0.0029240 k( 65) = ( 0.0000000 0.5000000 0.1290323), wk = 0.0029240 k( 66) = ( 0.0000000 0.5000000 0.1451613), wk = 0.0029240 k( 67) = ( 0.0000000 0.5000000 0.1612903), wk = 0.0029240 k( 68) = ( 0.0000000 0.5000000 0.1774194), wk = 0.0029240 k( 69) = ( 0.0000000 0.5000000 0.1935484), wk = 0.0029240 k( 70) = ( 0.0000000 0.5000000 0.2096774), wk = 0.0029240 k( 71) = ( 0.0000000 0.5000000 0.2258064), wk = 0.0029240 k( 72) = ( 0.0000000 0.5000000 0.2419355), wk = 0.0029240 k( 73) = ( 0.0000000 0.5000000 0.2580645), wk = 0.0029240 k( 74) = ( 0.0000000 0.5000000 0.2741936), wk = 0.0029240 k( 75) = ( 0.0000000 0.5000000 0.2903226), wk = 0.0029240 k( 76) = ( 0.0000000 0.5000000 0.3064516), wk = 0.0029240 k( 77) = ( 0.0000000 0.5000000 0.3225807), wk = 0.0029240 k( 78) = ( 0.0000000 0.5000000 0.3387097), wk = 0.0029240 k( 79) = ( 0.0000000 0.5000000 0.3548387), wk = 0.0029240 k( 80) = ( 0.0000000 0.5000000 0.3709677), wk = 0.0029240 k( 81) = ( 0.0000000 0.5000000 0.3870968), wk = 0.0029240 k( 82) = ( 0.0000000 0.5000000 0.4032258), wk = 0.0029240 k( 83) = ( 0.0000000 0.5000000 0.4193548), wk = 0.0029240 k( 84) = ( 0.0000000 0.5000000 0.4354839), wk = 0.0029240 k( 85) = ( 0.0000000 0.5000000 0.4516129), wk = 0.0029240 k( 86) = ( 0.0000000 0.5000000 0.4677419), wk = 0.0029240 k( 87) = ( 0.0000000 0.5000000 0.4838710), wk = 0.0029240 k( 88) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029240 k( 89) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029240 k( 90) = ( 0.0184999 0.4907221 0.5000000), wk = 0.0029240 k( 91) = ( 0.0369997 0.4814442 0.5000000), wk = 0.0029240 k( 92) = ( 0.0554996 0.4721663 0.5000000), wk = 0.0029240 k( 93) = ( 0.0739995 0.4628884 0.5000000), wk = 0.0029240 k( 94) = ( 0.0924994 0.4536105 0.5000000), wk = 0.0029240 k( 95) = ( 0.1109993 0.4443326 0.5000000), wk = 0.0029240 k( 96) = ( 0.1294991 0.4350547 0.5000000), wk = 0.0029240 k( 97) = ( 0.1479990 0.4257768 0.5000000), wk = 0.0029240 k( 98) = ( 0.1664989 0.4164989 0.5000000), wk = 0.0029240 k( 99) = ( 0.1849988 0.4072210 0.5000000), wk = 0.0029240 k( 100) = ( 0.2034987 0.3979431 0.5000000), wk = 0.0029240 k( 101) = ( 0.2219985 0.3886652 0.5000000), wk = 0.0029240 k( 102) = ( 0.2404984 0.3793873 0.5000000), wk = 0.0029240 k( 103) = ( 0.2589983 0.3701094 0.5000000), wk = 0.0029240 k( 104) = ( 0.2774982 0.3608315 0.5000000), wk = 0.0029240 k( 105) = ( 0.2959980 0.3515536 0.5000000), wk = 0.0029240 k( 106) = ( 0.3144979 0.3422757 0.5000000), wk = 0.0029240 k( 107) = ( 0.3329978 0.3329978 0.5000000), wk = 0.0029240 k( 108) = ( 0.3329978 0.3329978 0.5000000), wk = 0.0029240 k( 109) = ( 0.3237479 0.3237479 0.5000000), wk = 0.0029240 k( 110) = ( 0.3144979 0.3144979 0.5000000), wk = 0.0029240 k( 111) = ( 0.3052480 0.3052480 0.5000000), wk = 0.0029240 k( 112) = ( 0.2959980 0.2959980 0.5000000), wk = 0.0029240 k( 113) = ( 0.2867481 0.2867481 0.5000000), wk = 0.0029240 k( 114) = ( 0.2774982 0.2774982 0.5000000), wk = 0.0029240 k( 115) = ( 0.2682482 0.2682482 0.5000000), wk = 0.0029240 k( 116) = ( 0.2589983 0.2589983 0.5000000), wk = 0.0029240 k( 117) = ( 0.2497484 0.2497484 0.5000000), wk = 0.0029240 k( 118) = ( 0.2404984 0.2404984 0.5000000), wk = 0.0029240 k( 119) = ( 0.2312485 0.2312485 0.5000000), wk = 0.0029240 k( 120) = ( 0.2219985 0.2219985 0.5000000), wk = 0.0029240 k( 121) = ( 0.2127486 0.2127486 0.5000000), wk = 0.0029240 k( 122) = ( 0.2034987 0.2034987 0.5000000), wk = 0.0029240 k( 123) = ( 0.1942487 0.1942487 0.5000000), wk = 0.0029240 k( 124) = ( 0.1849988 0.1849988 0.5000000), wk = 0.0029240 k( 125) = ( 0.1757488 0.1757488 0.5000000), wk = 0.0029240 k( 126) = ( 0.1664989 0.1664989 0.5000000), wk = 0.0029240 k( 127) = ( 0.1572490 0.1572490 0.5000000), wk = 0.0029240 k( 128) = ( 0.1479990 0.1479990 0.5000000), wk = 0.0029240 k( 129) = ( 0.1387491 0.1387491 0.5000000), wk = 0.0029240 k( 130) = ( 0.1294991 0.1294991 0.5000000), wk = 0.0029240 k( 131) = ( 0.1202492 0.1202492 0.5000000), wk = 0.0029240 k( 132) = ( 0.1109993 0.1109993 0.5000000), wk = 0.0029240 k( 133) = ( 0.1017493 0.1017493 0.5000000), wk = 0.0029240 k( 134) = ( 0.0924994 0.0924994 0.5000000), wk = 0.0029240 k( 135) = ( 0.0832495 0.0832495 0.5000000), wk = 0.0029240 k( 136) = ( 0.0739995 0.0739995 0.5000000), wk = 0.0029240 k( 137) = ( 0.0647496 0.0647496 0.5000000), wk = 0.0029240 k( 138) = ( 0.0554996 0.0554996 0.5000000), wk = 0.0029240 k( 139) = ( 0.0462497 0.0462497 0.5000000), wk = 0.0029240 k( 140) = ( 0.0369997 0.0369997 0.5000000), wk = 0.0029240 k( 141) = ( 0.0277498 0.0277498 0.5000000), wk = 0.0029240 k( 142) = ( 0.0184999 0.0184999 0.5000000), wk = 0.0029240 k( 143) = ( 0.0092499 0.0092499 0.5000000), wk = 0.0029240 k( 144) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029240 k( 145) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029240 k( 146) = ( 0.0000000 0.0000000 0.4838710), wk = 0.0029240 k( 147) = ( 0.0000000 0.0000000 0.4677419), wk = 0.0029240 k( 148) = ( 0.0000000 0.0000000 0.4516129), wk = 0.0029240 k( 149) = ( 0.0000000 0.0000000 0.4354839), wk = 0.0029240 k( 150) = ( 0.0000000 0.0000000 0.4193548), wk = 0.0029240 k( 151) = ( 0.0000000 0.0000000 0.4032258), wk = 0.0029240 k( 152) = ( 0.0000000 0.0000000 0.3870968), wk = 0.0029240 k( 153) = ( 0.0000000 0.0000000 0.3709677), wk = 0.0029240 k( 154) = ( 0.0000000 0.0000000 0.3548387), wk = 0.0029240 k( 155) = ( 0.0000000 0.0000000 0.3387097), wk = 0.0029240 k( 156) = ( 0.0000000 0.0000000 0.3225807), wk = 0.0029240 k( 157) = ( 0.0000000 0.0000000 0.3064516), wk = 0.0029240 k( 158) = ( 0.0000000 0.0000000 0.2903226), wk = 0.0029240 k( 159) = ( 0.0000000 0.0000000 0.2741936), wk = 0.0029240 k( 160) = ( 0.0000000 0.0000000 0.2580645), wk = 0.0029240 k( 161) = ( 0.0000000 0.0000000 0.2419355), wk = 0.0029240 k( 162) = ( 0.0000000 0.0000000 0.2258065), wk = 0.0029240 k( 163) = ( 0.0000000 0.0000000 0.2096774), wk = 0.0029240 k( 164) = ( 0.0000000 0.0000000 0.1935484), wk = 0.0029240 k( 165) = ( 0.0000000 0.0000000 0.1774194), wk = 0.0029240 k( 166) = ( 0.0000000 0.0000000 0.1612903), wk = 0.0029240 k( 167) = ( 0.0000000 0.0000000 0.1451613), wk = 0.0029240 k( 168) = ( 0.0000000 0.0000000 0.1290323), wk = 0.0029240 k( 169) = ( 0.0000000 0.0000000 0.1129032), wk = 0.0029240 k( 170) = ( 0.0000000 0.0000000 0.0967742), wk = 0.0029240 k( 171) = ( 0.0000000 0.0000000 0.0806452), wk = 0.0029240 k( 172) = ( 0.0000000 0.0000000 0.0645161), wk = 0.0029240 k( 173) = ( 0.0000000 0.0000000 0.0483871), wk = 0.0029240 k( 174) = ( 0.0000000 0.0000000 0.0322581), wk = 0.0029240 k( 175) = ( 0.0000000 0.0000000 0.0161290), wk = 0.0029240 k( 176) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029240 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029240 k( 178) = ( -0.0161290 0.0161290 0.0000000), wk = 0.0029240 k( 179) = ( -0.0322581 0.0322581 0.0000000), wk = 0.0029240 k( 180) = ( -0.0483871 0.0483871 0.0000000), wk = 0.0029240 k( 181) = ( -0.0645161 0.0645161 -0.0000000), wk = 0.0029240 k( 182) = ( -0.0806452 0.0806452 0.0000000), wk = 0.0029240 k( 183) = ( -0.0967742 0.0967742 0.0000000), wk = 0.0029240 k( 184) = ( -0.1129032 0.1129032 0.0000000), wk = 0.0029240 k( 185) = ( -0.1290323 0.1290323 -0.0000000), wk = 0.0029240 k( 186) = ( -0.1451613 0.1451613 0.0000000), wk = 0.0029240 k( 187) = ( -0.1612903 0.1612903 0.0000000), wk = 0.0029240 k( 188) = ( -0.1774194 0.1774194 0.0000000), wk = 0.0029240 k( 189) = ( -0.1935484 0.1935484 0.0000000), wk = 0.0029240 k( 190) = ( -0.2096774 0.2096774 0.0000000), wk = 0.0029240 k( 191) = ( -0.2258064 0.2258064 0.0000000), wk = 0.0029240 k( 192) = ( -0.2419355 0.2419355 -0.0000000), wk = 0.0029240 k( 193) = ( -0.2580645 0.2580645 -0.0000000), wk = 0.0029240 k( 194) = ( -0.2741936 0.2741936 0.0000000), wk = 0.0029240 k( 195) = ( -0.2903226 0.2903226 0.0000000), wk = 0.0029240 k( 196) = ( -0.3064516 0.3064516 0.0000000), wk = 0.0029240 k( 197) = ( -0.3225807 0.3225807 0.0000000), wk = 0.0029240 k( 198) = ( -0.3387097 0.3387097 0.0000000), wk = 0.0029240 k( 199) = ( -0.3548387 0.3548387 -0.0000000), wk = 0.0029240 k( 200) = ( -0.3709677 0.3709677 -0.0000000), wk = 0.0029240 k( 201) = ( -0.3870968 0.3870968 0.0000000), wk = 0.0029240 k( 202) = ( -0.4032258 0.4032258 0.0000000), wk = 0.0029240 k( 203) = ( -0.4193548 0.4193548 0.0000000), wk = 0.0029240 k( 204) = ( -0.4354839 0.4354839 0.0000000), wk = 0.0029240 k( 205) = ( -0.4516129 0.4516129 0.0000000), wk = 0.0029240 k( 206) = ( -0.4677419 0.4677419 0.0000000), wk = 0.0029240 k( 207) = ( -0.4838710 0.4838710 0.0000000), wk = 0.0029240 k( 208) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0029240 k( 209) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0029240 k( 210) = ( -0.4907221 0.5092779 0.0000000), wk = 0.0029240 k( 211) = ( -0.4814442 0.5185558 0.0000000), wk = 0.0029240 k( 212) = ( -0.4721663 0.5278337 -0.0000000), wk = 0.0029240 k( 213) = ( -0.4628884 0.5371116 0.0000000), wk = 0.0029240 k( 214) = ( -0.4536105 0.5463895 0.0000000), wk = 0.0029240 k( 215) = ( -0.4443326 0.5556674 0.0000000), wk = 0.0029240 k( 216) = ( -0.4350547 0.5649453 0.0000000), wk = 0.0029240 k( 217) = ( -0.4257768 0.5742232 0.0000000), wk = 0.0029240 k( 218) = ( -0.4164989 0.5835011 0.0000000), wk = 0.0029240 k( 219) = ( -0.4072210 0.5927790 0.0000000), wk = 0.0029240 k( 220) = ( -0.3979431 0.6020569 0.0000000), wk = 0.0029240 k( 221) = ( -0.3886652 0.6113348 0.0000000), wk = 0.0029240 k( 222) = ( -0.3793873 0.6206127 0.0000000), wk = 0.0029240 k( 223) = ( -0.3701094 0.6298906 0.0000000), wk = 0.0029240 k( 224) = ( -0.3608315 0.6391685 0.0000000), wk = 0.0029240 k( 225) = ( -0.3515536 0.6484464 0.0000000), wk = 0.0029240 k( 226) = ( -0.3422757 0.6577243 -0.0000000), wk = 0.0029240 k( 227) = ( -0.3329978 0.6670022 -0.0000000), wk = 0.0029240 k( 228) = ( -0.3329978 0.6670022 -0.0000000), wk = 0.0029240 k( 229) = ( -0.3329978 0.6670022 0.0161290), wk = 0.0029240 k( 230) = ( -0.3329978 0.6670022 0.0322581), wk = 0.0029240 k( 231) = ( -0.3329978 0.6670022 0.0483871), wk = 0.0029240 k( 232) = ( -0.3329978 0.6670022 0.0645161), wk = 0.0029240 k( 233) = ( -0.3329978 0.6670022 0.0806452), wk = 0.0029240 k( 234) = ( -0.3329978 0.6670022 0.0967742), wk = 0.0029240 k( 235) = ( -0.3329978 0.6670022 0.1129032), wk = 0.0029240 k( 236) = ( -0.3329978 0.6670022 0.1290323), wk = 0.0029240 k( 237) = ( -0.3329978 0.6670022 0.1451613), wk = 0.0029240 k( 238) = ( -0.3329978 0.6670022 0.1612903), wk = 0.0029240 k( 239) = ( -0.3329978 0.6670022 0.1774194), wk = 0.0029240 k( 240) = ( -0.3329978 0.6670022 0.1935484), wk = 0.0029240 k( 241) = ( -0.3329978 0.6670022 0.2096774), wk = 0.0029240 k( 242) = ( -0.3329978 0.6670022 0.2258064), wk = 0.0029240 k( 243) = ( -0.3329978 0.6670022 0.2419355), wk = 0.0029240 k( 244) = ( -0.3329978 0.6670022 0.2580645), wk = 0.0029240 k( 245) = ( -0.3329978 0.6670022 0.2741936), wk = 0.0029240 k( 246) = ( -0.3329978 0.6670022 0.2903226), wk = 0.0029240 k( 247) = ( -0.3329978 0.6670022 0.3064516), wk = 0.0029240 k( 248) = ( -0.3329978 0.6670022 0.3225807), wk = 0.0029240 k( 249) = ( -0.3329978 0.6670022 0.3387097), wk = 0.0029240 k( 250) = ( -0.3329978 0.6670022 0.3548387), wk = 0.0029240 k( 251) = ( -0.3329978 0.6670022 0.3709677), wk = 0.0029240 k( 252) = ( -0.3329978 0.6670022 0.3870968), wk = 0.0029240 k( 253) = ( -0.3329978 0.6670022 0.4032258), wk = 0.0029240 k( 254) = ( -0.3329978 0.6670022 0.4193548), wk = 0.0029240 k( 255) = ( -0.3329978 0.6670022 0.4354839), wk = 0.0029240 k( 256) = ( -0.3329978 0.6670022 0.4516129), wk = 0.0029240 k( 257) = ( -0.3329978 0.6670022 0.4677419), wk = 0.0029240 k( 258) = ( -0.3329978 0.6670022 0.4838710), wk = 0.0029240 k( 259) = ( -0.3329978 0.6670022 0.5000000), wk = 0.0029240 k( 260) = ( -0.3329978 0.6670022 0.5000000), wk = 0.0029240 k( 261) = ( -0.3422757 0.6577243 0.5000000), wk = 0.0029240 k( 262) = ( -0.3515536 0.6484464 0.5000000), wk = 0.0029240 k( 263) = ( -0.3608315 0.6391685 0.5000000), wk = 0.0029240 k( 264) = ( -0.3701094 0.6298906 0.5000000), wk = 0.0029240 k( 265) = ( -0.3793873 0.6206127 0.5000000), wk = 0.0029240 k( 266) = ( -0.3886652 0.6113348 0.5000000), wk = 0.0029240 k( 267) = ( -0.3979431 0.6020569 0.5000000), wk = 0.0029240 k( 268) = ( -0.4072210 0.5927790 0.5000000), wk = 0.0029240 k( 269) = ( -0.4164989 0.5835011 0.5000000), wk = 0.0029240 k( 270) = ( -0.4257768 0.5742232 0.5000000), wk = 0.0029240 k( 271) = ( -0.4350547 0.5649453 0.5000000), wk = 0.0029240 k( 272) = ( -0.4443326 0.5556674 0.5000000), wk = 0.0029240 k( 273) = ( -0.4536105 0.5463895 0.5000000), wk = 0.0029240 k( 274) = ( -0.4628884 0.5371116 0.5000000), wk = 0.0029240 k( 275) = ( -0.4721663 0.5278337 0.5000000), wk = 0.0029240 k( 276) = ( -0.4814442 0.5185558 0.5000000), wk = 0.0029240 k( 277) = ( -0.4907221 0.5092779 0.5000000), wk = 0.0029240 k( 278) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0029240 k( 279) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0029240 k( 280) = ( -0.5000000 0.5000000 0.4838710), wk = 0.0029240 k( 281) = ( -0.5000000 0.5000000 0.4677419), wk = 0.0029240 k( 282) = ( -0.5000000 0.5000000 0.4516129), wk = 0.0029240 k( 283) = ( -0.5000000 0.5000000 0.4354839), wk = 0.0029240 k( 284) = ( -0.5000000 0.5000000 0.4193548), wk = 0.0029240 k( 285) = ( -0.5000000 0.5000000 0.4032258), wk = 0.0029240 k( 286) = ( -0.5000000 0.5000000 0.3870968), wk = 0.0029240 k( 287) = ( -0.5000000 0.5000000 0.3709677), wk = 0.0029240 k( 288) = ( -0.5000000 0.5000000 0.3548387), wk = 0.0029240 k( 289) = ( -0.5000000 0.5000000 0.3387097), wk = 0.0029240 k( 290) = ( -0.5000000 0.5000000 0.3225807), wk = 0.0029240 k( 291) = ( -0.5000000 0.5000000 0.3064516), wk = 0.0029240 k( 292) = ( -0.5000000 0.5000000 0.2903226), wk = 0.0029240 k( 293) = ( -0.5000000 0.5000000 0.2741936), wk = 0.0029240 k( 294) = ( -0.5000000 0.5000000 0.2580645), wk = 0.0029240 k( 295) = ( -0.5000000 0.5000000 0.2419355), wk = 0.0029240 k( 296) = ( -0.5000000 0.5000000 0.2258065), wk = 0.0029240 k( 297) = ( -0.5000000 0.5000000 0.2096774), wk = 0.0029240 k( 298) = ( -0.5000000 0.5000000 0.1935484), wk = 0.0029240 k( 299) = ( -0.5000000 0.5000000 0.1774194), wk = 0.0029240 k( 300) = ( -0.5000000 0.5000000 0.1612903), wk = 0.0029240 k( 301) = ( -0.5000000 0.5000000 0.1451613), wk = 0.0029240 k( 302) = ( -0.5000000 0.5000000 0.1290323), wk = 0.0029240 k( 303) = ( -0.5000000 0.5000000 0.1129032), wk = 0.0029240 k( 304) = ( -0.5000000 0.5000000 0.0967742), wk = 0.0029240 k( 305) = ( -0.5000000 0.5000000 0.0806452), wk = 0.0029240 k( 306) = ( -0.5000000 0.5000000 0.0645161), wk = 0.0029240 k( 307) = ( -0.5000000 0.5000000 0.0483871), wk = 0.0029240 k( 308) = ( -0.5000000 0.5000000 0.0322581), wk = 0.0029240 k( 309) = ( -0.5000000 0.5000000 0.0161290), wk = 0.0029240 k( 310) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0029240 k( 311) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029240 k( 312) = ( -0.0161290 0.0161290 0.5000000), wk = 0.0029240 k( 313) = ( -0.0322581 0.0322581 0.5000000), wk = 0.0029240 k( 314) = ( -0.0483871 0.0483871 0.5000000), wk = 0.0029240 k( 315) = ( -0.0645161 0.0645161 0.5000000), wk = 0.0029240 k( 316) = ( -0.0806452 0.0806452 0.5000000), wk = 0.0029240 k( 317) = ( -0.0967742 0.0967742 0.5000000), wk = 0.0029240 k( 318) = ( -0.1129032 0.1129032 0.5000000), wk = 0.0029240 k( 319) = ( -0.1290323 0.1290323 0.5000000), wk = 0.0029240 k( 320) = ( -0.1451613 0.1451613 0.5000000), wk = 0.0029240 k( 321) = ( -0.1612903 0.1612903 0.5000000), wk = 0.0029240 k( 322) = ( -0.1774194 0.1774194 0.5000000), wk = 0.0029240 k( 323) = ( -0.1935484 0.1935484 0.5000000), wk = 0.0029240 k( 324) = ( -0.2096774 0.2096774 0.5000000), wk = 0.0029240 k( 325) = ( -0.2258064 0.2258064 0.5000000), wk = 0.0029240 k( 326) = ( -0.2419355 0.2419355 0.5000000), wk = 0.0029240 k( 327) = ( -0.2580645 0.2580645 0.5000000), wk = 0.0029240 k( 328) = ( -0.2741936 0.2741936 0.5000000), wk = 0.0029240 k( 329) = ( -0.2903226 0.2903226 0.5000000), wk = 0.0029240 k( 330) = ( -0.3064516 0.3064516 0.5000000), wk = 0.0029240 k( 331) = ( -0.3225807 0.3225807 0.5000000), wk = 0.0029240 k( 332) = ( -0.3387097 0.3387097 0.5000000), wk = 0.0029240 k( 333) = ( -0.3548387 0.3548387 0.5000000), wk = 0.0029240 k( 334) = ( -0.3709677 0.3709677 0.5000000), wk = 0.0029240 k( 335) = ( -0.3870968 0.3870968 0.5000000), wk = 0.0029240 k( 336) = ( -0.4032258 0.4032258 0.5000000), wk = 0.0029240 k( 337) = ( -0.4193548 0.4193548 0.5000000), wk = 0.0029240 k( 338) = ( -0.4354839 0.4354839 0.5000000), wk = 0.0029240 k( 339) = ( -0.4516129 0.4516129 0.5000000), wk = 0.0029240 k( 340) = ( -0.4677419 0.4677419 0.5000000), wk = 0.0029240 k( 341) = ( -0.4838710 0.4838710 0.5000000), wk = 0.0029240 k( 342) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0029240 Dense grid: 102051 G-vectors FFT dimensions: ( 64, 64, 60) Smooth grid: 100107 G-vectors FFT dimensions: ( 64, 64, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.67 Mb ( 708, 62) NL pseudopotentials 1.19 Mb ( 354, 220) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 2835) G-vector shells 0.01 Mb ( 1426) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.68 Mb ( 708, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each matrix 0.42 Mb ( 220, 2, 62) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CsCuO.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 6.1 secs Computing kpt #: 3 total cpu time spent up to now is 7.7 secs Computing kpt #: 4 total cpu time spent up to now is 9.2 secs Computing kpt #: 5 total cpu time spent up to now is 10.8 secs Computing kpt #: 6 total cpu time spent up to now is 12.7 secs Computing kpt #: 7 total cpu time spent up to now is 14.7 secs Computing kpt #: 8 total cpu time spent up to now is 17.5 secs Computing kpt #: 9 total cpu time spent up to now is 19.6 secs Computing kpt #: 10 total cpu time spent up to now is 21.4 secs Computing kpt #: 11 total cpu time spent up to now is 23.1 secs Computing kpt #: 12 total cpu time spent up to now is 24.7 secs Computing kpt #: 13 total cpu time spent up to now is 26.4 secs Computing kpt #: 14 total cpu time spent up to now is 27.9 secs Computing kpt #: 15 total cpu time spent up to now is 29.4 secs Computing kpt #: 16 total cpu time spent up to now is 31.0 secs Computing kpt #: 17 total cpu time spent up to now is 32.4 secs Computing kpt #: 18 total cpu time spent up to now is 33.8 secs Computing kpt #: 19 total cpu time spent up to now is 35.2 secs Computing kpt #: 20 total cpu time spent up to now is 36.6 secs Computing kpt #: 21 total cpu time spent up to now is 38.0 secs Computing kpt #: 22 total cpu time spent up to now is 39.3 secs Computing kpt #: 23 total cpu time spent up to now is 40.8 secs Computing kpt #: 24 total cpu time spent up to now is 42.2 secs Computing kpt #: 25 total cpu time spent up to now is 43.8 secs Computing kpt #: 26 total cpu time spent up to now is 45.3 secs Computing kpt #: 27 total cpu time spent up to now is 46.9 secs Computing kpt #: 28 total cpu time spent up to now is 48.4 secs Computing kpt #: 29 total cpu time spent up to now is 50.0 secs Computing kpt #: 30 total cpu time spent up to now is 51.6 secs Computing kpt #: 31 total cpu time spent up to now is 53.4 secs Computing kpt #: 32 total cpu time spent up to now is 55.2 secs Computing kpt #: 33 total cpu time spent up to now is 56.8 secs Computing kpt #: 34 total cpu time spent up to now is 58.6 secs Computing kpt #: 35 total cpu time spent up to now is 60.6 secs Computing kpt #: 36 total cpu time spent up to now is 62.4 secs Computing kpt #: 37 total cpu time spent up to now is 64.8 secs Computing kpt #: 38 total cpu time spent up to now is 67.1 secs Computing kpt #: 39 total cpu time spent up to now is 69.6 secs Computing kpt #: 40 total cpu time spent up to now is 71.7 secs Computing kpt #: 41 total cpu time spent up to now is 73.9 secs Computing kpt #: 42 total cpu time spent up to now is 75.8 secs Computing kpt #: 43 total cpu time spent up to now is 77.7 secs Computing kpt #: 44 total cpu time spent up to now is 79.5 secs Computing kpt #: 45 total cpu time spent up to now is 81.2 secs Computing kpt #: 46 total cpu time spent up to now is 82.8 secs Computing kpt #: 47 total cpu time spent up to now is 84.6 secs Computing kpt #: 48 total cpu time spent up to now is 86.4 secs Computing kpt #: 49 total cpu time spent up to now is 88.1 secs Computing kpt #: 50 total cpu time spent up to now is 89.7 secs Computing kpt #: 51 total cpu time spent up to now is 91.3 secs Computing kpt #: 52 total cpu time spent up to now is 92.9 secs Computing kpt #: 53 total cpu time spent up to now is 94.3 secs Computing kpt #: 54 total cpu time spent up to now is 95.8 secs Computing kpt #: 55 total cpu time spent up to now is 97.3 secs Computing kpt #: 56 total cpu time spent up to now is 98.7 secs Computing kpt #: 57 total cpu time spent up to now is 100.2 secs Computing kpt #: 58 total cpu time spent up to now is 101.6 secs Computing kpt #: 59 total cpu time spent up to now is 103.0 secs Computing kpt #: 60 total cpu time spent up to now is 104.5 secs Computing kpt #: 61 total cpu time spent up to now is 106.0 secs Computing kpt #: 62 total cpu time spent up to now is 107.4 secs Computing kpt #: 63 total cpu time spent up to now is 108.9 secs Computing kpt #: 64 total cpu time spent up to now is 110.4 secs Computing kpt #: 65 total cpu time spent up to now is 111.9 secs Computing kpt #: 66 total cpu time spent up to now is 113.4 secs Computing kpt #: 67 total cpu time spent up to now is 114.9 secs Computing kpt #: 68 total cpu time spent up to now is 116.4 secs Computing kpt #: 69 total cpu time spent up to now is 117.9 secs Computing kpt #: 70 total cpu time spent up to now is 119.4 secs Computing kpt #: 71 total cpu time spent up to now is 121.0 secs Computing kpt #: 72 total cpu time spent up to now is 122.5 secs Computing kpt #: 73 total cpu time spent up to now is 124.1 secs Computing kpt #: 74 total cpu time spent up to now is 125.7 secs Computing kpt #: 75 total cpu time spent up to now is 127.2 secs Computing kpt #: 76 total cpu time spent up to now is 128.8 secs Computing kpt #: 77 total cpu time spent up to now is 130.7 secs Computing kpt #: 78 total cpu time spent up to now is 132.6 secs Computing kpt #: 79 total cpu time spent up to now is 134.5 secs Computing kpt #: 80 total cpu time spent up to now is 136.8 secs Computing kpt #: 81 total cpu time spent up to now is 139.1 secs Computing kpt #: 82 total cpu time spent up to now is 141.6 secs Computing kpt #: 83 total cpu time spent up to now is 144.3 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 147.5 secs Computing kpt #: 85 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 150.7 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 154.1 secs Computing kpt #: 87 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 157.3 secs Computing kpt #: 88 total cpu time spent up to now is 159.5 secs Computing kpt #: 89 total cpu time spent up to now is 161.8 secs Computing kpt #: 90 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 165.1 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 168.4 secs Computing kpt #: 92 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 171.7 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 175.0 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 178.3 secs Computing kpt #: 95 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 181.5 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 184.8 secs Computing kpt #: 97 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 188.1 secs Computing kpt #: 98 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 191.4 secs Computing kpt #: 99 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 194.7 secs Computing kpt #: 100 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 197.9 secs Computing kpt #: 101 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 201.1 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 204.5 secs Computing kpt #: 103 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 207.7 secs Computing kpt #: 104 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 210.9 secs Computing kpt #: 105 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 214.1 secs Computing kpt #: 106 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 217.3 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 220.6 secs Computing kpt #: 108 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 223.8 secs Computing kpt #: 109 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 227.0 secs Computing kpt #: 110 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 230.2 secs Computing kpt #: 111 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 233.5 secs Computing kpt #: 112 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 236.7 secs Computing kpt #: 113 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 239.9 secs Computing kpt #: 114 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 243.2 secs Computing kpt #: 115 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 246.5 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 249.8 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 253.1 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 256.7 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 260.1 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 263.4 secs Computing kpt #: 121 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 266.6 secs Computing kpt #: 122 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 269.9 secs Computing kpt #: 123 total cpu time spent up to now is 273.0 secs Computing kpt #: 124 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 276.2 secs Computing kpt #: 125 total cpu time spent up to now is 279.0 secs Computing kpt #: 126 total cpu time spent up to now is 282.1 secs Computing kpt #: 127 total cpu time spent up to now is 285.3 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 288.6 secs Computing kpt #: 129 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 291.9 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 295.2 secs Computing kpt #: 131 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 298.4 secs Computing kpt #: 132 total cpu time spent up to now is 300.8 secs Computing kpt #: 133 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 304.1 secs Computing kpt #: 134 total cpu time spent up to now is 307.2 secs Computing kpt #: 135 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 310.4 secs Computing kpt #: 136 total cpu time spent up to now is 312.3 secs Computing kpt #: 137 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 315.4 secs Computing kpt #: 138 total cpu time spent up to now is 317.3 secs Computing kpt #: 139 total cpu time spent up to now is 319.2 secs Computing kpt #: 140 total cpu time spent up to now is 321.1 secs Computing kpt #: 141 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 324.3 secs Computing kpt #: 142 total cpu time spent up to now is 327.0 secs Computing kpt #: 143 total cpu time spent up to now is 329.4 secs Computing kpt #: 144 total cpu time spent up to now is 330.6 secs Computing kpt #: 145 total cpu time spent up to now is 331.9 secs Computing kpt #: 146 total cpu time spent up to now is 333.7 secs Computing kpt #: 147 total cpu time spent up to now is 335.3 secs Computing kpt #: 148 total cpu time spent up to now is 337.0 secs Computing kpt #: 149 total cpu time spent up to now is 338.6 secs Computing kpt #: 150 total cpu time spent up to now is 340.3 secs Computing kpt #: 151 total cpu time spent up to now is 342.1 secs Computing kpt #: 152 total cpu time spent up to now is 344.3 secs Computing kpt #: 153 total cpu time spent up to now is 346.3 secs Computing kpt #: 154 total cpu time spent up to now is 348.5 secs Computing kpt #: 155 total cpu time spent up to now is 351.1 secs Computing kpt #: 156 total cpu time spent up to now is 353.8 secs Computing kpt #: 157 total cpu time spent up to now is 356.5 secs Computing kpt #: 158 total cpu time spent up to now is 359.5 secs Computing kpt #: 159 total cpu time spent up to now is 361.6 secs Computing kpt #: 160 total cpu time spent up to now is 363.5 secs Computing kpt #: 161 total cpu time spent up to now is 365.3 secs Computing kpt #: 162 total cpu time spent up to now is 367.1 secs Computing kpt #: 163 total cpu time spent up to now is 368.7 secs Computing kpt #: 164 total cpu time spent up to now is 370.3 secs Computing kpt #: 165 total cpu time spent up to now is 371.9 secs Computing kpt #: 166 total cpu time spent up to now is 373.5 secs Computing kpt #: 167 total cpu time spent up to now is 375.1 secs Computing kpt #: 168 total cpu time spent up to now is 376.7 secs Computing kpt #: 169 total cpu time spent up to now is 378.4 secs Computing kpt #: 170 total cpu time spent up to now is 380.0 secs Computing kpt #: 171 total cpu time spent up to now is 382.0 secs Computing kpt #: 172 total cpu time spent up to now is 384.1 secs Computing kpt #: 173 total cpu time spent up to now is 386.0 secs Computing kpt #: 174 total cpu time spent up to now is 387.6 secs Computing kpt #: 175 total cpu time spent up to now is 389.1 secs Computing kpt #: 176 total cpu time spent up to now is 390.6 secs Computing kpt #: 177 total cpu time spent up to now is 392.2 secs Computing kpt #: 178 total cpu time spent up to now is 393.7 secs Computing kpt #: 179 total cpu time spent up to now is 395.3 secs Computing kpt #: 180 total cpu time spent up to now is 396.8 secs Computing kpt #: 181 total cpu time spent up to now is 398.4 secs Computing kpt #: 182 total cpu time spent up to now is 400.0 secs Computing kpt #: 183 total cpu time spent up to now is 401.6 secs Computing kpt #: 184 total cpu time spent up to now is 403.3 secs Computing kpt #: 185 total cpu time spent up to now is 405.2 secs Computing kpt #: 186 total cpu time spent up to now is 407.0 secs Computing kpt #: 187 total cpu time spent up to now is 410.0 secs Computing kpt #: 188 total cpu time spent up to now is 412.0 secs Computing kpt #: 189 total cpu time spent up to now is 414.0 secs Computing kpt #: 190 total cpu time spent up to now is 415.7 secs Computing kpt #: 191 total cpu time spent up to now is 417.4 secs Computing kpt #: 192 total cpu time spent up to now is 419.0 secs Computing kpt #: 193 total cpu time spent up to now is 420.7 secs Computing kpt #: 194 total cpu time spent up to now is 422.4 secs Computing kpt #: 195 total cpu time spent up to now is 424.0 secs Computing kpt #: 196 total cpu time spent up to now is 425.7 secs Computing kpt #: 197 total cpu time spent up to now is 427.3 secs Computing kpt #: 198 total cpu time spent up to now is 429.0 secs Computing kpt #: 199 total cpu time spent up to now is 430.7 secs Computing kpt #: 200 total cpu time spent up to now is 432.4 secs Computing kpt #: 201 total cpu time spent up to now is 434.1 secs Computing kpt #: 202 total cpu time spent up to now is 435.7 secs Computing kpt #: 203 total cpu time spent up to now is 437.4 secs Computing kpt #: 204 total cpu time spent up to now is 439.1 secs Computing kpt #: 205 total cpu time spent up to now is 440.9 secs Computing kpt #: 206 total cpu time spent up to now is 442.5 secs Computing kpt #: 207 total cpu time spent up to now is 444.3 secs Computing kpt #: 208 total cpu time spent up to now is 445.9 secs Computing kpt #: 209 total cpu time spent up to now is 447.6 secs Computing kpt #: 210 total cpu time spent up to now is 449.3 secs Computing kpt #: 211 total cpu time spent up to now is 451.1 secs Computing kpt #: 212 total cpu time spent up to now is 452.9 secs Computing kpt #: 213 total cpu time spent up to now is 454.5 secs Computing kpt #: 214 total cpu time spent up to now is 456.5 secs Computing kpt #: 215 total cpu time spent up to now is 458.3 secs Computing kpt #: 216 total cpu time spent up to now is 460.0 secs Computing kpt #: 217 total cpu time spent up to now is 461.7 secs Computing kpt #: 218 total cpu time spent up to now is 463.6 secs Computing kpt #: 219 total cpu time spent up to now is 465.5 secs Computing kpt #: 220 total cpu time spent up to now is 467.4 secs Computing kpt #: 221 total cpu time spent up to now is 469.0 secs Computing kpt #: 222 total cpu time spent up to now is 470.8 secs Computing kpt #: 223 total cpu time spent up to now is 472.7 secs Computing kpt #: 224 total cpu time spent up to now is 474.5 secs Computing kpt #: 225 total cpu time spent up to now is 476.5 secs Computing kpt #: 226 total cpu time spent up to now is 478.5 secs Computing kpt #: 227 total cpu time spent up to now is 481.1 secs Computing kpt #: 228 total cpu time spent up to now is 483.5 secs Computing kpt #: 229 total cpu time spent up to now is 485.5 secs Computing kpt #: 230 total cpu time spent up to now is 488.2 secs Computing kpt #: 231 total cpu time spent up to now is 490.4 secs Computing kpt #: 232 total cpu time spent up to now is 492.4 secs Computing kpt #: 233 total cpu time spent up to now is 494.4 secs Computing kpt #: 234 total cpu time spent up to now is 496.6 secs Computing kpt #: 235 total cpu time spent up to now is 498.5 secs Computing kpt #: 236 total cpu time spent up to now is 500.1 secs Computing kpt #: 237 total cpu time spent up to now is 501.8 secs Computing kpt #: 238 total cpu time spent up to now is 503.3 secs Computing kpt #: 239 total cpu time spent up to now is 504.8 secs Computing kpt #: 240 total cpu time spent up to now is 506.3 secs Computing kpt #: 241 total cpu time spent up to now is 507.8 secs Computing kpt #: 242 total cpu time spent up to now is 509.2 secs Computing kpt #: 243 total cpu time spent up to now is 510.7 secs Computing kpt #: 244 total cpu time spent up to now is 512.2 secs Computing kpt #: 245 total cpu time spent up to now is 513.6 secs Computing kpt #: 246 total cpu time spent up to now is 515.1 secs Computing kpt #: 247 total cpu time spent up to now is 516.6 secs Computing kpt #: 248 total cpu time spent up to now is 518.0 secs Computing kpt #: 249 total cpu time spent up to now is 519.5 secs Computing kpt #: 250 total cpu time spent up to now is 521.1 secs Computing kpt #: 251 total cpu time spent up to now is 522.7 secs Computing kpt #: 252 total cpu time spent up to now is 524.6 secs Computing kpt #: 253 total cpu time spent up to now is 527.7 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 531.0 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 534.3 secs Computing kpt #: 256 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 537.7 secs Computing kpt #: 257 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 541.0 secs Computing kpt #: 258 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 544.2 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 547.4 secs Computing kpt #: 260 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 550.8 secs Computing kpt #: 261 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 554.0 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 557.6 secs Computing kpt #: 263 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 560.9 secs Computing kpt #: 264 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 564.2 secs Computing kpt #: 265 total cpu time spent up to now is 566.7 secs Computing kpt #: 266 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 569.9 secs Computing kpt #: 267 total cpu time spent up to now is 572.4 secs Computing kpt #: 268 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 575.7 secs Computing kpt #: 269 total cpu time spent up to now is 578.8 secs Computing kpt #: 270 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 582.0 secs Computing kpt #: 271 total cpu time spent up to now is 584.8 secs Computing kpt #: 272 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 588.2 secs Computing kpt #: 273 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 591.4 secs Computing kpt #: 274 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 594.8 secs Computing kpt #: 275 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 598.0 secs Computing kpt #: 276 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 601.3 secs Computing kpt #: 277 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 604.7 secs Computing kpt #: 278 total cpu time spent up to now is 606.7 secs Computing kpt #: 279 total cpu time spent up to now is 608.8 secs Computing kpt #: 280 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 612.0 secs Computing kpt #: 281 total cpu time spent up to now is 615.1 secs Computing kpt #: 282 total cpu time spent up to now is 618.0 secs Computing kpt #: 283 total cpu time spent up to now is 621.0 secs Computing kpt #: 284 total cpu time spent up to now is 622.8 secs Computing kpt #: 285 total cpu time spent up to now is 624.4 secs Computing kpt #: 286 total cpu time spent up to now is 625.9 secs Computing kpt #: 287 total cpu time spent up to now is 627.4 secs Computing kpt #: 288 total cpu time spent up to now is 628.8 secs Computing kpt #: 289 total cpu time spent up to now is 630.3 secs Computing kpt #: 290 total cpu time spent up to now is 631.8 secs Computing kpt #: 291 total cpu time spent up to now is 633.3 secs Computing kpt #: 292 total cpu time spent up to now is 635.0 secs Computing kpt #: 293 total cpu time spent up to now is 636.5 secs Computing kpt #: 294 total cpu time spent up to now is 638.0 secs Computing kpt #: 295 total cpu time spent up to now is 639.5 secs Computing kpt #: 296 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 642.7 secs Computing kpt #: 297 total cpu time spent up to now is 645.0 secs Computing kpt #: 298 total cpu time spent up to now is 646.9 secs Computing kpt #: 299 total cpu time spent up to now is 648.8 secs Computing kpt #: 300 total cpu time spent up to now is 650.3 secs Computing kpt #: 301 total cpu time spent up to now is 651.8 secs Computing kpt #: 302 total cpu time spent up to now is 653.4 secs Computing kpt #: 303 total cpu time spent up to now is 655.0 secs Computing kpt #: 304 total cpu time spent up to now is 656.5 secs Computing kpt #: 305 total cpu time spent up to now is 658.1 secs Computing kpt #: 306 total cpu time spent up to now is 659.6 secs Computing kpt #: 307 total cpu time spent up to now is 661.2 secs Computing kpt #: 308 total cpu time spent up to now is 662.9 secs Computing kpt #: 309 total cpu time spent up to now is 664.6 secs Computing kpt #: 310 total cpu time spent up to now is 666.3 secs Computing kpt #: 311 total cpu time spent up to now is 667.5 secs Computing kpt #: 312 total cpu time spent up to now is 668.8 secs Computing kpt #: 313 total cpu time spent up to now is 670.1 secs Computing kpt #: 314 total cpu time spent up to now is 671.3 secs Computing kpt #: 315 total cpu time spent up to now is 672.7 secs Computing kpt #: 316 total cpu time spent up to now is 674.1 secs Computing kpt #: 317 total cpu time spent up to now is 675.5 secs Computing kpt #: 318 total cpu time spent up to now is 676.9 secs Computing kpt #: 319 total cpu time spent up to now is 678.3 secs Computing kpt #: 320 total cpu time spent up to now is 679.7 secs Computing kpt #: 321 total cpu time spent up to now is 681.2 secs Computing kpt #: 322 total cpu time spent up to now is 682.6 secs Computing kpt #: 323 total cpu time spent up to now is 684.0 secs Computing kpt #: 324 total cpu time spent up to now is 685.6 secs Computing kpt #: 325 total cpu time spent up to now is 687.1 secs Computing kpt #: 326 total cpu time spent up to now is 688.6 secs Computing kpt #: 327 total cpu time spent up to now is 690.2 secs Computing kpt #: 328 total cpu time spent up to now is 691.9 secs Computing kpt #: 329 total cpu time spent up to now is 693.6 secs Computing kpt #: 330 total cpu time spent up to now is 695.2 secs Computing kpt #: 331 total cpu time spent up to now is 697.1 secs Computing kpt #: 332 total cpu time spent up to now is 699.0 secs Computing kpt #: 333 total cpu time spent up to now is 700.8 secs Computing kpt #: 334 total cpu time spent up to now is 702.7 secs Computing kpt #: 335 total cpu time spent up to now is 704.4 secs Computing kpt #: 336 total cpu time spent up to now is 705.9 secs Computing kpt #: 337 total cpu time spent up to now is 707.5 secs Computing kpt #: 338 total cpu time spent up to now is 709.4 secs Computing kpt #: 339 total cpu time spent up to now is 711.3 secs Computing kpt #: 340 total cpu time spent up to now is 713.2 secs Computing kpt #: 341 total cpu time spent up to now is 715.2 secs Computing kpt #: 342 total cpu time spent up to now is 717.3 secs ethr = 1.92E-08, avg # of iterations = 58.2 total cpu time spent up to now is 717.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12499 PWs) bands (ev): -14.4844 -14.4844 -14.2409 -14.2409 -11.6492 -11.6492 -11.2284 -11.2284 -3.4389 -3.4389 -2.9363 -2.9363 -2.1512 -2.1512 -2.1074 -2.1074 -1.5242 -1.5242 -1.4059 -1.4059 0.9799 0.9799 1.0979 1.0979 2.4569 2.4569 2.9601 2.9601 2.9654 2.9654 3.0768 3.0768 3.7995 3.7995 3.9211 3.9211 4.1421 4.1421 4.2306 4.2306 4.4302 4.4302 4.5394 4.5394 4.5901 4.5901 4.7221 4.7221 6.2877 6.2877 6.3554 6.3554 7.4238 7.4238 7.7594 7.7594 8.6386 8.6386 10.4292 10.4292 10.6032 10.6032 k = 0.0092 0.0161-0.0000 ( 12503 PWs) bands (ev): -14.4842 -14.4842 -14.2409 -14.2409 -11.6494 -11.6494 -11.2286 -11.2286 -3.4384 -3.4384 -2.9364 -2.9364 -2.1500 -2.1500 -2.1073 -2.1073 -1.5237 -1.5237 -1.4061 -1.4061 0.9796 0.9796 1.0977 1.0977 2.4557 2.4557 2.9601 2.9601 2.9657 2.9657 3.0769 3.0769 3.7968 3.7968 3.9209 3.9209 4.1423 4.1423 4.2306 4.2306 4.4302 4.4302 4.5392 4.5392 4.5900 4.5900 4.7221 4.7221 6.2866 6.2866 6.3550 6.3550 7.4251 7.4251 7.7580 7.7580 8.6422 8.6422 10.4261 10.4261 10.6049 10.6049 k = 0.0185 0.0321-0.0000 ( 12487 PWs) bands (ev): -14.4835 -14.4835 -14.2412 -14.2412 -11.6502 -11.6502 -11.2290 -11.2290 -3.4369 -3.4369 -2.9366 -2.9366 -2.1464 -2.1464 -2.1068 -2.1068 -1.5223 -1.5223 -1.4069 -1.4069 0.9789 0.9789 1.0973 1.0973 2.4519 2.4519 2.9600 2.9600 2.9667 2.9667 3.0772 3.0772 3.7888 3.7888 3.9205 3.9205 4.1429 4.1429 4.2308 4.2308 4.4303 4.4303 4.5388 4.5388 4.5900 4.5900 4.7221 4.7221 6.2832 6.2832 6.3539 6.3539 7.4292 7.4292 7.7537 7.7537 8.6529 8.6529 10.4171 10.4171 10.6103 10.6103 k = 0.0277 0.0482-0.0000 ( 12493 PWs) bands (ev): -14.4824 -14.4824 -14.2416 -14.2416 -11.6516 -11.6516 -11.2298 -11.2298 -3.4343 -3.4343 -2.9371 -2.9371 -2.1405 -2.1405 -2.1059 -2.1059 -1.5201 -1.5201 -1.4081 -1.4081 0.9777 0.9777 1.0965 1.0965 2.4457 2.4457 2.9599 2.9599 2.9683 2.9683 3.0777 3.0777 3.7758 3.7758 3.9199 3.9199 4.1439 4.1439 4.2312 4.2312 4.4303 4.4303 4.5381 4.5381 4.5899 4.5899 4.7222 4.7222 6.2777 6.2777 6.3520 6.3520 7.4360 7.4360 7.7469 7.7469 8.6704 8.6704 10.4032 10.4032 10.6191 10.6191 k = 0.0370 0.0642-0.0000 ( 12481 PWs) bands (ev): -14.4808 -14.4808 -14.2422 -14.2422 -11.6535 -11.6535 -11.2308 -11.2308 -3.4307 -3.4307 -2.9377 -2.9377 -2.1323 -2.1323 -2.1047 -2.1047 -1.5171 -1.5171 -1.4098 -1.4098 0.9760 0.9760 1.0955 1.0955 2.4371 2.4371 2.9596 2.9596 2.9705 2.9705 3.0784 3.0784 3.7581 3.7581 3.9188 3.9188 4.1451 4.1451 4.2316 4.2316 4.4304 4.4304 4.5372 4.5372 4.5898 4.5898 4.7222 4.7222 6.2701 6.2701 6.3494 6.3494 7.4454 7.4454 7.7381 7.7381 8.6942 8.6942 10.3854 10.3854 10.6315 10.6315 k = 0.0462 0.0803-0.0000 ( 12485 PWs) bands (ev): -14.4788 -14.4788 -14.2429 -14.2429 -11.6558 -11.6558 -11.2321 -11.2321 -3.4262 -3.4262 -2.9385 -2.9385 -2.1219 -2.1219 -2.1028 -2.1028 -1.5136 -1.5136 -1.4118 -1.4118 0.9738 0.9738 1.0942 1.0942 2.4263 2.4263 2.9593 2.9593 2.9732 2.9732 3.0793 3.0793 3.7363 3.7363 3.9175 3.9175 4.1464 4.1464 4.2322 4.2322 4.4305 4.4305 4.5359 4.5359 4.5897 4.5897 4.7222 4.7222 6.2605 6.2605 6.3462 6.3462 7.4575 7.4575 7.7276 7.7276 8.7236 8.7236 10.3650 10.3650 10.6472 10.6472 k = 0.0555 0.0963-0.0000 ( 12489 PWs) bands (ev): -14.4764 -14.4764 -14.2439 -14.2439 -11.6587 -11.6587 -11.2336 -11.2336 -3.4208 -3.4208 -2.9396 -2.9396 -2.1104 -2.1104 -2.0995 -2.0995 -1.5096 -1.5096 -1.4141 -1.4141 0.9712 0.9712 1.0927 1.0927 2.4134 2.4134 2.9590 2.9590 2.9763 2.9763 3.0803 3.0803 3.7108 3.7108 3.9159 3.9159 4.1476 4.1476 4.2330 4.2330 4.4306 4.4306 4.5344 4.5344 4.5896 4.5896 4.7223 4.7223 6.2491 6.2491 6.3425 6.3425 7.4721 7.4721 7.7160 7.7160 8.7579 8.7579 10.3431 10.3431 10.6662 10.6662 k = 0.0647 0.1124-0.0000 ( 12493 PWs) bands (ev): -14.4735 -14.4735 -14.2450 -14.2450 -11.6620 -11.6620 -11.2353 -11.2353 -3.4145 -3.4145 -2.9409 -2.9409 -2.1025 -2.1025 -2.0902 -2.0902 -1.5055 -1.5055 -1.4165 -1.4165 0.9682 0.9682 1.0909 1.0909 2.3986 2.3986 2.9586 2.9586 2.9797 2.9797 3.0814 3.0814 3.6823 3.6823 3.9139 3.9139 4.1486 4.1486 4.2338 4.2338 4.4307 4.4307 4.5326 4.5326 4.5894 4.5894 4.7223 4.7223 6.2360 6.2360 6.3381 6.3381 7.4894 7.4894 7.7040 7.7040 8.7964 8.7964 10.3208 10.3208 10.6873 10.6873 k = 0.0740 0.1284-0.0000 ( 12500 PWs) bands (ev): -14.4703 -14.4703 -14.2463 -14.2463 -11.6657 -11.6657 -11.2372 -11.2372 -3.4076 -3.4076 -2.9424 -2.9424 -2.0987 -2.0987 -2.0741 -2.0741 -1.5016 -1.5016 -1.4189 -1.4189 0.9647 0.9647 1.0891 1.0891 2.3820 2.3820 2.9583 2.9583 2.9832 2.9832 3.0825 3.0825 3.6512 3.6512 3.9116 3.9116 4.1494 4.1494 4.2347 4.2347 4.4309 4.4309 4.5306 4.5306 4.5892 4.5892 4.7224 4.7224 6.2215 6.2215 6.3333 6.3333 7.5092 7.5092 7.6920 7.6920 8.8384 8.8384 10.2989 10.2989 10.6838 10.6838 k = 0.0832 0.1445-0.0000 ( 12504 PWs) bands (ev): -14.4667 -14.4667 -14.2478 -14.2478 -11.6698 -11.6698 -11.2392 -11.2392 -3.3999 -3.3999 -2.9442 -2.9442 -2.0955 -2.0955 -2.0552 -2.0552 -1.4981 -1.4981 -1.4210 -1.4210 0.9608 0.9608 1.0871 1.0871 2.3639 2.3639 2.9580 2.9580 2.9868 2.9868 3.0838 3.0838 3.6183 3.6183 3.9092 3.9092 4.1500 4.1500 4.2357 4.2357 4.4310 4.4310 4.5284 4.5284 4.5890 4.5890 4.7224 4.7224 6.2057 6.2057 6.3281 6.3281 7.5315 7.5315 7.6805 7.6805 8.8831 8.8831 10.2781 10.2781 10.6306 10.6306 k = 0.0925 0.1605-0.0000 ( 12508 PWs) bands (ev): -14.4627 -14.4627 -14.2495 -14.2495 -11.6742 -11.6742 -11.2414 -11.2414 -3.3916 -3.3916 -2.9463 -2.9463 -2.0920 -2.0920 -2.0341 -2.0341 -1.4956 -1.4956 -1.4227 -1.4227 0.9566 0.9566 1.0850 1.0850 2.3443 2.3443 2.9579 2.9579 2.9904 2.9904 3.0850 3.0850 3.5841 3.5841 3.9065 3.9065 4.1502 4.1502 4.2368 4.2368 4.4311 4.4311 4.5259 4.5259 4.5888 4.5888 4.7224 4.7224 6.1889 6.1889 6.3224 6.3224 7.5562 7.5562 7.6700 7.6700 8.9297 8.9297 10.2589 10.2589 10.5731 10.5731 k = 0.1017 0.1766-0.0000 ( 12512 PWs) bands (ev): -14.4584 -14.4584 -14.2513 -14.2513 -11.6789 -11.6789 -11.2435 -11.2435 -3.3828 -3.3828 -2.9488 -2.9488 -2.0882 -2.0882 -2.0112 -2.0112 -1.4942 -1.4942 -1.4238 -1.4238 0.9520 0.9520 1.0829 1.0829 2.3236 2.3236 2.9578 2.9578 2.9939 2.9939 3.0861 3.0861 3.5491 3.5491 3.9036 3.9036 4.1501 4.1501 4.2380 4.2380 4.4312 4.4312 4.5233 4.5233 4.5885 4.5885 4.7224 4.7224 6.1714 6.1714 6.3164 6.3164 7.5834 7.5834 7.6608 7.6608 8.9777 8.9777 10.2415 10.2415 10.5144 10.5144 k = 0.1110 0.1926-0.0000 ( 12522 PWs) bands (ev): -14.4538 -14.4538 -14.2534 -14.2534 -11.6839 -11.6839 -11.2457 -11.2457 -3.3735 -3.3735 -2.9516 -2.9516 -2.0841 -2.0841 -1.9868 -1.9868 -1.4943 -1.4943 -1.4241 -1.4241 0.9471 0.9471 1.0808 1.0808 2.3017 2.3017 2.9580 2.9580 2.9973 2.9973 3.0872 3.0872 3.5142 3.5142 3.9007 3.9007 4.1498 4.1498 4.2392 4.2392 4.4312 4.4312 4.5205 4.5205 4.5883 4.5883 4.7224 4.7224 6.1534 6.1534 6.3102 6.3102 7.6129 7.6129 7.6533 7.6533 9.0263 9.0263 10.2264 10.2264 10.4550 10.4550 k = 0.1202 0.2087-0.0000 ( 12538 PWs) bands (ev): -14.4489 -14.4489 -14.2557 -14.2557 -11.6891 -11.6891 -11.2478 -11.2478 -3.3639 -3.3639 -2.9548 -2.9548 -2.0795 -2.0795 -1.9610 -1.9610 -1.4958 -1.4958 -1.4240 -1.4240 0.9419 0.9419 1.0787 1.0787 2.2790 2.2790 2.9583 2.9583 3.0006 3.0006 3.0880 3.0880 3.4797 3.4797 3.8976 3.8976 4.1491 4.1491 4.2405 4.2405 4.4313 4.4313 4.5176 4.5176 4.5880 4.5880 4.7224 4.7224 6.1351 6.1351 6.3037 6.3037 7.6443 7.6443 7.6483 7.6483 9.0750 9.0750 10.2135 10.2135 10.3955 10.3955 k = 0.1295 0.2248-0.0000 ( 12530 PWs) bands (ev): -14.4438 -14.4438 -14.2583 -14.2583 -11.6944 -11.6944 -11.2499 -11.2499 -3.3540 -3.3540 -2.9585 -2.9585 -2.0745 -2.0745 -1.9342 -1.9342 -1.4985 -1.4985 -1.4237 -1.4237 0.9364 0.9364 1.0767 1.0767 2.2556 2.2556 2.9589 2.9589 3.0038 3.0038 3.0887 3.0887 3.4465 3.4465 3.8945 3.8945 4.1483 4.1483 4.2417 4.2417 4.4313 4.4313 4.5145 4.5145 4.5878 4.5878 4.7224 4.7224 6.1168 6.1168 6.2970 6.2970 7.6445 7.6445 7.6791 7.6791 9.1231 9.1231 10.2030 10.2030 10.3360 10.3360 k = 0.1387 0.2408-0.0000 ( 12526 PWs) bands (ev): -14.4384 -14.4384 -14.2610 -14.2610 -11.6998 -11.6998 -11.2518 -11.2518 -3.3439 -3.3439 -2.9626 -2.9626 -2.0690 -2.0690 -1.9066 -1.9066 -1.5019 -1.5019 -1.4236 -1.4236 0.9307 0.9307 1.0748 1.0748 2.2318 2.2318 2.9598 2.9598 3.0068 3.0068 3.0891 3.0891 3.4149 3.4149 3.8914 3.8914 4.1472 4.1472 4.2430 4.2430 4.4313 4.4313 4.5114 4.5114 4.5877 4.5877 4.7224 4.7224 6.0987 6.0987 6.2903 6.2903 7.6438 7.6438 7.7156 7.7156 9.1702 9.1702 10.1944 10.1944 10.2774 10.2774 k = 0.1480 0.2569-0.0000 ( 12520 PWs) bands (ev): -14.4329 -14.4329 -14.2640 -14.2640 -11.7052 -11.7052 -11.2536 -11.2536 -3.3337 -3.3337 -2.9672 -2.9672 -2.0631 -2.0631 -1.8787 -1.8787 -1.5059 -1.5059 -1.4242 -1.4242 0.9248 0.9248 1.0729 1.0729 2.2076 2.2076 2.9610 2.9610 3.0096 3.0096 3.0893 3.0893 3.3856 3.3856 3.8884 3.8884 4.1459 4.1459 4.2443 4.2443 4.4313 4.4313 4.5083 4.5083 4.5875 4.5875 4.7224 4.7224 6.0811 6.0811 6.2835 6.2835 7.6457 7.6457 7.7544 7.7544 9.2157 9.2157 10.1841 10.1841 10.2235 10.2235 k = 0.1572 0.2729-0.0000 ( 12522 PWs) bands (ev): -14.4271 -14.4271 -14.2672 -14.2672 -11.7106 -11.7106 -11.2551 -11.2551 -3.3234 -3.3234 -2.9723 -2.9723 -2.0568 -2.0568 -1.8509 -1.8509 -1.5097 -1.5097 -1.4259 -1.4259 0.9188 0.9188 1.0711 1.0711 2.1835 2.1835 2.9625 2.9625 3.0124 3.0124 3.0893 3.0893 3.3590 3.3590 3.8855 3.8855 4.1445 4.1445 4.2455 4.2455 4.4312 4.4312 4.5052 4.5052 4.5875 4.5875 4.7223 4.7223 6.0641 6.0641 6.2766 6.2766 7.6505 7.6505 7.7954 7.7954 9.2592 9.2592 10.1482 10.1482 10.1982 10.1982 k = 0.1665 0.2890-0.0000 ( 12526 PWs) bands (ev): -14.4213 -14.4213 -14.2706 -14.2706 -11.7160 -11.7160 -11.2564 -11.2564 -3.3131 -3.3131 -2.9780 -2.9780 -2.0501 -2.0501 -1.8238 -1.8238 -1.5131 -1.5131 -1.4290 -1.4290 0.9126 0.9126 1.0694 1.0694 2.1595 2.1595 2.9644 2.9644 3.0151 3.0151 3.0892 3.0892 3.3355 3.3355 3.8827 3.8827 4.1430 4.1430 4.2467 4.2467 4.4311 4.4311 4.5021 4.5021 4.5875 4.5875 4.7223 4.7223 6.0479 6.0479 6.2699 6.2699 7.6583 7.6583 7.8386 7.8386 9.3005 9.3005 10.0929 10.0929 10.1956 10.1956 k = 0.1757 0.3050-0.0000 ( 12520 PWs) bands (ev): -14.4153 -14.4153 -14.2742 -14.2742 -11.7212 -11.7212 -11.2574 -11.2574 -3.3028 -3.3028 -2.9842 -2.9842 -2.0430 -2.0430 -1.7981 -1.7981 -1.5154 -1.5154 -1.4338 -1.4338 0.9064 0.9064 1.0677 1.0677 2.1360 2.1360 2.9667 2.9667 3.0177 3.0177 3.0893 3.0893 3.3152 3.3152 3.8800 3.8800 4.1414 4.1414 4.2478 4.2478 4.4309 4.4309 4.4991 4.4991 4.5876 4.5876 4.7223 4.7223 6.0327 6.0327 6.2632 6.2632 7.6692 7.6692 7.8839 7.8839 9.3391 9.3391 10.0356 10.0356 10.1983 10.1983 k = 0.1850 0.3211-0.0000 ( 12518 PWs) bands (ev): -14.4093 -14.4093 -14.2781 -14.2781 -11.7263 -11.7263 -11.2581 -11.2581 -3.2927 -3.2927 -2.9909 -2.9909 -2.0355 -2.0355 -1.7746 -1.7746 -1.5159 -1.5159 -1.4404 -1.4404 0.9002 0.9002 1.0660 1.0660 2.1132 2.1132 2.9694 2.9694 3.0203 3.0203 3.0899 3.0899 3.2982 3.2982 3.8776 3.8776 4.1398 4.1398 4.2488 4.2488 4.4307 4.4307 4.4962 4.4962 4.5878 4.5878 4.7223 4.7223 6.0186 6.0186 6.2566 6.2566 7.6832 7.6832 7.9314 7.9314 9.3749 9.3749 9.9784 9.9784 10.2042 10.2042 k = 0.1942 0.3371-0.0000 ( 12520 PWs) bands (ev): -14.4033 -14.4033 -14.2821 -14.2821 -11.7311 -11.7311 -11.2584 -11.2584 -3.2827 -3.2827 -2.9983 -2.9983 -2.0277 -2.0277 -1.7541 -1.7541 -1.5140 -1.5140 -1.4491 -1.4491 0.8939 0.8939 1.0642 1.0642 2.0914 2.0914 2.9724 2.9724 3.0229 3.0229 3.0915 3.0915 3.2844 3.2844 3.8753 3.8753 4.1382 4.1382 4.2498 4.2498 4.4304 4.4304 4.4934 4.4934 4.5881 4.5881 4.7223 4.7223 6.0057 6.0057 6.2503 6.2503 7.7005 7.7005 7.9810 7.9810 9.4078 9.4078 9.9217 9.9217 10.2128 10.2128 k = 0.2035 0.3532-0.0000 ( 12516 PWs) bands (ev): -14.3972 -14.3972 -14.2864 -14.2864 -11.7358 -11.7358 -11.2584 -11.2584 -3.2729 -3.2729 -3.0062 -3.0062 -2.0196 -2.0196 -1.7376 -1.7376 -1.5092 -1.5092 -1.4599 -1.4599 0.8877 0.8877 1.0624 1.0624 2.0708 2.0708 2.9759 2.9759 3.0255 3.0255 3.0946 3.0946 3.2735 3.2735 3.8733 3.8733 4.1366 4.1366 4.2507 4.2507 4.4301 4.4301 4.4909 4.4909 4.5886 4.5886 4.7223 4.7223 5.9942 5.9942 6.2442 6.2442 7.7210 7.7210 8.0327 8.0327 9.4375 9.4375 9.8657 9.8657 10.2241 10.2241 k = 0.2127 0.3692-0.0000 ( 12508 PWs) bands (ev): -14.3912 -14.3912 -14.2909 -14.2909 -11.7401 -11.7401 -11.2580 -11.2580 -3.2634 -3.2634 -3.0147 -3.0147 -2.0113 -2.0113 -1.7255 -1.7255 -1.5012 -1.5012 -1.4725 -1.4725 0.8815 0.8815 1.0604 1.0604 2.0519 2.0519 2.9798 2.9798 3.0282 3.0282 3.0999 3.0999 3.2652 3.2652 3.8716 3.8716 4.1351 4.1351 4.2514 4.2514 4.4297 4.4297 4.4885 4.4885 4.5892 4.5892 4.7223 4.7223 5.9842 5.9842 6.2384 6.2384 7.7448 7.7448 8.0864 8.0864 9.4641 9.4641 9.8106 9.8106 10.2378 10.2378 k = 0.2220 0.3853-0.0000 ( 12496 PWs) bands (ev): -14.3852 -14.3852 -14.2955 -14.2955 -11.7440 -11.7440 -11.2572 -11.2572 -3.2541 -3.2541 -3.0238 -3.0238 -2.0027 -2.0027 -1.7179 -1.7179 -1.4939 -1.4939 -1.4837 -1.4837 0.8755 0.8755 1.0583 1.0583 2.0348 2.0348 2.9840 2.9840 3.0309 3.0309 3.1078 3.1078 3.2591 3.2591 3.8701 3.8701 4.1336 4.1336 4.2521 4.2521 4.4293 4.4293 4.4864 4.4864 4.5901 4.5901 4.7224 4.7224 5.9757 5.9757 6.2328 6.2328 7.7719 7.7719 8.1420 8.1420 9.4877 9.4877 9.7564 9.7564 10.2538 10.2538 k = 0.2312 0.4013-0.0000 ( 12516 PWs) bands (ev): -14.3793 -14.3793 -14.3004 -14.3004 -11.7477 -11.7477 -11.2559 -11.2559 -3.2452 -3.2452 -3.0334 -3.0334 -1.9941 -1.9941 -1.7142 -1.7142 -1.5070 -1.5070 -1.4740 -1.4740 0.8696 0.8696 1.0559 1.0559 2.0198 2.0198 2.9886 2.9886 3.0338 3.0338 3.1189 3.1189 3.2548 3.2548 3.8688 3.8688 4.1322 4.1322 4.2526 4.2526 4.4289 4.4289 4.4845 4.4845 4.5911 4.5911 4.7225 4.7225 5.9687 5.9687 6.2276 6.2276 7.8022 7.8022 8.1995 8.1995 9.5082 9.5082 9.7032 9.7032 10.2720 10.2720 k = 0.2405 0.4174-0.0000 ( 12524 PWs) bands (ev): -14.3735 -14.3735 -14.3053 -14.3053 -11.7509 -11.7509 -11.2543 -11.2543 -3.2366 -3.2366 -3.0436 -3.0436 -1.9853 -1.9853 -1.7139 -1.7139 -1.5261 -1.5261 -1.4590 -1.4590 0.8639 0.8639 1.0533 1.0533 2.0073 2.0073 2.9935 2.9935 3.0367 3.0367 3.1333 3.1333 3.2519 3.2519 3.8679 3.8679 4.1310 4.1310 4.2531 4.2531 4.4284 4.4284 4.4829 4.4829 4.5923 4.5923 4.7226 4.7226 5.9634 5.9634 6.2228 6.2228 7.8356 7.8356 8.2589 8.2589 9.5258 9.5258 9.6511 9.6511 10.2921 10.2921 k = 0.2497 0.4335-0.0000 ( 12534 PWs) bands (ev): -14.3679 -14.3679 -14.3105 -14.3105 -11.7537 -11.7537 -11.2522 -11.2522 -3.2284 -3.2284 -3.0543 -3.0543 -1.9766 -1.9766 -1.7160 -1.7160 -1.5474 -1.5474 -1.4432 -1.4432 0.8584 0.8584 1.0506 1.0506 1.9974 1.9974 2.9986 2.9986 3.0399 3.0399 3.1515 3.1515 3.2502 3.2502 3.8672 3.8672 4.1299 4.1299 4.2534 4.2534 4.4280 4.4280 4.4816 4.4816 4.5937 4.5937 4.7228 4.7228 5.9597 5.9597 6.2183 6.2183 7.8722 7.8722 8.3199 8.3199 9.5406 9.5406 9.6003 9.6003 10.3141 10.3141 k = 0.2590 0.4495-0.0000 ( 12548 PWs) bands (ev): -14.3624 -14.3624 -14.3157 -14.3157 -11.7561 -11.7561 -11.2497 -11.2497 -3.2205 -3.2205 -3.0655 -3.0655 -1.9680 -1.9680 -1.7198 -1.7198 -1.5704 -1.5704 -1.4277 -1.4277 0.8531 0.8531 1.0475 1.0475 1.9904 1.9904 3.0040 3.0040 3.0432 3.0432 3.1733 3.1733 3.2494 3.2494 3.8667 3.8667 4.1290 4.1290 4.2536 4.2536 4.4275 4.4275 4.4805 4.4805 4.5954 4.5954 4.7230 4.7230 5.9578 5.9578 6.2142 6.2142 7.9118 7.9118 8.3826 8.3826 9.5495 9.5495 9.5541 9.5541 10.3376 10.3376 k = 0.2682 0.4656-0.0000 ( 12568 PWs) bands (ev): -14.3571 -14.3571 -14.3211 -14.3211 -11.7581 -11.7581 -11.2469 -11.2469 -3.2131 -3.2131 -3.0772 -3.0772 -1.9595 -1.9595 -1.7247 -1.7247 -1.5950 -1.5950 -1.4133 -1.4133 0.8481 0.8481 1.0443 1.0443 1.9864 1.9864 3.0096 3.0096 3.0466 3.0466 3.1988 3.1988 3.2494 3.2494 3.8666 3.8666 4.1282 4.1282 4.2537 4.2537 4.4272 4.4272 4.4797 4.4797 4.5973 4.5973 4.7232 4.7232 5.9575 5.9575 6.2105 6.2105 7.9543 7.9543 8.4467 8.4467 9.5025 9.5025 9.5629 9.5629 10.3624 10.3624 k = 0.2775 0.4816-0.0000 ( 12556 PWs) bands (ev): -14.3520 -14.3520 -14.3265 -14.3265 -11.7596 -11.7596 -11.2437 -11.2437 -3.2061 -3.2061 -3.0893 -3.0893 -1.9513 -1.9513 -1.7304 -1.7304 -1.6208 -1.6208 -1.4005 -1.4005 0.8433 0.8433 1.0409 1.0409 1.9856 1.9856 3.0153 3.0153 3.0503 3.0503 3.2276 3.2276 3.2500 3.2500 3.8667 3.8667 4.1275 4.1275 4.2537 4.2537 4.4268 4.4268 4.4792 4.4792 4.5995 4.5995 4.7236 4.7236 5.9590 5.9590 6.2073 6.2073 7.9996 7.9996 8.5121 8.5121 9.4560 9.4560 9.5706 9.5706 10.3883 10.3883 k = 0.2867 0.4977-0.0000 ( 12582 PWs) bands (ev): -14.3471 -14.3471 -14.3320 -14.3320 -11.7607 -11.7607 -11.2401 -11.2401 -3.1996 -3.1996 -3.1018 -3.1018 -1.9434 -1.9434 -1.7364 -1.7364 -1.6476 -1.6476 -1.3897 -1.3897 0.8388 0.8388 1.0374 1.0374 1.9879 1.9879 3.0212 3.0212 3.0541 3.0541 3.2497 3.2497 3.2613 3.2613 3.8670 3.8670 4.1271 4.1271 4.2536 4.2536 4.4266 4.4266 4.4789 4.4789 4.6020 4.6020 4.7239 4.7239 5.9621 5.9621 6.2045 6.2045 8.0475 8.0475 8.5785 8.5785 9.4115 9.4115 9.5764 9.5764 10.4146 10.4146 k = 0.2960 0.5137-0.0000 ( 12570 PWs) bands (ev): -14.3424 -14.3424 -14.3376 -14.3376 -11.7613 -11.7613 -11.2362 -11.2362 -3.1935 -3.1935 -3.1147 -3.1147 -1.9360 -1.9360 -1.7426 -1.7426 -1.6749 -1.6749 -1.3812 -1.3812 0.8347 0.8347 1.0338 1.0338 1.9935 1.9935 3.0270 3.0270 3.0582 3.0582 3.2515 3.2515 3.2961 3.2961 3.8676 3.8676 4.1267 4.1267 4.2535 4.2535 4.4264 4.4264 4.4788 4.4788 4.6048 4.6048 4.7244 4.7244 5.9669 5.9669 6.2020 6.2020 8.0980 8.0980 8.6453 8.6453 9.3693 9.3693 9.5804 9.5804 10.4407 10.4407 k = 0.3052 0.5298-0.0000 ( 12556 PWs) bands (ev): -14.3431 -14.3431 -14.3380 -14.3380 -11.7615 -11.7615 -11.2320 -11.2320 -3.1878 -3.1878 -3.1279 -3.1279 -1.9293 -1.9293 -1.7490 -1.7490 -1.7024 -1.7024 -1.3751 -1.3751 0.8309 0.8309 1.0302 1.0302 2.0023 2.0023 3.0327 3.0327 3.0624 3.0624 3.2530 3.2530 3.3343 3.3343 3.8683 3.8683 4.1266 4.1266 4.2532 4.2532 4.4264 4.4264 4.4790 4.4790 4.6078 4.6078 4.7249 4.7249 5.9733 5.9733 6.2001 6.2001 8.1509 8.1509 8.7121 8.7121 9.3299 9.3299 9.5830 9.5830 10.4650 10.4650 k = 0.3145 0.5458-0.0000 ( 12552 PWs) bands (ev): -14.3486 -14.3486 -14.3338 -14.3338 -11.7614 -11.7614 -11.2276 -11.2276 -3.1827 -3.1827 -3.1412 -3.1412 -1.9232 -1.9232 -1.7563 -1.7563 -1.7286 -1.7286 -1.3714 -1.3714 0.8274 0.8274 1.0266 1.0266 2.0141 2.0141 3.0382 3.0382 3.0669 3.0669 3.2546 3.2546 3.3748 3.3748 3.8693 3.8693 4.1265 4.1265 4.2529 4.2529 4.4264 4.4264 4.4793 4.4793 4.6110 4.6110 4.7255 4.7255 5.9813 5.9813 6.1985 6.1985 8.2060 8.2060 8.7775 8.7775 9.2945 9.2945 9.5844 9.5844 10.4840 10.4840 k = 0.3237 0.5619-0.0000 ( 12568 PWs) bands (ev): -14.3541 -14.3541 -14.3298 -14.3298 -11.7608 -11.7608 -11.2229 -11.2229 -3.1780 -3.1780 -3.1547 -3.1547 -1.9182 -1.9182 -1.7688 -1.7688 -1.7488 -1.7488 -1.3702 -1.3702 0.8242 0.8242 1.0230 1.0230 2.0288 2.0288 3.0433 3.0433 3.0716 3.0716 3.2563 3.2563 3.4172 3.4172 3.8705 3.8705 4.1266 4.1266 4.2525 4.2525 4.4266 4.4266 4.4798 4.4798 4.6145 4.6145 4.7261 4.7261 5.9907 5.9907 6.1973 6.1973 8.2631 8.2631 8.8397 8.8397 9.2651 9.2651 9.5847 9.5847 10.4878 10.4878 k = 0.3330 0.5779-0.0000 ( 12556 PWs) bands (ev): -14.3595 -14.3595 -14.3261 -14.3261 -11.7599 -11.7599 -11.2181 -11.2181 -3.1748 -3.1748 -3.1674 -3.1674 -1.9144 -1.9144 -1.7908 -1.7908 -1.7579 -1.7579 -1.3713 -1.3713 0.8214 0.8214 1.0195 1.0195 2.0462 2.0462 3.0480 3.0480 3.0766 3.0766 3.2580 3.2580 3.4612 3.4612 3.8718 3.8718 4.1268 4.1268 4.2520 4.2520 4.4269 4.4269 4.4804 4.4804 4.6183 4.6183 4.7269 4.7269 6.0016 6.0016 6.1965 6.1965 8.3221 8.3221 8.8949 8.8949 9.2450 9.2450 9.5844 9.5844 10.4575 10.4575 k = 0.3330 0.5779-0.0000 ( 12556 PWs) bands (ev): -14.3595 -14.3595 -14.3261 -14.3261 -11.7599 -11.7599 -11.2181 -11.2181 -3.1748 -3.1748 -3.1674 -3.1674 -1.9144 -1.9144 -1.7908 -1.7908 -1.7579 -1.7579 -1.3713 -1.3713 0.8214 0.8214 1.0195 1.0195 2.0462 2.0462 3.0480 3.0480 3.0766 3.0766 3.2580 3.2580 3.4612 3.4612 3.8718 3.8718 4.1268 4.1268 4.2520 4.2520 4.4269 4.4269 4.4804 4.4804 4.6183 4.6183 4.7269 4.7269 6.0016 6.0016 6.1965 6.1965 8.3221 8.3221 8.8949 8.8949 9.2450 9.2450 9.5844 9.5844 10.4575 10.4575 k = 0.3145 0.5779-0.0000 ( 12558 PWs) bands (ev): -14.3572 -14.3572 -14.3276 -14.3276 -11.7603 -11.7603 -11.2206 -11.2206 -3.1783 -3.1783 -3.1590 -3.1590 -1.9163 -1.9163 -1.7804 -1.7804 -1.7527 -1.7527 -1.3706 -1.3706 0.8230 0.8230 1.0214 1.0214 2.0374 2.0374 3.0455 3.0455 3.0737 3.0737 3.2571 3.2571 3.4389 3.4389 3.8711 3.8711 4.1267 4.1267 4.2522 4.2522 4.4268 4.4268 4.4801 4.4801 4.6163 4.6163 4.7265 4.7265 5.9961 5.9961 6.1971 6.1971 8.2917 8.2917 8.8694 8.8694 9.2505 9.2505 9.5833 9.5833 10.4772 10.4772 k = 0.2960 0.5779-0.0000 ( 12552 PWs) bands (ev): -14.3555 -14.3555 -14.3285 -14.3285 -11.7605 -11.7605 -11.2232 -11.2232 -3.1831 -3.1831 -3.1494 -3.1494 -1.9190 -1.9190 -1.7739 -1.7739 -1.7427 -1.7427 -1.3705 -1.3705 0.8252 0.8252 1.0235 1.0235 2.0295 2.0295 3.0423 3.0423 3.0702 3.0702 3.2560 3.2560 3.4165 3.4165 3.8703 3.8703 4.1268 4.1268 4.2524 4.2524 4.4269 4.4269 4.4798 4.4798 4.6144 4.6144 4.7261 4.7261 5.9911 5.9911 6.1982 6.1982 8.2608 8.2608 8.8441 8.8441 9.2523 9.2523 9.5796 9.5796 10.4837 10.4837 k = 0.2775 0.5779-0.0000 ( 12555 PWs) bands (ev): -14.3546 -14.3546 -14.3287 -14.3287 -11.7605 -11.7605 -11.2258 -11.2258 -3.1877 -3.1877 -3.1399 -3.1399 -1.9223 -1.9223 -1.7698 -1.7698 -1.7293 -1.7293 -1.3712 -1.3712 0.8278 0.8278 1.0258 1.0258 2.0226 2.0226 3.0385 3.0385 3.0660 3.0660 3.2549 3.2549 3.3943 3.3943 3.8695 3.8695 4.1270 4.1270 4.2525 4.2525 4.4271 4.4271 4.4796 4.4796 4.6124 4.6124 4.7257 4.7257 5.9866 5.9866 6.1997 6.1997 8.2297 8.2297 8.8203 8.8203 9.2497 9.2497 9.5733 9.5733 10.4781 10.4781 k = 0.2590 0.5779-0.0000 ( 12565 PWs) bands (ev): -14.3545 -14.3545 -14.3281 -14.3281 -11.7603 -11.7603 -11.2285 -11.2285 -3.1920 -3.1920 -3.1308 -3.1308 -1.9259 -1.9259 -1.7668 -1.7668 -1.7144 -1.7144 -1.3726 -1.3726 0.8308 0.8308 1.0284 1.0284 2.0167 2.0167 3.0341 3.0341 3.0613 3.0613 3.2537 3.2537 3.3725 3.3725 3.8686 3.8686 4.1272 4.1272 4.2526 4.2526 4.4274 4.4274 4.4795 4.4795 4.6104 4.6104 4.7254 4.7254 5.9825 5.9825 6.2016 6.2016 8.1989 8.1989 8.7991 8.7991 9.2427 9.2427 9.5645 9.5645 10.4639 10.4639 k = 0.2405 0.5779-0.0000 ( 12561 PWs) bands (ev): -14.3549 -14.3549 -14.3270 -14.3270 -11.7600 -11.7600 -11.2311 -11.2311 -3.1960 -3.1960 -3.1221 -3.1221 -1.9298 -1.9298 -1.7641 -1.7641 -1.6987 -1.6987 -1.3749 -1.3749 0.8341 0.8341 1.0311 1.0311 2.0116 2.0116 3.0294 3.0294 3.0561 3.0561 3.2523 3.2523 3.3514 3.3514 3.8677 3.8677 4.1275 4.1275 4.2527 4.2527 4.4278 4.4278 4.4795 4.4795 4.6085 4.6085 4.7250 4.7250 5.9789 5.9789 6.2038 6.2038 8.1689 8.1689 8.7809 8.7809 9.2321 9.2321 9.5534 9.5534 10.4442 10.4442 k = 0.2220 0.5779-0.0000 ( 12578 PWs) bands (ev): -14.3558 -14.3558 -14.3255 -14.3255 -11.7595 -11.7595 -11.2337 -11.2337 -3.1997 -3.1997 -3.1139 -3.1139 -1.9338 -1.9338 -1.7616 -1.7616 -1.6827 -1.6827 -1.3780 -1.3780 0.8377 0.8377 1.0339 1.0339 2.0074 2.0074 3.0244 3.0244 3.0505 3.0505 3.2506 3.2506 3.3313 3.3313 3.8667 3.8667 4.1279 4.1279 4.2527 4.2527 4.4282 4.4282 4.4795 4.4795 4.6067 4.6067 4.7247 4.7247 5.9757 5.9757 6.2063 6.2063 8.1398 8.1398 8.7659 8.7659 9.2185 9.2185 9.5402 9.5402 10.4214 10.4214 k = 0.2035 0.5779-0.0000 ( 12569 PWs) bands (ev): -14.3570 -14.3570 -14.3239 -14.3239 -11.7589 -11.7589 -11.2363 -11.2363 -3.2031 -3.2031 -3.1061 -3.1061 -1.9377 -1.9377 -1.7592 -1.7592 -1.6665 -1.6665 -1.3820 -1.3820 0.8414 0.8414 1.0367 1.0367 2.0041 2.0041 3.0191 3.0191 3.0445 3.0445 3.2484 3.2484 3.3127 3.3127 3.8657 3.8657 4.1284 4.1284 4.2527 4.2527 4.4287 4.4287 4.4796 4.4796 4.6050 4.6050 4.7244 4.7244 5.9728 5.9728 6.2091 6.2091 8.1121 8.1121 8.7541 8.7541 9.2027 9.2027 9.5253 9.5253 10.3968 10.3968 k = 0.1850 0.5779-0.0000 ( 12561 PWs) bands (ev): -14.3583 -14.3583 -14.3221 -14.3221 -11.7583 -11.7583 -11.2388 -11.2388 -3.2062 -3.2062 -3.0989 -3.0989 -1.9415 -1.9415 -1.7569 -1.7569 -1.6502 -1.6502 -1.3868 -1.3868 0.8453 0.8453 1.0395 1.0395 2.0015 2.0015 3.0138 3.0138 3.0383 3.0383 3.2455 3.2455 3.2960 3.2960 3.8647 3.8647 4.1288 4.1288 4.2526 4.2526 4.4292 4.4292 4.4797 4.4797 4.6034 4.6034 4.7241 4.7241 5.9704 5.9704 6.2119 6.2119 8.0859 8.0859 8.7455 8.7455 9.1855 9.1855 9.5091 9.5091 10.3717 10.3717 k = 0.1665 0.5779-0.0000 ( 12567 PWs) bands (ev): -14.3596 -14.3596 -14.3204 -14.3204 -11.7576 -11.7576 -11.2411 -11.2411 -3.2090 -3.2090 -3.0923 -3.0923 -1.9452 -1.9452 -1.7547 -1.7547 -1.6340 -1.6340 -1.3925 -1.3925 0.8491 0.8491 1.0422 1.0422 1.9996 1.9996 3.0085 3.0085 3.0319 3.0319 3.2411 3.2411 3.2822 3.2822 3.8636 3.8636 4.1293 4.1293 4.2525 4.2525 4.4297 4.4297 4.4799 4.4799 4.6019 4.6019 4.7239 4.7239 5.9683 5.9683 6.2148 6.2148 8.0615 8.0615 8.7397 8.7397 9.1676 9.1676 9.4922 9.4922 10.3468 10.3468 k = 0.1480 0.5779-0.0000 ( 12558 PWs) bands (ev): -14.3608 -14.3608 -14.3188 -14.3188 -11.7569 -11.7569 -11.2433 -11.2433 -3.2114 -3.2114 -3.0862 -3.0862 -1.9485 -1.9485 -1.7528 -1.7528 -1.6180 -1.6180 -1.3990 -1.3990 0.8527 0.8527 1.0449 1.0449 1.9982 1.9982 3.0033 3.0033 3.0256 3.0256 3.2347 3.2347 3.2720 3.2720 3.8626 3.8626 4.1297 4.1297 4.2525 4.2525 4.4302 4.4302 4.4801 4.4801 4.6005 4.6005 4.7237 4.7237 5.9665 5.9665 6.2177 6.2177 8.0391 8.0391 8.7366 8.7366 9.1496 9.1496 9.4751 9.4751 10.3229 10.3229 k = 0.1295 0.5779-0.0000 ( 12550 PWs) bands (ev): -14.3620 -14.3620 -14.3174 -14.3174 -11.7562 -11.7562 -11.2453 -11.2453 -3.2136 -3.2136 -3.0808 -3.0808 -1.9516 -1.9516 -1.7510 -1.7510 -1.6021 -1.6021 -1.4062 -1.4062 0.8562 0.8562 1.0473 1.0473 1.9974 1.9974 2.9983 2.9983 3.0194 3.0194 3.2264 3.2264 3.2653 3.2653 3.8616 3.8616 4.1302 4.1302 4.2524 4.2524 4.4306 4.4306 4.4803 4.4803 4.5993 4.5993 4.7235 4.7235 5.9649 5.9649 6.2204 6.2204 8.0190 8.0190 8.7358 8.7358 9.1320 9.1320 9.4584 9.4584 10.3006 10.3006 k = 0.1110 0.5779-0.0000 ( 12545 PWs) bands (ev): -14.3631 -14.3631 -14.3160 -14.3160 -11.7555 -11.7555 -11.2471 -11.2471 -3.2155 -3.2155 -3.0761 -3.0761 -1.9543 -1.9543 -1.7495 -1.7495 -1.5867 -1.5867 -1.4142 -1.4142 0.8595 0.8595 1.0496 1.0496 1.9970 1.9970 2.9937 2.9937 3.0136 3.0136 3.2174 3.2174 3.2613 3.2613 3.8608 3.8608 4.1306 4.1306 4.2523 4.2523 4.4310 4.4310 4.4806 4.4806 4.5983 4.5983 4.7234 4.7234 5.9637 5.9637 6.2230 6.2230 8.0012 8.0012 8.7367 8.7367 9.1153 9.1153 9.4426 9.4426 10.2803 10.2803 k = 0.0925 0.5779-0.0000 ( 12535 PWs) bands (ev): -14.3640 -14.3640 -14.3149 -14.3149 -11.7549 -11.7549 -11.2487 -11.2487 -3.2170 -3.2170 -3.0721 -3.0721 -1.9567 -1.9567 -1.7481 -1.7481 -1.5717 -1.5717 -1.4227 -1.4227 0.8623 0.8623 1.0515 1.0515 1.9968 1.9968 2.9895 2.9895 3.0083 3.0083 3.2087 3.2087 3.2588 3.2588 3.8600 3.8600 4.1309 4.1309 4.2522 4.2522 4.4313 4.4313 4.4808 4.4808 4.5974 4.5974 4.7232 4.7232 5.9626 5.9626 6.2253 6.2253 7.9860 7.9860 8.7390 8.7390 9.0999 9.0999 9.4282 9.4282 10.2625 10.2625 k = 0.0740 0.5779-0.0000 ( 12540 PWs) bands (ev): -14.3648 -14.3648 -14.3139 -14.3139 -11.7544 -11.7544 -11.2500 -11.2500 -3.2183 -3.2183 -3.0688 -3.0688 -1.9586 -1.9586 -1.7471 -1.7471 -1.5576 -1.5576 -1.4315 -1.4315 0.8648 0.8648 1.0532 1.0532 1.9969 1.9969 2.9859 2.9859 3.0038 3.0038 3.2012 3.2012 3.2572 3.2572 3.8593 3.8593 4.1312 4.1312 4.2521 4.2521 4.4316 4.4316 4.4810 4.4810 4.5967 4.5967 4.7231 4.7231 5.9618 5.9618 6.2273 6.2273 7.9733 7.9733 8.7420 8.7420 9.0864 9.0864 9.4157 9.4157 10.2474 10.2474 k = 0.0555 0.5779-0.0000 ( 12546 PWs) bands (ev): -14.3654 -14.3654 -14.3132 -14.3132 -11.7540 -11.7540 -11.2511 -11.2511 -3.2193 -3.2193 -3.0661 -3.0661 -1.9602 -1.9602 -1.7462 -1.7462 -1.5446 -1.5446 -1.4404 -1.4404 0.8667 0.8667 1.0546 1.0546 1.9970 1.9970 2.9829 2.9829 3.0001 3.0001 3.1952 3.1952 3.2561 3.2561 3.8587 3.8587 4.1315 4.1315 4.2520 4.2520 4.4318 4.4318 4.4812 4.4812 4.5962 4.5962 4.7230 4.7230 5.9612 5.9612 6.2289 6.2289 7.9634 7.9634 8.7452 8.7452 9.0752 9.0752 9.4055 9.4055 10.2355 10.2355 k = 0.0370 0.5779-0.0000 ( 12540 PWs) bands (ev): -14.3659 -14.3659 -14.3127 -14.3127 -11.7536 -11.7536 -11.2518 -11.2518 -3.2200 -3.2200 -3.0643 -3.0643 -1.9613 -1.9613 -1.7456 -1.7456 -1.5334 -1.5334 -1.4485 -1.4485 0.8682 0.8682 1.0555 1.0555 1.9972 1.9972 2.9807 2.9807 2.9973 2.9973 3.1908 3.1908 3.2553 3.2553 3.8583 3.8583 4.1316 4.1316 4.2520 4.2520 4.4320 4.4320 4.4813 4.4813 4.5958 4.5958 4.7230 4.7230 5.9608 5.9608 6.2301 6.2301 7.9563 7.9563 8.7480 8.7480 9.0668 9.0668 9.3980 9.3980 10.2268 10.2268 k = 0.0185 0.5779-0.0000 ( 12540 PWs) bands (ev): -14.3661 -14.3661 -14.3123 -14.3123 -11.7534 -11.7534 -11.2523 -11.2523 -3.2205 -3.2205 -3.0631 -3.0631 -1.9619 -1.9619 -1.7452 -1.7452 -1.5254 -1.5254 -1.4548 -1.4548 0.8690 0.8690 1.0561 1.0561 1.9973 1.9973 2.9794 2.9794 2.9957 2.9957 3.1881 3.1881 3.2549 3.2549 3.8581 3.8581 4.1318 4.1318 4.2519 4.2519 4.4320 4.4320 4.4814 4.4814 4.5955 4.5955 4.7229 4.7229 5.9605 5.9605 6.2308 6.2308 7.9520 7.9520 8.7499 8.7499 9.0616 9.0616 9.3933 9.3933 10.2215 10.2215 k = 0.0000 0.5779-0.0000 ( 12550 PWs) bands (ev): -14.3662 -14.3662 -14.3122 -14.3122 -11.7534 -11.7534 -11.2525 -11.2525 -3.2206 -3.2206 -3.0628 -3.0628 -1.9621 -1.9621 -1.7451 -1.7451 -1.5223 -1.5223 -1.4572 -1.4572 0.8693 0.8693 1.0563 1.0563 1.9973 1.9973 2.9789 2.9789 2.9951 2.9951 3.1872 3.1872 3.2548 3.2548 3.8580 3.8580 4.1318 4.1318 4.2519 4.2519 4.4321 4.4321 4.4814 4.4814 4.5954 4.5954 4.7229 4.7229 5.9604 5.9604 6.2310 6.2310 7.9506 7.9506 8.7505 8.7505 9.0598 9.0598 9.3918 9.3918 10.2197 10.2197 k = 0.0000 0.5779-0.0000 ( 12550 PWs) bands (ev): -14.3662 -14.3662 -14.3122 -14.3122 -11.7534 -11.7534 -11.2525 -11.2525 -3.2206 -3.2206 -3.0628 -3.0628 -1.9621 -1.9621 -1.7451 -1.7451 -1.5223 -1.5223 -1.4572 -1.4572 0.8693 0.8693 1.0563 1.0563 1.9973 1.9973 2.9789 2.9789 2.9951 2.9951 3.1872 3.1872 3.2548 3.2548 3.8580 3.8580 4.1318 4.1318 4.2519 4.2519 4.4321 4.4321 4.4814 4.4814 4.5954 4.5954 4.7229 4.7229 5.9604 5.9604 6.2310 6.2310 7.9506 7.9506 8.7505 8.7505 9.0598 9.0598 9.3918 9.3918 10.2197 10.2197 k = 0.0000 0.5779 0.0187 ( 12544 PWs) bands (ev): -14.3661 -14.3661 -14.3122 -14.3122 -11.7531 -11.7531 -11.2528 -11.2528 -3.2207 -3.2207 -3.0630 -3.0630 -1.9627 -1.9627 -1.7451 -1.7451 -1.5231 -1.5231 -1.4562 -1.4562 0.8699 0.8699 1.0571 1.0571 1.9978 1.9978 2.9763 2.9763 2.9933 2.9933 3.1854 3.1854 3.2570 3.2570 3.8585 3.8585 4.1321 4.1321 4.2530 4.2530 4.4332 4.4332 4.4816 4.4816 4.5968 4.5968 4.7231 4.7231 5.9597 5.9597 6.2267 6.2267 7.9538 7.9538 8.7542 8.7542 9.0624 9.0624 9.3894 9.3894 10.2216 10.2216 k = 0.0000 0.5779 0.0375 ( 12544 PWs) bands (ev): -14.3659 -14.3659 -14.3122 -14.3122 -11.7522 -11.7522 -11.2539 -11.2539 -3.2211 -3.2211 -3.0638 -3.0638 -1.9644 -1.9644 -1.7450 -1.7450 -1.5253 -1.5253 -1.4534 -1.4534 0.8714 0.8714 1.0595 1.0595 1.9991 1.9991 2.9685 2.9685 2.9884 2.9884 3.1799 3.1799 3.2632 3.2632 3.8599 3.8599 4.1330 4.1330 4.2560 4.2560 4.4364 4.4364 4.4820 4.4820 4.6009 4.6009 4.7235 4.7235 5.9574 5.9574 6.2137 6.2137 7.9632 7.9632 8.7650 8.7650 9.0700 9.0700 9.3825 9.3825 10.2273 10.2273 k = 0.0000 0.5779 0.0562 ( 12540 PWs) bands (ev): -14.3656 -14.3656 -14.3122 -14.3122 -11.7508 -11.7508 -11.2557 -11.2557 -3.2216 -3.2216 -3.0652 -3.0652 -1.9671 -1.9671 -1.7451 -1.7451 -1.5283 -1.5283 -1.4493 -1.4493 0.8741 0.8741 1.0634 1.0634 2.0014 2.0014 2.9551 2.9551 2.9813 2.9813 3.1709 3.1709 3.2729 3.2729 3.8623 3.8623 4.1345 4.1345 4.2608 4.2608 4.4416 4.4416 4.4827 4.4827 4.6077 4.6077 4.7244 4.7244 5.9537 5.9537 6.1926 6.1926 7.9785 7.9785 8.7830 8.7830 9.0823 9.0823 9.3717 9.3717 10.2363 10.2363 k = 0.0000 0.5779 0.0749 ( 12538 PWs) bands (ev): -14.3651 -14.3651 -14.3122 -14.3122 -11.7488 -11.7488 -11.2581 -11.2581 -3.2224 -3.2224 -3.0670 -3.0670 -1.9707 -1.9707 -1.7454 -1.7454 -1.5318 -1.5318 -1.4442 -1.4442 0.8778 0.8778 1.0689 1.0689 2.0046 2.0046 2.9368 2.9368 2.9722 2.9722 3.1586 3.1586 3.2854 3.2854 3.8656 3.8656 4.1365 4.1365 4.2672 4.2672 4.4487 4.4487 4.4837 4.4837 4.6171 4.6171 4.7259 4.7259 5.9484 5.9484 6.1641 6.1641 7.9990 7.9990 8.8079 8.8079 9.0986 9.0986 9.3583 9.3583 10.2483 10.2483 k = 0.0000 0.5779 0.0937 ( 12550 PWs) bands (ev): -14.3645 -14.3645 -14.3122 -14.3122 -11.7462 -11.7462 -11.2613 -11.2613 -3.2234 -3.2234 -3.0694 -3.0694 -1.9751 -1.9751 -1.7462 -1.7462 -1.5351 -1.5351 -1.4386 -1.4386 0.8827 0.8827 1.0758 1.0758 2.0086 2.0086 2.9145 2.9145 2.9611 2.9611 3.1434 3.1434 3.2999 3.2999 3.8698 3.8698 4.1390 4.1390 4.2747 4.2747 4.4573 4.4573 4.4850 4.4850 4.6288 4.6288 4.7282 4.7282 5.9417 5.9417 6.1291 6.1291 8.0240 8.0240 8.8395 8.8395 9.1176 9.1176 9.3441 9.3441 10.2627 10.2627 k = 0.0000 0.5779 0.1124 ( 12544 PWs) bands (ev): -14.3638 -14.3638 -14.3122 -14.3122 -11.7431 -11.7431 -11.2652 -11.2652 -3.2246 -3.2246 -3.0723 -3.0723 -1.9801 -1.9801 -1.7477 -1.7477 -1.5381 -1.5381 -1.4328 -1.4328 0.8888 0.8888 1.0843 1.0843 2.0136 2.0136 2.8890 2.8890 2.9478 2.9478 3.1254 3.1254 3.3162 3.3162 3.8748 3.8748 4.1419 4.1419 4.2829 4.2829 4.4670 4.4670 4.4870 4.4870 4.6427 4.6427 4.7318 4.7318 5.9335 5.9335 6.0884 6.0884 8.0527 8.0527 8.8775 8.8775 9.1366 9.1366 9.3323 9.3323 10.2791 10.2791 k = 0.0000 0.5779 0.1311 ( 12540 PWs) bands (ev): -14.3629 -14.3629 -14.3122 -14.3122 -11.7394 -11.7394 -11.2697 -11.2697 -3.2259 -3.2259 -3.0756 -3.0756 -1.9855 -1.9855 -1.7500 -1.7500 -1.5403 -1.5403 -1.4270 -1.4270 0.8960 0.8960 1.0942 1.0942 2.0194 2.0194 2.8609 2.8609 2.9324 2.9324 3.1050 3.1050 3.3338 3.3338 3.8806 3.8806 4.1452 4.1452 4.2914 4.2914 4.4762 4.4762 4.4908 4.4908 4.6582 4.6582 4.7373 4.7373 5.9238 5.9238 6.0432 6.0432 8.0844 8.0844 8.9213 8.9213 9.1513 9.1513 9.3279 9.3279 10.2970 10.2970 k = 0.0000 0.5779 0.1499 ( 12520 PWs) bands (ev): -14.3620 -14.3620 -14.3122 -14.3122 -11.7352 -11.7352 -11.2749 -11.2749 -3.2274 -3.2274 -3.0795 -3.0795 -1.9911 -1.9911 -1.7534 -1.7534 -1.5416 -1.5416 -1.4213 -1.4213 0.9045 0.9045 1.1054 1.1054 2.0262 2.0262 2.8308 2.8308 2.9148 2.9148 3.0825 3.0825 3.3527 3.3527 3.8872 3.8872 4.1488 4.1488 4.2996 4.2996 4.4822 4.4822 4.4988 4.4988 4.6746 4.6746 4.7455 4.7455 5.9127 5.9127 5.9945 5.9945 8.1185 8.1185 8.9704 8.9704 9.1560 9.1560 9.3368 9.3368 10.3161 10.3161 k = 0.0000 0.5779 0.1686 ( 12530 PWs) bands (ev): -14.3609 -14.3609 -14.3122 -14.3122 -11.7304 -11.7304 -11.2807 -11.2807 -3.2289 -3.2289 -3.0838 -3.0838 -1.9969 -1.9969 -1.7578 -1.7578 -1.5420 -1.5420 -1.4159 -1.4159 0.9144 0.9144 1.1180 1.1180 2.0338 2.0338 2.7989 2.7989 2.8952 2.8952 3.0581 3.0581 3.3726 3.3726 3.8944 3.8944 4.1528 4.1528 4.3072 4.3072 4.4851 4.4851 4.5103 4.5103 4.6912 4.6912 4.7572 4.7572 5.8999 5.8999 5.9432 5.9432 8.1544 8.1544 9.0238 9.0238 9.1492 9.1492 9.3611 9.3611 10.3363 10.3363 k = 0.0000 0.5779 0.1874 ( 12528 PWs) bands (ev): -14.3597 -14.3597 -14.3123 -14.3123 -11.7251 -11.7251 -11.2872 -11.2872 -3.2305 -3.2305 -3.0885 -3.0885 -2.0027 -2.0027 -1.7634 -1.7634 -1.5414 -1.5414 -1.4109 -1.4109 0.9255 0.9255 1.1318 1.1318 2.0423 2.0423 2.7657 2.7657 2.8736 2.8736 3.0322 3.0322 3.3937 3.3937 3.9024 3.9024 4.1570 4.1570 4.3136 4.3136 4.4867 4.4867 4.5229 4.5229 4.7074 4.7074 4.7732 4.7732 5.8830 5.8830 5.8929 5.8929 8.1917 8.1917 9.0792 9.0792 9.1356 9.1356 9.3977 9.3977 10.3575 10.3575 k = 0.0000 0.5779 0.2061 ( 12542 PWs) bands (ev): -14.3584 -14.3584 -14.3123 -14.3123 -11.7193 -11.7193 -11.2942 -11.2942 -3.2321 -3.2321 -3.0935 -3.0935 -2.0083 -2.0083 -1.7701 -1.7701 -1.5398 -1.5398 -1.4064 -1.4064 0.9381 0.9381 1.1468 1.1468 2.0516 2.0516 2.7315 2.7315 2.8500 2.8500 3.0050 3.0050 3.4159 3.4159 3.9110 3.9110 4.1614 4.1614 4.3187 4.3187 4.4875 4.4875 4.5355 4.5355 4.7236 4.7236 4.7932 4.7932 5.8342 5.8342 5.8720 5.8720 8.2301 8.2301 9.1045 9.1045 9.1506 9.1506 9.4424 9.4424 10.3801 10.3801 k = 0.0000 0.5779 0.2248 ( 12540 PWs) bands (ev): -14.3570 -14.3570 -14.3124 -14.3124 -11.7129 -11.7129 -11.3018 -11.3018 -3.2337 -3.2337 -3.0990 -3.0990 -2.0136 -2.0136 -1.7779 -1.7779 -1.5374 -1.5374 -1.4023 -1.4023 0.9521 0.9521 1.1628 1.1628 2.0618 2.0618 2.6964 2.6964 2.8246 2.8246 2.9768 2.9768 3.4393 3.4393 3.9201 3.9201 4.1659 4.1659 4.3224 4.3224 4.4875 4.4875 4.5473 4.5473 4.7404 4.7404 4.8165 4.8165 5.7799 5.7799 5.8551 5.8551 8.2693 8.2693 9.0855 9.0855 9.2100 9.2100 9.4922 9.4922 10.4042 10.4042 k = 0.0000 0.5779 0.2436 ( 12542 PWs) bands (ev): -14.3555 -14.3555 -14.3125 -14.3125 -11.7061 -11.7061 -11.3100 -11.3100 -3.2352 -3.2352 -3.1048 -3.1048 -2.0186 -2.0186 -1.7866 -1.7866 -1.5341 -1.5341 -1.3988 -1.3988 0.9674 0.9674 1.1798 1.1798 2.0729 2.0729 2.6608 2.6608 2.7974 2.7974 2.9478 2.9478 3.4637 3.4637 3.9299 3.9299 4.1707 4.1707 4.3246 4.3246 4.4866 4.4866 4.5576 4.5576 4.7587 4.7587 4.8422 4.8422 5.7259 5.7259 5.8371 5.8371 8.3091 8.3091 9.0629 9.0629 9.2739 9.2739 9.5448 9.5448 10.4305 10.4305 k = 0.0000 0.5779 0.2623 ( 12546 PWs) bands (ev): -14.3540 -14.3540 -14.3127 -14.3127 -11.6988 -11.6988 -11.3187 -11.3187 -3.2367 -3.2367 -3.1108 -3.1108 -2.0231 -2.0231 -1.7961 -1.7961 -1.5302 -1.5302 -1.3959 -1.3959 0.9842 0.9842 1.1976 1.1976 2.0847 2.0847 2.6250 2.6250 2.7687 2.7687 2.9182 2.9182 3.4894 3.4894 3.9401 3.9401 4.1755 4.1755 4.3254 4.3254 4.4846 4.4846 4.5659 4.5659 4.7789 4.7789 4.8696 4.8696 5.6729 5.6729 5.8179 5.8179 8.3492 8.3492 9.0405 9.0405 9.3386 9.3386 9.5985 9.5985 10.4597 10.4597 k = 0.0000 0.5779 0.2810 ( 12532 PWs) bands (ev): -14.3524 -14.3524 -14.3129 -14.3129 -11.6909 -11.6909 -11.3279 -11.3279 -3.2380 -3.2380 -3.1172 -3.1172 -2.0270 -2.0270 -1.8064 -1.8064 -1.5257 -1.5257 -1.3936 -1.3936 1.0024 1.0024 1.2160 1.2160 2.0974 2.0974 2.5892 2.5892 2.7386 2.7386 2.8883 2.8883 3.5162 3.5162 3.9509 3.9509 4.1803 4.1803 4.3249 4.3249 4.4814 4.4814 4.5717 4.5717 4.8013 4.8013 4.8979 4.8979 5.6218 5.6218 5.7975 5.7975 8.3896 8.3896 9.0190 9.0190 9.4027 9.4027 9.6517 9.6517 10.4927 10.4927 k = 0.0000 0.5779 0.2998 ( 12532 PWs) bands (ev): -14.3507 -14.3507 -14.3132 -14.3132 -11.6827 -11.6827 -11.3376 -11.3376 -3.2392 -3.2392 -3.1237 -3.1237 -2.0303 -2.0303 -1.8172 -1.8172 -1.5208 -1.5208 -1.3919 -1.3919 1.0219 1.0219 1.2349 1.2349 2.1108 2.1108 2.5536 2.5536 2.7072 2.7072 2.8581 2.8581 3.5443 3.5443 3.9621 3.9621 4.1851 4.1851 4.3234 4.3234 4.4770 4.4770 4.5745 4.5745 4.8259 4.8259 4.9267 4.9267 5.5732 5.5732 5.7759 5.7759 8.4299 8.4299 8.9990 8.9990 9.4653 9.4653 9.7028 9.7028 10.5302 10.5302 k = 0.0000 0.5779 0.3185 ( 12530 PWs) bands (ev): -14.3490 -14.3490 -14.3135 -14.3135 -11.6739 -11.6739 -11.3477 -11.3477 -3.2401 -3.2401 -3.1304 -3.1304 -2.0329 -2.0329 -1.8285 -1.8285 -1.5155 -1.5155 -1.3908 -1.3908 1.0426 1.0426 1.2541 1.2541 2.1249 2.1249 2.5187 2.5187 2.6747 2.6747 2.8278 2.8278 3.5736 3.5736 3.9737 3.9737 4.1898 4.1898 4.3211 4.3211 4.4714 4.4714 4.5738 4.5738 4.8523 4.8523 4.9557 4.9557 5.5276 5.5276 5.7531 5.7531 8.4699 8.4699 8.9808 8.9808 9.5252 9.5252 9.7504 9.7504 10.5732 10.5732 k = 0.0000 0.5779 0.3372 ( 12516 PWs) bands (ev): -14.3473 -14.3473 -14.3138 -14.3138 -11.6648 -11.6648 -11.3582 -11.3582 -3.2409 -3.2409 -3.1372 -3.1372 -2.0348 -2.0348 -1.8401 -1.8401 -1.5099 -1.5099 -1.3903 -1.3903 1.0646 1.0646 1.2734 1.2734 2.1397 2.1397 2.4847 2.4847 2.6414 2.6414 2.7975 2.7975 3.6041 3.6041 3.9856 3.9856 4.1942 4.1942 4.3183 4.3183 4.4648 4.4648 4.5693 4.5693 4.8803 4.8803 4.9845 4.9845 5.4856 5.4856 5.7293 5.7293 8.5094 8.5094 8.9645 8.9645 9.5816 9.5816 9.7932 9.7932 10.6221 10.6221 k = 0.0000 0.5779 0.3560 ( 12508 PWs) bands (ev): -14.3455 -14.3455 -14.3143 -14.3143 -11.6552 -11.6552 -11.3691 -11.3691 -3.2413 -3.2413 -3.1441 -3.1441 -2.0360 -2.0360 -1.8520 -1.8520 -1.5041 -1.5041 -1.3905 -1.3905 1.0877 1.0877 1.2924 1.2924 2.1550 2.1550 2.4519 2.4519 2.6076 2.6076 2.7673 2.7673 3.6358 3.6358 3.9979 3.9979 4.1981 4.1981 4.3152 4.3152 4.4570 4.4570 4.5608 4.5608 4.9096 4.9096 5.0128 5.0128 5.4475 5.4475 5.7044 5.7044 8.5482 8.5482 8.9502 8.9502 9.6338 9.6338 9.8304 9.8304 10.6772 10.6772 k = 0.0000 0.5779 0.3747 ( 12506 PWs) bands (ev): -14.3437 -14.3437 -14.3148 -14.3148 -11.6453 -11.6453 -11.3804 -11.3804 -3.2415 -3.2415 -3.1511 -3.1511 -2.0363 -2.0363 -1.8641 -1.8641 -1.4981 -1.4981 -1.3913 -1.3913 1.1117 1.1117 1.3109 1.3109 2.1708 2.1708 2.4210 2.4210 2.5734 2.5734 2.7372 2.7372 3.6686 3.6686 4.0104 4.0104 4.2013 4.2013 4.3121 4.3121 4.4484 4.4484 4.5481 4.5481 4.9400 4.9400 5.0406 5.0406 5.4137 5.4137 5.6784 5.6784 8.5859 8.5859 8.9378 8.9378 9.6810 9.6810 9.8616 9.8616 10.7380 10.7380 k = 0.0000 0.5779 0.3934 ( 12504 PWs) bands (ev): -14.3419 -14.3419 -14.3153 -14.3153 -11.6349 -11.6349 -11.3919 -11.3919 -3.2413 -3.2413 -3.1580 -3.1580 -2.0358 -2.0358 -1.8762 -1.8762 -1.4920 -1.4920 -1.3926 -1.3926 1.1364 1.1364 1.3285 1.3285 2.1868 2.1868 2.3926 2.3926 2.5392 2.5392 2.7074 2.7074 3.7026 3.7026 4.0232 4.0232 4.2034 4.2034 4.3095 4.3095 4.4387 4.4387 4.5313 4.5313 4.9709 4.9709 5.0675 5.0675 5.3841 5.3841 5.6516 5.6516 8.6223 8.6223 8.9273 8.9273 9.7231 9.7231 9.8867 9.8867 10.8036 10.8036 k = 0.0000 0.5779 0.4122 ( 12506 PWs) bands (ev): -14.3401 -14.3401 -14.3160 -14.3160 -11.6243 -11.6243 -11.4037 -11.4037 -3.2407 -3.2407 -3.1649 -3.1649 -2.0345 -2.0345 -1.8884 -1.8884 -1.4857 -1.4857 -1.3945 -1.3945 1.1618 1.1618 1.3448 1.3448 2.2025 2.2025 2.3673 2.3673 2.5053 2.5053 2.6778 2.6778 3.7377 3.7377 4.0360 4.0360 4.2042 4.2042 4.3076 4.3076 4.4279 4.4279 4.5109 4.5109 5.0023 5.0023 5.0937 5.0937 5.3586 5.3586 5.6238 5.6238 8.6571 8.6571 8.9186 8.9186 9.7598 9.7598 9.9060 9.9060 10.8723 10.8723 k = 0.0000 0.5779 0.4309 ( 12502 PWs) bands (ev): -14.3384 -14.3384 -14.3167 -14.3167 -11.6133 -11.6133 -11.4158 -11.4158 -3.2398 -3.2398 -3.1717 -3.1717 -2.0323 -2.0323 -1.9004 -1.9004 -1.4795 -1.4795 -1.3969 -1.3969 1.1875 1.1875 1.3594 1.3594 2.2172 2.2172 2.3465 2.3465 2.4721 2.4721 2.6485 2.6485 3.7737 3.7737 4.0488 4.0488 4.2034 4.2034 4.3069 4.3069 4.4156 4.4156 4.4879 4.4879 5.0335 5.0335 5.1191 5.1191 5.3369 5.3369 5.5953 5.5953 8.6899 8.6899 8.9113 8.9113 9.7913 9.7913 9.9202 9.9202 10.9422 10.9422 k = 0.0000 0.5779 0.4497 ( 12528 PWs) bands (ev): -14.3366 -14.3366 -14.3175 -14.3175 -11.6020 -11.6020 -11.4280 -11.4280 -3.2385 -3.2385 -3.1783 -3.1783 -2.0293 -2.0293 -1.9124 -1.9124 -1.4732 -1.4732 -1.3998 -1.3998 1.2133 1.2133 1.3717 1.3717 2.2294 2.2294 2.3319 2.3319 2.4399 2.4399 2.6196 2.6196 3.8105 3.8105 4.0615 4.0615 4.2009 4.2009 4.3074 4.3074 4.4012 4.4012 4.4637 4.4637 5.0642 5.0642 5.1439 5.1439 5.3187 5.3187 5.5659 5.5659 8.7205 8.7205 8.9051 8.9051 9.8181 9.8181 9.9299 9.9299 11.0112 11.0112 k = 0.0000 0.5779 0.4684 ( 12526 PWs) bands (ev): -14.3348 -14.3348 -14.3184 -14.3184 -11.5904 -11.5904 -11.4405 -11.4405 -3.2368 -3.2368 -3.1848 -3.1848 -2.0255 -2.0255 -1.9241 -1.9241 -1.4669 -1.4669 -1.4032 -1.4032 1.2388 1.2388 1.3814 1.3814 2.2372 2.2372 2.3256 2.3256 2.4094 2.4094 2.5911 2.5911 3.8479 3.8479 4.0736 4.0736 4.1967 4.1967 4.3088 4.3088 4.3837 4.3837 4.4407 4.4407 5.0938 5.0938 5.1683 5.1683 5.3033 5.3033 5.5359 5.5359 8.7486 8.7486 8.8998 8.8998 9.8407 9.8407 9.9357 9.9357 11.0767 11.0767 k = 0.0000 0.5779 0.4871 ( 12516 PWs) bands (ev): -14.3331 -14.3331 -14.3194 -14.3194 -11.5786 -11.5786 -11.4530 -11.4530 -3.2347 -3.2347 -3.1910 -3.1910 -2.0208 -2.0208 -1.9355 -1.9355 -1.4607 -1.4607 -1.4070 -1.4070 1.2638 1.2638 1.3879 1.3879 2.2400 2.2400 2.3278 2.3278 2.3822 2.3822 2.5631 2.5631 3.8856 3.8856 4.0847 4.0847 4.1915 4.1915 4.3098 4.3098 4.3630 4.3630 4.4209 4.4209 5.1216 5.1216 5.1925 5.1925 5.2906 5.2906 5.5054 5.5054 8.7742 8.7742 8.8948 8.8948 9.8596 9.8596 9.9383 9.9383 11.1367 11.1367 k = 0.0000 0.5779 0.5059 ( 12498 PWs) bands (ev): -14.3315 -14.3315 -14.3204 -14.3204 -11.5665 -11.5665 -11.4657 -11.4657 -3.2321 -3.2321 -3.1970 -3.1970 -2.0153 -2.0153 -1.9465 -1.9465 -1.4545 -1.4545 -1.4112 -1.4112 1.2877 1.2877 1.3909 1.3909 2.2401 2.2401 2.3297 2.3297 2.3651 2.3651 2.5357 2.5357 3.9232 3.9232 4.0933 4.0933 4.1865 4.1865 4.3052 4.3052 4.3450 4.3450 4.4049 4.4049 5.1468 5.1468 5.2159 5.2159 5.2811 5.2811 5.4743 5.4743 8.7969 8.7969 8.8898 8.8898 9.8755 9.8755 9.9382 9.9382 11.1894 11.1894 k = 0.0000 0.5779 0.5246 ( 12512 PWs) bands (ev): -14.3299 -14.3299 -14.3215 -14.3215 -11.5543 -11.5543 -11.4784 -11.4784 -3.2291 -3.2291 -3.2026 -3.2026 -2.0091 -2.0091 -1.9571 -1.9571 -1.4484 -1.4484 -1.4157 -1.4157 1.3103 1.3103 1.3901 1.3901 2.2409 2.2409 2.3159 2.3159 2.3710 2.3710 2.5088 2.5088 3.9602 3.9602 4.0971 4.0971 4.1841 4.1841 4.2869 4.2869 4.3400 4.3400 4.3914 4.3914 5.1689 5.1689 5.2341 5.2341 5.2790 5.2790 5.4429 5.4429 8.8168 8.8168 8.8843 8.8843 9.8890 9.8890 9.9359 9.9359 11.2334 11.2335 k = 0.0000 0.5779 0.5433 ( 12500 PWs) bands (ev): -14.3283 -14.3283 -14.3227 -14.3227 -11.5419 -11.5419 -11.4912 -11.4912 -3.2257 -3.2257 -3.2080 -3.2080 -2.0021 -2.0021 -1.9673 -1.9673 -1.4425 -1.4425 -1.4206 -1.4206 1.3310 1.3310 1.3854 1.3854 2.2445 2.2445 2.2962 2.2962 2.3886 2.3886 2.4827 2.4827 3.9957 3.9957 4.0928 4.0928 4.1873 4.1873 4.2612 4.2612 4.3438 4.3438 4.3796 4.3796 5.1880 5.1880 5.2373 5.2373 5.2934 5.2934 5.4114 5.4114 8.8339 8.8339 8.8779 8.8779 9.9006 9.9006 9.9318 9.9318 11.2680 11.2682 k = 0.0000 0.5779 0.5621 ( 12504 PWs) bands (ev): -14.3268 -14.3268 -14.3240 -14.3240 -11.5293 -11.5293 -11.5040 -11.5040 -3.2219 -3.2219 -3.2130 -3.2130 -1.9943 -1.9943 -1.9769 -1.9769 -1.4367 -1.4367 -1.4257 -1.4257 1.3493 1.3493 1.3769 1.3769 2.2518 2.2518 2.2780 2.2780 2.4098 2.4098 2.4573 2.4573 4.0285 4.0285 4.0791 4.0791 4.1975 4.1975 4.2359 4.2359 4.3508 4.3508 4.3690 4.3690 5.2044 5.2044 5.2298 5.2298 5.3193 5.3193 5.3799 5.3799 8.8483 8.8483 8.8700 8.8700 9.9105 9.9105 9.9260 9.9260 11.2944 11.3049 k = 0.0000 0.5779 0.5808 ( 12496 PWs) bands (ev): -14.3254 -14.3254 -14.3254 -14.3254 -11.5167 -11.5167 -11.5167 -11.5167 -3.2176 -3.2176 -3.2176 -3.2176 -1.9859 -1.9859 -1.9859 -1.9859 -1.4311 -1.4311 -1.4311 -1.4311 1.3647 1.3647 1.3647 1.3647 2.2630 2.2630 2.2630 2.2630 2.4329 2.4329 2.4329 2.4329 4.0570 4.0570 4.0570 4.0570 4.2142 4.2142 4.2142 4.2142 4.3594 4.3594 4.3594 4.3594 5.2183 5.2183 5.2183 5.2183 5.3490 5.3490 5.3490 5.3490 8.8602 8.8602 8.8602 8.8602 9.9189 9.9189 9.9189 9.9189 11.3044 11.3044 k = 0.0000 0.5779 0.5808 ( 12496 PWs) bands (ev): -14.3254 -14.3254 -14.3254 -14.3254 -11.5167 -11.5167 -11.5167 -11.5167 -3.2176 -3.2176 -3.2176 -3.2176 -1.9859 -1.9859 -1.9859 -1.9859 -1.4311 -1.4311 -1.4311 -1.4311 1.3647 1.3647 1.3647 1.3647 2.2630 2.2630 2.2630 2.2630 2.4329 2.4329 2.4329 2.4329 4.0570 4.0570 4.0570 4.0570 4.2142 4.2142 4.2142 4.2142 4.3594 4.3594 4.3594 4.3594 5.2183 5.2183 5.2183 5.2183 5.3490 5.3490 5.3490 5.3490 8.8602 8.8602 8.8602 8.8602 9.9189 9.9189 9.9189 9.9189 11.3044 11.3044 k = 0.0185 0.5779 0.5808 ( 12494 PWs) bands (ev): -14.3254 -14.3254 -14.3254 -14.3254 -11.5166 -11.5166 -11.5166 -11.5166 -3.2214 -3.2214 -3.2143 -3.2143 -1.9978 -1.9978 -1.9739 -1.9739 -1.4396 -1.4396 -1.4233 -1.4233 1.3642 1.3642 1.3654 1.3654 2.2627 2.2627 2.2633 2.2633 2.4323 2.4323 2.4346 2.4346 4.0563 4.0563 4.0578 4.0578 4.2125 4.2125 4.2163 4.2163 4.3591 4.3591 4.3599 4.3599 5.2178 5.2178 5.2188 5.2188 5.3489 5.3489 5.3493 5.3493 8.8603 8.8603 8.8605 8.8605 9.9166 9.9166 9.9204 9.9204 11.3031 11.3058 k = 0.0370 0.5779 0.5808 ( 12512 PWs) bands (ev): -14.3254 -14.3254 -14.3254 -14.3254 -11.5165 -11.5165 -11.5164 -11.5164 -3.2255 -3.2255 -3.2115 -3.2115 -2.0095 -2.0095 -1.9617 -1.9617 -1.4486 -1.4486 -1.4161 -1.4161 1.3639 1.3639 1.3661 1.3661 2.2625 2.2625 2.2636 2.2636 2.4326 2.4326 2.4371 2.4371 4.0559 4.0559 4.0588 4.0588 4.2114 4.2114 4.2189 4.2189 4.3590 4.3590 4.3608 4.3608 5.2173 5.2173 5.2193 5.2193 5.3490 5.3490 5.3498 5.3498 8.8606 8.8606 8.8611 8.8611 9.9133 9.9133 9.9210 9.9210 11.2979 11.3014 k = 0.0555 0.5779 0.5808 ( 12512 PWs) bands (ev): -14.3255 -14.3255 -14.3255 -14.3255 -11.5163 -11.5163 -11.5162 -11.5162 -3.2301 -3.2301 -3.2091 -3.2091 -2.0208 -2.0208 -1.9494 -1.9494 -1.4582 -1.4582 -1.4096 -1.4096 1.3636 1.3636 1.3670 1.3670 2.2622 2.2622 2.2639 2.2639 2.4340 2.4340 2.4406 2.4406 4.0557 4.0557 4.0601 4.0601 4.2108 4.2108 4.2219 4.2219 4.3592 4.3592 4.3619 4.3619 5.2168 5.2168 5.2198 5.2198 5.3495 5.3495 5.3506 5.3506 8.8612 8.8612 8.8621 8.8621 9.9093 9.9093 9.9206 9.9206 11.2908 11.2917 k = 0.0740 0.5779 0.5808 ( 12510 PWs) bands (ev): -14.3256 -14.3256 -14.3256 -14.3256 -11.5160 -11.5160 -11.5158 -11.5158 -3.2349 -3.2349 -3.2072 -3.2072 -2.0317 -2.0317 -1.9372 -1.9372 -1.4683 -1.4683 -1.4038 -1.4038 1.3636 1.3636 1.3679 1.3679 2.2619 2.2619 2.2640 2.2640 2.4363 2.4363 2.4451 2.4451 4.0556 4.0556 4.0614 4.0614 4.2108 4.2108 4.2253 4.2253 4.3597 4.3597 4.3633 4.3633 5.2163 5.2163 5.2202 5.2202 5.3501 5.3501 5.3517 5.3517 8.8623 8.8623 8.8633 8.8633 9.9045 9.9045 9.9193 9.9193 11.2834 11.2856 k = 0.0925 0.5779 0.5808 ( 12506 PWs) bands (ev): -14.3257 -14.3257 -14.3257 -14.3257 -11.5155 -11.5155 -11.5154 -11.5154 -3.2400 -3.2400 -3.2058 -3.2058 -2.0423 -2.0423 -1.9251 -1.9251 -1.4788 -1.4788 -1.3987 -1.3987 1.3637 1.3637 1.3690 1.3690 2.2616 2.2616 2.2641 2.2641 2.4396 2.4396 2.4504 2.4504 4.0558 4.0558 4.0629 4.0629 4.2113 4.2113 4.2290 4.2290 4.3604 4.3604 4.3650 4.3650 5.2158 5.2158 5.2207 5.2207 5.3511 5.3511 5.3530 5.3530 8.8636 8.8636 8.8650 8.8650 9.8991 9.8991 9.9172 9.9172 11.2721 11.2730 k = 0.1110 0.5779 0.5808 ( 12506 PWs) bands (ev): -14.3259 -14.3259 -14.3258 -14.3258 -11.5150 -11.5150 -11.5148 -11.5148 -3.2453 -3.2453 -3.2049 -3.2049 -2.0524 -2.0524 -1.9131 -1.9131 -1.4897 -1.4897 -1.3945 -1.3945 1.3641 1.3641 1.3702 1.3702 2.2613 2.2613 2.2641 2.2641 2.4439 2.4439 2.4567 2.4567 4.0561 4.0561 4.0644 4.0644 4.2123 4.2123 4.2329 4.2329 4.3614 4.3614 4.3669 4.3669 5.2153 5.2153 5.2211 5.2211 5.3523 5.3523 5.3546 5.3546 8.8654 8.8654 8.8670 8.8670 9.8933 9.8933 9.9142 9.9142 11.2595 11.2605 k = 0.1295 0.5779 0.5808 ( 12512 PWs) bands (ev): -14.3260 -14.3260 -14.3260 -14.3260 -11.5144 -11.5144 -11.5142 -11.5142 -3.2508 -3.2508 -3.2045 -3.2045 -2.0620 -2.0620 -1.9015 -1.9015 -1.5010 -1.5010 -1.3909 -1.3909 1.3647 1.3647 1.3716 1.3716 2.2609 2.2609 2.2638 2.2638 2.4493 2.4493 2.4638 2.4638 4.0565 4.0565 4.0660 4.0660 4.2138 4.2138 4.2369 4.2369 4.3627 4.3627 4.3693 4.3693 5.2148 5.2148 5.2215 5.2215 5.3538 5.3538 5.3565 5.3565 8.8677 8.8677 8.8695 8.8695 9.8870 9.8870 9.9106 9.9106 11.2456 11.2457 k = 0.1480 0.5779 0.5808 ( 12514 PWs) bands (ev): -14.3262 -14.3262 -14.3262 -14.3262 -11.5137 -11.5137 -11.5134 -11.5134 -3.2564 -3.2564 -3.2045 -3.2045 -2.0711 -2.0711 -1.8902 -1.8902 -1.5125 -1.5125 -1.3882 -1.3882 1.3655 1.3655 1.3731 1.3731 2.2604 2.2604 2.2634 2.2634 2.4555 2.4555 2.4718 2.4718 4.0570 4.0570 4.0675 4.0675 4.2157 4.2157 4.2411 4.2411 4.3642 4.3642 4.3719 4.3719 5.2144 5.2144 5.2218 5.2218 5.3556 5.3556 5.3587 5.3587 8.8704 8.8704 8.8725 8.8725 9.8806 9.8806 9.9065 9.9065 11.2308 11.2309 k = 0.1665 0.5779 0.5808 ( 12522 PWs) bands (ev): -14.3265 -14.3265 -14.3265 -14.3265 -11.5129 -11.5129 -11.5126 -11.5126 -3.2621 -3.2621 -3.2050 -3.2050 -2.0796 -2.0796 -1.8793 -1.8793 -1.5242 -1.5242 -1.3863 -1.3863 1.3666 1.3666 1.3747 1.3747 2.2598 2.2598 2.2628 2.2628 2.4628 2.4628 2.4806 2.4806 4.0576 4.0576 4.0689 4.0689 4.2180 4.2180 4.2452 4.2452 4.3660 4.3660 4.3748 4.3748 5.2140 5.2140 5.2221 5.2221 5.3577 5.3577 5.3612 5.3612 8.8736 8.8736 8.8759 8.8759 9.8741 9.8741 9.9019 9.9019 11.2158 11.2159 k = 0.1850 0.5779 0.5808 ( 12528 PWs) bands (ev): -14.3267 -14.3267 -14.3267 -14.3267 -11.5120 -11.5120 -11.5117 -11.5117 -3.2677 -3.2677 -3.2059 -3.2059 -2.0876 -2.0876 -1.8690 -1.8690 -1.5360 -1.5360 -1.3852 -1.3852 1.3679 1.3679 1.3765 1.3765 2.2591 2.2591 2.2619 2.2619 2.4709 2.4709 2.4901 2.4901 4.0582 4.0582 4.0703 4.0703 4.2205 4.2205 4.2491 4.2491 4.3681 4.3681 4.3781 4.3781 5.2137 5.2137 5.2225 5.2225 5.3601 5.3601 5.3641 5.3641 8.8772 8.8772 8.8798 8.8798 9.8677 9.8677 9.8973 9.8973 11.2009 11.2010 k = 0.2035 0.5779 0.5808 ( 12518 PWs) bands (ev): -14.3270 -14.3270 -14.3270 -14.3270 -11.5111 -11.5111 -11.5107 -11.5107 -3.2733 -3.2733 -3.2071 -3.2071 -2.0951 -2.0951 -1.8594 -1.8594 -1.5478 -1.5478 -1.3848 -1.3848 1.3695 1.3695 1.3784 1.3784 2.2582 2.2582 2.2608 2.2608 2.4798 2.4798 2.5004 2.5004 4.0588 4.0588 4.0715 4.0715 4.2233 4.2233 4.2530 4.2530 4.3705 4.3705 4.3816 4.3816 5.2134 5.2134 5.2227 5.2227 5.3630 5.3630 5.3673 5.3673 8.8814 8.8814 8.8842 8.8842 9.8618 9.8618 9.8926 9.8926 11.1863 11.1867 k = 0.2220 0.5779 0.5808 ( 12530 PWs) bands (ev): -14.3273 -14.3273 -14.3273 -14.3273 -11.5100 -11.5100 -11.5096 -11.5096 -3.2788 -3.2788 -3.2086 -3.2086 -2.1019 -2.1019 -1.8505 -1.8505 -1.5596 -1.5596 -1.3853 -1.3853 1.3714 1.3714 1.3805 1.3805 2.2571 2.2571 2.2595 2.2595 2.4896 2.4896 2.5114 2.5114 4.0594 4.0594 4.0726 4.0726 4.2261 4.2261 4.2565 4.2565 4.3732 4.3732 4.3853 4.3853 5.2132 5.2132 5.2230 5.2230 5.3661 5.3661 5.3708 5.3708 8.8861 8.8861 8.8892 8.8892 9.8563 9.8563 9.8882 9.8882 11.1719 11.1720 k = 0.2405 0.5779 0.5808 ( 12526 PWs) bands (ev): -14.3277 -14.3277 -14.3277 -14.3277 -11.5088 -11.5088 -11.5084 -11.5084 -3.2841 -3.2841 -3.2105 -3.2105 -2.1082 -2.1082 -1.8425 -1.8425 -1.5712 -1.5712 -1.3866 -1.3866 1.3736 1.3736 1.3827 1.3827 2.2559 2.2559 2.2579 2.2579 2.5000 2.5000 2.5229 2.5229 4.0600 4.0600 4.0735 4.0735 4.2290 4.2290 4.2598 4.2598 4.3762 4.3762 4.3892 4.3892 5.2131 5.2131 5.2233 5.2233 5.3697 5.3697 5.3748 5.3748 8.8912 8.8912 8.8945 8.8945 9.8515 9.8515 9.8842 9.8842 11.1576 11.1578 k = 0.2590 0.5779 0.5808 ( 12518 PWs) bands (ev): -14.3281 -14.3281 -14.3281 -14.3281 -11.5076 -11.5076 -11.5072 -11.5072 -3.2891 -3.2891 -3.2125 -3.2125 -2.1139 -2.1139 -1.8354 -1.8354 -1.5825 -1.5825 -1.3887 -1.3887 1.3760 1.3760 1.3850 1.3850 2.2546 2.2546 2.2562 2.2562 2.5111 2.5111 2.5350 2.5350 4.0604 4.0604 4.0742 4.0742 4.2317 4.2317 4.2627 4.2627 4.3794 4.3794 4.3932 4.3932 5.2130 5.2130 5.2235 5.2235 5.3736 5.3736 5.3791 5.3791 8.8967 8.8967 8.9003 8.9003 9.8476 9.8476 9.8810 9.8810 11.1430 11.1433 k = 0.2775 0.5779 0.5808 ( 12514 PWs) bands (ev): -14.3285 -14.3285 -14.3285 -14.3285 -11.5063 -11.5063 -11.5059 -11.5059 -3.2939 -3.2939 -3.2147 -3.2147 -2.1190 -2.1190 -1.8295 -1.8295 -1.5934 -1.5934 -1.3916 -1.3916 1.3786 1.3786 1.3874 1.3874 2.2532 2.2532 2.2544 2.2544 2.5228 2.5228 2.5475 2.5475 4.0608 4.0608 4.0748 4.0748 4.2342 4.2342 4.2653 4.2653 4.3829 4.3829 4.3972 4.3972 5.2130 5.2130 5.2238 5.2238 5.3780 5.3780 5.3838 5.3838 8.9024 8.9024 8.9064 8.9064 9.8446 9.8446 9.8785 9.8785 11.1276 11.1287 k = 0.2960 0.5779 0.5808 ( 12518 PWs) bands (ev): -14.3289 -14.3289 -14.3289 -14.3289 -11.5049 -11.5049 -11.5045 -11.5045 -3.2984 -3.2984 -3.2171 -3.2171 -2.1235 -2.1235 -1.8247 -1.8247 -1.6037 -1.6037 -1.3953 -1.3953 1.3813 1.3813 1.3899 1.3899 2.2517 2.2517 2.2524 2.2524 2.5349 2.5349 2.5605 2.5605 4.0611 4.0611 4.0751 4.0751 4.2365 4.2365 4.2675 4.2675 4.3865 4.3865 4.4011 4.4011 5.2131 5.2131 5.2240 5.2240 5.3827 5.3827 5.3890 5.3890 8.9084 8.9084 8.9126 8.9126 9.8426 9.8426 9.8769 9.8769 11.1109 11.1111 k = 0.3145 0.5779 0.5808 ( 12526 PWs) bands (ev): -14.3294 -14.3294 -14.3294 -14.3294 -11.5035 -11.5035 -11.5030 -11.5030 -3.3025 -3.3025 -3.2195 -3.2195 -2.1274 -2.1274 -1.8213 -1.8213 -1.6133 -1.6133 -1.3997 -1.3997 1.3843 1.3843 1.3924 1.3924 2.2501 2.2501 2.2504 2.2504 2.5475 2.5475 2.5738 2.5738 4.0613 4.0613 4.0753 4.0753 4.2384 4.2384 4.2693 4.2693 4.3903 4.3903 4.4048 4.4048 5.2132 5.2132 5.2243 5.2243 5.3879 5.3879 5.3945 5.3945 8.9143 8.9143 8.9190 8.9190 9.8416 9.8416 9.8763 9.8763 11.0925 11.0927 k = 0.3330 0.5779 0.5808 ( 12520 PWs) bands (ev): -14.3299 -14.3299 -14.3299 -14.3299 -11.5020 -11.5020 -11.5015 -11.5015 -3.3062 -3.3062 -3.2219 -3.2219 -2.1308 -2.1308 -1.8192 -1.8192 -1.6221 -1.6221 -1.4049 -1.4049 1.3872 1.3872 1.3949 1.3949 2.2483 2.2483 2.2485 2.2485 2.5605 2.5605 2.5873 2.5873 4.0614 4.0614 4.0754 4.0754 4.2400 4.2400 4.2708 4.2708 4.3941 4.3941 4.4083 4.4083 5.2135 5.2135 5.2246 5.2246 5.3934 5.3934 5.4004 5.4004 8.9202 8.9202 8.9253 8.9253 9.8413 9.8413 9.8764 9.8764 11.0719 11.0719 k = 0.3330 0.5779 0.5808 ( 12520 PWs) bands (ev): -14.3299 -14.3299 -14.3299 -14.3299 -11.5020 -11.5020 -11.5015 -11.5015 -3.3062 -3.3062 -3.2219 -3.2219 -2.1308 -2.1308 -1.8192 -1.8192 -1.6221 -1.6221 -1.4049 -1.4049 1.3872 1.3872 1.3949 1.3949 2.2483 2.2483 2.2485 2.2485 2.5605 2.5605 2.5873 2.5873 4.0614 4.0614 4.0754 4.0754 4.2400 4.2400 4.2708 4.2708 4.3941 4.3941 4.4083 4.4083 5.2135 5.2135 5.2246 5.2246 5.3934 5.3934 5.4004 5.4004 8.9202 8.9202 8.9253 8.9253 9.8413 9.8413 9.8764 9.8764 11.0719 11.0723 k = 0.3237 0.5619 0.5808 ( 12522 PWs) bands (ev): -14.3289 -14.3289 -14.3289 -14.3289 -11.5050 -11.5050 -11.5045 -11.5045 -3.2990 -3.2990 -3.2173 -3.2173 -2.1246 -2.1246 -1.8230 -1.8230 -1.6049 -1.6049 -1.3941 -1.3941 1.3812 1.3812 1.3900 1.3900 2.2517 2.2517 2.2526 2.2526 2.5348 2.5348 2.5605 2.5605 4.0614 4.0614 4.0754 4.0754 4.2372 4.2372 4.2680 4.2680 4.3865 4.3865 4.4019 4.4019 5.2130 5.2130 5.2240 5.2240 5.3826 5.3826 5.3888 5.3888 8.9090 8.9090 8.9133 8.9133 9.8401 9.8401 9.8743 9.8743 11.1170 11.1171 k = 0.3145 0.5458 0.5808 ( 12526 PWs) bands (ev): -14.3280 -14.3280 -14.3280 -14.3280 -11.5077 -11.5077 -11.5072 -11.5072 -3.2916 -3.2916 -3.2131 -3.2131 -2.1183 -2.1183 -1.8285 -1.8285 -1.5876 -1.5876 -1.3842 -1.3842 1.3753 1.3753 1.3852 1.3852 2.2550 2.2550 2.2571 2.2571 2.5107 2.5107 2.5350 2.5350 4.0614 4.0614 4.0754 4.0754 4.2343 4.2343 4.2645 4.2645 4.3792 4.3792 4.3959 4.3959 5.2127 5.2127 5.2234 5.2234 5.3732 5.3732 5.3784 5.3784 8.8985 8.8985 8.9021 8.9021 9.8364 9.8364 9.8696 9.8696 11.1646 11.1646 k = 0.3052 0.5298 0.5808 ( 12522 PWs) bands (ev): -14.3272 -14.3272 -14.3272 -14.3272 -11.5101 -11.5101 -11.5097 -11.5097 -3.2840 -3.2840 -3.2094 -3.2094 -2.1118 -2.1118 -1.8352 -1.8352 -1.5710 -1.5710 -1.3754 -1.3754 1.3695 1.3695 1.3805 1.3805 2.2581 2.2581 2.2619 2.2619 2.4887 2.4887 2.5115 2.5115 4.0615 4.0615 4.0753 4.0753 4.2311 4.2311 4.2604 4.2604 4.3722 4.3722 4.3905 4.3905 5.2126 5.2126 5.2228 5.2228 5.3654 5.3654 5.3693 5.3693 8.8886 8.8886 8.8914 8.8914 9.8299 9.8299 9.8620 9.8620 11.2139 11.2140 k = 0.2960 0.5137 0.5808 ( 12520 PWs) bands (ev): -14.3265 -14.3265 -14.3265 -14.3265 -11.5122 -11.5122 -11.5118 -11.5118 -3.2764 -3.2764 -3.2063 -3.2063 -2.1051 -2.1051 -1.8425 -1.8425 -1.5557 -1.5557 -1.3680 -1.3680 1.3637 1.3637 1.3760 1.3760 2.2611 2.2611 2.2667 2.2667 2.4692 2.4692 2.4906 2.4906 4.0616 4.0616 4.0750 4.0750 4.2279 4.2279 4.2557 4.2557 4.3656 4.3656 4.3857 4.3857 5.2128 5.2128 5.2222 5.2222 5.3591 5.3591 5.3616 5.3616 8.8790 8.8790 8.8813 8.8813 9.8206 9.8206 9.8514 9.8514 11.2636 11.2638 k = 0.2867 0.4977 0.5808 ( 12524 PWs) bands (ev): -14.3260 -14.3260 -14.3260 -14.3260 -11.5139 -11.5139 -11.5136 -11.5136 -3.2687 -3.2687 -3.2037 -3.2037 -2.0983 -2.0983 -1.8503 -1.8503 -1.5422 -1.5422 -1.3622 -1.3622 1.3581 1.3581 1.3715 1.3715 2.2636 2.2636 2.2714 2.2714 2.4527 2.4527 2.4726 2.4726 4.0617 4.0617 4.0746 4.0746 4.2244 4.2244 4.2503 4.2503 4.3595 4.3595 4.3815 4.3815 5.2133 5.2133 5.2217 5.2217 5.3544 5.3544 5.3553 5.3553 8.8697 8.8697 8.8716 8.8716 9.8081 9.8081 9.8375 9.8375 11.3104 11.3104 k = 0.2775 0.4816 0.5808 ( 12504 PWs) bands (ev): -14.3256 -14.3256 -14.3256 -14.3256 -11.5152 -11.5152 -11.5149 -11.5149 -3.2610 -3.2610 -3.2016 -3.2016 -2.0913 -2.0913 -1.8582 -1.8582 -1.5308 -1.5308 -1.3583 -1.3583 1.3526 1.3526 1.3671 1.3671 2.2656 2.2656 2.2756 2.2756 2.4399 2.4399 2.4583 2.4583 4.0618 4.0618 4.0741 4.0741 4.2209 4.2209 4.2445 4.2445 4.3539 4.3539 4.3780 4.3780 5.2141 5.2141 5.2213 5.2213 5.3504 5.3504 5.3512 5.3512 8.8606 8.8606 8.8621 8.8621 9.7924 9.7924 9.8201 9.8201 11.3418 11.3433 k = 0.2682 0.4656 0.5808 ( 12496 PWs) bands (ev): -14.3254 -14.3254 -14.3254 -14.3254 -11.5161 -11.5161 -11.5159 -11.5159 -3.2535 -3.2535 -3.2002 -3.2002 -2.0841 -2.0841 -1.8662 -1.8662 -1.5218 -1.5218 -1.3564 -1.3564 1.3472 1.3472 1.3627 1.3627 2.2668 2.2668 2.2792 2.2792 2.4312 2.4312 2.4479 2.4479 4.0620 4.0620 4.0733 4.0733 4.2173 4.2173 4.2381 4.2381 4.3489 4.3489 4.3751 4.3751 5.2151 5.2151 5.2209 5.2209 5.3468 5.3468 5.3495 5.3495 8.8515 8.8515 8.8527 8.8527 9.7733 9.7733 9.7991 9.7991 11.3387 11.3416 k = 0.2590 0.4495 0.5808 ( 12494 PWs) bands (ev): -14.3253 -14.3253 -14.3253 -14.3253 -11.5166 -11.5166 -11.5165 -11.5165 -3.2461 -3.2461 -3.1992 -3.1992 -2.0766 -2.0766 -1.8741 -1.8741 -1.5153 -1.5153 -1.3568 -1.3568 1.3419 1.3419 1.3583 1.3583 2.2675 2.2675 2.2820 2.2820 2.4270 2.4270 2.4419 2.4419 4.0621 4.0621 4.0725 4.0725 4.2137 4.2137 4.2314 4.2314 4.3444 4.3444 4.3728 4.3728 5.2164 5.2164 5.2207 5.2207 5.3447 5.3447 5.3494 5.3494 8.8423 8.8423 8.8434 8.8434 9.7506 9.7506 9.7743 9.7743 11.3131 11.3241 k = 0.2497 0.4335 0.5808 ( 12514 PWs) bands (ev): -14.3254 -14.3254 -14.3254 -14.3254 -11.5167 -11.5167 -11.5166 -11.5166 -3.2390 -3.2390 -3.1989 -3.1989 -2.0689 -2.0689 -1.8818 -1.8818 -1.5114 -1.5114 -1.3595 -1.3595 1.3367 1.3367 1.3538 1.3538 2.2675 2.2675 2.2837 2.2837 2.4274 2.4274 2.4401 2.4401 4.0622 4.0622 4.0714 4.0714 4.2102 4.2102 4.2245 4.2245 4.3404 4.3404 4.3710 4.3710 5.2180 5.2180 5.2207 5.2207 5.3439 5.3439 5.3506 5.3506 8.8329 8.8329 8.8339 8.8339 9.7244 9.7244 9.7458 9.7458 11.2910 11.2932 k = 0.2405 0.4174 0.5808 ( 12522 PWs) bands (ev): -14.3256 -14.3256 -14.3256 -14.3256 -11.5164 -11.5164 -11.5163 -11.5163 -3.2323 -3.2323 -3.1990 -3.1990 -2.0610 -2.0610 -1.8892 -1.8892 -1.5102 -1.5102 -1.3647 -1.3647 1.3316 1.3316 1.3492 1.3492 2.2674 2.2674 2.2848 2.2848 2.4324 2.4324 2.4424 2.4424 4.0622 4.0622 4.0702 4.0702 4.2067 4.2067 4.2176 4.2176 4.3370 4.3370 4.3697 4.3697 5.2198 5.2198 5.2208 5.2208 5.3446 5.3446 5.3532 5.3532 8.8232 8.8232 8.8242 8.8242 9.6947 9.6947 9.7136 9.7136 11.2720 11.2774 k = 0.2312 0.4013 0.5808 ( 12518 PWs) bands (ev): -14.3260 -14.3260 -14.3260 -14.3260 -11.5156 -11.5156 -11.5156 -11.5156 -3.2259 -3.2259 -3.1997 -3.1997 -2.0528 -2.0528 -1.8963 -1.8963 -1.5117 -1.5117 -1.3723 -1.3723 1.3265 1.3265 1.3445 1.3445 2.2674 2.2674 2.2854 2.2854 2.4415 2.4415 2.4486 2.4486 4.0623 4.0623 4.0689 4.0689 4.2035 4.2035 4.2106 4.2106 4.3341 4.3341 4.3688 4.3688 5.2212 5.2212 5.2217 5.2217 5.3467 5.3467 5.3570 5.3570 8.8131 8.8131 8.8142 8.8142 9.6616 9.6616 9.6779 9.6779 11.2556 11.2574 k = 0.2220 0.3853 0.5808 ( 12520 PWs) bands (ev): -14.3266 -14.3266 -14.3266 -14.3266 -11.5144 -11.5144 -11.5144 -11.5144 -3.2200 -3.2200 -3.2008 -3.2008 -2.0444 -2.0444 -1.9030 -1.9030 -1.5156 -1.5156 -1.3824 -1.3824 1.3215 1.3215 1.3396 1.3396 2.2678 2.2678 2.2860 2.2860 2.4543 2.4543 2.4581 2.4581 4.0622 4.0622 4.0674 4.0674 4.2005 4.2005 4.2038 4.2038 4.3317 4.3317 4.3682 4.3682 5.2218 5.2218 5.2238 5.2238 5.3503 5.3503 5.3622 5.3622 8.8024 8.8024 8.8038 8.8038 9.6256 9.6256 9.6393 9.6393 11.2422 11.2437 k = 0.2127 0.3692 0.5808 ( 12518 PWs) bands (ev): -14.3273 -14.3273 -14.3273 -14.3273 -11.5129 -11.5129 -11.5128 -11.5128 -3.2146 -3.2146 -3.2024 -3.2024 -2.0357 -2.0357 -1.9094 -1.9094 -1.5219 -1.5219 -1.3949 -1.3949 1.3166 1.3166 1.3347 1.3347 2.2690 2.2690 2.2869 2.2869 2.4702 2.4702 2.4707 2.4707 4.0622 4.0622 4.0659 4.0659 4.1972 4.1972 4.1977 4.1977 4.3298 4.3298 4.3679 4.3679 5.2226 5.2226 5.2260 5.2260 5.3553 5.3553 5.3684 5.3684 8.7912 8.7912 8.7929 8.7929 9.5869 9.5869 9.5981 9.5981 11.2309 11.2312 k = 0.2035 0.3532 0.5808 ( 12506 PWs) bands (ev): -14.3281 -14.3281 -14.3281 -14.3281 -11.5110 -11.5110 -11.5108 -11.5108 -3.2097 -3.2097 -3.2043 -3.2043 -2.0268 -2.0268 -1.9153 -1.9153 -1.5305 -1.5305 -1.4097 -1.4097 1.3118 1.3118 1.3296 1.3296 2.2710 2.2710 2.2883 2.2883 2.4860 2.4860 2.4888 2.4888 4.0621 4.0621 4.0643 4.0643 4.1910 4.1910 4.1953 4.1953 4.3282 4.3282 4.3678 4.3678 5.2236 5.2236 5.2281 5.2281 5.3616 5.3616 5.3758 5.3758 8.7792 8.7792 8.7813 8.7813 9.5461 9.5461 9.5548 9.5548 11.2217 11.2218 k = 0.1942 0.3371 0.5808 ( 12500 PWs) bands (ev): -14.3291 -14.3291 -14.3291 -14.3291 -11.5087 -11.5087 -11.5085 -11.5085 -3.2065 -3.2065 -3.2054 -3.2054 -2.0178 -2.0178 -1.9207 -1.9207 -1.5409 -1.5409 -1.4267 -1.4267 1.3071 1.3071 1.3244 1.3244 2.2738 2.2738 2.2902 2.2902 2.5037 2.5037 2.5097 2.5097 4.0619 4.0619 4.0626 4.0626 4.1852 4.1852 4.1931 4.1931 4.3271 4.3271 4.3679 4.3679 5.2248 5.2248 5.2303 5.2303 5.3694 5.3694 5.3842 5.3842 8.7664 8.7664 8.7691 8.7691 9.5039 9.5039 9.5103 9.5103 11.2135 11.2135 k = 0.1850 0.3211 0.5808 ( 12516 PWs) bands (ev): -14.3301 -14.3301 -14.3301 -14.3301 -11.5061 -11.5061 -11.5058 -11.5058 -3.2090 -3.2090 -3.2017 -3.2017 -2.0085 -2.0085 -1.9258 -1.9258 -1.5531 -1.5531 -1.4456 -1.4456 1.3025 1.3025 1.3191 1.3191 2.2774 2.2774 2.2928 2.2928 2.5236 2.5236 2.5326 2.5326 4.0610 4.0610 4.0617 4.0617 4.1799 4.1799 4.1913 4.1913 4.3263 4.3263 4.3682 4.3682 5.2262 5.2262 5.2324 5.2324 5.3784 5.3784 5.3937 5.3937 8.7527 8.7527 8.7560 8.7560 9.4607 9.4607 9.4650 9.4650 11.2053 11.2053 k = 0.1757 0.3050 0.5808 ( 12524 PWs) bands (ev): -14.3313 -14.3313 -14.3313 -14.3313 -11.5031 -11.5031 -11.5029 -11.5029 -3.2118 -3.2118 -3.1987 -3.1987 -1.9992 -1.9992 -1.9303 -1.9303 -1.5667 -1.5667 -1.4663 -1.4663 1.2980 1.2980 1.3139 1.3139 2.2817 2.2817 2.2958 2.2958 2.5453 2.5453 2.5571 2.5571 4.0594 4.0594 4.0614 4.0614 4.1751 4.1751 4.1897 4.1897 4.3259 4.3259 4.3685 4.3685 5.2277 5.2277 5.2345 5.2345 5.3887 5.3887 5.4040 5.4040 8.7382 8.7382 8.7422 8.7422 9.4173 9.4173 9.4198 9.4198 11.1962 11.1962 k = 0.1665 0.2890 0.5808 ( 12548 PWs) bands (ev): -14.3326 -14.3326 -14.3326 -14.3326 -11.5000 -11.5000 -11.4997 -11.4997 -3.2146 -3.2146 -3.1963 -3.1963 -1.9897 -1.9897 -1.9344 -1.9344 -1.5815 -1.5815 -1.4884 -1.4884 1.2938 1.2938 1.3088 1.3088 2.2864 2.2864 2.2993 2.2993 2.5686 2.5686 2.5828 2.5828 4.0579 4.0579 4.0610 4.0610 4.1709 4.1709 4.1885 4.1885 4.3257 4.3257 4.3690 4.3690 5.2294 5.2294 5.2365 5.2365 5.4000 5.4000 5.4151 5.4151 8.7226 8.7226 8.7275 8.7275 9.3743 9.3743 9.3752 9.3752 11.1851 11.1851 k = 0.1572 0.2729 0.5808 ( 12540 PWs) bands (ev): -14.3339 -14.3339 -14.3339 -14.3339 -11.4966 -11.4966 -11.4963 -11.4963 -3.2176 -3.2176 -3.1945 -3.1945 -1.9802 -1.9802 -1.9381 -1.9381 -1.5970 -1.5970 -1.5119 -1.5119 1.2897 1.2897 1.3038 1.3038 2.2916 2.2916 2.3031 2.3031 2.5931 2.5931 2.6094 2.6094 4.0566 4.0566 4.0606 4.0606 4.1673 4.1673 4.1875 4.1875 4.3259 4.3259 4.3694 4.3694 5.2311 5.2311 5.2384 5.2384 5.4123 5.4123 5.4270 5.4270 8.7062 8.7062 8.7119 8.7119 9.3320 9.3320 9.3323 9.3323 11.1711 11.1711 k = 0.1480 0.2569 0.5808 ( 12540 PWs) bands (ev): -14.3353 -14.3353 -14.3353 -14.3353 -11.4931 -11.4931 -11.4927 -11.4927 -3.2205 -3.2205 -3.1934 -3.1934 -1.9707 -1.9707 -1.9413 -1.9413 -1.6132 -1.6132 -1.5363 -1.5363 1.2859 1.2859 1.2990 1.2990 2.2969 2.2969 2.3072 2.3072 2.6185 2.6185 2.6365 2.6365 4.0554 4.0554 4.0602 4.0602 4.1643 4.1643 4.1866 4.1866 4.3264 4.3264 4.3699 4.3699 5.2329 5.2329 5.2403 5.2403 5.4255 5.4255 5.4395 5.4395 8.6888 8.6888 8.6955 8.6955 9.2906 9.2906 9.2919 9.2919 11.1535 11.1536 k = 0.1387 0.2408 0.5808 ( 12544 PWs) bands (ev): -14.3368 -14.3368 -14.3368 -14.3368 -11.4894 -11.4894 -11.4890 -11.4890 -3.2234 -3.2234 -3.1929 -3.1929 -1.9612 -1.9612 -1.9441 -1.9441 -1.6296 -1.6296 -1.5615 -1.5615 1.2823 1.2823 1.2944 1.2944 2.3023 2.3023 2.3114 2.3114 2.6446 2.6446 2.6638 2.6638 4.0544 4.0544 4.0598 4.0598 4.1619 4.1619 4.1860 4.1860 4.3271 4.3271 4.3703 4.3703 5.2348 5.2348 5.2421 5.2421 5.4393 5.4393 5.4525 5.4525 8.6705 8.6705 8.6783 8.6783 9.2515 9.2515 9.2535 9.2535 11.1319 11.1322 k = 0.1295 0.2248 0.5808 ( 12552 PWs) bands (ev): -14.3382 -14.3382 -14.3382 -14.3382 -11.4857 -11.4857 -11.4853 -11.4853 -3.2262 -3.2262 -3.1930 -3.1930 -1.9517 -1.9517 -1.9464 -1.9464 -1.6461 -1.6461 -1.5872 -1.5872 1.2791 1.2791 1.2901 1.2901 2.3077 2.3077 2.3157 2.3157 2.6708 2.6708 2.6910 2.6910 4.0536 4.0536 4.0594 4.0594 4.1601 4.1601 4.1855 4.1855 4.3281 4.3281 4.3707 4.3707 5.2367 5.2367 5.2438 5.2438 5.4537 5.4537 5.4658 5.4658 8.6517 8.6517 8.6605 8.6605 9.2152 9.2152 9.2176 9.2176 11.1064 11.1064 k = 0.1202 0.2087 0.5808 ( 12552 PWs) bands (ev): -14.3397 -14.3397 -14.3397 -14.3397 -11.4819 -11.4819 -11.4815 -11.4815 -3.2289 -3.2289 -3.1937 -3.1937 -1.9482 -1.9482 -1.9424 -1.9424 -1.6624 -1.6624 -1.6130 -1.6130 1.2761 1.2761 1.2861 1.2861 2.3131 2.3131 2.3200 2.3200 2.6969 2.6969 2.7176 2.7176 4.0531 4.0531 4.0590 4.0590 4.1587 4.1587 4.1851 4.1851 4.3293 4.3293 4.3710 4.3710 5.2386 5.2386 5.2454 5.2454 5.4683 5.4683 5.4794 5.4794 8.6324 8.6324 8.6421 8.6421 9.1817 9.1817 9.1844 9.1844 11.0774 11.0776 k = 0.1110 0.1926 0.5808 ( 12538 PWs) bands (ev): -14.3411 -14.3411 -14.3411 -14.3411 -11.4782 -11.4782 -11.4778 -11.4778 -3.2312 -3.2312 -3.1949 -3.1949 -1.9494 -1.9494 -1.9332 -1.9332 -1.6784 -1.6784 -1.6388 -1.6388 1.2733 1.2733 1.2823 1.2823 2.3182 2.3182 2.3241 2.3241 2.7226 2.7226 2.7433 2.7433 4.0527 4.0527 4.0587 4.0587 4.1579 4.1579 4.1847 4.1847 4.3308 4.3308 4.3712 4.3712 5.2405 5.2405 5.2469 5.2469 5.4830 5.4830 5.4929 5.4929 8.6130 8.6130 8.6236 8.6236 9.1514 9.1514 9.1540 9.1540 11.0456 11.0456 k = 0.1017 0.1766 0.5808 ( 12546 PWs) bands (ev): -14.3425 -14.3425 -14.3425 -14.3425 -11.4745 -11.4745 -11.4741 -11.4741 -3.2333 -3.2333 -3.1966 -3.1966 -1.9501 -1.9501 -1.9242 -1.9242 -1.6937 -1.6937 -1.6643 -1.6643 1.2709 1.2709 1.2790 1.2790 2.3231 2.3231 2.3282 2.3282 2.7475 2.7475 2.7679 2.7679 4.0526 4.0526 4.0585 4.0585 4.1576 4.1576 4.1843 4.1843 4.3324 4.3324 4.3712 4.3712 5.2424 5.2424 5.2483 5.2483 5.4977 5.4977 5.5063 5.5063 8.5938 8.5938 8.6050 8.6050 9.1242 9.1242 9.1267 9.1267 11.0117 11.0121 k = 0.0925 0.1605 0.5808 ( 12546 PWs) bands (ev): -14.3439 -14.3439 -14.3438 -14.3438 -11.4710 -11.4710 -11.4706 -11.4706 -3.2351 -3.2351 -3.1988 -3.1988 -1.9502 -1.9502 -1.9155 -1.9155 -1.7085 -1.7085 -1.6893 -1.6893 1.2688 1.2688 1.2759 1.2759 2.3277 2.3277 2.3320 2.3320 2.7712 2.7712 2.7910 2.7910 4.0526 4.0526 4.0583 4.0583 4.1577 4.1577 4.1839 4.1839 4.3343 4.3343 4.3711 4.3711 5.2442 5.2442 5.2496 5.2496 5.5119 5.5119 5.5194 5.5194 8.5751 8.5751 8.5868 8.5868 9.1000 9.1000 9.1023 9.1023 10.9767 10.9767 k = 0.0832 0.1445 0.5808 ( 12556 PWs) bands (ev): -14.3451 -14.3451 -14.3451 -14.3451 -11.4676 -11.4676 -11.4673 -11.4673 -3.2365 -3.2365 -3.2013 -3.2013 -1.9496 -1.9496 -1.9070 -1.9070 -1.7225 -1.7225 -1.7134 -1.7134 1.2669 1.2669 1.2732 1.2732 2.3320 2.3320 2.3357 2.3357 2.7937 2.7937 2.8125 2.8125 4.0528 4.0528 4.0581 4.0581 4.1582 4.1582 4.1834 4.1834 4.3364 4.3364 4.3708 4.3708 5.2459 5.2459 5.2508 5.2508 5.5256 5.5256 5.5320 5.5320 8.5574 8.5574 8.5692 8.5692 9.0788 9.0788 9.0808 9.0808 10.9416 10.9423 k = 0.0740 0.1284 0.5808 ( 12552 PWs) bands (ev): -14.3463 -14.3463 -14.3463 -14.3463 -11.4645 -11.4645 -11.4641 -11.4641 -3.2375 -3.2375 -3.2042 -3.2042 -1.9482 -1.9482 -1.8990 -1.8990 -1.7365 -1.7365 -1.7357 -1.7357 1.2653 1.2653 1.2708 1.2708 2.3360 2.3360 2.3390 2.3390 2.8145 2.8145 2.8320 2.8320 4.0532 4.0532 4.0581 4.0581 4.1590 4.1590 4.1828 4.1828 4.3387 4.3387 4.3704 4.3704 5.2475 5.2475 5.2519 5.2519 5.5386 5.5386 5.5439 5.5439 8.5409 8.5409 8.5526 8.5526 9.0605 9.0605 9.0622 9.0622 10.9074 10.9074 k = 0.0647 0.1124 0.5808 ( 12538 PWs) bands (ev): -14.3474 -14.3474 -14.3474 -14.3474 -11.4616 -11.4616 -11.4613 -11.4613 -3.2380 -3.2380 -3.2073 -3.2073 -1.9459 -1.9459 -1.8915 -1.8915 -1.7582 -1.7582 -1.7480 -1.7480 1.2640 1.2640 1.2687 1.2687 2.3395 2.3395 2.3420 2.3420 2.8335 2.8335 2.8495 2.8495 4.0536 4.0536 4.0580 4.0580 4.1601 4.1601 4.1820 4.1820 4.3411 4.3411 4.3697 4.3697 5.2490 5.2490 5.2528 5.2528 5.5505 5.5505 5.5549 5.5549 8.5260 8.5260 8.5372 8.5372 9.0447 9.0447 9.0461 9.0461 10.8749 10.8751 k = 0.0555 0.0963 0.5808 ( 12530 PWs) bands (ev): -14.3484 -14.3484 -14.3484 -14.3484 -11.4590 -11.4590 -11.4587 -11.4587 -3.2381 -3.2381 -3.2105 -3.2105 -1.9427 -1.9427 -1.8848 -1.8848 -1.7780 -1.7780 -1.7596 -1.7596 1.2630 1.2630 1.2668 1.2668 2.3426 2.3426 2.3446 2.3446 2.8505 2.8505 2.8647 2.8647 4.0541 4.0541 4.0580 4.0580 4.1615 4.1615 4.1811 4.1811 4.3435 4.3435 4.3688 4.3688 5.2503 5.2503 5.2536 5.2536 5.5613 5.5613 5.5648 5.5648 8.5129 8.5129 8.5233 8.5233 9.0315 9.0315 9.0326 9.0326 10.8451 10.8451 k = 0.0462 0.0803 0.5808 ( 12530 PWs) bands (ev): -14.3492 -14.3492 -14.3492 -14.3492 -11.4567 -11.4567 -11.4565 -11.4565 -3.2378 -3.2378 -3.2139 -3.2139 -1.9384 -1.9384 -1.8795 -1.8795 -1.7954 -1.7954 -1.7704 -1.7704 1.2621 1.2621 1.2653 1.2653 2.3453 2.3453 2.3469 2.3469 2.8654 2.8654 2.8775 2.8775 4.0547 4.0547 4.0580 4.0580 4.1630 4.1630 4.1800 4.1800 4.3461 4.3461 4.3677 4.3677 5.2515 5.2515 5.2543 5.2543 5.5707 5.5707 5.5734 5.5734 8.5017 8.5017 8.5110 8.5110 9.0205 9.0205 9.0214 9.0214 10.8186 10.8188 k = 0.0370 0.0642 0.5808 ( 12538 PWs) bands (ev): -14.3499 -14.3499 -14.3499 -14.3499 -11.4548 -11.4548 -11.4547 -11.4547 -3.2370 -3.2370 -3.2173 -3.2173 -1.9330 -1.9330 -1.8765 -1.8765 -1.8091 -1.8091 -1.7804 -1.7804 1.2615 1.2615 1.2640 1.2640 2.3476 2.3476 2.3488 2.3488 2.8779 2.8779 2.8879 2.8879 4.0553 4.0553 4.0579 4.0579 4.1648 4.1648 4.1788 4.1788 4.3487 4.3487 4.3663 4.3663 5.2526 5.2526 5.2548 5.2548 5.5787 5.5787 5.5807 5.5807 8.4927 8.4927 8.5006 8.5006 9.0118 9.0118 9.0124 9.0124 10.7964 10.7964 k = 0.0277 0.0482 0.5808 ( 12530 PWs) bands (ev): -14.3505 -14.3505 -14.3505 -14.3505 -11.4533 -11.4533 -11.4532 -11.4532 -3.2357 -3.2357 -3.2206 -3.2206 -1.9265 -1.9265 -1.8774 -1.8774 -1.8176 -1.8176 -1.7897 -1.7897 1.2611 1.2611 1.2630 1.2630 2.3493 2.3493 2.3502 2.3502 2.8881 2.8881 2.8957 2.8957 4.0558 4.0558 4.0578 4.0578 4.1666 4.1666 4.1774 4.1774 4.3513 4.3513 4.3647 4.3647 5.2535 5.2535 5.2552 5.2552 5.5851 5.5851 5.5865 5.5865 8.4860 8.4860 8.4921 8.4921 9.0051 9.0051 9.0056 9.0056 10.7787 10.7790 k = 0.0185 0.0321 0.5808 ( 12518 PWs) bands (ev): -14.3509 -14.3509 -14.3509 -14.3509 -11.4522 -11.4522 -11.4521 -11.4521 -3.2340 -3.2340 -3.2238 -3.2238 -1.9189 -1.9189 -1.8827 -1.8827 -1.8201 -1.8201 -1.7983 -1.7983 1.2609 1.2609 1.2621 1.2621 2.3507 2.3507 2.3512 2.3512 2.8958 2.8958 2.9010 2.9010 4.0563 4.0563 4.0577 4.0577 4.1685 4.1685 4.1758 4.1758 4.3539 4.3539 4.3629 4.3629 5.2542 5.2542 5.2553 5.2553 5.5897 5.5897 5.5906 5.5906 8.4814 8.4814 8.4856 8.4856 9.0004 9.0004 9.0007 9.0007 10.7662 10.7664 k = 0.0092 0.0161 0.5808 ( 12504 PWs) bands (ev): -14.3511 -14.3511 -14.3511 -14.3511 -11.4516 -11.4516 -11.4515 -11.4515 -3.2319 -3.2319 -3.2268 -3.2268 -1.9102 -1.9102 -1.8912 -1.8912 -1.8178 -1.8178 -1.8060 -1.8060 1.2609 1.2609 1.2615 1.2615 2.3515 2.3515 2.3518 2.3518 2.9010 2.9010 2.9036 2.9036 4.0568 4.0568 4.0575 4.0575 4.1704 4.1704 4.1741 4.1741 4.3563 4.3563 4.3609 4.3609 5.2548 5.2548 5.2553 5.2553 5.5926 5.5926 5.5931 5.5931 8.4792 8.4792 8.4813 8.4813 8.9977 8.9977 8.9978 8.9978 10.7590 10.7604 k = 0.0000 0.0000 0.5808 ( 12480 PWs) bands (ev): -14.3512 -14.3512 -14.3512 -14.3512 -11.4513 -11.4513 -11.4513 -11.4513 -3.2295 -3.2295 -3.2295 -3.2295 -1.9007 -1.9007 -1.9007 -1.9007 -1.8127 -1.8127 -1.8127 -1.8127 1.2611 1.2611 1.2611 1.2611 2.3519 2.3519 2.3519 2.3519 2.9036 2.9036 2.9036 2.9036 4.0572 4.0572 4.0572 4.0572 4.1723 4.1723 4.1723 4.1723 4.3587 4.3587 4.3587 4.3587 5.2551 5.2551 5.2551 5.2551 5.5937 5.5937 5.5937 5.5937 8.4791 8.4791 8.4791 8.4791 8.9968 8.9968 8.9968 8.9968 10.7576 10.7576 k = 0.0000 0.0000 0.5808 ( 12480 PWs) bands (ev): -14.3512 -14.3512 -14.3512 -14.3512 -11.4513 -11.4513 -11.4513 -11.4513 -3.2295 -3.2295 -3.2295 -3.2295 -1.9007 -1.9007 -1.9007 -1.9007 -1.8127 -1.8127 -1.8127 -1.8127 1.2611 1.2611 1.2611 1.2611 2.3519 2.3519 2.3519 2.3519 2.9036 2.9036 2.9036 2.9036 4.0572 4.0572 4.0572 4.0572 4.1723 4.1723 4.1723 4.1723 4.3587 4.3587 4.3587 4.3587 5.2551 5.2551 5.2551 5.2551 5.5937 5.5937 5.5937 5.5937 8.4791 8.4791 8.4791 8.4791 8.9968 8.9968 8.9968 8.9968 10.7576 10.7576 k = 0.0000 0.0000 0.5621 ( 12478 PWs) bands (ev): -14.3574 -14.3574 -14.3450 -14.3450 -11.4619 -11.4619 -11.4407 -11.4407 -3.2417 -3.2417 -3.2171 -3.2171 -1.9117 -1.9117 -1.8934 -1.8934 -1.8178 -1.8178 -1.8035 -1.8035 1.2540 1.2540 1.2671 1.2671 2.3451 2.3451 2.3612 2.3612 2.8768 2.8768 2.9311 2.9311 4.0188 4.0188 4.0829 4.0829 4.1603 4.1603 4.1962 4.1962 4.3508 4.3508 4.3674 4.3674 5.2454 5.2454 5.2642 5.2642 5.5537 5.5537 5.6333 5.6333 8.4490 8.4490 8.5128 8.5128 8.9761 8.9761 9.0082 9.0082 10.7325 10.7325 k = 0.0000 0.0000 0.5433 ( 12490 PWs) bands (ev): -14.3637 -14.3637 -14.3389 -14.3389 -11.4723 -11.4723 -11.4300 -11.4300 -3.2537 -3.2537 -3.2044 -3.2044 -1.9244 -1.9244 -1.8919 -1.8919 -1.8165 -1.8165 -1.7920 -1.7920 1.2458 1.2458 1.2718 1.2718 2.3410 2.3410 2.3730 2.3730 2.8507 2.8507 2.9592 2.9592 3.9738 3.9738 4.0930 4.0930 4.1581 4.1581 4.2307 4.2307 4.3438 4.3438 4.3767 4.3767 5.2348 5.2348 5.2729 5.2729 5.5134 5.5134 5.6723 5.6723 8.4225 8.4225 8.5500 8.5500 8.9469 8.9469 9.0098 9.0098 10.7150 10.7150 k = 0.0000 0.0000 0.5246 ( 12508 PWs) bands (ev): -14.3700 -14.3700 -14.3329 -14.3329 -11.4827 -11.4827 -11.4194 -11.4194 -3.2655 -3.2655 -3.1917 -3.1917 -1.9377 -1.9377 -1.8965 -1.8965 -1.8085 -1.8085 -1.7794 -1.7794 1.2367 1.2367 1.2752 1.2752 2.3397 2.3397 2.3871 2.3871 2.8253 2.8253 2.9879 2.9879 3.9258 3.9258 4.0921 4.0921 4.1621 4.1621 4.2701 4.2701 4.3389 4.3389 4.3869 4.3869 5.2229 5.2229 5.2818 5.2818 5.4729 5.4729 5.7106 5.7106 8.3994 8.3994 8.5908 8.5908 8.9103 8.9103 9.0012 9.0012 10.7058 10.7058 k = 0.0000 0.0000 0.5059 ( 12542 PWs) bands (ev): -14.3763 -14.3763 -14.3270 -14.3270 -11.4929 -11.4929 -11.4087 -11.4087 -3.2769 -3.2769 -3.1788 -3.1788 -1.9511 -1.9511 -1.9051 -1.9051 -1.7960 -1.7960 -1.7662 -1.7662 1.2267 1.2267 1.2773 1.2773 2.3413 2.3413 2.4032 2.4032 2.8006 2.8006 3.0172 3.0172 3.8767 3.8767 4.0861 4.0861 4.1683 4.1683 4.3042 4.3042 4.3415 4.3415 4.3984 4.3984 5.2096 5.2096 5.2911 5.2911 5.4323 5.4323 5.7482 5.7482 8.3797 8.3797 8.6352 8.6352 8.8671 8.8671 8.9826 8.9826 10.7052 10.7052 k = 0.0000 0.0000 0.4871 ( 12552 PWs) bands (ev): -14.3826 -14.3826 -14.3212 -14.3212 -11.5030 -11.5030 -11.3981 -11.3981 -3.2881 -3.2881 -3.1658 -3.1658 -1.9645 -1.9645 -1.9158 -1.9158 -1.7808 -1.7808 -1.7526 -1.7526 1.2160 1.2160 1.2779 1.2779 2.3458 2.3458 2.4213 2.4213 2.7766 2.7766 3.0471 3.0471 3.8274 3.8274 4.0782 4.0782 4.1746 4.1746 4.3147 4.3147 4.3654 4.3654 4.4131 4.4131 5.1947 5.1947 5.3013 5.3013 5.3921 5.3921 5.7850 5.7850 8.3634 8.3634 8.6831 8.6831 8.8184 8.8184 8.9546 8.9546 10.7132 10.7132 k = 0.0000 0.0000 0.4684 ( 12546 PWs) bands (ev): -14.3889 -14.3889 -14.3156 -14.3156 -11.5128 -11.5128 -11.3876 -11.3876 -3.2990 -3.2990 -3.1527 -3.1527 -1.9775 -1.9775 -1.9275 -1.9275 -1.7640 -1.7640 -1.7388 -1.7388 1.2047 1.2047 1.2771 1.2771 2.3532 2.3532 2.4412 2.4412 2.7534 2.7534 3.0776 3.0776 3.7785 3.7785 4.0694 4.0694 4.1804 4.1804 4.3137 4.3137 4.3924 4.3924 4.4358 4.4358 5.1780 5.1780 5.3115 5.3115 5.3540 5.3540 5.8209 5.8209 8.3504 8.3504 8.7330 8.7330 8.7668 8.7668 8.9178 8.9178 10.7293 10.7293 k = 0.0000 0.0000 0.4497 ( 12558 PWs) bands (ev): -14.3951 -14.3951 -14.3101 -14.3101 -11.5225 -11.5225 -11.3771 -11.3771 -3.3095 -3.3095 -3.1397 -3.1397 -1.9902 -1.9902 -1.9396 -1.9396 -1.7463 -1.7463 -1.7250 -1.7250 1.1929 1.1929 1.2749 1.2749 2.3636 2.3636 2.4627 2.4627 2.7310 2.7310 3.1085 3.1085 3.7302 3.7302 4.0604 4.0604 4.1851 4.1851 4.3117 4.3117 4.4101 4.4101 4.4676 4.4676 5.1593 5.1593 5.3032 5.3032 5.3372 5.3372 5.8558 5.8558 8.3407 8.3407 8.7060 8.7060 8.7919 8.7919 8.8734 8.8734 10.7529 10.7529 k = 0.0000 0.0000 0.4309 ( 12552 PWs) bands (ev): -14.4012 -14.4012 -14.3047 -14.3047 -11.5319 -11.5319 -11.3668 -11.3668 -3.3196 -3.3196 -3.1266 -3.1266 -2.0025 -2.0025 -1.9518 -1.9518 -1.7280 -1.7280 -1.7112 -1.7112 1.1807 1.1807 1.2714 1.2714 2.3770 2.3770 2.4857 2.4857 2.7093 2.7093 3.1400 3.1400 3.6829 3.6829 4.0513 4.0513 4.1886 4.1886 4.3103 4.3103 4.4228 4.4228 4.5014 4.5014 5.1385 5.1385 5.2673 5.2673 5.3517 5.3517 5.8896 5.8896 8.3342 8.3342 8.6462 8.6462 8.8220 8.8220 8.8510 8.8510 10.7833 10.7833 k = 0.0000 0.0000 0.4122 ( 12538 PWs) bands (ev): -14.4073 -14.4073 -14.2995 -14.2995 -11.5411 -11.5411 -11.3567 -11.3567 -3.3294 -3.3294 -3.1137 -3.1137 -2.0143 -2.0143 -1.9639 -1.9639 -1.7095 -1.7095 -1.6973 -1.6973 1.1682 1.1682 1.2666 1.2666 2.3931 2.3931 2.5099 2.5099 2.6885 2.6885 3.1719 3.1719 3.6367 3.6367 4.0422 4.0422 4.1907 4.1907 4.3100 4.3100 4.4336 4.4336 4.5329 4.5329 5.1154 5.1154 5.2290 5.2290 5.3732 5.3732 5.9223 5.9223 8.3308 8.3308 8.5835 8.5835 8.7659 8.7659 8.9135 8.9135 10.8196 10.8196 k = 0.0000 0.0000 0.3934 ( 12530 PWs) bands (ev): -14.4132 -14.4132 -14.2945 -14.2945 -11.5500 -11.5500 -11.3467 -11.3467 -3.3389 -3.3389 -3.1008 -3.1008 -2.0257 -2.0257 -1.9759 -1.9759 -1.6912 -1.6912 -1.6829 -1.6829 1.1555 1.1555 1.2606 1.2606 2.4120 2.4120 2.5351 2.5351 2.6685 2.6685 3.2042 3.2042 3.5918 3.5918 4.0333 4.0333 4.1914 4.1914 4.3108 4.3108 4.4437 4.4437 4.5604 4.5604 5.0901 5.0901 5.1912 5.1912 5.3997 5.3997 5.9539 5.9539 8.3304 8.3304 8.5189 8.5189 8.7054 8.7054 8.9799 8.9799 10.8611 10.8611 k = 0.0000 0.0000 0.3747 ( 12520 PWs) bands (ev): -14.4191 -14.4191 -14.2897 -14.2897 -11.5586 -11.5586 -11.3370 -11.3370 -3.3479 -3.3479 -3.0881 -3.0881 -2.0366 -2.0366 -1.9876 -1.9876 -1.6747 -1.6747 -1.6669 -1.6669 1.1428 1.1428 1.2535 1.2535 2.4334 2.4334 2.5613 2.5613 2.6494 2.6494 3.2369 3.2369 3.5483 3.5483 4.0246 4.0246 4.1910 4.1910 4.3125 4.3125 4.4531 4.4531 4.5829 4.5829 5.0625 5.0625 5.1542 5.1542 5.4311 5.4311 5.9843 5.9843 8.3330 8.3330 8.4530 8.4530 8.6419 8.6419 9.0501 9.0501 10.9071 10.9071 k = 0.0000 0.0000 0.3560 ( 12521 PWs) bands (ev): -14.4248 -14.4248 -14.2851 -14.2851 -11.5669 -11.5669 -11.3275 -11.3275 -3.3566 -3.3566 -3.0756 -3.0756 -2.0470 -2.0470 -1.9989 -1.9989 -1.6606 -1.6606 -1.6487 -1.6487 1.1299 1.1299 1.2454 1.2454 2.4573 2.4573 2.5880 2.5880 2.6313 2.6313 3.2700 3.2700 3.5062 3.5062 4.0162 4.0162 4.1895 4.1895 4.3149 4.3149 4.4620 4.4620 4.6002 4.6002 5.0329 5.0329 5.1182 5.1182 5.4676 5.4676 6.0134 6.0134 8.3383 8.3383 8.3863 8.3863 8.5763 8.5763 9.1238 9.1238 10.9564 10.9564 k = 0.0000 0.0000 0.3372 ( 12517 PWs) bands (ev): -14.4303 -14.4303 -14.2807 -14.2807 -11.5749 -11.5749 -11.3183 -11.3183 -3.3648 -3.3648 -3.0633 -3.0633 -2.0570 -2.0570 -2.0098 -2.0098 -1.6477 -1.6477 -1.6297 -1.6297 1.1172 1.1172 1.2366 1.2366 2.4834 2.4834 2.6100 2.6100 2.6193 2.6193 3.3034 3.3034 3.4658 3.4658 4.0080 4.0080 4.1872 4.1872 4.3177 4.3177 4.4704 4.4704 4.6123 4.6123 5.0015 5.0015 5.0832 5.0832 5.5089 5.5089 6.0412 6.0412 8.3191 8.3191 8.3464 8.3464 8.5096 8.5096 9.2012 9.2012 10.9885 10.9886 k = 0.0000 0.0000 0.3185 ( 12499 PWs) bands (ev): -14.4356 -14.4356 -14.2765 -14.2765 -11.5826 -11.5826 -11.3094 -11.3094 -3.3727 -3.3727 -3.0513 -3.0513 -2.0665 -2.0665 -2.0202 -2.0202 -1.6354 -1.6354 -1.6105 -1.6105 1.1047 1.1047 1.2270 1.2270 2.5115 2.5115 2.5964 2.5964 2.6442 2.6442 3.3370 3.3370 3.4270 3.4270 4.0001 4.0001 4.1843 4.1843 4.3205 4.3205 4.4782 4.4782 4.6193 4.6193 4.9689 4.9689 5.0490 5.0490 5.5548 5.5548 6.0676 6.0676 8.2519 8.2519 8.3570 8.3570 8.4426 8.4426 9.2821 9.2821 10.9542 10.9542 k = 0.0000 0.0000 0.2998 ( 12507 PWs) bands (ev): -14.4408 -14.4408 -14.2725 -14.2725 -11.5899 -11.5899 -11.3009 -11.3009 -3.3801 -3.3801 -3.0397 -3.0397 -2.0755 -2.0755 -2.0302 -2.0302 -1.6237 -1.6237 -1.5914 -1.5914 1.0923 1.0923 1.2169 1.2169 2.5414 2.5414 2.5809 2.5809 2.6720 2.6720 3.3705 3.3705 3.3903 3.3903 3.9926 3.9926 4.1810 4.1810 4.3232 4.3232 4.4853 4.4853 4.6219 4.6219 4.9357 4.9357 5.0154 5.0154 5.6046 5.6046 6.0927 6.0927 8.1849 8.1849 8.3700 8.3700 8.3761 8.3761 9.3665 9.3665 10.9122 10.9122 k = 0.0000 0.0000 0.2810 ( 12493 PWs) bands (ev): -14.4457 -14.4457 -14.2687 -14.2687 -11.5968 -11.5968 -11.2927 -11.2927 -3.3871 -3.3871 -3.0285 -3.0285 -2.0841 -2.0841 -2.0396 -2.0396 -1.6125 -1.6125 -1.5726 -1.5726 1.0803 1.0803 1.2064 1.2064 2.5657 2.5657 2.5734 2.5734 2.6998 2.6998 3.3545 3.3545 3.4051 3.4051 3.9853 3.9853 4.1774 4.1774 4.3253 4.3253 4.4917 4.4917 4.6204 4.6204 4.9025 4.9025 4.9823 4.9823 5.6579 5.6579 6.1163 6.1163 8.1184 8.1184 8.3107 8.3107 8.3851 8.3851 9.4543 9.4543 10.8673 10.8673 k = 0.0000 0.0000 0.2623 ( 12489 PWs) bands (ev): -14.4504 -14.4504 -14.2652 -14.2652 -11.6033 -11.6033 -11.2849 -11.2849 -3.3937 -3.3937 -3.0177 -3.0177 -2.0922 -2.0922 -2.0484 -2.0484 -1.6018 -1.6018 -1.5542 -1.5542 1.0687 1.0687 1.1957 1.1957 2.5521 2.5521 2.6057 2.6057 2.7275 2.7275 3.3213 3.3213 3.4390 3.4390 3.9785 3.9785 4.1738 4.1738 4.3266 4.3266 4.4971 4.4971 4.6156 4.6156 4.8698 4.8698 4.9496 4.9496 5.7140 5.7140 6.1386 6.1386 8.0527 8.0527 8.2472 8.2472 8.4023 8.4023 9.5455 9.5455 10.8212 10.8212 k = 0.0000 0.0000 0.2436 ( 12471 PWs) bands (ev): -14.4549 -14.4549 -14.2618 -14.2618 -11.6095 -11.6095 -11.2775 -11.2775 -3.3999 -3.3999 -3.0073 -3.0073 -2.0999 -2.0999 -2.0566 -2.0566 -1.5917 -1.5917 -1.5364 -1.5364 1.0576 1.0576 1.1849 1.1849 2.5392 2.5392 2.6393 2.6393 2.7547 2.7547 3.2899 3.2899 3.4730 3.4730 3.9719 3.9719 4.1701 4.1701 4.3268 4.3268 4.5014 4.5014 4.6079 4.6079 4.8381 4.8381 4.9177 4.9177 5.7721 5.7721 6.1594 6.1594 7.9879 7.9879 8.1859 8.1859 8.4211 8.4211 9.6401 9.6401 10.7750 10.7750 k = 0.0000 0.0000 0.2248 ( 12491 PWs) bands (ev): -14.4591 -14.4591 -14.2588 -14.2588 -11.6152 -11.6152 -11.2706 -11.2706 -3.4056 -3.4056 -2.9975 -2.9975 -2.1071 -2.1071 -2.0643 -2.0643 -1.5822 -1.5822 -1.5192 -1.5192 1.0470 1.0470 1.1742 1.1742 2.5271 2.5271 2.6735 2.6735 2.7812 2.7812 3.2606 3.2606 3.5069 3.5069 3.9658 3.9658 4.1665 4.1665 4.3258 4.3258 4.5043 4.5043 4.5983 4.5983 4.8077 4.8077 4.8868 4.8868 5.8316 5.8316 6.1787 6.1787 7.9244 7.9244 8.1274 8.1274 8.4415 8.4415 9.7378 9.7378 10.7297 10.7297 k = 0.0000 0.0000 0.2061 ( 12497 PWs) bands (ev): -14.4630 -14.4630 -14.2559 -14.2559 -11.6205 -11.6205 -11.2641 -11.2641 -3.4109 -3.4109 -2.9883 -2.9883 -2.1138 -2.1138 -2.0713 -2.0713 -1.5733 -1.5733 -1.5028 -1.5028 1.0369 1.0369 1.1638 1.1638 2.5160 2.5160 2.7079 2.7079 2.8069 2.8069 3.2332 3.2332 3.5405 3.5405 3.9600 3.9600 4.1630 4.1630 4.3231 4.3231 4.5056 4.5056 4.5873 4.5873 4.7788 4.7788 4.8573 4.8573 5.8919 5.8919 6.1965 6.1965 7.8623 7.8623 8.0721 8.0721 8.4629 8.4629 9.8387 9.8387 10.6861 10.6861 k = 0.0000 0.0000 0.1874 ( 12509 PWs) bands (ev): -14.4666 -14.4666 -14.2533 -14.2533 -11.6254 -11.6254 -11.2581 -11.2581 -3.4157 -3.4157 -2.9797 -2.9797 -2.1200 -2.1200 -2.0776 -2.0776 -1.5650 -1.5650 -1.4873 -1.4873 1.0276 1.0276 1.1536 1.1536 2.5058 2.5058 2.7420 2.7420 2.8314 2.8314 3.2080 3.2080 3.5738 3.5738 3.9546 3.9546 4.1597 4.1597 4.3188 4.3188 4.5047 4.5047 4.5762 4.5762 4.7514 4.7514 4.8300 4.8300 5.9522 5.9522 6.2128 6.2128 7.8019 7.8019 8.0204 8.0204 8.4851 8.4851 9.9427 9.9427 10.6448 10.6448 k = 0.0000 0.0000 0.1686 ( 12497 PWs) bands (ev): -14.4699 -14.4699 -14.2510 -14.2510 -11.6299 -11.6299 -11.2526 -11.2526 -3.4201 -3.4201 -2.9718 -2.9718 -2.1258 -2.1258 -2.0834 -2.0834 -1.5575 -1.5575 -1.4729 -1.4729 1.0189 1.0189 1.1440 1.1440 2.4966 2.4966 2.7756 2.7756 2.8545 2.8545 3.1848 3.1848 3.6064 3.6064 3.9495 3.9495 4.1566 4.1566 4.3125 4.3125 4.5010 4.5010 4.5659 4.5659 4.7255 4.7255 4.8055 4.8055 6.0117 6.0117 6.2277 6.2277 7.7435 7.7435 7.9727 7.9727 8.5076 8.5076 10.0496 10.0496 10.6062 10.6062 k = 0.0000 0.0000 0.1499 ( 12479 PWs) bands (ev): -14.4729 -14.4729 -14.2489 -14.2489 -11.6339 -11.6339 -11.2476 -11.2476 -3.4240 -3.4240 -2.9646 -2.9646 -2.1310 -2.1310 -2.0885 -2.0885 -1.5506 -1.5506 -1.4595 -1.4595 1.0110 1.0110 1.1350 1.1350 2.4883 2.4883 2.8079 2.8079 2.8760 2.8760 3.1638 3.1638 3.6382 3.6382 3.9448 3.9448 4.1537 4.1537 4.3044 4.3044 4.4942 4.4942 4.5575 4.5575 4.7011 4.7011 4.7844 4.7844 6.0698 6.0698 6.2411 6.2411 7.6876 7.6876 7.9293 7.9293 8.5299 8.5299 10.1592 10.1592 10.5707 10.5707 k = 0.0000 0.0000 0.1311 ( 12495 PWs) bands (ev): -14.4756 -14.4756 -14.2470 -14.2470 -11.6374 -11.6374 -11.2432 -11.2432 -3.4275 -3.4275 -2.9581 -2.9581 -2.1356 -2.1356 -2.0930 -2.0930 -1.5445 -1.5445 -1.4475 -1.4475 1.0039 1.0039 1.1268 1.1268 2.4810 2.4810 2.8387 2.8387 2.8957 2.8957 3.1449 3.1449 3.6688 3.6688 3.9405 3.9405 4.1511 4.1511 4.2945 4.2945 4.4847 4.4847 4.5514 4.5514 4.6780 4.6780 4.7669 4.7669 6.1253 6.1253 6.2530 6.2530 7.6346 7.6346 7.8903 7.8903 8.5516 8.5516 10.2715 10.2715 10.5387 10.5387 k = 0.0000 0.0000 0.1124 ( 12483 PWs) bands (ev): -14.4779 -14.4779 -14.2454 -14.2454 -11.6405 -11.6405 -11.2393 -11.2393 -3.4305 -3.4305 -2.9524 -2.9524 -2.1397 -2.1397 -2.0968 -2.0968 -1.5392 -1.5392 -1.4368 -1.4368 0.9977 0.9977 1.1194 1.1194 2.4746 2.4746 2.8672 2.8672 2.9134 2.9134 3.1281 3.1281 3.6978 3.6978 3.9364 3.9364 4.1488 4.1488 4.2832 4.2832 4.4737 4.4737 4.5472 4.5472 4.6567 4.6567 4.7529 4.7529 6.1772 6.1772 6.2638 6.2638 7.5853 7.5853 7.8562 7.8562 8.5721 8.5721 10.3861 10.3861 10.5105 10.5105 k = 0.0000 0.0000 0.0937 ( 12481 PWs) bands (ev): -14.4799 -14.4799 -14.2440 -14.2440 -11.6431 -11.6431 -11.2360 -11.2360 -3.4331 -3.4331 -2.9476 -2.9476 -2.1432 -2.1432 -2.1001 -2.1001 -1.5346 -1.5346 -1.4275 -1.4275 0.9923 0.9923 1.1130 1.1130 2.4692 2.4692 2.8931 2.8931 2.9287 2.9287 3.1135 3.1135 3.7248 3.7248 3.9327 3.9327 4.1468 4.1468 4.2710 4.2710 4.4623 4.4623 4.5444 4.5444 4.6376 4.6376 4.7422 4.7422 6.2238 6.2238 6.2738 6.2738 7.5405 7.5405 7.8269 7.8269 8.5907 8.5907 10.4843 10.4843 10.5047 10.5047 k = 0.0000 0.0000 0.0749 ( 12489 PWs) bands (ev): -14.4815 -14.4815 -14.2429 -14.2429 -11.6453 -11.6453 -11.2333 -11.2333 -3.4352 -3.4352 -2.9435 -2.9435 -2.1461 -2.1461 -2.1027 -2.1027 -1.5309 -1.5309 -1.4198 -1.4198 0.9879 0.9879 1.1077 1.1077 2.4648 2.4648 2.9156 2.9156 2.9416 2.9416 3.1011 3.1011 3.7490 3.7490 3.9292 3.9292 4.1452 4.1452 4.2588 4.2588 4.4517 4.4517 4.5424 4.5424 4.6211 4.6211 4.7343 4.7343 6.2604 6.2604 6.2865 6.2865 7.5013 7.5013 7.8028 7.8028 8.6070 8.6070 10.4655 10.4655 10.6205 10.6205 k = 0.0000 0.0000 0.0562 ( 12489 PWs) bands (ev): -14.4828 -14.4828 -14.2420 -14.2420 -11.6470 -11.6470 -11.2312 -11.2312 -3.4368 -3.4368 -2.9404 -2.9404 -2.1483 -2.1483 -2.1048 -2.1048 -1.5280 -1.5280 -1.4138 -1.4138 0.9844 0.9844 1.1034 1.1034 2.4614 2.4614 2.9342 2.9342 2.9519 2.9519 3.0910 3.0910 3.7696 3.7696 3.9261 3.9261 4.1438 4.1438 4.2477 4.2477 4.4428 4.4428 4.5410 4.5410 4.6078 4.6078 4.7287 4.7287 6.2773 6.2773 6.3101 6.3101 7.4687 7.4687 7.7839 7.7839 8.6204 8.6204 10.4497 10.4497 10.6463 10.6463 k = 0.0000 0.0000 0.0375 ( 12499 PWs) bands (ev): -14.4837 -14.4837 -14.2414 -14.2414 -11.6482 -11.6482 -11.2297 -11.2297 -3.4380 -3.4380 -2.9381 -2.9381 -2.1499 -2.1499 -2.1063 -2.1063 -1.5259 -1.5259 -1.4094 -1.4094 0.9819 0.9819 1.1004 1.1004 2.4589 2.4589 2.9483 2.9483 2.9593 2.9593 3.0834 3.0834 3.7856 3.7856 3.9235 3.9235 4.1429 4.1429 4.2386 4.2386 4.4359 4.4359 4.5401 4.5401 4.5980 4.5980 4.7249 4.7249 6.2836 6.2836 6.3342 6.3342 7.4443 7.4443 7.7703 7.7703 8.6304 8.6304 10.4383 10.4383 10.6227 10.6227 k = 0.0000 0.0000 0.0187 ( 12503 PWs) bands (ev): -14.4843 -14.4843 -14.2410 -14.2410 -11.6489 -11.6489 -11.2287 -11.2287 -3.4387 -3.4387 -2.9367 -2.9367 -2.1509 -2.1509 -2.1071 -2.1071 -1.5246 -1.5246 -1.4067 -1.4067 0.9804 0.9804 1.0985 1.0985 2.4574 2.4574 2.9571 2.9571 2.9639 2.9639 3.0785 3.0785 3.7959 3.7959 3.9217 3.9217 4.1423 4.1423 4.2326 4.2326 4.4317 4.4317 4.5396 4.5396 4.5921 4.5921 4.7228 4.7228 6.2867 6.2867 6.3499 6.3499 7.4290 7.4290 7.7622 7.7622 8.6365 8.6365 10.4315 10.4315 10.6081 10.6081 k = 0.0000 0.0000 0.0000 ( 12499 PWs) bands (ev): -14.4844 -14.4844 -14.2409 -14.2409 -11.6492 -11.6492 -11.2284 -11.2284 -3.4389 -3.4389 -2.9363 -2.9363 -2.1512 -2.1512 -2.1074 -2.1074 -1.5242 -1.5242 -1.4059 -1.4059 0.9799 0.9799 1.0979 1.0979 2.4569 2.4569 2.9601 2.9601 2.9654 2.9654 3.0768 3.0768 3.7995 3.7995 3.9211 3.9211 4.1421 4.1421 4.2306 4.2306 4.4302 4.4302 4.5394 4.5394 4.5901 4.5901 4.7221 4.7221 6.2877 6.2877 6.3554 6.3554 7.4238 7.4238 7.7594 7.7594 8.6386 8.6386 10.4292 10.4292 10.6032 10.6032 k = 0.0000 0.0000 0.0000 ( 12499 PWs) bands (ev): -14.4844 -14.4844 -14.2409 -14.2409 -11.6492 -11.6492 -11.2284 -11.2284 -3.4389 -3.4389 -2.9363 -2.9363 -2.1512 -2.1512 -2.1074 -2.1074 -1.5242 -1.5242 -1.4059 -1.4059 0.9799 0.9799 1.0979 1.0979 2.4569 2.4569 2.9601 2.9601 2.9654 2.9654 3.0768 3.0768 3.7995 3.7995 3.9211 3.9211 4.1421 4.1421 4.2306 4.2306 4.4302 4.4302 4.5394 4.5394 4.5901 4.5901 4.7221 4.7221 6.2877 6.2877 6.3554 6.3554 7.4238 7.4238 7.7594 7.7594 8.6386 8.6386 10.4292 10.4292 10.6032 10.6032 k =-0.0161 0.0093 0.0000 ( 12503 PWs) bands (ev): -14.4843 -14.4843 -14.2410 -14.2410 -11.6494 -11.6494 -11.2282 -11.2282 -3.4388 -3.4388 -2.9368 -2.9368 -2.1511 -2.1511 -2.1070 -2.1070 -1.5245 -1.5245 -1.4063 -1.4063 0.9795 0.9795 1.0977 1.0977 2.4567 2.4567 2.9604 2.9604 2.9649 2.9649 3.0781 3.0781 3.7997 3.7997 3.9213 3.9213 4.1420 4.1420 4.2306 4.2306 4.4303 4.4303 4.5393 4.5393 4.5902 4.5902 4.7221 4.7221 6.2875 6.2875 6.3551 6.3551 7.4228 7.4228 7.7659 7.7659 8.6401 8.6401 10.4298 10.4298 10.5937 10.5937 k =-0.0323 0.0186 0.0000 ( 12509 PWs) bands (ev): -14.4839 -14.4839 -14.2413 -14.2413 -11.6501 -11.6501 -11.2276 -11.2276 -3.4382 -3.4382 -2.9382 -2.9382 -2.1507 -2.1507 -2.1058 -2.1058 -1.5254 -1.5254 -1.4076 -1.4076 0.9785 0.9785 1.0971 1.0971 2.4562 2.4562 2.9609 2.9609 2.9637 2.9637 3.0820 3.0820 3.8006 3.8006 3.9221 3.9221 4.1420 4.1420 4.2307 4.2307 4.4307 4.4307 4.5391 4.5391 4.5907 4.5907 4.7222 4.7222 6.2871 6.2871 6.3542 6.3542 7.4204 7.4204 7.7848 7.7848 8.6446 8.6446 10.4317 10.4317 10.5672 10.5672 k =-0.0484 0.0279 0.0000 ( 12501 PWs) bands (ev): -14.4832 -14.4832 -14.2418 -14.2418 -11.6513 -11.6513 -11.2265 -11.2265 -3.4374 -3.4374 -2.9406 -2.9406 -2.1501 -2.1501 -2.1037 -2.1037 -1.5269 -1.5269 -1.4097 -1.4097 0.9767 0.9767 1.0960 1.0960 2.4553 2.4553 2.9599 2.9599 2.9639 2.9639 3.0879 3.0879 3.8019 3.8019 3.9234 3.9234 4.1419 4.1419 4.2309 4.2309 4.4312 4.4312 4.5387 4.5387 4.5916 4.5916 4.7224 4.7224 6.2863 6.2863 6.3528 6.3528 7.4179 7.4179 7.8148 7.8148 8.6521 8.6521 10.4347 10.4347 10.5280 10.5280 k =-0.0645 0.0372 0.0000 ( 12481 PWs) bands (ev): -14.4823 -14.4823 -14.2426 -14.2426 -11.6530 -11.6530 -11.2250 -11.2250 -3.4362 -3.4362 -2.9439 -2.9439 -2.1492 -2.1492 -2.1009 -2.1009 -1.5291 -1.5291 -1.4126 -1.4126 0.9742 0.9742 1.0946 1.0946 2.4541 2.4541 2.9575 2.9575 2.9659 2.9659 3.0957 3.0957 3.8038 3.8038 3.9251 3.9251 4.1418 4.1418 4.2311 4.2311 4.4319 4.4319 4.5381 4.5381 4.5929 4.5929 4.7226 4.7226 6.2853 6.2853 6.3508 6.3508 7.4168 7.4168 7.8543 7.8543 8.6626 8.6626 10.4376 10.4376 10.4819 10.4819 k =-0.0806 0.0465 0.0000 ( 12485 PWs) bands (ev): -14.4811 -14.4811 -14.2435 -14.2435 -11.6550 -11.6550 -11.2231 -11.2231 -3.4346 -3.4346 -2.9481 -2.9481 -2.1480 -2.1480 -2.0973 -2.0973 -1.5319 -1.5319 -1.4162 -1.4162 0.9711 0.9711 1.0927 1.0927 2.4526 2.4526 2.9549 2.9549 2.9688 2.9688 3.1047 3.1047 3.8062 3.8062 3.9274 3.9274 4.1416 4.1416 4.2314 4.2314 4.4328 4.4328 4.5372 4.5372 4.5945 4.5945 4.7229 4.7229 6.2839 6.2839 6.3482 6.3482 7.4185 7.4185 7.9017 7.9017 8.6761 8.6761 10.4193 10.4193 10.4534 10.4534 k =-0.0968 0.0558 0.0000 ( 12481 PWs) bands (ev): -14.4797 -14.4797 -14.2447 -14.2447 -11.6575 -11.6575 -11.2209 -11.2209 -3.4327 -3.4327 -2.9531 -2.9531 -2.1467 -2.1467 -2.0929 -2.0929 -1.5354 -1.5354 -1.4204 -1.4204 0.9673 0.9673 1.0904 1.0904 2.4507 2.4507 2.9525 2.9525 2.9724 2.9724 3.1146 3.1146 3.8090 3.8090 3.9301 3.9301 4.1413 4.1413 4.2318 4.2318 4.4338 4.4338 4.5362 4.5362 4.5965 4.5965 4.7233 4.7233 6.2823 6.2823 6.3450 6.3450 7.4239 7.4239 7.9560 7.9560 8.6925 8.6925 10.3669 10.3669 10.4579 10.4579 k =-0.1129 0.0651 0.0000 ( 12475 PWs) bands (ev): -14.4780 -14.4780 -14.2460 -14.2460 -11.6603 -11.6603 -11.2184 -11.2184 -3.4305 -3.4305 -2.9589 -2.9589 -2.1451 -2.1451 -2.0877 -2.0877 -1.5396 -1.5396 -1.4251 -1.4251 0.9627 0.9627 1.0878 1.0878 2.4486 2.4486 2.9508 2.9508 2.9766 2.9766 3.1252 3.1252 3.8123 3.8123 3.9333 3.9333 4.1410 4.1410 4.2322 4.2322 4.4350 4.4350 4.5349 4.5349 4.5989 4.5989 4.7237 4.7237 6.2805 6.2805 6.3413 6.3413 7.4340 7.4340 8.0162 8.0162 8.7117 8.7117 10.3105 10.3105 10.4670 10.4670 k =-0.1290 0.0743 0.0000 ( 12491 PWs) bands (ev): -14.4760 -14.4760 -14.2476 -14.2476 -11.6635 -11.6635 -11.2156 -11.2156 -3.4279 -3.4279 -2.9655 -2.9655 -2.1434 -2.1434 -2.0818 -2.0818 -1.5446 -1.5446 -1.4303 -1.4303 0.9576 0.9576 1.0846 1.0846 2.4463 2.4463 2.9498 2.9498 2.9816 2.9816 3.1361 3.1361 3.8159 3.8159 3.9370 3.9370 4.1405 4.1405 4.2327 4.2327 4.4363 4.4363 4.5333 4.5333 4.6017 4.6017 4.7242 4.7242 6.2784 6.2784 6.3370 6.3370 7.4491 7.4491 8.0814 8.0814 8.7338 8.7338 10.2536 10.2536 10.4782 10.4782 k =-0.1452 0.0836 0.0000 ( 12493 PWs) bands (ev): -14.4739 -14.4739 -14.2493 -14.2493 -11.6669 -11.6669 -11.2125 -11.2125 -3.4251 -3.4251 -2.9728 -2.9728 -2.1415 -2.1415 -2.0753 -2.0753 -1.5503 -1.5503 -1.4357 -1.4357 0.9518 0.9518 1.0811 1.0811 2.4437 2.4437 2.9496 2.9496 2.9872 2.9872 3.1472 3.1472 3.8199 3.8199 3.9410 3.9410 4.1400 4.1400 4.2332 4.2332 4.4376 4.4376 4.5315 4.5315 4.6048 4.6048 4.7248 4.7248 6.2761 6.2761 6.3323 6.3323 7.4697 7.4697 8.1512 8.1512 8.7586 8.7586 10.1973 10.1973 10.4912 10.4912 k =-0.1613 0.0929 0.0000 ( 12503 PWs) bands (ev): -14.4715 -14.4715 -14.2512 -14.2512 -11.6706 -11.6706 -11.2092 -11.2092 -3.4219 -3.4219 -2.9806 -2.9806 -2.1394 -2.1394 -2.0681 -2.0681 -1.5567 -1.5567 -1.4413 -1.4413 0.9454 0.9454 1.0772 1.0772 2.4410 2.4410 2.9503 2.9503 2.9935 2.9935 3.1583 3.1583 3.8241 3.8241 3.9455 3.9455 4.1394 4.1394 4.2338 4.2338 4.4390 4.4390 4.5294 4.5294 4.6083 4.6083 4.7255 4.7255 6.2736 6.2736 6.3270 6.3270 7.4959 7.4959 8.2249 8.2249 8.7860 8.7860 10.1422 10.1422 10.5045 10.5046 k =-0.1774 0.1022 0.0000 ( 12513 PWs) bands (ev): -14.4690 -14.4690 -14.2533 -14.2533 -11.6744 -11.6744 -11.2058 -11.2058 -3.4185 -3.4185 -2.9891 -2.9891 -2.1373 -2.1373 -2.0603 -2.0603 -1.5640 -1.5640 -1.4470 -1.4470 0.9385 0.9385 1.0729 1.0729 2.4381 2.4381 2.9520 2.9520 3.0004 3.0004 3.1693 3.1693 3.8285 3.8285 3.9503 3.9503 4.1386 4.1386 4.2344 4.2344 4.4405 4.4405 4.5271 4.5271 4.6120 4.6120 4.7263 4.7263 6.2709 6.2709 6.3212 6.3212 7.5280 7.5280 8.3020 8.3020 8.8160 8.8160 10.0885 10.0885 10.4582 10.4582 k =-0.1935 0.1115 0.0000 ( 12509 PWs) bands (ev): -14.4662 -14.4662 -14.2555 -14.2555 -11.6784 -11.6784 -11.2022 -11.2022 -3.4148 -3.4148 -2.9980 -2.9980 -2.1350 -2.1350 -2.0518 -2.0518 -1.5721 -1.5721 -1.4527 -1.4527 0.9310 0.9310 1.0683 1.0683 2.4351 2.4351 2.9546 2.9546 3.0080 3.0080 3.1800 3.1800 3.8331 3.8331 3.9554 3.9554 4.1378 4.1378 4.2350 4.2350 4.4419 4.4419 4.5246 4.5246 4.6160 4.6160 4.7272 4.7272 6.2680 6.2680 6.3151 6.3151 7.5659 7.5659 8.3821 8.3821 8.8484 8.8484 10.0367 10.0367 10.3827 10.3827 k =-0.2097 0.1208 0.0000 ( 12517 PWs) bands (ev): -14.4633 -14.4633 -14.2579 -14.2579 -11.6825 -11.6825 -11.1986 -11.1986 -3.4108 -3.4108 -3.0074 -3.0074 -2.1327 -2.1327 -2.0429 -2.0429 -1.5809 -1.5809 -1.4582 -1.4582 0.9231 0.9231 1.0634 1.0634 2.4321 2.4321 2.9580 2.9580 3.0161 3.0161 3.1904 3.1904 3.8377 3.8377 3.9609 3.9609 4.1368 4.1368 4.2356 4.2356 4.4432 4.4432 4.5220 4.5220 4.6201 4.6201 4.7282 4.7282 6.2651 6.2651 6.3085 6.3085 7.6095 7.6095 8.4647 8.4647 8.8831 8.8831 9.9869 9.9869 10.3093 10.3093 k =-0.2258 0.1301 0.0000 ( 12517 PWs) bands (ev): -14.4603 -14.4603 -14.2604 -14.2604 -11.6867 -11.6867 -11.1949 -11.1949 -3.4065 -3.4065 -3.0170 -3.0170 -2.1303 -2.1303 -2.0334 -2.0334 -1.5905 -1.5905 -1.4635 -1.4635 0.9149 0.9149 1.0583 1.0583 2.4290 2.4290 2.9623 2.9623 3.0247 3.0247 3.2004 3.2004 3.8424 3.8424 3.9666 3.9666 4.1357 4.1357 4.2363 4.2363 4.4445 4.4445 4.5192 4.5192 4.6244 4.6244 4.7292 4.7292 6.2621 6.2621 6.3017 6.3017 7.6588 7.6588 8.5494 8.5494 8.9199 8.9199 9.9393 9.9393 10.2389 10.2389 k =-0.2419 0.1394 0.0000 ( 12514 PWs) bands (ev): -14.4571 -14.4571 -14.2630 -14.2630 -11.6908 -11.6908 -11.1912 -11.1912 -3.4021 -3.4021 -3.0270 -3.0270 -2.1280 -2.1280 -2.0234 -2.0234 -1.6008 -1.6008 -1.4685 -1.4685 0.9063 0.9063 1.0529 1.0529 2.4259 2.4259 2.9673 2.9673 3.0338 3.0338 3.2098 3.2098 3.8470 3.8470 3.9725 3.9725 4.1344 4.1344 4.2370 4.2370 4.4456 4.4456 4.5164 4.5164 4.6288 4.6288 4.7304 4.7304 6.2590 6.2590 6.2946 6.2946 7.7135 7.7135 8.6356 8.6356 8.9586 8.9586 9.8940 9.8940 10.1718 10.1718 k =-0.2581 0.1487 0.0000 ( 12506 PWs) bands (ev): -14.4539 -14.4539 -14.2657 -14.2657 -11.6950 -11.6950 -11.1876 -11.1876 -3.3974 -3.3974 -3.0371 -3.0371 -2.1256 -2.1256 -2.0130 -2.0130 -1.6117 -1.6117 -1.4733 -1.4733 0.8975 0.8975 1.0474 1.0474 2.4228 2.4228 2.9729 2.9729 3.0432 3.0432 3.2187 3.2187 3.8516 3.8516 3.9786 3.9786 4.1331 4.1331 4.2376 4.2376 4.4465 4.4465 4.5136 4.5136 4.6331 4.6331 4.7318 4.7318 6.2558 6.2558 6.2873 6.2873 7.7734 7.7734 8.7227 8.7227 8.9990 8.9990 9.8511 9.8511 10.1084 10.1084 k =-0.2742 0.1580 0.0000 ( 12516 PWs) bands (ev): -14.4505 -14.4505 -14.2685 -14.2685 -11.6990 -11.6990 -11.1840 -11.1840 -3.3925 -3.3925 -3.0474 -3.0474 -2.1232 -2.1232 -2.0021 -2.0021 -1.6232 -1.6232 -1.4778 -1.4778 0.8886 0.8886 1.0418 1.0418 2.4197 2.4197 2.9791 2.9791 3.0530 3.0530 3.2270 3.2270 3.8560 3.8560 3.9848 3.9848 4.1316 4.1316 4.2383 4.2383 4.4472 4.4472 4.5108 4.5108 4.6374 4.6374 4.7332 4.7332 6.2527 6.2527 6.2799 6.2799 7.8382 7.8382 8.8103 8.8103 9.0408 9.0408 9.8106 9.8106 10.0490 10.0490 k =-0.2903 0.1673 0.0000 ( 12512 PWs) bands (ev): -14.4471 -14.4471 -14.2714 -14.2714 -11.7030 -11.7030 -11.1805 -11.1805 -3.3875 -3.3875 -3.0577 -3.0577 -2.1209 -2.1209 -1.9909 -1.9909 -1.6352 -1.6352 -1.4820 -1.4820 0.8797 0.8797 1.0362 1.0362 2.4168 2.4168 2.9856 2.9856 3.0629 3.0629 3.2346 3.2346 3.8602 3.8602 3.9911 3.9911 4.1301 4.1301 4.2389 4.2389 4.4476 4.4476 4.5082 4.5082 4.6416 4.6416 4.7347 4.7347 6.2496 6.2496 6.2724 6.2724 7.9074 7.9074 8.8976 8.8976 9.0837 9.0837 9.7728 9.7728 9.9938 9.9938 k =-0.3065 0.1766 0.0000 ( 12522 PWs) bands (ev): -14.4437 -14.4437 -14.2742 -14.2742 -11.7068 -11.7068 -11.1772 -11.1772 -3.3824 -3.3824 -3.0679 -3.0679 -2.1187 -2.1187 -1.9794 -1.9794 -1.6476 -1.6476 -1.4858 -1.4858 0.8709 0.8709 1.0307 1.0307 2.4139 2.4139 2.9925 2.9925 3.0729 3.0729 3.2416 3.2416 3.8642 3.8642 3.9974 3.9974 4.1285 4.1285 4.2395 4.2395 4.4478 4.4478 4.5057 4.5057 4.6456 4.6456 4.7364 4.7364 6.2465 6.2465 6.2651 6.2651 7.9805 7.9805 8.9840 8.9840 9.1274 9.1274 9.7375 9.7375 9.9430 9.9430 k =-0.3226 0.1859 0.0000 ( 12532 PWs) bands (ev): -14.4403 -14.4403 -14.2771 -14.2771 -11.7104 -11.7104 -11.1740 -11.1740 -3.3772 -3.3772 -3.0780 -3.0780 -2.1166 -2.1166 -1.9675 -1.9675 -1.6603 -1.6603 -1.4894 -1.4894 0.8623 0.8623 1.0253 1.0253 2.4112 2.4112 2.9995 2.9995 3.0828 3.0828 3.2480 3.2480 3.8679 3.8679 4.0037 4.0037 4.1268 4.1268 4.2401 4.2401 4.4476 4.4476 4.5035 4.5035 4.6494 4.6494 4.7381 4.7381 6.2435 6.2435 6.2580 6.2580 8.0570 8.0570 9.0685 9.0685 9.1714 9.1714 9.7049 9.7049 9.8966 9.8966 k =-0.3387 0.1952 0.0000 ( 12526 PWs) bands (ev): -14.4370 -14.4370 -14.2799 -14.2799 -11.7139 -11.7139 -11.1710 -11.1710 -3.3720 -3.3720 -3.0878 -3.0878 -2.1146 -2.1146 -1.9555 -1.9555 -1.6733 -1.6733 -1.4926 -1.4926 0.8540 0.8540 1.0200 1.0200 2.4086 2.4086 3.0066 3.0066 3.0926 3.0926 3.2536 3.2536 3.8713 3.8713 4.0098 4.0098 4.1251 4.1251 4.2406 4.2406 4.4471 4.4471 4.5015 4.5015 4.6530 4.6530 4.7400 4.7400 6.2405 6.2405 6.2511 6.2511 8.1361 8.1361 9.1502 9.1502 9.2155 9.2155 9.6751 9.6751 9.8548 9.8548 k =-0.3548 0.2045 0.0000 ( 12524 PWs) bands (ev): -14.4337 -14.4337 -14.2827 -14.2827 -11.7170 -11.7170 -11.1683 -11.1683 -3.3667 -3.3667 -3.0973 -3.0973 -2.1127 -2.1127 -1.9432 -1.9432 -1.6865 -1.6865 -1.4955 -1.4955 0.8460 0.8460 1.0151 1.0151 2.4062 2.4062 3.0135 3.0135 3.1020 3.1020 3.2586 3.2586 3.8745 3.8745 4.0157 4.0157 4.1233 4.1233 4.2411 4.2411 4.4463 4.4463 4.4999 4.4999 4.6562 4.6562 4.7418 4.7418 6.2376 6.2376 6.2448 6.2448 8.2168 8.2168 9.2275 9.2275 9.2594 9.2594 9.6480 9.6480 9.8176 9.8176 k =-0.3710 0.2137 0.0000 ( 12536 PWs) bands (ev): -14.4306 -14.4306 -14.2854 -14.2854 -11.7200 -11.7200 -11.1657 -11.1657 -3.3616 -3.3616 -3.1064 -3.1064 -2.1109 -2.1109 -1.9307 -1.9307 -1.6998 -1.6998 -1.4981 -1.4981 0.8386 0.8386 1.0104 1.0104 2.4040 2.4040 3.0202 3.0202 3.1110 3.1110 3.2629 3.2629 3.8773 3.8773 4.0214 4.0214 4.1216 4.1216 4.2415 4.2415 4.4453 4.4453 4.4985 4.4985 4.6591 4.6591 4.7437 4.7437 6.2344 6.2344 6.2393 6.2393 8.2981 8.2981 9.2933 9.2933 9.3084 9.3084 9.6237 9.6237 9.7850 9.7850 k =-0.3871 0.2230 0.0000 ( 12536 PWs) bands (ev): -14.4277 -14.4277 -14.2879 -14.2879 -11.7226 -11.7226 -11.1634 -11.1634 -3.3567 -3.3567 -3.1149 -3.1149 -2.1094 -2.1094 -1.9182 -1.9182 -1.7131 -1.7131 -1.5004 -1.5004 0.8318 0.8318 1.0062 1.0062 2.4021 2.4021 3.0265 3.0265 3.1193 3.1193 3.2666 3.2666 3.8798 3.8798 4.0266 4.0266 4.1199 4.1199 4.2419 4.2419 4.4441 4.4441 4.4974 4.4974 4.6617 4.6617 4.7455 4.7455 6.2304 6.2304 6.2353 6.2353 8.3786 8.3786 9.3370 9.3370 9.3714 9.3714 9.6022 9.6022 9.7569 9.7569 k =-0.4032 0.2323 0.0000 ( 12536 PWs) bands (ev): -14.4250 -14.4250 -14.2903 -14.2903 -11.7249 -11.7249 -11.1614 -11.1614 -3.3521 -3.3521 -3.1227 -3.1227 -2.1080 -2.1080 -1.9057 -1.9057 -1.7263 -1.7263 -1.5024 -1.5024 0.8257 0.8257 1.0024 1.0024 2.4003 2.4003 3.0322 3.0322 3.1268 3.1268 3.2697 3.2697 3.8819 3.8819 4.0315 4.0315 4.1182 4.1182 4.2422 4.2422 4.4429 4.4429 4.4966 4.4966 4.6639 4.6639 4.7472 4.7472 6.2260 6.2260 6.2327 6.2327 8.4567 8.4567 9.3742 9.3742 9.4304 9.4304 9.5835 9.5835 9.7331 9.7331 k =-0.4194 0.2416 0.0000 ( 12536 PWs) bands (ev): -14.4226 -14.4226 -14.2924 -14.2924 -11.7269 -11.7269 -11.1597 -11.1597 -3.3478 -3.3478 -3.1296 -3.1296 -2.1068 -2.1068 -1.8933 -1.8933 -1.7393 -1.7393 -1.5041 -1.5041 0.8204 0.8204 0.9991 0.9991 2.3988 2.3988 3.0374 3.0374 3.1335 3.1335 3.2722 3.2722 3.8837 3.8837 4.0358 4.0358 4.1167 4.1167 4.2424 4.2424 4.4416 4.4416 4.4960 4.4960 4.6658 4.6658 4.7487 4.7487 6.2218 6.2218 6.2307 6.2307 8.5302 8.5302 9.4073 9.4073 9.4811 9.4811 9.5678 9.5678 9.7135 9.7135 k =-0.4355 0.2509 0.0000 ( 12534 PWs) bands (ev): -14.4206 -14.4206 -14.2942 -14.2942 -11.7286 -11.7286 -11.1582 -11.1582 -3.3441 -3.3441 -3.1356 -3.1356 -2.1058 -2.1058 -1.8811 -1.8811 -1.7520 -1.7520 -1.5055 -1.5055 0.8160 0.8160 0.9963 0.9963 2.3975 2.3975 3.0418 3.0418 3.1392 3.1392 3.2741 3.2741 3.8852 3.8852 4.0396 4.0396 4.1153 4.1153 4.2427 4.2427 4.4405 4.4405 4.4956 4.4956 4.6673 4.6673 4.7501 4.7501 6.2182 6.2182 6.2291 6.2291 8.5968 8.5968 9.4358 9.4358 9.5222 9.5222 9.5551 9.5551 9.6977 9.6977 k =-0.4516 0.2602 0.0000 ( 12538 PWs) bands (ev): -14.4189 -14.4189 -14.2956 -14.2956 -11.7299 -11.7299 -11.1571 -11.1571 -3.3410 -3.3410 -3.1405 -3.1405 -2.1050 -2.1050 -1.8697 -1.8697 -1.7638 -1.7638 -1.5066 -1.5066 0.8124 0.8124 0.9941 0.9941 2.3966 2.3966 3.0453 3.0453 3.1437 3.1437 3.2756 3.2756 3.8864 3.8864 4.0426 4.0426 4.1142 4.1142 4.2428 4.2428 4.4395 4.4395 4.4953 4.4953 4.6685 4.6685 4.7512 4.7512 6.2153 6.2153 6.2279 6.2279 8.6534 8.6534 9.4587 9.4587 9.5443 9.5443 9.5544 9.5544 9.6857 9.6857 k =-0.4677 0.2695 0.0000 ( 12542 PWs) bands (ev): -14.4177 -14.4177 -14.2967 -14.2967 -11.7308 -11.7308 -11.1563 -11.1563 -3.3387 -3.3387 -3.1441 -3.1441 -2.1044 -2.1044 -1.8595 -1.8595 -1.7743 -1.7743 -1.5074 -1.5074 0.8099 0.8099 0.9925 0.9925 2.3959 2.3959 3.0478 3.0478 3.1470 3.1470 3.2766 3.2766 3.8872 3.8872 4.0448 4.0448 4.1133 4.1133 4.2429 4.2429 4.4387 4.4387 4.4951 4.4951 4.6693 4.6693 4.7520 4.7520 6.2131 6.2131 6.2270 6.2270 8.6970 8.6970 9.4756 9.4756 9.5379 9.5379 9.5753 9.5753 9.6773 9.6773 k =-0.4839 0.2788 0.0000 ( 12548 PWs) bands (ev): -14.4169 -14.4169 -14.2974 -14.2974 -11.7314 -11.7314 -11.1558 -11.1558 -3.3372 -3.3372 -3.1463 -3.1463 -2.1041 -2.1041 -1.8519 -1.8519 -1.7820 -1.7820 -1.5078 -1.5078 0.8083 0.8083 0.9915 0.9915 2.3954 2.3954 3.0494 3.0494 3.1490 3.1490 3.2772 3.2772 3.8877 3.8877 4.0462 4.0462 4.1128 4.1128 4.2430 4.2430 4.4382 4.4382 4.4950 4.4950 4.6698 4.6698 4.7525 4.7525 6.2119 6.2119 6.2265 6.2265 8.7247 8.7247 9.4858 9.4858 9.5340 9.5340 9.5876 9.5876 9.6722 9.6722 k =-0.5000 0.2881 0.0000 ( 12544 PWs) bands (ev): -14.4167 -14.4167 -14.2976 -14.2976 -11.7316 -11.7316 -11.1557 -11.1557 -3.3367 -3.3367 -3.1470 -3.1470 -2.1040 -2.1040 -1.8490 -1.8490 -1.7850 -1.7850 -1.5080 -1.5080 0.8078 0.8078 0.9912 0.9912 2.3953 2.3953 3.0499 3.0499 3.1497 3.1497 3.2774 3.2774 3.8878 3.8878 4.0466 4.0466 4.1126 4.1126 4.2430 4.2430 4.4381 4.4381 4.4950 4.4950 4.6700 4.6700 4.7527 4.7527 6.2114 6.2114 6.2263 6.2263 8.7342 8.7342 9.4891 9.4891 9.5327 9.5327 9.5916 9.5916 9.6705 9.6705 k =-0.5000 0.2881 0.0000 ( 12544 PWs) bands (ev): -14.4167 -14.4167 -14.2976 -14.2976 -11.7316 -11.7316 -11.1557 -11.1557 -3.3367 -3.3367 -3.1470 -3.1470 -2.1040 -2.1040 -1.8490 -1.8490 -1.7850 -1.7850 -1.5080 -1.5080 0.8078 0.8078 0.9912 0.9912 2.3953 2.3953 3.0499 3.0499 3.1497 3.1497 3.2774 3.2774 3.8878 3.8878 4.0466 4.0466 4.1126 4.1126 4.2430 4.2430 4.4381 4.4381 4.4950 4.4950 4.6700 4.6700 4.7527 4.7527 6.2114 6.2114 6.2263 6.2263 8.7342 8.7342 9.4891 9.4891 9.5327 9.5327 9.5916 9.5916 9.6705 9.6705 k =-0.4907 0.3042-0.0000 ( 12554 PWs) bands (ev): -14.4165 -14.4165 -14.2977 -14.2977 -11.7317 -11.7317 -11.1559 -11.1559 -3.3361 -3.3361 -3.1471 -3.1471 -2.1030 -2.1030 -1.8494 -1.8494 -1.7847 -1.7847 -1.5072 -1.5072 0.8078 0.8078 0.9913 0.9913 2.3935 2.3935 3.0502 3.0502 3.1494 3.1494 3.2773 3.2773 3.8877 3.8877 4.0435 4.0435 4.1135 4.1135 4.2431 4.2431 4.4380 4.4380 4.4949 4.4949 4.6698 4.6698 4.7525 4.7525 6.2113 6.2113 6.2251 6.2251 8.7356 8.7356 9.4611 9.4611 9.5353 9.5353 9.5914 9.5914 9.7004 9.7004 k =-0.4814 0.3203-0.0000 ( 12554 PWs) bands (ev): -14.4159 -14.4159 -14.2979 -14.2979 -11.7322 -11.7322 -11.1567 -11.1567 -3.3340 -3.3340 -3.1472 -3.1472 -2.1000 -2.1000 -1.8506 -1.8506 -1.7838 -1.7838 -1.5047 -1.5047 0.8078 0.8078 0.9915 0.9915 2.3880 2.3880 3.0509 3.0509 3.1484 3.1484 3.2771 3.2771 3.8873 3.8873 4.0346 4.0346 4.1157 4.1157 4.2432 4.2432 4.4378 4.4378 4.4946 4.4946 4.6692 4.6692 4.7519 4.7519 6.2109 6.2109 6.2214 6.2214 8.7398 8.7398 9.4019 9.4019 9.5449 9.5449 9.5908 9.5908 9.7634 9.7634 k =-0.4722 0.3364-0.0000 ( 12544 PWs) bands (ev): -14.4148 -14.4148 -14.2982 -14.2982 -11.7330 -11.7330 -11.1580 -11.1580 -3.3306 -3.3306 -3.1474 -3.1474 -2.0950 -2.0950 -1.8524 -1.8524 -1.7825 -1.7825 -1.5006 -1.5006 0.8078 0.8078 0.9918 0.9918 2.3790 2.3790 3.0521 3.0521 3.1469 3.1469 3.2768 3.2768 3.8865 3.8865 4.0208 4.0208 4.1184 4.1184 4.2434 4.2434 4.4375 4.4375 4.4943 4.4943 4.6683 4.6683 4.7509 4.7509 6.2102 6.2102 6.2153 6.2153 8.7467 8.7467 9.3340 9.3340 9.5611 9.5611 9.5902 9.5902 9.8366 9.8366 k =-0.4629 0.3525-0.0000 ( 12548 PWs) bands (ev): -14.4134 -14.4134 -14.2988 -14.2988 -11.7340 -11.7340 -11.1597 -11.1597 -3.3259 -3.3259 -3.1477 -3.1477 -2.0881 -2.0881 -1.8546 -1.8546 -1.7809 -1.7809 -1.4951 -1.4951 0.8078 0.8078 0.9923 0.9923 2.3667 2.3667 3.0536 3.0536 3.1448 3.1448 3.2763 3.2763 3.8854 3.8854 4.0030 4.0030 4.1210 4.1210 4.2438 4.2438 4.4371 4.4371 4.4937 4.4937 4.6670 4.6670 4.7495 4.7495 6.2069 6.2069 6.2093 6.2093 8.7563 8.7563 9.2637 9.2637 9.5802 9.5802 9.5931 9.5931 9.9127 9.9127 k =-0.4536 0.3686-0.0000 ( 12548 PWs) bands (ev): -14.4116 -14.4116 -14.2994 -14.2994 -11.7353 -11.7353 -11.1620 -11.1620 -3.3199 -3.3199 -3.1481 -3.1481 -2.0792 -2.0792 -1.8571 -1.8571 -1.7794 -1.7794 -1.4881 -1.4881 0.8079 0.8079 0.9929 0.9929 2.3514 2.3514 3.0554 3.0554 3.1421 3.1421 3.2757 3.2757 3.8837 3.8837 3.9816 3.9816 4.1233 4.1233 4.2441 4.2441 4.4365 4.4365 4.4931 4.4931 4.6653 4.6653 4.7479 4.7479 6.1966 6.1966 6.2083 6.2083 8.7683 8.7683 9.1929 9.1929 9.5841 9.5841 9.6176 9.6176 9.9358 9.9358 k =-0.4443 0.3847-0.0000 ( 12548 PWs) bands (ev): -14.4094 -14.4094 -14.3003 -14.3003 -11.7369 -11.7369 -11.1647 -11.1647 -3.3128 -3.3128 -3.1486 -3.1486 -2.0684 -2.0684 -1.8595 -1.8595 -1.7779 -1.7779 -1.4798 -1.4798 0.8080 0.8080 0.9937 0.9937 2.3333 2.3333 3.0572 3.0572 3.1389 3.1389 3.2750 3.2750 3.8811 3.8811 3.9573 3.9573 4.1251 4.1251 4.2446 4.2446 4.4359 4.4359 4.4923 4.4923 4.6632 4.6632 4.7460 4.7460 6.1844 6.1844 6.2070 6.2070 8.7828 8.7828 9.1222 9.1222 9.5830 9.5830 9.6532 9.6532 9.8859 9.8859 k =-0.4351 0.4008-0.0000 ( 12546 PWs) bands (ev): -14.4068 -14.4068 -14.3013 -14.3013 -11.7387 -11.7387 -11.1678 -11.1678 -3.3046 -3.3046 -3.1492 -3.1492 -2.0557 -2.0557 -1.8619 -1.8619 -1.7767 -1.7767 -1.4704 -1.4704 0.8081 0.8081 0.9947 0.9947 2.3129 2.3129 3.0589 3.0589 3.1351 3.1351 3.2741 3.2741 3.8764 3.8764 3.9317 3.9317 4.1265 4.1265 4.2451 4.2451 4.4352 4.4352 4.4914 4.4914 4.6608 4.6608 4.7441 4.7441 6.1707 6.1707 6.2057 6.2057 8.7994 8.7994 9.0521 9.0521 9.5815 9.5815 9.6951 9.6951 9.8287 9.8287 k =-0.4258 0.4169-0.0000 ( 12544 PWs) bands (ev): -14.4039 -14.4039 -14.3025 -14.3025 -11.7406 -11.7406 -11.1713 -11.1713 -3.2953 -3.2953 -3.1501 -3.1501 -2.0413 -2.0413 -1.8640 -1.8640 -1.7756 -1.7756 -1.4602 -1.4602 0.8084 0.8084 0.9958 0.9958 2.2904 2.2904 3.0604 3.0604 3.1309 3.1309 3.2731 3.2731 3.8658 3.8658 3.9088 3.9088 4.1275 4.1275 4.2457 4.2457 4.4344 4.4344 4.4904 4.4904 4.6579 4.6579 4.7420 4.7420 6.1558 6.1558 6.2042 6.2042 8.8177 8.8177 8.9827 8.9827 9.5801 9.5801 9.7363 9.7363 9.7732 9.7732 k =-0.4165 0.4330-0.0000 ( 12544 PWs) bands (ev): -14.4007 -14.4007 -14.3039 -14.3039 -11.7427 -11.7427 -11.1751 -11.1751 -3.2851 -3.2851 -3.1511 -3.1511 -2.0253 -2.0253 -1.8659 -1.8659 -1.7748 -1.7748 -1.4493 -1.4493 0.8088 0.8088 0.9972 0.9972 2.2663 2.2663 3.0617 3.0617 3.1263 3.1263 3.2720 3.2720 3.8428 3.8428 3.8952 3.8952 4.1281 4.1281 4.2463 4.2463 4.4336 4.4336 4.4894 4.4894 4.6547 4.6547 4.7400 4.7400 6.1400 6.1400 6.2028 6.2028 8.8366 8.8366 8.9151 8.9151 9.5789 9.5789 9.6944 9.6944 9.8031 9.8031 k =-0.4072 0.4491-0.0000 ( 12562 PWs) bands (ev): -14.3971 -14.3971 -14.3054 -14.3054 -11.7449 -11.7449 -11.1793 -11.1793 -3.2741 -3.2741 -3.1523 -3.1523 -2.0077 -2.0077 -1.8674 -1.8674 -1.7741 -1.7741 -1.4381 -1.4381 0.8093 0.8093 0.9988 0.9988 2.2410 2.2410 3.0625 3.0625 3.1213 3.1213 3.2708 3.2708 3.8097 3.8097 3.8889 3.8889 4.1284 4.1284 4.2469 4.2469 4.4327 4.4327 4.4883 4.4883 4.6511 4.6511 4.7380 4.7380 6.1235 6.1235 6.2014 6.2014 8.8340 8.8340 8.8709 8.8709 9.5780 9.5780 9.6267 9.6267 9.8620 9.8620 k =-0.3979 0.4652-0.0000 ( 12558 PWs) bands (ev): -14.3932 -14.3932 -14.3072 -14.3072 -11.7471 -11.7471 -11.1837 -11.1837 -3.2624 -3.2624 -3.1538 -3.1538 -1.9890 -1.9890 -1.8683 -1.8683 -1.7735 -1.7735 -1.4268 -1.4268 0.8099 0.8099 1.0006 1.0006 2.2149 2.2149 3.0629 3.0629 3.1160 3.1160 3.2695 3.2695 3.7716 3.7716 3.8853 3.8853 4.1285 4.1285 4.2476 4.2476 4.4318 4.4318 4.4872 4.4872 4.6473 4.6473 4.7361 4.7361 6.1068 6.1068 6.2000 6.2000 8.7725 8.7725 8.8872 8.8872 9.5558 9.5558 9.5786 9.5786 9.9270 9.9270 k =-0.3887 0.4813-0.0000 ( 12572 PWs) bands (ev): -14.3890 -14.3890 -14.3092 -14.3092 -11.7493 -11.7493 -11.1883 -11.1883 -3.2500 -3.2500 -3.1555 -3.1555 -1.9695 -1.9695 -1.8684 -1.8684 -1.7728 -1.7728 -1.4157 -1.4157 0.8108 0.8108 1.0026 1.0026 2.1885 2.1885 3.0627 3.0627 3.1104 3.1104 3.2681 3.2681 3.7306 3.7306 3.8827 3.8827 4.1285 4.1285 4.2483 4.2483 4.4309 4.4309 4.4861 4.4861 4.6433 4.6433 4.7344 4.7344 6.0900 6.0900 6.1988 6.1988 8.7059 8.7059 8.9095 8.9095 9.4859 9.4859 9.5784 9.5784 9.9971 9.9971 k =-0.3794 0.4974-0.0000 ( 12562 PWs) bands (ev): -14.3846 -14.3846 -14.3114 -14.3114 -11.7515 -11.7515 -11.1932 -11.1932 -3.2372 -3.2372 -3.1576 -3.1576 -1.9503 -1.9503 -1.8670 -1.8670 -1.7719 -1.7719 -1.4052 -1.4052 0.8119 0.8119 1.0049 1.0049 2.1622 2.1622 3.0619 3.0619 3.1047 3.1047 3.2665 3.2665 3.6875 3.6875 3.8804 3.8804 4.1283 4.1283 4.2490 4.2490 4.4301 4.4301 4.4851 4.4851 4.6391 4.6391 4.7328 4.7328 6.0734 6.0734 6.1978 6.1978 8.6395 8.6395 8.9313 8.9313 9.4174 9.4174 9.5789 9.5789 10.0717 10.0717 k =-0.3701 0.5135-0.0000 ( 12554 PWs) bands (ev): -14.3800 -14.3800 -14.3139 -14.3139 -11.7536 -11.7536 -11.1981 -11.1981 -3.2240 -3.2240 -3.1599 -3.1599 -1.9330 -1.9330 -1.8626 -1.8626 -1.7706 -1.7706 -1.3955 -1.3955 0.8132 0.8132 1.0074 1.0074 2.1363 2.1363 3.0605 3.0605 3.0989 3.0989 3.2649 3.2649 3.6431 3.6431 3.8784 3.8784 4.1280 4.1280 4.2496 4.2496 4.4293 4.4293 4.4840 4.4840 4.6348 4.6348 4.7313 4.7313 6.0573 6.0573 6.1969 6.1969 8.5738 8.5738 8.9502 8.9502 9.3532 9.3532 9.5799 9.5799 10.1500 10.1500 k =-0.3608 0.5296-0.0000 ( 12552 PWs) bands (ev): -14.3751 -14.3751 -14.3166 -14.3166 -11.7555 -11.7555 -11.2031 -11.2031 -3.2105 -3.2105 -3.1626 -3.1626 -1.9204 -1.9204 -1.8528 -1.8528 -1.7688 -1.7688 -1.3870 -1.3870 0.8148 0.8148 1.0101 1.0101 2.1114 2.1114 3.0584 3.0584 3.0931 3.0931 3.2633 3.2633 3.5977 3.5977 3.8766 3.8766 4.1277 4.1277 4.2503 4.2503 4.4285 4.4285 4.4830 4.4830 4.6306 4.6306 4.7300 4.7300 6.0419 6.0419 6.1964 6.1964 8.5090 8.5090 8.9618 8.9618 9.2978 9.2978 9.5811 9.5811 10.2312 10.2312 k =-0.3516 0.5457-0.0000 ( 12548 PWs) bands (ev): -14.3701 -14.3701 -14.3195 -14.3195 -11.7572 -11.7572 -11.2082 -11.2082 -3.1969 -3.1969 -3.1656 -3.1656 -1.9140 -1.9140 -1.8363 -1.8363 -1.7663 -1.7663 -1.3800 -1.3800 0.8167 0.8167 1.0131 1.0131 2.0878 2.0878 3.0556 3.0556 3.0874 3.0874 3.2615 3.2615 3.5519 3.5519 3.8748 3.8748 4.1273 4.1273 4.2509 4.2509 4.4279 4.4279 4.4820 4.4820 4.6264 4.6264 4.7289 4.7289 6.0274 6.0274 6.1961 6.1961 8.4453 8.4453 8.9596 8.9596 9.2580 9.2580 9.5823 9.5823 10.3135 10.3135 k =-0.3423 0.5618-0.0000 ( 12548 PWs) bands (ev): -14.3649 -14.3649 -14.3227 -14.3227 -11.7587 -11.7587 -11.2132 -11.2132 -3.1833 -3.1833 -3.1688 -3.1688 -1.9126 -1.9126 -1.8147 -1.8147 -1.7628 -1.7628 -1.3747 -1.3747 0.8189 0.8189 1.0162 1.0162 2.0660 2.0660 3.0521 3.0521 3.0819 3.0819 3.2598 3.2598 3.5063 3.5063 3.8732 3.8732 4.1270 4.1270 4.2515 4.2515 4.4273 4.4273 4.4812 4.4812 4.6222 4.6222 4.7278 4.7278 6.0139 6.0139 6.1961 6.1961 8.3829 8.3829 8.9371 8.9371 9.2405 9.2405 9.5835 9.5835 10.3927 10.3927 k =-0.3330 0.5779-0.0000 ( 12556 PWs) bands (ev): -14.3595 -14.3595 -14.3261 -14.3261 -11.7599 -11.7599 -11.2181 -11.2181 -3.1748 -3.1748 -3.1674 -3.1674 -1.9144 -1.9144 -1.7908 -1.7908 -1.7579 -1.7579 -1.3713 -1.3713 0.8214 0.8214 1.0195 1.0195 2.0462 2.0462 3.0480 3.0480 3.0766 3.0766 3.2580 3.2580 3.4612 3.4612 3.8718 3.8718 4.1268 4.1268 4.2520 4.2520 4.4269 4.4269 4.4804 4.4804 4.6183 4.6183 4.7269 4.7269 6.0016 6.0016 6.1965 6.1965 8.3221 8.3221 8.8949 8.8949 9.2450 9.2450 9.5844 9.5844 10.4575 10.4575 k =-0.3330 0.5779-0.0000 ( 12556 PWs) bands (ev): -14.3595 -14.3595 -14.3261 -14.3261 -11.7599 -11.7599 -11.2181 -11.2181 -3.1748 -3.1748 -3.1674 -3.1674 -1.9144 -1.9144 -1.7908 -1.7908 -1.7579 -1.7579 -1.3713 -1.3713 0.8214 0.8214 1.0195 1.0195 2.0462 2.0462 3.0480 3.0480 3.0766 3.0766 3.2580 3.2580 3.4612 3.4612 3.8718 3.8718 4.1268 4.1268 4.2520 4.2520 4.4269 4.4269 4.4804 4.4804 4.6183 4.6183 4.7269 4.7269 6.0016 6.0016 6.1965 6.1965 8.3221 8.3221 8.8949 8.8949 9.2450 9.2450 9.5844 9.5844 10.4575 10.4575 k =-0.3330 0.5779 0.0187 ( 12554 PWs) bands (ev): -14.3595 -14.3595 -14.3261 -14.3261 -11.7596 -11.7596 -11.2185 -11.2185 -3.1754 -3.1754 -3.1673 -3.1673 -1.9161 -1.9161 -1.7903 -1.7903 -1.7571 -1.7571 -1.3716 -1.3716 0.8224 0.8224 1.0206 1.0206 2.0467 2.0467 3.0452 3.0452 3.0733 3.0733 3.2607 3.2607 3.4589 3.4589 3.8722 3.8722 4.1271 4.1271 4.2535 4.2535 4.4282 4.4282 4.4807 4.4807 4.6195 4.6195 4.7273 4.7273 6.0009 6.0009 6.1929 6.1929 8.3240 8.3240 8.8980 8.8980 9.2481 9.2481 9.5839 9.5839 10.4572 10.4572 k =-0.3330 0.5779 0.0375 ( 12560 PWs) bands (ev): -14.3593 -14.3593 -14.3261 -14.3261 -11.7586 -11.7586 -11.2197 -11.2197 -3.1770 -3.1770 -3.1669 -3.1669 -1.9209 -1.9209 -1.7890 -1.7890 -1.7543 -1.7543 -1.3722 -1.3722 0.8252 0.8252 1.0237 1.0237 2.0484 2.0484 3.0363 3.0363 3.0646 3.0646 3.2684 3.2684 3.4524 3.4524 3.8737 3.8737 4.1281 4.1281 4.2580 4.2580 4.4321 4.4321 4.4816 4.4816 4.6232 4.6232 4.7283 4.7283 5.9986 5.9986 6.1822 6.1822 8.3298 8.3298 8.9069 8.9069 9.2574 9.2574 9.5825 9.5825 10.4563 10.4563 k =-0.3330 0.5779 0.0562 ( 12556 PWs) bands (ev): -14.3591 -14.3591 -14.3260 -14.3260 -11.7571 -11.7571 -11.2216 -11.2216 -3.1794 -3.1794 -3.1667 -3.1667 -1.9283 -1.9283 -1.7876 -1.7876 -1.7496 -1.7496 -1.3734 -1.3734 0.8300 0.8300 1.0289 1.0289 2.0511 2.0511 3.0210 3.0210 3.0523 3.0523 3.2797 3.2797 3.4417 3.4417 3.8760 3.8760 4.1299 4.1299 4.2649 4.2649 4.4385 4.4385 4.4832 4.4832 4.6293 4.6293 4.7301 4.7301 5.9949 5.9949 6.1645 6.1645 8.3393 8.3393 8.9213 8.9213 9.2729 9.2729 9.5803 9.5803 10.4547 10.4547 k =-0.3330 0.5779 0.0749 ( 12558 PWs) bands (ev): -14.3587 -14.3587 -14.3259 -14.3259 -11.7549 -11.7549 -11.2242 -11.2242 -3.1825 -3.1825 -3.1667 -3.1667 -1.9376 -1.9376 -1.7866 -1.7866 -1.7431 -1.7431 -1.3749 -1.3749 0.8366 0.8366 1.0360 1.0360 2.0550 2.0550 2.9994 2.9994 3.0376 3.0376 3.2934 3.2934 3.4274 3.4274 3.8793 3.8793 4.1324 4.1324 4.2738 4.2738 4.4472 4.4472 4.4853 4.4853 4.6377 4.6377 4.7330 4.7330 5.9896 5.9896 6.1404 6.1404 8.3523 8.3523 8.9404 8.9404 9.2949 9.2949 9.5773 9.5773 10.4523 10.4523 k =-0.3330 0.5779 0.0937 ( 12548 PWs) bands (ev): -14.3582 -14.3582 -14.3258 -14.3258 -11.7520 -11.7520 -11.2276 -11.2276 -3.1861 -3.1861 -3.1669 -3.1669 -1.9483 -1.9483 -1.7862 -1.7862 -1.7351 -1.7351 -1.3768 -1.3768 0.8451 0.8451 1.0451 1.0451 2.0599 2.0599 2.9728 2.9728 3.0208 3.0208 3.3084 3.3084 3.4099 3.4099 3.8833 3.8833 4.1357 4.1357 4.2839 4.2839 4.4579 4.4579 4.4879 4.4879 4.6482 4.6482 4.7372 4.7372 5.9829 5.9829 6.1104 6.1104 8.3686 8.3686 8.9632 8.9632 9.3233 9.3233 9.5737 9.5737 10.4488 10.4488 k =-0.3330 0.5779 0.1124 ( 12536 PWs) bands (ev): -14.3576 -14.3576 -14.3257 -14.3257 -11.7486 -11.7486 -11.2317 -11.2317 -3.1902 -3.1902 -3.1675 -3.1675 -1.9597 -1.9597 -1.7864 -1.7864 -1.7262 -1.7262 -1.3790 -1.3790 0.8554 0.8554 1.0561 1.0561 2.0659 2.0659 2.9424 2.9424 3.0015 3.0015 3.3235 3.3235 3.3907 3.3907 3.8882 3.8882 4.1397 4.1397 4.2945 4.2945 4.4703 4.4703 4.4912 4.4912 4.6605 4.6605 4.7433 4.7433 5.9746 5.9746 6.0751 6.0751 8.3879 8.3879 8.9887 8.9887 9.3584 9.3584 9.5697 9.5697 10.4439 10.4439 k =-0.3330 0.5779 0.1311 ( 12548 PWs) bands (ev): -14.3570 -14.3570 -14.3256 -14.3256 -11.7445 -11.7445 -11.2366 -11.2366 -3.1947 -3.1947 -3.1683 -3.1683 -1.9717 -1.9717 -1.7871 -1.7871 -1.7167 -1.7167 -1.3815 -1.3815 0.8673 0.8673 1.0689 1.0689 2.0730 2.0730 2.9091 2.9091 2.9799 2.9799 3.3340 3.3340 3.3744 3.3744 3.8938 3.8938 4.1445 4.1445 4.3048 4.3048 4.4836 4.4836 4.4952 4.4952 4.6743 4.6743 4.7517 4.7517 5.9649 5.9649 6.0353 6.0353 8.4099 8.4099 9.0157 9.0157 9.3999 9.3999 9.5655 9.5655 10.4371 10.4371 k =-0.3330 0.5779 0.1499 ( 12553 PWs) bands (ev): -14.3562 -14.3562 -14.3254 -14.3254 -11.7399 -11.7399 -11.2421 -11.2421 -3.1997 -3.1997 -3.1694 -3.1694 -1.9839 -1.9839 -1.7881 -1.7881 -1.7070 -1.7070 -1.3842 -1.3842 0.8809 0.8809 1.0833 1.0833 2.0811 2.0811 2.8734 2.8734 2.9560 2.9560 3.3251 3.3251 3.3764 3.3764 3.9002 3.9002 4.1498 4.1498 4.3141 4.3141 4.4942 4.4942 4.5033 4.5033 4.6893 4.6893 4.7628 4.7628 5.9535 5.9535 5.9919 5.9919 8.4341 8.4341 9.0431 9.0431 9.4477 9.4477 9.5616 9.5616 10.4278 10.4278 k =-0.3330 0.5779 0.1686 ( 12543 PWs) bands (ev): -14.3554 -14.3554 -14.3253 -14.3253 -11.7346 -11.7346 -11.2484 -11.2484 -3.2051 -3.2051 -3.1708 -3.1708 -1.9961 -1.9961 -1.7894 -1.7894 -1.6974 -1.6974 -1.3871 -1.3871 0.8961 0.8961 1.0993 1.0993 2.0903 2.0903 2.8359 2.8359 2.9300 2.9300 3.3010 3.3010 3.3926 3.3926 3.9072 3.9072 4.1557 4.1557 4.3221 4.3221 4.4990 4.4990 4.5177 4.5177 4.7055 4.7055 4.7771 4.7771 5.9372 5.9372 5.9488 5.9488 8.4600 8.4600 9.0701 9.0701 9.5008 9.5008 9.5584 9.5584 10.4158 10.4158 k =-0.3330 0.5779 0.1874 ( 12547 PWs) bands (ev): -14.3545 -14.3545 -14.3251 -14.3251 -11.7288 -11.7288 -11.2553 -11.2553 -3.2108 -3.2108 -3.1725 -3.1725 -2.0081 -2.0081 -1.7908 -1.7908 -1.6880 -1.6880 -1.3900 -1.3900 0.9128 0.9128 1.1167 1.1167 2.1006 2.1006 2.7969 2.7969 2.9022 2.9022 3.2724 3.2724 3.4129 3.4129 3.9149 3.9149 4.1619 4.1619 4.3285 4.3285 4.5019 4.5019 4.5338 4.5338 4.7228 4.7228 4.7945 4.7945 5.8939 5.8939 5.9290 5.9290 8.4872 8.4872 9.0958 9.0958 9.5487 9.5487 9.5665 9.5665 10.4014 10.4014 k =-0.3330 0.5779 0.2061 ( 12551 PWs) bands (ev): -14.3535 -14.3535 -14.3250 -14.3250 -11.7223 -11.7223 -11.2628 -11.2628 -3.2167 -3.2167 -3.1744 -3.1744 -2.0199 -2.0199 -1.7924 -1.7924 -1.6791 -1.6791 -1.3929 -1.3929 0.9309 0.9309 1.1354 1.1354 2.1118 2.1118 2.7569 2.7569 2.8726 2.8726 3.2417 3.2417 3.4351 3.4351 3.9232 3.9232 4.1686 4.1686 4.3330 4.3330 4.5037 4.5037 4.5500 4.5500 4.7414 4.7414 4.8148 4.8148 5.8433 5.8433 5.9134 5.9134 8.5150 8.5150 9.1194 9.1194 9.5516 9.5516 9.6248 9.6248 10.3854 10.3854 k =-0.3330 0.5779 0.2248 ( 12543 PWs) bands (ev): -14.3524 -14.3524 -14.3248 -14.3248 -11.7154 -11.7154 -11.2710 -11.2710 -3.2229 -3.2229 -3.1766 -3.1766 -2.0312 -2.0312 -1.7942 -1.7942 -1.6707 -1.6707 -1.3958 -1.3958 0.9503 0.9503 1.1552 1.1552 2.1240 2.1240 2.7162 2.7162 2.8417 2.8417 3.2096 3.2096 3.4588 3.4588 3.9321 3.9321 4.1755 4.1755 4.3358 4.3358 4.5042 4.5042 4.5658 4.5658 4.7618 4.7618 4.8375 4.8375 5.7915 5.7915 5.8968 5.8968 8.5430 8.5430 9.1405 9.1405 9.5518 9.5518 9.6900 9.6900 10.3693 10.3693 k =-0.3330 0.5779 0.2436 ( 12551 PWs) bands (ev): -14.3513 -14.3513 -14.3247 -14.3247 -11.7078 -11.7078 -11.2797 -11.2797 -3.2292 -3.2292 -3.1791 -3.1791 -2.0421 -2.0421 -1.7960 -1.7960 -1.6628 -1.6628 -1.3985 -1.3985 0.9709 0.9709 1.1759 1.1759 2.1372 2.1372 2.6752 2.6752 2.8096 2.8096 3.1764 3.1764 3.4840 3.4840 3.9416 3.9416 4.1825 4.1825 4.3371 4.3371 4.5032 4.5032 4.5806 4.5806 4.7840 4.7840 4.8621 4.8621 5.7393 5.7393 5.8790 5.8790 8.5707 8.5707 9.1583 9.1583 9.5537 9.5537 9.7566 9.7566 10.3549 10.3549 k =-0.3330 0.5779 0.2623 ( 12550 PWs) bands (ev): -14.3501 -14.3501 -14.3246 -14.3246 -11.6998 -11.6998 -11.2891 -11.2891 -3.2357 -3.2357 -3.1817 -3.1817 -2.0525 -2.0525 -1.7978 -1.7978 -1.6557 -1.6557 -1.4010 -1.4010 0.9926 0.9926 1.1974 1.1974 2.1514 2.1514 2.6341 2.6341 2.7766 2.7766 3.1426 3.1426 3.5105 3.5105 3.9516 3.9516 4.1897 4.1897 4.3369 4.3369 4.5009 4.5009 4.5937 4.5937 4.8081 4.8081 4.8881 4.8881 5.6874 5.6874 5.8600 5.8600 8.5975 8.5975 9.1726 9.1726 9.5578 9.5578 9.8218 9.8218 10.3450 10.3450 k =-0.3330 0.5779 0.2810 ( 12560 PWs) bands (ev): -14.3489 -14.3489 -14.3245 -14.3245 -11.6912 -11.6912 -11.2989 -11.2989 -3.2421 -3.2421 -3.1845 -3.1845 -2.0622 -2.0622 -1.7997 -1.7997 -1.6493 -1.6493 -1.4032 -1.4032 1.0154 1.0154 1.2194 1.2194 2.1664 2.1664 2.5933 2.5933 2.7429 2.7429 3.1081 3.1081 3.5383 3.5383 3.9621 3.9621 4.1968 4.1968 4.3357 4.3357 4.4971 4.4971 4.6048 4.6048 4.8338 4.8338 4.9152 4.9152 5.6366 5.6366 5.8398 5.8398 8.6230 8.6230 9.1828 9.1828 9.5644 9.5644 9.8818 9.8818 10.3433 10.3433 k =-0.3330 0.5779 0.2998 ( 12555 PWs) bands (ev): -14.3477 -14.3477 -14.3244 -14.3244 -11.6821 -11.6821 -11.3093 -11.3093 -3.2486 -3.2486 -3.1875 -3.1875 -2.0713 -2.0713 -1.8016 -1.8016 -1.6436 -1.6436 -1.4051 -1.4051 1.0390 1.0390 1.2416 1.2416 2.1822 2.1822 2.5531 2.5531 2.7088 2.7088 3.0733 3.0733 3.5674 3.5674 3.9730 3.9730 4.2038 4.2038 4.3335 4.3335 4.4919 4.4919 4.6132 4.6132 4.8611 4.8611 4.9429 4.9429 5.5876 5.5876 5.8185 5.8185 8.6470 8.6470 9.1888 9.1888 9.5736 9.5736 9.9322 9.9322 10.3547 10.3547 k =-0.3330 0.5779 0.3185 ( 12559 PWs) bands (ev): -14.3464 -14.3464 -14.3244 -14.3244 -11.6726 -11.6726 -11.3201 -11.3201 -3.2549 -3.2549 -3.1906 -3.1906 -2.0797 -2.0797 -1.8034 -1.8034 -1.6387 -1.6387 -1.4066 -1.4066 1.0635 1.0635 1.2640 1.2640 2.1988 2.1988 2.5138 2.5138 2.6745 2.6745 3.0382 3.0382 3.5977 3.5977 3.9843 3.9843 4.2105 4.2105 4.3308 4.3308 4.4856 4.4856 4.6183 4.6183 4.8895 4.8895 4.9711 4.9711 5.5409 5.5409 5.7961 5.7961 8.6692 8.6692 9.1905 9.1905 9.5856 9.5856 9.9682 9.9682 10.3839 10.3839 k =-0.3330 0.5779 0.3372 ( 12553 PWs) bands (ev): -14.3451 -14.3451 -14.3244 -14.3244 -11.6626 -11.6626 -11.3314 -11.3314 -3.2611 -3.2611 -3.1938 -3.1938 -2.0874 -2.0874 -1.8052 -1.8052 -1.6345 -1.6345 -1.4077 -1.4077 1.0885 1.0885 1.2861 1.2861 2.2159 2.2159 2.4759 2.4759 2.6404 2.6404 3.0031 3.0031 3.6294 3.6294 3.9961 3.9961 4.2167 4.2167 4.3278 4.3278 4.4782 4.4782 4.6198 4.6198 4.9188 4.9188 4.9995 4.9995 5.4972 5.4972 5.7726 5.7726 8.6898 8.6898 9.1878 9.1878 9.6002 9.6002 9.9885 9.9885 10.4322 10.4322 k =-0.3330 0.5779 0.3560 ( 12537 PWs) bands (ev): -14.3438 -14.3438 -14.3245 -14.3245 -11.6521 -11.6521 -11.3431 -11.3431 -3.2671 -3.2671 -3.1970 -3.1970 -2.0944 -2.0944 -1.8070 -1.8070 -1.6311 -1.6311 -1.4085 -1.4085 1.1142 1.1142 1.3076 1.3076 2.2334 2.2334 2.4398 2.4398 2.6066 2.6066 2.9679 2.9679 3.6622 3.6622 4.0081 4.0081 4.2220 4.2220 4.3250 4.3250 4.4697 4.4697 4.6172 4.6172 4.9485 4.9485 5.0279 5.0279 5.4571 5.4571 5.7482 5.7482 8.7087 8.7087 9.1808 9.1808 9.6171 9.6171 9.9956 9.9956 10.4971 10.4971 k =-0.3330 0.5779 0.3747 ( 12547 PWs) bands (ev): -14.3425 -14.3425 -14.3246 -14.3246 -11.6413 -11.6413 -11.3551 -11.3551 -3.2728 -3.2728 -3.2002 -3.2002 -2.1007 -2.1007 -1.8087 -1.8087 -1.6284 -1.6284 -1.4089 -1.4089 1.1402 1.1402 1.3283 1.3283 2.2508 2.2508 2.4060 2.4060 2.5738 2.5738 2.9327 2.9327 3.6960 3.6960 4.0205 4.0205 4.2262 4.2262 4.3227 4.3227 4.4603 4.4603 4.6102 4.6102 4.9784 4.9784 5.0564 5.0564 5.4210 5.4210 5.7227 5.7227 8.7262 8.7262 9.1699 9.1699 9.6361 9.6361 9.9938 9.9938 10.5741 10.5741 k =-0.3330 0.5779 0.3934 ( 12544 PWs) bands (ev): -14.3412 -14.3412 -14.3247 -14.3247 -11.6300 -11.6300 -11.3675 -11.3675 -3.2782 -3.2782 -3.2034 -3.2034 -2.1064 -2.1064 -1.8104 -1.8104 -1.6263 -1.6263 -1.4090 -1.4090 1.1664 1.1664 1.3478 1.3478 2.2673 2.2673 2.3755 2.3755 2.5423 2.5423 2.8978 2.8978 3.7309 3.7309 4.0330 4.0330 4.2288 4.2288 4.3215 4.3215 4.4499 4.4499 4.5988 4.5988 5.0080 5.0080 5.0849 5.0849 5.3890 5.3890 5.6964 5.6964 8.7427 8.7427 9.1554 9.1554 9.6566 9.6566 9.9866 9.9866 10.6592 10.6592 k =-0.3330 0.5779 0.4122 ( 12538 PWs) bands (ev): -14.3399 -14.3399 -14.3249 -14.3249 -11.6184 -11.6184 -11.3802 -11.3802 -3.2832 -3.2832 -3.2064 -3.2064 -2.1113 -2.1113 -1.8119 -1.8119 -1.6247 -1.6247 -1.4089 -1.4089 1.1927 1.1927 1.3656 1.3656 2.2806 2.2806 2.3501 2.3501 2.5132 2.5132 2.8631 2.8631 3.7667 3.7667 4.0457 4.0457 4.2294 4.2294 4.3220 4.3220 4.4386 4.4386 4.5832 4.5832 5.0369 5.0369 5.1134 5.1134 5.3613 5.3613 5.6692 5.6692 8.7584 8.7584 9.1379 9.1379 9.6783 9.6783 9.9767 9.9767 10.7494 10.7494 k =-0.3330 0.5779 0.4309 ( 12537 PWs) bands (ev): -14.3386 -14.3386 -14.3252 -14.3252 -11.6064 -11.6064 -11.3931 -11.3931 -3.2878 -3.2878 -3.2094 -3.2094 -2.1157 -2.1157 -1.8133 -1.8133 -1.6236 -1.6236 -1.4085 -1.4085 1.2188 1.2188 1.3814 1.3814 2.2850 2.2850 2.3348 2.3348 2.4878 2.4878 2.8288 2.8288 3.8031 3.8031 4.0583 4.0583 4.2280 4.2280 4.3242 4.3242 4.4261 4.4261 4.5639 4.5639 5.0646 5.0646 5.1422 5.1422 5.3378 5.3378 5.6413 5.6413 8.7739 8.7739 9.1177 9.1177 9.7004 9.7004 9.9653 9.9653 10.8425 10.8425 k =-0.3330 0.5779 0.4497 ( 12506 PWs) bands (ev): -14.3374 -14.3374 -14.3256 -14.3256 -11.5941 -11.5941 -11.4063 -11.4063 -3.2920 -3.2920 -3.2121 -3.2121 -2.1194 -2.1194 -1.8146 -1.8146 -1.6228 -1.6228 -1.4080 -1.4080 1.2447 1.2447 1.3946 1.3946 2.2761 2.2761 2.3320 2.3320 2.4689 2.4689 2.7948 2.7948 3.8400 3.8400 4.0706 4.0706 4.2248 4.2248 4.3281 4.3281 4.4124 4.4124 4.5419 4.5419 5.0907 5.0907 5.1712 5.1712 5.3180 5.3180 5.6126 5.6126 8.7895 8.7895 9.0954 9.0954 9.7227 9.7227 9.9533 9.9533 10.9363 10.9363 k =-0.3330 0.5779 0.4684 ( 12514 PWs) bands (ev): -14.3361 -14.3361 -14.3260 -14.3260 -11.5815 -11.5815 -11.4197 -11.4197 -3.2957 -3.2957 -3.2145 -3.2145 -2.1225 -2.1225 -1.8158 -1.8158 -1.6224 -1.6224 -1.4073 -1.4073 1.2699 1.2699 1.4050 1.4050 2.2620 2.2620 2.3305 2.3305 2.4602 2.4602 2.7614 2.7614 3.8770 3.8770 4.0823 4.0823 4.2204 4.2204 4.3333 4.3333 4.3974 4.3974 4.5182 4.5182 5.1149 5.1149 5.2003 5.2003 5.3018 5.3018 5.5832 5.5832 8.8055 8.8055 9.0716 9.0716 9.7446 9.7446 9.9411 9.9411 11.0249 11.0249 k =-0.3330 0.5779 0.4871 ( 12516 PWs) bands (ev): -14.3350 -14.3350 -14.3265 -14.3265 -11.5687 -11.5687 -11.4332 -11.4332 -3.2988 -3.2988 -3.2167 -3.2167 -2.1251 -2.1251 -1.8168 -1.8168 -1.6221 -1.6221 -1.4067 -1.4067 1.2942 1.2942 1.4120 1.4120 2.2495 2.2495 2.3223 2.3223 2.4635 2.4635 2.7285 2.7285 3.9138 3.9138 4.0925 4.0925 4.2160 4.2160 4.3385 4.3385 4.3815 4.3815 4.4942 4.4942 5.1370 5.1370 5.2284 5.2284 5.2896 5.2896 5.5532 5.5532 8.8222 8.8222 9.0468 9.0468 9.7658 9.7658 9.9288 9.9288 11.0690 11.0695 k =-0.3330 0.5779 0.5059 ( 12517 PWs) bands (ev): -14.3338 -14.3338 -14.3270 -14.3270 -11.5557 -11.5557 -11.4468 -11.4468 -3.3014 -3.3014 -3.2185 -3.2185 -2.1272 -2.1272 -1.8177 -1.8177 -1.6220 -1.6220 -1.4061 -1.4061 1.3174 1.3174 1.4154 1.4154 2.2405 2.2405 2.3083 2.3083 2.4767 2.4767 2.6962 2.6962 3.9496 3.9496 4.0999 4.0999 4.2131 4.2131 4.3389 4.3389 4.3690 4.3690 4.4714 4.4714 5.1569 5.1569 5.2494 5.2494 5.2868 5.2868 5.5227 5.5227 8.8399 8.8399 9.0215 9.0215 9.7858 9.7858 9.9166 9.9166 11.0715 11.0720 k =-0.3330 0.5779 0.5246 ( 12517 PWs) bands (ev): -14.3328 -14.3328 -14.3276 -14.3276 -11.5424 -11.5424 -11.4605 -11.4605 -3.3035 -3.3035 -3.2200 -3.2200 -2.1288 -2.1288 -1.8184 -1.8184 -1.6220 -1.6220 -1.4056 -1.4056 1.3390 1.3390 1.4150 1.4150 2.2359 2.2359 2.2916 2.2916 2.4960 2.4960 2.6648 2.6648 3.9839 3.9839 4.1025 4.1025 4.2140 4.2140 4.3256 4.3256 4.3691 4.3691 4.4507 4.4507 5.1749 5.1749 5.2505 5.2505 5.3054 5.3054 5.4917 5.4917 8.8587 8.8587 8.9960 8.9960 9.8045 9.8045 9.9044 9.9044 11.0711 11.0714 k =-0.3330 0.5779 0.5433 ( 12522 PWs) bands (ev): -14.3317 -14.3317 -14.3283 -14.3283 -11.5290 -11.5290 -11.4743 -11.4743 -3.3050 -3.3050 -3.2211 -3.2211 -2.1299 -2.1299 -1.8188 -1.8188 -1.6220 -1.6220 -1.4052 -1.4052 1.3587 1.3587 1.4109 1.4109 2.2357 2.2357 2.2751 2.2751 2.5189 2.5189 2.6344 2.6344 4.0156 4.0156 4.0985 4.0985 4.2203 4.2203 4.3043 4.3043 4.3769 4.3769 4.4325 4.4325 5.1908 5.1908 5.2422 5.2422 5.3342 5.3342 5.4604 5.4604 8.8788 8.8788 8.9709 8.9709 9.8213 9.8213 9.8924 9.8924 11.0714 11.0722 k =-0.3330 0.5779 0.5621 ( 12527 PWs) bands (ev): -14.3308 -14.3308 -14.3291 -14.3291 -11.5154 -11.5154 -11.4880 -11.4880 -3.3059 -3.3059 -3.2217 -3.2217 -2.1305 -2.1305 -1.8191 -1.8191 -1.6221 -1.6221 -1.4049 -1.4049 1.3759 1.3759 1.4031 1.4031 2.2400 2.2400 2.2603 2.2603 2.5433 2.5433 2.6059 2.6059 4.0435 4.0435 4.0876 4.0876 4.2315 4.2315 4.2828 4.2828 4.3869 4.3869 4.4172 4.4172 5.2048 5.2048 5.2321 5.2321 5.3651 5.3651 5.4288 5.4288 8.9000 8.9000 8.9465 8.9465 9.8350 9.8350 9.8817 9.8817 11.0716 11.0721 k =-0.3330 0.5779 0.5808 ( 12520 PWs) bands (ev): -14.3299 -14.3299 -14.3299 -14.3299 -11.5020 -11.5020 -11.5015 -11.5015 -3.3062 -3.3062 -3.2219 -3.2219 -2.1308 -2.1308 -1.8192 -1.8192 -1.6221 -1.6221 -1.4049 -1.4049 1.3872 1.3872 1.3949 1.3949 2.2483 2.2483 2.2485 2.2485 2.5605 2.5605 2.5873 2.5873 4.0614 4.0614 4.0754 4.0754 4.2400 4.2400 4.2708 4.2708 4.3941 4.3941 4.4083 4.4083 5.2135 5.2135 5.2246 5.2246 5.3934 5.3934 5.4004 5.4004 8.9202 8.9202 8.9253 8.9253 9.8413 9.8413 9.8764 9.8764 11.0719 11.0720 k =-0.3330 0.5779 0.5808 ( 12520 PWs) bands (ev): -14.3299 -14.3299 -14.3299 -14.3299 -11.5020 -11.5020 -11.5015 -11.5015 -3.3062 -3.3062 -3.2219 -3.2219 -2.1308 -2.1308 -1.8192 -1.8192 -1.6221 -1.6221 -1.4049 -1.4049 1.3872 1.3872 1.3949 1.3949 2.2483 2.2483 2.2485 2.2485 2.5605 2.5605 2.5873 2.5873 4.0614 4.0614 4.0754 4.0754 4.2400 4.2400 4.2708 4.2708 4.3941 4.3941 4.4083 4.4083 5.2135 5.2135 5.2246 5.2246 5.3934 5.3934 5.4004 5.4004 8.9202 8.9202 8.9253 8.9253 9.8413 9.8413 9.8764 9.8764 11.0719 11.0721 k =-0.3423 0.5618 0.5808 ( 12508 PWs) bands (ev): -14.3310 -14.3310 -14.3310 -14.3310 -11.4988 -11.4988 -11.4983 -11.4983 -3.3130 -3.3130 -3.2271 -3.2271 -2.1367 -2.1367 -1.8181 -1.8181 -1.6381 -1.6381 -1.4163 -1.4163 1.3933 1.3933 1.3999 1.3999 2.2444 2.2444 2.2454 2.2454 2.5875 2.5875 2.6152 2.6152 4.0614 4.0614 4.0752 4.0752 4.2426 4.2426 4.2731 4.2731 4.4019 4.4019 4.4150 4.4150 5.2142 5.2142 5.2252 5.2252 5.4057 5.4057 5.4132 5.4132 8.9321 8.9321 8.9381 8.9381 9.8400 9.8400 9.8759 9.8759 11.0295 11.0297 k =-0.3516 0.5457 0.5808 ( 12520 PWs) bands (ev): -14.3321 -14.3321 -14.3321 -14.3321 -11.4954 -11.4954 -11.4949 -11.4949 -3.3195 -3.3195 -3.2326 -3.2326 -2.1425 -2.1425 -1.8205 -1.8205 -1.6516 -1.6516 -1.4281 -1.4281 1.3993 1.3993 1.4050 1.4050 2.2407 2.2407 2.2424 2.2424 2.6151 2.6151 2.6436 2.6436 4.0614 4.0614 4.0749 4.0749 4.2450 4.2450 4.2749 4.2749 4.4098 4.4098 4.4219 4.4219 5.2151 5.2151 5.2258 5.2258 5.4192 5.4192 5.4271 5.4271 8.9450 8.9450 8.9519 8.9519 9.8364 9.8364 9.8731 9.8731 10.9903 10.9904 k =-0.3608 0.5296 0.5808 ( 12520 PWs) bands (ev): -14.3333 -14.3333 -14.3333 -14.3333 -11.4919 -11.4919 -11.4913 -11.4913 -3.3255 -3.3255 -3.2386 -3.2386 -2.1480 -2.1480 -1.8275 -1.8275 -1.6616 -1.6616 -1.4400 -1.4400 1.4052 1.4052 1.4101 1.4101 2.2375 2.2375 2.2396 2.2396 2.6432 2.6432 2.6720 2.6720 4.0614 4.0614 4.0746 4.0746 4.2472 4.2472 4.2762 4.2762 4.4177 4.4177 4.4289 4.4289 5.2161 5.2161 5.2264 5.2264 5.4339 5.4339 5.4419 5.4419 8.9587 8.9587 8.9667 8.9667 9.8304 9.8304 9.8679 9.8679 10.9547 10.9547 k =-0.3701 0.5135 0.5808 ( 12514 PWs) bands (ev): -14.3346 -14.3346 -14.3346 -14.3346 -11.4883 -11.4883 -11.4877 -11.4877 -3.3310 -3.3310 -3.2448 -3.2448 -2.1531 -2.1531 -1.8393 -1.8393 -1.6674 -1.6674 -1.4520 -1.4520 1.4111 1.4111 1.4151 1.4151 2.2346 2.2346 2.2371 2.2371 2.6712 2.6712 2.7000 2.7000 4.0615 4.0615 4.0742 4.0742 4.2494 4.2494 4.2772 4.2772 4.4255 4.4255 4.4359 4.4359 5.2172 5.2172 5.2270 5.2270 5.4495 5.4495 5.4575 5.4575 8.9736 8.9736 8.9826 8.9826 9.8222 9.8222 9.8603 9.8603 10.9229 10.9230 k =-0.3794 0.4974 0.5808 ( 12530 PWs) bands (ev): -14.3358 -14.3358 -14.3358 -14.3358 -11.4846 -11.4846 -11.4841 -11.4841 -3.3359 -3.3359 -3.2513 -3.2513 -2.1577 -2.1577 -1.8555 -1.8555 -1.6692 -1.6692 -1.4637 -1.4637 1.4168 1.4168 1.4202 1.4202 2.2321 2.2321 2.2348 2.2348 2.6988 2.6988 2.7273 2.7273 4.0617 4.0617 4.0738 4.0738 4.2514 4.2514 4.2778 4.2778 4.4331 4.4331 4.4427 4.4427 5.2184 5.2184 5.2276 5.2276 5.4658 5.4658 5.4737 5.4737 8.9895 8.9895 8.9997 8.9997 9.8116 9.8116 9.8505 9.8505 10.8952 10.8952 k =-0.3887 0.4813 0.5808 ( 12522 PWs) bands (ev): -14.3371 -14.3371 -14.3370 -14.3370 -11.4810 -11.4810 -11.4805 -11.4805 -3.3402 -3.3402 -3.2581 -3.2581 -2.1618 -2.1618 -1.8752 -1.8752 -1.6678 -1.6678 -1.4752 -1.4752 1.4223 1.4223 1.4251 1.4251 2.2299 2.2299 2.2327 2.2327 2.7257 2.7257 2.7536 2.7536 4.0618 4.0618 4.0733 4.0733 4.2533 4.2533 4.2781 4.2781 4.4405 4.4405 4.4494 4.4494 5.2196 5.2196 5.2282 5.2282 5.4826 5.4826 5.4903 5.4903 9.0066 9.0066 9.0180 9.0180 9.7989 9.7989 9.8382 9.8382 10.8718 10.8721 k =-0.3979 0.4652 0.5808 ( 12530 PWs) bands (ev): -14.3383 -14.3383 -14.3383 -14.3383 -11.4774 -11.4774 -11.4769 -11.4769 -3.3439 -3.3439 -3.2651 -3.2651 -2.1652 -2.1652 -1.8971 -1.8971 -1.6641 -1.6641 -1.4864 -1.4864 1.4276 1.4276 1.4298 1.4298 2.2280 2.2280 2.2308 2.2308 2.7516 2.7516 2.7785 2.7785 4.0620 4.0620 4.0728 4.0728 4.2550 4.2550 4.2782 4.2782 4.4476 4.4476 4.4557 4.4557 5.2209 5.2209 5.2288 5.2288 5.4996 5.4996 5.5070 5.5070 9.0249 9.0249 9.0374 9.0374 9.7840 9.7840 9.8236 9.8236 10.8528 10.8529 k =-0.4072 0.4491 0.5808 ( 12514 PWs) bands (ev): -14.3395 -14.3395 -14.3394 -14.3394 -11.4740 -11.4740 -11.4735 -11.4735 -3.3468 -3.3468 -3.2721 -3.2721 -2.1678 -2.1678 -1.9203 -1.9203 -1.6588 -1.6588 -1.4971 -1.4971 1.4326 1.4326 1.4343 1.4343 2.2265 2.2265 2.2292 2.2292 2.7763 2.7763 2.8018 2.8018 4.0622 4.0622 4.0722 4.0722 4.2567 4.2567 4.2781 4.2781 4.4543 4.4543 4.4616 4.4616 5.2222 5.2222 5.2293 5.2293 5.5166 5.5166 5.5235 5.5235 9.0443 9.0443 9.0580 9.0580 9.7670 9.7670 9.8067 9.8067 10.8385 10.8385 k =-0.4165 0.4330 0.5808 ( 12526 PWs) bands (ev): -14.3406 -14.3406 -14.3406 -14.3406 -11.4707 -11.4707 -11.4702 -11.4702 -3.3491 -3.3491 -3.2793 -3.2793 -2.1694 -2.1694 -1.9441 -1.9441 -1.6525 -1.6525 -1.5074 -1.5074 1.4372 1.4372 1.4385 1.4385 2.2251 2.2251 2.2277 2.2277 2.7994 2.7994 2.8233 2.8233 4.0625 4.0625 4.0717 4.0717 4.2584 4.2584 4.2778 4.2778 4.4605 4.4605 4.4672 4.4672 5.2234 5.2234 5.2298 5.2298 5.5332 5.5332 5.5396 5.5396 9.0648 9.0648 9.0795 9.0795 9.7481 9.7481 9.7875 9.7875 10.8288 10.8288 k =-0.4258 0.4169 0.5808 ( 12522 PWs) bands (ev): -14.3416 -14.3416 -14.3416 -14.3416 -11.4676 -11.4676 -11.4672 -11.4672 -3.3505 -3.3505 -3.2864 -3.2864 -2.1699 -2.1699 -1.9678 -1.9678 -1.6456 -1.6456 -1.5172 -1.5172 1.4415 1.4415 1.4425 1.4425 2.2241 2.2241 2.2265 2.2265 2.8207 2.8207 2.8427 2.8427 4.0628 4.0628 4.0711 4.0711 4.2599 4.2599 4.2774 4.2774 4.4663 4.4663 4.4722 4.4722 5.2246 5.2246 5.2303 5.2303 5.5492 5.5492 5.5550 5.5550 9.0862 9.0862 9.1019 9.1019 9.7276 9.7276 9.7663 9.7663 10.8237 10.8238 k =-0.4351 0.4008 0.5808 ( 12522 PWs) bands (ev): -14.3426 -14.3426 -14.3426 -14.3426 -11.4648 -11.4648 -11.4644 -11.4644 -3.3513 -3.3513 -3.2935 -3.2935 -2.1692 -2.1692 -1.9911 -1.9911 -1.6383 -1.6383 -1.5266 -1.5266 1.4453 1.4453 1.4461 1.4461 2.2232 2.2232 2.2254 2.2254 2.8402 2.8402 2.8600 2.8600 4.0632 4.0632 4.0705 4.0705 4.2614 4.2614 4.2768 4.2768 4.4715 4.4715 4.4766 4.4766 5.2258 5.2258 5.2307 5.2307 5.5642 5.5642 5.5695 5.5695 9.1084 9.1084 9.1247 9.1247 9.7060 9.7060 9.7435 9.7435 10.8232 10.8232 k =-0.4443 0.3847 0.5808 ( 12514 PWs) bands (ev): -14.3435 -14.3435 -14.3434 -14.3434 -11.4623 -11.4623 -11.4619 -11.4619 -3.3512 -3.3512 -3.3004 -3.3004 -2.1671 -2.1671 -2.0137 -2.0137 -1.6307 -1.6307 -1.5357 -1.5357 1.4487 1.4487 1.4492 1.4492 2.2225 2.2225 2.2245 2.2245 2.8576 2.8576 2.8750 2.8750 4.0635 4.0635 4.0699 4.0699 4.2628 4.2628 4.2761 4.2761 4.4761 4.4761 4.4806 4.4806 5.2269 5.2269 5.2311 5.2311 5.5780 5.5780 5.5826 5.5826 9.1309 9.1309 9.1476 9.1476 9.6839 9.6839 9.7194 9.7194 10.8272 10.8274 k =-0.4536 0.3686 0.5808 ( 12510 PWs) bands (ev): -14.3442 -14.3442 -14.3442 -14.3442 -11.4600 -11.4600 -11.4598 -11.4598 -3.3504 -3.3504 -3.3072 -3.3072 -2.1636 -2.1636 -2.0351 -2.0351 -1.6231 -1.6231 -1.5444 -1.5444 1.4516 1.4516 1.4520 1.4520 2.2220 2.2220 2.2237 2.2237 2.8727 2.8727 2.8875 2.8875 4.0639 4.0639 4.0693 4.0693 4.2642 4.2642 4.2753 4.2753 4.4802 4.4802 4.4839 4.4839 5.2279 5.2279 5.2313 5.2313 5.5903 5.5903 5.5942 5.5942 9.1534 9.1534 9.1698 9.1698 9.6622 9.6622 9.6948 9.6948 10.8354 10.8354 k =-0.4629 0.3525 0.5808 ( 12510 PWs) bands (ev): -14.3448 -14.3448 -14.3448 -14.3448 -11.4582 -11.4582 -11.4579 -11.4579 -3.3489 -3.3489 -3.3137 -3.3137 -2.1584 -2.1584 -2.0553 -2.0553 -1.6153 -1.6153 -1.5527 -1.5527 1.4540 1.4540 1.4543 1.4543 2.2217 2.2217 2.2231 2.2231 2.8856 2.8856 2.8976 2.8976 4.0644 4.0644 4.0687 4.0687 4.2655 4.2655 4.2745 4.2745 4.4836 4.4836 4.4865 4.4865 5.2288 5.2288 5.2315 5.2315 5.6008 5.6008 5.6039 5.6039 9.1750 9.1750 9.1904 9.1904 9.6419 9.6419 9.6706 9.6706 10.8474 10.8475 k =-0.4722 0.3364 0.5808 ( 12518 PWs) bands (ev): -14.3453 -14.3453 -14.3453 -14.3453 -11.4567 -11.4567 -11.4565 -11.4565 -3.3466 -3.3466 -3.3199 -3.3199 -2.1516 -2.1516 -2.0741 -2.0741 -1.6076 -1.6076 -1.5609 -1.5609 1.4559 1.4559 1.4561 1.4561 2.2215 2.2215 2.2225 2.2225 2.8960 2.8960 2.9052 2.9052 4.0648 4.0648 4.0681 4.0681 4.2668 4.2668 4.2736 4.2736 4.4863 4.4863 4.4885 4.4885 5.2295 5.2295 5.2316 5.2316 5.6093 5.6093 5.6117 5.6117 9.1948 9.1948 9.2081 9.2081 9.6246 9.6246 9.6481 9.6481 10.8628 10.8630 k =-0.4814 0.3203 0.5808 ( 12502 PWs) bands (ev): -14.3457 -14.3457 -14.3457 -14.3457 -11.4556 -11.4556 -11.4555 -11.4555 -3.3437 -3.3437 -3.3257 -3.3257 -2.1431 -2.1431 -2.0913 -2.0913 -1.5999 -1.5999 -1.5689 -1.5689 1.4573 1.4573 1.4574 1.4574 2.2214 2.2214 2.2221 2.2221 2.9040 2.9040 2.9101 2.9101 4.0653 4.0653 4.0675 4.0675 4.2681 4.2681 4.2726 4.2726 4.4884 4.4884 4.4899 4.4899 5.2302 5.2302 5.2316 5.2316 5.6156 5.6156 5.6172 5.6172 9.2115 9.2115 9.2215 9.2215 9.6119 9.6119 9.6288 9.6288 10.8807 10.8809 k =-0.4907 0.3042 0.5808 ( 12498 PWs) bands (ev): -14.3459 -14.3459 -14.3459 -14.3459 -11.4549 -11.4549 -11.4549 -11.4549 -3.3400 -3.3400 -3.3310 -3.3310 -2.1328 -2.1328 -2.1069 -2.1069 -1.5922 -1.5922 -1.5767 -1.5767 1.4581 1.4581 1.4582 1.4582 2.2214 2.2214 2.2218 2.2218 2.9094 2.9094 2.9125 2.9125 4.0658 4.0658 4.0669 4.0669 4.2693 4.2693 4.2715 4.2715 4.4898 4.4898 4.4905 4.4905 5.2307 5.2307 5.2314 5.2314 5.6197 5.6197 5.6204 5.6204 9.2237 9.2237 9.2291 9.2291 9.6054 9.6054 9.6143 9.6143 10.9008 10.9181 k =-0.5000 0.2881 0.5808 ( 12492 PWs) bands (ev): -14.3460 -14.3460 -14.3460 -14.3460 -11.4547 -11.4547 -11.4547 -11.4547 -3.3358 -3.3358 -3.3358 -3.3358 -2.1207 -2.1207 -2.1207 -2.1207 -1.5845 -1.5845 -1.5845 -1.5845 1.4584 1.4584 1.4584 1.4584 2.2216 2.2216 2.2216 2.2216 2.9122 2.9122 2.9122 2.9122 4.0664 4.0664 4.0664 4.0664 4.2704 4.2704 4.2704 4.2704 4.4905 4.4905 4.4905 4.4905 5.2311 5.2311 5.2311 5.2311 5.6213 5.6213 5.6213 5.6213 9.2298 9.2298 9.2298 9.2298 9.6062 9.6062 9.6062 9.6062 10.9159 10.9159 k =-0.5000 0.2881 0.5808 ( 12492 PWs) bands (ev): -14.3460 -14.3460 -14.3460 -14.3460 -11.4547 -11.4547 -11.4547 -11.4547 -3.3358 -3.3358 -3.3358 -3.3358 -2.1207 -2.1207 -2.1207 -2.1207 -1.5845 -1.5845 -1.5845 -1.5845 1.4584 1.4584 1.4584 1.4584 2.2216 2.2216 2.2216 2.2216 2.9122 2.9122 2.9122 2.9122 4.0664 4.0664 4.0664 4.0664 4.2704 4.2704 4.2704 4.2704 4.4905 4.4905 4.4905 4.4905 5.2311 5.2311 5.2311 5.2311 5.6213 5.6213 5.6213 5.6213 9.2298 9.2298 9.2298 9.2298 9.6062 9.6062 9.6062 9.6062 10.9159 10.9159 k =-0.5000 0.2881 0.5621 ( 12500 PWs) bands (ev): -14.3491 -14.3491 -14.3430 -14.3430 -11.4692 -11.4692 -11.4401 -11.4401 -3.3411 -3.3411 -3.3300 -3.3300 -2.1310 -2.1310 -2.1099 -2.1099 -1.5914 -1.5914 -1.5779 -1.5779 1.4434 1.4434 1.4692 1.4692 2.2145 2.2145 2.2339 2.2339 2.8814 2.8814 2.9439 2.9439 4.0455 4.0455 4.0831 4.0831 4.2539 4.2539 4.2891 4.2891 4.4706 4.4706 4.5122 4.5122 5.2205 5.2205 5.2409 5.2409 5.5870 5.5870 5.6550 5.6550 9.2055 9.2055 9.2585 9.2585 9.5815 9.5815 9.6314 9.6314 10.8998 10.8999 k =-0.5000 0.2881 0.5433 ( 12504 PWs) bands (ev): -14.3522 -14.3522 -14.3400 -14.3400 -11.4837 -11.4837 -11.4255 -11.4255 -3.3458 -3.3458 -3.3237 -3.3237 -2.1406 -2.1406 -2.0985 -2.0985 -1.5986 -1.5986 -1.5716 -1.5716 1.4245 1.4245 1.4752 1.4752 2.2130 2.2130 2.2508 2.2508 2.8515 2.8515 2.9764 2.9764 4.0209 4.0209 4.0948 4.0948 4.2408 4.2408 4.3087 4.3087 4.4523 4.4523 4.5354 4.5354 5.2088 5.2088 5.2503 5.2503 5.5522 5.5522 5.6880 5.6880 9.1854 9.1854 9.2915 9.2915 9.5578 9.5578 9.6567 9.6567 10.8717 10.8717 k =-0.5000 0.2881 0.5246 ( 12502 PWs) bands (ev): -14.3553 -14.3553 -14.3372 -14.3372 -11.4980 -11.4980 -11.4109 -11.4109 -3.3499 -3.3499 -3.3169 -3.3169 -2.1496 -2.1496 -2.0866 -2.0866 -1.6061 -1.6061 -1.5656 -1.5656 1.4026 1.4026 1.4763 1.4763 2.2173 2.2173 2.2718 2.2718 2.8224 2.8224 3.0097 3.0097 3.9933 3.9933 4.1010 4.1010 4.2326 4.2326 4.3280 4.3280 4.4359 4.4359 4.5598 4.5598 5.1957 5.1957 5.2597 5.2597 5.5170 5.5170 5.7205 5.7205 9.1698 9.1698 9.3286 9.3286 9.5354 9.5354 9.6815 9.6815 10.8318 10.8318 k =-0.5000 0.2881 0.5059 ( 12498 PWs) bands (ev): -14.3585 -14.3585 -14.3344 -14.3344 -11.5121 -11.5121 -11.3964 -11.3964 -3.3534 -3.3534 -3.3097 -3.3097 -2.1578 -2.1578 -2.0743 -2.0743 -1.6140 -1.6140 -1.5599 -1.5599 1.3781 1.3781 1.4725 1.4725 2.2274 2.2274 2.2961 2.2961 2.7943 2.7943 3.0438 3.0438 3.9632 3.9632 4.1015 4.1015 4.2296 4.2296 4.3462 4.3462 4.4214 4.4214 4.5848 4.5848 5.1812 5.1812 5.2696 5.2696 5.4814 5.4814 5.7522 5.7522 9.1585 9.1585 9.3696 9.3696 9.5147 9.5147 9.7051 9.7051 10.7801 10.7801 k =-0.5000 0.2881 0.4871 ( 12520 PWs) bands (ev): -14.3617 -14.3617 -14.3317 -14.3317 -11.5261 -11.5261 -11.3819 -11.3819 -3.3564 -3.3564 -3.3021 -3.3021 -2.1651 -2.1651 -2.0617 -2.0617 -1.6221 -1.6221 -1.5545 -1.5545 1.3516 1.3516 1.4640 1.4640 2.2430 2.2430 2.3233 2.3233 2.7672 2.7672 3.0786 3.0786 3.9314 3.9314 4.0970 4.0970 4.2312 4.2312 4.3617 4.3617 4.4100 4.4100 4.6096 4.6096 5.1652 5.1652 5.2806 5.2806 5.4457 5.4457 5.7832 5.7832 9.1515 9.1515 9.4143 9.4143 9.4958 9.4958 9.7266 9.7266 10.7149 10.7149 k =-0.5000 0.2881 0.4684 ( 12520 PWs) bands (ev): -14.3649 -14.3649 -14.3290 -14.3290 -11.5398 -11.5398 -11.3676 -11.3676 -3.3587 -3.3587 -3.2942 -3.2942 -2.1716 -2.1716 -2.0487 -2.0487 -1.6305 -1.6305 -1.5494 -1.5494 1.3236 1.3236 1.4514 1.4514 2.2637 2.2637 2.3528 2.3528 2.7411 2.7411 3.1141 3.1141 3.8982 3.8982 4.0892 4.0892 4.2359 4.2359 4.3702 4.3702 4.4056 4.4056 4.6331 4.6331 5.1476 5.1476 5.2930 5.2930 5.4104 5.4104 5.8135 5.8135 9.1487 9.1487 9.4607 9.4607 9.4810 9.4810 9.7453 9.7453 10.6354 10.6354 k =-0.5000 0.2881 0.4497 ( 12518 PWs) bands (ev): -14.3682 -14.3682 -14.3265 -14.3265 -11.5532 -11.5532 -11.3535 -11.3535 -3.3605 -3.3605 -3.2860 -3.2860 -2.1772 -2.1772 -2.0355 -2.0355 -1.6393 -1.6393 -1.5446 -1.5446 1.2945 1.2945 1.4352 1.4352 2.2888 2.2888 2.3841 2.3841 2.7161 2.7161 3.1503 3.1503 3.8643 3.8643 4.0794 4.0794 4.2421 4.2421 4.3678 4.3678 4.4121 4.4121 4.6544 4.6544 5.1285 5.1285 5.3057 5.3057 5.3774 5.3774 5.8430 5.8430 9.1499 9.1499 9.4619 9.4619 9.5167 9.5167 9.7602 9.7602 10.5441 10.5441 k =-0.5000 0.2881 0.4309 ( 12506 PWs) bands (ev): -14.3714 -14.3714 -14.3241 -14.3241 -11.5664 -11.5664 -11.3396 -11.3396 -3.3617 -3.3617 -3.2776 -3.2776 -2.1819 -2.1819 -2.0221 -2.0221 -1.6483 -1.6483 -1.5401 -1.5401 1.2647 1.2647 1.4160 1.4160 2.3177 2.3177 2.4168 2.4168 2.6923 2.6923 3.1871 3.1871 3.8302 3.8302 4.0685 4.0685 4.2486 4.2486 4.3602 4.3602 4.4241 4.4241 4.6724 4.6724 5.1079 5.1079 5.3084 5.3084 5.3579 5.3579 5.8717 5.8717 9.1550 9.1550 9.4493 9.4493 9.5715 9.5715 9.7706 9.7706 10.4446 10.4446 k =-0.5000 0.2881 0.4122 ( 12506 PWs) bands (ev): -14.3745 -14.3745 -14.3218 -14.3218 -11.5792 -11.5792 -11.3259 -11.3259 -3.3624 -3.3624 -3.2692 -3.2692 -2.1855 -2.1855 -2.0085 -2.0085 -1.6575 -1.6575 -1.5358 -1.5358 1.2345 1.2345 1.3944 1.3944 2.3497 2.3497 2.4505 2.4505 2.6700 2.6700 3.2246 3.2246 3.7961 3.7961 4.0572 4.0572 4.2545 4.2545 4.3522 4.3522 4.4370 4.4370 4.6864 4.6864 5.0860 5.0860 5.2843 5.2843 5.3693 5.3693 5.8995 5.8995 9.1638 9.1638 9.4386 9.4386 9.6296 9.6296 9.7760 9.7760 10.3400 10.3400 k =-0.5000 0.2881 0.3934 ( 12504 PWs) bands (ev): -14.3777 -14.3777 -14.3195 -14.3195 -11.5917 -11.5917 -11.3125 -11.3125 -3.3627 -3.3627 -3.2606 -3.2606 -2.1882 -2.1882 -1.9948 -1.9948 -1.6671 -1.6671 -1.5319 -1.5319 1.2042 1.2042 1.3710 1.3710 2.3842 2.3842 2.4846 2.4846 2.6495 2.6495 3.2626 3.2626 3.7623 3.7623 4.0458 4.0458 4.2588 4.2588 4.3454 4.3454 4.4496 4.4496 4.6957 4.6957 5.0629 5.0629 5.2498 5.2498 5.3955 5.3955 5.9264 5.9264 9.1761 9.1761 9.4300 9.4300 9.6901 9.6901 9.7766 9.7766 10.2328 10.2328 k =-0.5000 0.2881 0.3747 ( 12522 PWs) bands (ev): -14.3808 -14.3808 -14.3174 -14.3174 -11.6037 -11.6037 -11.2995 -11.2995 -3.3625 -3.3625 -3.2520 -3.2520 -2.1898 -2.1898 -1.9810 -1.9810 -1.6769 -1.6769 -1.5282 -1.5282 1.1740 1.1740 1.3462 1.3462 2.4202 2.4202 2.5182 2.5182 2.6318 2.6318 3.3012 3.3012 3.7291 3.7291 4.0345 4.0345 4.2607 4.2607 4.3408 4.3408 4.4617 4.4617 4.7002 4.7002 5.0387 5.0387 5.2132 5.2132 5.4286 5.4286 5.9524 5.9524 9.1914 9.1914 9.4235 9.4235 9.7490 9.7490 9.7758 9.7758 10.1250 10.1250 k =-0.5000 0.2881 0.3560 ( 12522 PWs) bands (ev): -14.3838 -14.3838 -14.3154 -14.3154 -11.6154 -11.6154 -11.2868 -11.2868 -3.3618 -3.3618 -3.2435 -3.2435 -2.1904 -2.1904 -1.9672 -1.9672 -1.6869 -1.6869 -1.5249 -1.5249 1.1440 1.1440 1.3205 1.3205 2.4567 2.4567 2.5487 2.5487 2.6202 2.6202 3.3404 3.3404 3.6966 3.6966 4.0234 4.0234 4.2597 4.2597 4.3388 4.3388 4.4730 4.4730 4.6999 4.6999 5.0136 5.0136 5.1759 5.1759 5.4667 5.4667 5.9775 5.9775 9.2096 9.2096 9.4192 9.4192 9.7584 9.7584 9.8203 9.8203 10.0195 10.0195 k =-0.5000 0.2881 0.3372 ( 12520 PWs) bands (ev): -14.3868 -14.3868 -14.3135 -14.3135 -11.6266 -11.6266 -11.2745 -11.2745 -3.3609 -3.3609 -3.2350 -3.2350 -2.1900 -2.1900 -1.9534 -1.9534 -1.6971 -1.6971 -1.5218 -1.5218 1.1145 1.1145 1.2943 1.2943 2.4904 2.4904 2.5692 2.5692 2.6240 2.6240 3.3799 3.3799 3.6650 3.6650 4.0126 4.0126 4.2558 4.2558 4.3393 4.3393 4.4836 4.4836 4.6953 4.6953 4.9877 4.9877 5.1385 5.1385 5.5092 5.5092 6.0015 6.0015 9.2303 9.2303 9.4170 9.4170 9.7459 9.7459 9.8636 9.8636 9.9363 9.9363 k =-0.5000 0.2881 0.3185 ( 12526 PWs) bands (ev): -14.3897 -14.3897 -14.3118 -14.3118 -11.6374 -11.6374 -11.2626 -11.2626 -3.3596 -3.3596 -3.2268 -3.2268 -2.1886 -2.1886 -1.9397 -1.9397 -1.7074 -1.7074 -1.5190 -1.5190 1.0857 1.0857 1.2679 1.2679 2.5130 2.5130 2.5829 2.5829 2.6479 2.6479 3.4200 3.4200 3.6344 3.6344 4.0022 4.0022 4.2495 4.2495 4.3417 4.3417 4.4934 4.4934 4.6868 4.6868 4.9613 4.9613 5.1014 5.1014 5.5551 5.5551 6.0246 6.0246 9.2532 9.2532 9.4169 9.4169 9.7293 9.7293 9.7924 9.7924 9.9725 9.9726 k =-0.5000 0.2881 0.2998 ( 12534 PWs) bands (ev): -14.3925 -14.3925 -14.3101 -14.3101 -11.6477 -11.6477 -11.2512 -11.2512 -3.3581 -3.3581 -3.2187 -3.2187 -2.1862 -2.1862 -1.9261 -1.9261 -1.7180 -1.7180 -1.5165 -1.5165 1.0576 1.0576 1.2416 1.2416 2.5157 2.5157 2.6098 2.6098 2.6801 2.6801 3.4603 3.4603 3.6048 3.6048 3.9921 3.9921 4.2415 4.2415 4.3451 4.3451 4.5022 4.5022 4.6749 4.6749 4.9345 4.9345 5.0647 5.0647 5.6038 5.6038 6.0466 6.0466 9.2777 9.2777 9.4187 9.4187 9.6903 9.6903 9.7134 9.7134 10.0408 10.0408 k =-0.5000 0.2881 0.2810 ( 12530 PWs) bands (ev): -14.3952 -14.3952 -14.3085 -14.3085 -11.6574 -11.6574 -11.2403 -11.2403 -3.3564 -3.3564 -3.2109 -3.2109 -2.1829 -2.1829 -1.9127 -1.9127 -1.7286 -1.7286 -1.5143 -1.5143 1.0305 1.0305 1.2157 1.2157 2.5072 2.5072 2.6469 2.6469 2.7145 2.7145 3.5010 3.5010 3.5764 3.5764 3.9824 3.9824 4.2324 4.2324 4.3489 4.3489 4.5102 4.5102 4.6603 4.6603 4.9075 4.9075 5.0288 5.0288 5.6546 5.6546 6.0674 6.0674 9.3036 9.3036 9.4223 9.4223 9.5930 9.5930 9.6919 9.6919 10.1127 10.1127 k =-0.5000 0.2881 0.2623 ( 12538 PWs) bands (ev): -14.3977 -14.3977 -14.3071 -14.3071 -11.6667 -11.6667 -11.2300 -11.2300 -3.3546 -3.3546 -3.2034 -3.2034 -2.1787 -2.1787 -1.8995 -1.8995 -1.7393 -1.7393 -1.5124 -1.5124 1.0044 1.0044 1.1903 1.1903 2.4954 2.4954 2.6877 2.6877 2.7492 2.7492 3.5406 3.5406 3.5502 3.5502 3.9732 3.9732 4.2226 4.2226 4.3526 4.3526 4.5170 4.5170 4.6434 4.6434 4.8805 4.8805 4.9940 4.9940 5.7067 5.7067 6.0872 6.0872 9.3301 9.3301 9.4275 9.4275 9.4975 9.4975 9.6709 9.6709 10.1839 10.1840 k =-0.5000 0.2881 0.2436 ( 12538 PWs) bands (ev): -14.4002 -14.4002 -14.3057 -14.3057 -11.6753 -11.6753 -11.2202 -11.2202 -3.3527 -3.3527 -3.1962 -3.1962 -2.1738 -2.1738 -1.8866 -1.8866 -1.7500 -1.7500 -1.5108 -1.5108 0.9794 0.9794 1.1658 1.1658 2.4830 2.4830 2.7297 2.7297 2.7835 2.7835 3.5222 3.5222 3.5835 3.5835 3.9645 3.9645 4.2123 4.2123 4.3557 4.3557 4.5227 4.5227 4.6249 4.6249 4.8536 4.8536 4.9606 4.9606 5.7594 5.7594 6.1057 6.1057 9.3557 9.3557 9.4052 9.4052 9.4359 9.4359 9.6499 9.6499 10.1348 10.1348 k =-0.5000 0.2881 0.2248 ( 12542 PWs) bands (ev): -14.4025 -14.4025 -14.3045 -14.3045 -11.6834 -11.6834 -11.2110 -11.2110 -3.3508 -3.3508 -3.1894 -3.1894 -2.1682 -2.1682 -1.8740 -1.8740 -1.7607 -1.7607 -1.5095 -1.5095 0.9558 0.9558 1.1422 1.1422 2.4708 2.4708 2.7721 2.7721 2.8171 2.8171 3.4971 3.4971 3.6246 3.6246 3.9563 3.9563 4.2017 4.2017 4.3580 4.3580 4.5269 4.5269 4.6053 4.6053 4.8273 4.8273 4.9290 4.9290 5.8122 5.8122 6.1231 6.1231 9.3135 9.3135 9.3868 9.3868 9.4437 9.4437 9.6292 9.6292 10.0728 10.0728 k =-0.5000 0.2881 0.2061 ( 12546 PWs) bands (ev): -14.4047 -14.4047 -14.3034 -14.3034 -11.6910 -11.6910 -11.2025 -11.2025 -3.3488 -3.3488 -3.1830 -3.1830 -2.1620 -2.1620 -1.8620 -1.8620 -1.7713 -1.7713 -1.5084 -1.5084 0.9335 0.9335 1.1199 1.1199 2.4592 2.4592 2.8142 2.8142 2.8496 2.8496 3.4729 3.4729 3.6657 3.6657 3.9487 3.9487 4.1910 4.1910 4.3591 4.3591 4.5296 4.5296 4.5850 4.5850 4.8017 4.8017 4.8996 4.8996 5.8644 5.8644 6.1392 6.1392 9.2305 9.2305 9.4122 9.4122 9.4535 9.4535 9.6092 9.6092 10.0136 10.0136 k =-0.5000 0.2881 0.1874 ( 12530 PWs) bands (ev): -14.4067 -14.4067 -14.3023 -14.3023 -11.6979 -11.6979 -11.1946 -11.1946 -3.3470 -3.3470 -3.1771 -3.1771 -2.1553 -2.1553 -1.8505 -1.8505 -1.7817 -1.7817 -1.5077 -1.5077 0.9128 0.9128 1.0989 1.0989 2.4484 2.4484 2.8555 2.8555 2.8808 2.8808 3.4497 3.4497 3.7067 3.7067 3.9418 3.9418 4.1803 4.1803 4.3587 4.3587 4.5306 4.5306 4.5645 4.5645 4.7773 4.7773 4.8727 4.8727 5.9152 5.9152 6.1540 6.1540 9.1517 9.1517 9.4366 9.4366 9.4652 9.4652 9.5902 9.5902 9.9578 9.9578 k =-0.5000 0.2881 0.1686 ( 12534 PWs) bands (ev): -14.4085 -14.4085 -14.3014 -14.3014 -11.7042 -11.7042 -11.1873 -11.1873 -3.3452 -3.3452 -3.1716 -3.1716 -2.1484 -2.1484 -1.8397 -1.8397 -1.7917 -1.7917 -1.5072 -1.5072 0.8936 0.8936 1.0795 1.0795 2.4385 2.4385 2.8955 2.8955 2.9109 2.9109 3.4274 3.4274 3.7471 3.7471 3.9357 3.9357 4.1698 4.1698 4.3563 4.3563 4.5296 4.5296 4.5442 4.5442 4.7547 4.7547 4.8484 4.8484 5.9642 5.9642 6.1676 6.1676 9.0782 9.0782 9.4574 9.4574 9.4798 9.4798 9.5725 9.5725 9.9059 9.9059 k =-0.5000 0.2881 0.1499 ( 12520 PWs) bands (ev): -14.4102 -14.4102 -14.3006 -14.3006 -11.7099 -11.7099 -11.1808 -11.1808 -3.3435 -3.3435 -3.1666 -3.1666 -2.1413 -2.1413 -1.8300 -1.8300 -1.8010 -1.8010 -1.5069 -1.5069 0.8762 0.8762 1.0617 1.0617 2.4295 2.4295 2.9317 2.9317 2.9414 2.9414 3.4060 3.4060 3.7865 3.7865 3.9308 3.9308 4.1596 4.1596 4.3515 4.3515 4.5240 4.5240 4.5273 4.5273 4.7346 4.7346 4.8270 4.8270 6.0105 6.0105 6.1797 6.1797 9.0104 9.0104 9.4733 9.4733 9.4979 9.4979 9.5564 9.5564 9.8583 9.8583 k =-0.5000 0.2881 0.1311 ( 12532 PWs) bands (ev): -14.4117 -14.4117 -14.2999 -14.2999 -11.7149 -11.7149 -11.1750 -11.1750 -3.3420 -3.3420 -3.1621 -3.1621 -2.1342 -2.1342 -1.8226 -1.8226 -1.8084 -1.8084 -1.5068 -1.5068 0.8606 0.8606 1.0456 1.0456 2.4216 2.4216 2.9598 2.9598 2.9763 2.9763 3.3853 3.3853 3.8238 3.8238 3.9280 3.9280 4.1500 4.1500 4.3438 4.3438 4.5059 4.5059 4.5224 4.5224 4.7173 4.7173 4.8085 4.8085 6.0536 6.0536 6.1906 6.1906 8.9488 8.9488 9.4856 9.4856 9.5174 9.5174 9.5420 9.5420 9.8155 9.8155 k =-0.5000 0.2881 0.1124 ( 12544 PWs) bands (ev): -14.4130 -14.4130 -14.2993 -14.2993 -11.7193 -11.7193 -11.1699 -11.1699 -3.3406 -3.3406 -3.1582 -3.1582 -2.1274 -2.1274 -1.8233 -1.8233 -1.8079 -1.8079 -1.5069 -1.5069 0.8468 0.8468 1.0315 1.0315 2.4146 2.4146 2.9830 2.9830 3.0117 3.0117 3.3652 3.3652 3.8564 3.8564 3.9298 3.9298 4.1410 4.1410 4.3327 4.3327 4.4890 4.4890 4.5169 4.5169 4.7031 4.7031 4.7928 4.7928 6.0928 6.0928 6.2000 6.2000 8.8941 8.8941 9.4957 9.4957 9.5297 9.5297 9.5360 9.5360 9.7777 9.7777 k =-0.5000 0.2881 0.0937 ( 12546 PWs) bands (ev): -14.4141 -14.4141 -14.2988 -14.2988 -11.7230 -11.7230 -11.1656 -11.1656 -3.3395 -3.3395 -3.1548 -3.1548 -2.1210 -2.1210 -1.8297 -1.8297 -1.8020 -1.8020 -1.5071 -1.5071 0.8351 0.8351 1.0194 1.0194 2.4087 2.4087 3.0028 3.0028 3.0453 3.0453 3.3457 3.3457 3.8782 3.8782 3.9418 3.9418 4.1329 4.1329 4.3182 4.3182 4.4741 4.4741 4.5110 4.5110 4.6920 4.6920 4.7800 4.7800 6.1274 6.1274 6.2080 6.2080 8.8466 8.8466 9.5026 9.5026 9.5213 9.5213 9.5524 9.5524 9.7453 9.7453 k =-0.5000 0.2881 0.0749 ( 12548 PWs) bands (ev): -14.4150 -14.4150 -14.2983 -14.2983 -11.7261 -11.7261 -11.1620 -11.1620 -3.3385 -3.3385 -3.1520 -3.1520 -2.1153 -2.1153 -1.8361 -1.8361 -1.7962 -1.7962 -1.5073 -1.5073 0.8253 0.8253 1.0093 1.0093 2.4039 2.4039 3.0194 3.0194 3.0764 3.0764 3.3270 3.3270 3.8867 3.8867 3.9657 3.9657 4.1260 4.1260 4.3008 4.3008 4.4614 4.4614 4.5055 4.5055 4.6835 4.6835 4.7698 4.7698 6.1567 6.1567 6.2146 6.2146 8.8069 8.8069 9.5023 9.5023 9.5206 9.5206 9.5662 9.5662 9.7186 9.7186 k =-0.5000 0.2881 0.0562 ( 12534 PWs) bands (ev): -14.4158 -14.4158 -14.2980 -14.2980 -11.7285 -11.7285 -11.1592 -11.1592 -3.3377 -3.3377 -3.1499 -3.1499 -2.1106 -2.1106 -1.8415 -1.8415 -1.7914 -1.7914 -1.5076 -1.5076 0.8177 0.8177 1.0014 1.0014 2.4001 2.4001 3.0326 3.0326 3.1042 3.1042 3.3093 3.3093 3.8886 3.8886 3.9941 3.9941 4.1203 4.1203 4.2816 4.2816 4.4514 4.4514 4.5009 4.5009 4.6773 4.6773 4.7622 4.7622 6.1802 6.1802 6.2197 6.2197 8.7754 8.7754 9.4974 9.4974 9.5249 9.5249 9.5773 9.5773 9.6976 9.6976 k =-0.5000 0.2881 0.0375 ( 12542 PWs) bands (ev): -14.4163 -14.4163 -14.2978 -14.2978 -11.7302 -11.7302 -11.1573 -11.1573 -3.3372 -3.3372 -3.1483 -3.1483 -2.1070 -2.1070 -1.8456 -1.8456 -1.7879 -1.7879 -1.5078 -1.5078 0.8122 0.8122 0.9958 0.9958 2.3974 2.3974 3.0422 3.0422 3.1274 3.1274 3.2936 3.2936 3.8885 3.8885 4.0203 4.0203 4.1161 4.1161 4.2630 4.2630 4.4440 4.4440 4.4976 4.4976 4.6732 4.6732 4.7568 4.7568 6.1974 6.1974 6.2234 6.2234 8.7526 8.7526 9.4930 9.4930 9.5291 9.5291 9.5852 9.5852 9.6825 9.6825 k =-0.5000 0.2881 0.0187 ( 12546 PWs) bands (ev): -14.4166 -14.4166 -14.2976 -14.2976 -11.7312 -11.7312 -11.1561 -11.1561 -3.3369 -3.3369 -3.1473 -3.1473 -2.1048 -2.1048 -1.8482 -1.8482 -1.7857 -1.7857 -1.5079 -1.5079 0.8089 0.8089 0.9923 0.9923 2.3958 2.3958 3.0480 3.0480 3.1436 3.1436 3.2819 3.2819 3.8880 3.8880 4.0394 4.0394 4.1135 4.1135 4.2486 4.2486 4.4396 4.4396 4.4956 4.4956 4.6708 4.6708 4.7537 4.7537 6.2079 6.2079 6.2256 6.2256 8.7388 8.7388 9.4901 9.4901 9.5318 9.5318 9.5900 9.5900 9.6735 9.6735 k =-0.5000 0.2881 0.0000 ( 12544 PWs) bands (ev): -14.4167 -14.4167 -14.2976 -14.2976 -11.7316 -11.7316 -11.1557 -11.1557 -3.3367 -3.3367 -3.1470 -3.1470 -2.1040 -2.1040 -1.8490 -1.8490 -1.7850 -1.7850 -1.5080 -1.5080 0.8078 0.8078 0.9912 0.9912 2.3953 2.3953 3.0499 3.0499 3.1497 3.1497 3.2774 3.2774 3.8878 3.8878 4.0466 4.0466 4.1126 4.1126 4.2430 4.2430 4.4381 4.4381 4.4950 4.4950 4.6700 4.6700 4.7527 4.7527 6.2114 6.2114 6.2263 6.2263 8.7342 8.7342 9.4891 9.4891 9.5327 9.5327 9.5916 9.5916 9.6705 9.6705 k = 0.0000 0.0000 0.5808 ( 12480 PWs) bands (ev): -14.3512 -14.3512 -14.3512 -14.3512 -11.4513 -11.4513 -11.4513 -11.4513 -3.2295 -3.2295 -3.2295 -3.2295 -1.9007 -1.9007 -1.9007 -1.9007 -1.8127 -1.8127 -1.8127 -1.8127 1.2611 1.2611 1.2611 1.2611 2.3519 2.3519 2.3519 2.3519 2.9036 2.9036 2.9036 2.9036 4.0572 4.0572 4.0572 4.0572 4.1723 4.1723 4.1723 4.1723 4.3587 4.3587 4.3587 4.3587 5.2551 5.2551 5.2551 5.2551 5.5937 5.5937 5.5937 5.5937 8.4791 8.4791 8.4791 8.4791 8.9968 8.9968 8.9968 8.9968 10.7576 10.7576 k =-0.0161 0.0093 0.5808 ( 12498 PWs) bands (ev): -14.3512 -14.3512 -14.3512 -14.3512 -11.4513 -11.4513 -11.4513 -11.4513 -3.2298 -3.2298 -3.2298 -3.2298 -1.9026 -1.9026 -1.9026 -1.9026 -1.8109 -1.8109 -1.8109 -1.8109 1.2618 1.2618 1.2618 1.2618 2.3515 2.3515 2.3515 2.3515 2.9036 2.9036 2.9036 2.9036 4.0570 4.0570 4.0570 4.0570 4.1727 4.1727 4.1727 4.1727 4.3590 4.3590 4.3590 4.3590 5.2551 5.2551 5.2551 5.2551 5.5938 5.5938 5.5938 5.5938 8.4809 8.4809 8.4809 8.4809 8.9976 8.9976 8.9976 8.9976 10.7588 10.7588 k =-0.0323 0.0186 0.5808 ( 12510 PWs) bands (ev): -14.3511 -14.3511 -14.3511 -14.3511 -11.4514 -11.4514 -11.4514 -11.4514 -3.2306 -3.2306 -3.2306 -3.2306 -1.9078 -1.9078 -1.9078 -1.9078 -1.8058 -1.8058 -1.8058 -1.8058 1.2637 1.2637 1.2637 1.2637 2.3502 2.3502 2.3502 2.3502 2.9037 2.9037 2.9037 2.9037 4.0567 4.0567 4.0567 4.0567 4.1738 4.1738 4.1738 4.1738 4.3598 4.3598 4.3598 4.3598 5.2549 5.2549 5.2549 5.2549 5.5940 5.5940 5.5940 5.5940 8.4861 8.4861 8.4861 8.4861 8.9999 8.9999 8.9999 8.9999 10.7624 10.7624 k =-0.0484 0.0279 0.5808 ( 12518 PWs) bands (ev): -14.3511 -14.3511 -14.3511 -14.3511 -11.4514 -11.4514 -11.4514 -11.4514 -3.2319 -3.2319 -3.2319 -3.2319 -1.9155 -1.9155 -1.9155 -1.9155 -1.7983 -1.7983 -1.7983 -1.7983 1.2668 1.2668 1.2668 1.2668 2.3482 2.3482 2.3482 2.3482 2.9038 2.9038 2.9038 2.9038 4.0561 4.0561 4.0561 4.0561 4.1757 4.1757 4.1757 4.1757 4.3612 4.3612 4.3612 4.3612 5.2546 5.2546 5.2546 5.2546 5.5944 5.5944 5.5944 5.5944 8.4948 8.4948 8.4948 8.4948 9.0037 9.0037 9.0037 9.0037 10.7686 10.7686 k =-0.0645 0.0372 0.5808 ( 12530 PWs) bands (ev): -14.3510 -14.3510 -14.3510 -14.3510 -11.4515 -11.4515 -11.4515 -11.4515 -3.2336 -3.2336 -3.2336 -3.2336 -1.9247 -1.9247 -1.9247 -1.9247 -1.7893 -1.7893 -1.7893 -1.7893 1.2711 1.2711 1.2711 1.2711 2.3454 2.3454 2.3454 2.3454 2.9040 2.9040 2.9040 2.9040 4.0554 4.0554 4.0554 4.0554 4.1783 4.1783 4.1783 4.1783 4.3631 4.3631 4.3631 4.3631 5.2541 5.2541 5.2541 5.2541 5.5949 5.5949 5.5949 5.5949 8.5070 8.5070 8.5070 8.5070 9.0089 9.0089 9.0089 9.0089 10.7771 10.7771 k =-0.0806 0.0465 0.5808 ( 12534 PWs) bands (ev): -14.3509 -14.3509 -14.3509 -14.3509 -11.4515 -11.4515 -11.4515 -11.4515 -3.2359 -3.2359 -3.2359 -3.2359 -1.9349 -1.9349 -1.9349 -1.9349 -1.7794 -1.7794 -1.7794 -1.7794 1.2766 1.2766 1.2766 1.2766 2.3418 2.3418 2.3418 2.3418 2.9042 2.9042 2.9042 2.9042 4.0546 4.0546 4.0546 4.0546 4.1814 4.1814 4.1814 4.1814 4.3655 4.3655 4.3655 4.3655 5.2536 5.2536 5.2536 5.2536 5.5955 5.5955 5.5955 5.5955 8.5227 8.5227 8.5227 8.5227 9.0155 9.0155 9.0155 9.0155 10.7880 10.7880 k =-0.0968 0.0558 0.5808 ( 12536 PWs) bands (ev): -14.3507 -14.3507 -14.3507 -14.3507 -11.4516 -11.4516 -11.4516 -11.4516 -3.2387 -3.2387 -3.2387 -3.2387 -1.9456 -1.9456 -1.9456 -1.9456 -1.7690 -1.7690 -1.7690 -1.7690 1.2831 1.2831 1.2831 1.2831 2.3376 2.3376 2.3376 2.3376 2.9044 2.9044 2.9044 2.9044 4.0537 4.0537 4.0537 4.0537 4.1850 4.1850 4.1850 4.1850 4.3685 4.3685 4.3685 4.3685 5.2529 5.2529 5.2529 5.2529 5.5963 5.5963 5.5963 5.5963 8.5417 8.5417 8.5417 8.5417 9.0234 9.0234 9.0234 9.0234 10.8014 10.8014 k =-0.1129 0.0651 0.5808 ( 12536 PWs) bands (ev): -14.3506 -14.3506 -14.3506 -14.3506 -11.4517 -11.4517 -11.4517 -11.4517 -3.2419 -3.2419 -3.2419 -3.2419 -1.9567 -1.9567 -1.9567 -1.9567 -1.7582 -1.7582 -1.7582 -1.7582 1.2905 1.2905 1.2905 1.2905 2.3327 2.3327 2.3327 2.3327 2.9047 2.9047 2.9047 2.9047 4.0529 4.0529 4.0529 4.0529 4.1890 4.1890 4.1890 4.1890 4.3720 4.3720 4.3720 4.3720 5.2521 5.2521 5.2521 5.2521 5.5971 5.5971 5.5971 5.5971 8.5642 8.5642 8.5642 8.5642 9.0324 9.0324 9.0324 9.0324 10.8172 10.8172 k =-0.1290 0.0743 0.5808 ( 12534 PWs) bands (ev): -14.3504 -14.3504 -14.3504 -14.3504 -11.4519 -11.4519 -11.4519 -11.4519 -3.2455 -3.2455 -3.2455 -3.2455 -1.9679 -1.9679 -1.9679 -1.9679 -1.7473 -1.7473 -1.7473 -1.7473 1.2988 1.2988 1.2988 1.2988 2.3273 2.3273 2.3273 2.3273 2.9050 2.9050 2.9050 2.9050 4.0522 4.0522 4.0522 4.0522 4.1934 4.1934 4.1934 4.1934 4.3759 4.3759 4.3759 4.3759 5.2512 5.2512 5.2512 5.2512 5.5981 5.5981 5.5981 5.5981 8.5900 8.5900 8.5900 8.5900 9.0425 9.0425 9.0425 9.0425 10.8353 10.8353 k =-0.1452 0.0836 0.5808 ( 12526 PWs) bands (ev): -14.3502 -14.3502 -14.3502 -14.3502 -11.4520 -11.4520 -11.4520 -11.4520 -3.2495 -3.2495 -3.2495 -3.2495 -1.9791 -1.9791 -1.9791 -1.9791 -1.7363 -1.7363 -1.7363 -1.7363 1.3078 1.3078 1.3078 1.3078 2.3214 2.3214 2.3214 2.3214 2.9054 2.9054 2.9054 2.9054 4.0517 4.0517 4.0517 4.0517 4.1980 4.1980 4.1980 4.1980 4.3803 4.3803 4.3803 4.3803 5.2503 5.2503 5.2503 5.2503 5.5992 5.5992 5.5992 5.5992 8.6191 8.6191 8.6191 8.6191 9.0534 9.0534 9.0534 9.0534 10.8558 10.8558 k =-0.1613 0.0929 0.5808 ( 12526 PWs) bands (ev): -14.3500 -14.3500 -14.3500 -14.3500 -11.4521 -11.4521 -11.4521 -11.4521 -3.2538 -3.2538 -3.2538 -3.2538 -1.9901 -1.9901 -1.9901 -1.9901 -1.7254 -1.7254 -1.7254 -1.7254 1.3173 1.3173 1.3173 1.3173 2.3151 2.3151 2.3151 2.3151 2.9058 2.9058 2.9058 2.9058 4.0513 4.0513 4.0513 4.0513 4.2027 4.2027 4.2027 4.2027 4.3852 4.3852 4.3852 4.3852 5.2493 5.2493 5.2493 5.2493 5.6003 5.6003 5.6003 5.6003 8.6515 8.6515 8.6515 8.6515 9.0650 9.0650 9.0650 9.0650 10.8786 10.8786 k =-0.1774 0.1022 0.5808 ( 12536 PWs) bands (ev): -14.3497 -14.3497 -14.3497 -14.3497 -11.4523 -11.4523 -11.4523 -11.4523 -3.2584 -3.2584 -3.2584 -3.2584 -2.0010 -2.0010 -2.0010 -2.0010 -1.7146 -1.7146 -1.7146 -1.7146 1.3273 1.3273 1.3273 1.3273 2.3085 2.3085 2.3085 2.3085 2.9062 2.9062 2.9062 2.9062 4.0511 4.0511 4.0511 4.0511 4.2076 4.2076 4.2076 4.2076 4.3904 4.3904 4.3904 4.3904 5.2482 5.2482 5.2482 5.2482 5.6016 5.6016 5.6016 5.6016 8.6870 8.6870 8.6870 8.6870 9.0771 9.0771 9.0771 9.0771 10.9037 10.9037 k =-0.1935 0.1115 0.5808 ( 12536 PWs) bands (ev): -14.3495 -14.3495 -14.3495 -14.3495 -11.4524 -11.4524 -11.4524 -11.4524 -3.2633 -3.2633 -3.2633 -3.2633 -2.0117 -2.0117 -2.0117 -2.0117 -1.7040 -1.7040 -1.7040 -1.7040 1.3376 1.3376 1.3376 1.3376 2.3017 2.3017 2.3017 2.3017 2.9066 2.9066 2.9066 2.9066 4.0512 4.0512 4.0512 4.0512 4.2125 4.2125 4.2125 4.2125 4.3960 4.3960 4.3960 4.3960 5.2470 5.2470 5.2470 5.2470 5.6029 5.6029 5.6029 5.6029 8.7255 8.7255 8.7255 8.7255 9.0896 9.0896 9.0896 9.0896 10.9308 10.9308 k =-0.2097 0.1208 0.5808 ( 12534 PWs) bands (ev): -14.3492 -14.3492 -14.3492 -14.3492 -11.4526 -11.4526 -11.4526 -11.4526 -3.2684 -3.2684 -3.2684 -3.2684 -2.0220 -2.0220 -2.0220 -2.0220 -1.6936 -1.6936 -1.6936 -1.6936 1.3481 1.3481 1.3481 1.3481 2.2948 2.2948 2.2948 2.2948 2.9070 2.9070 2.9070 2.9070 4.0514 4.0514 4.0514 4.0514 4.2174 4.2174 4.2174 4.2174 4.4019 4.4019 4.4019 4.4019 5.2459 5.2459 5.2459 5.2459 5.6042 5.6042 5.6042 5.6042 8.7671 8.7671 8.7671 8.7671 9.1023 9.1023 9.1023 9.1023 10.9601 10.9601 k =-0.2258 0.1301 0.5808 ( 12546 PWs) bands (ev): -14.3490 -14.3490 -14.3490 -14.3490 -11.4528 -11.4528 -11.4528 -11.4528 -3.2736 -3.2736 -3.2736 -3.2736 -2.0320 -2.0320 -2.0320 -2.0320 -1.6834 -1.6834 -1.6834 -1.6834 1.3585 1.3585 1.3585 1.3585 2.2879 2.2879 2.2879 2.2879 2.9074 2.9074 2.9074 2.9074 4.0519 4.0519 4.0519 4.0519 4.2222 4.2222 4.2222 4.2222 4.4081 4.4081 4.4081 4.4081 5.2447 5.2447 5.2447 5.2447 5.6056 5.6056 5.6056 5.6056 8.8115 8.8115 8.8115 8.8115 9.1150 9.1150 9.1150 9.1150 10.9911 10.9911 k =-0.2419 0.1394 0.5808 ( 12546 PWs) bands (ev): -14.3487 -14.3487 -14.3487 -14.3487 -11.4529 -11.4529 -11.4529 -11.4529 -3.2790 -3.2790 -3.2790 -3.2790 -2.0416 -2.0416 -2.0416 -2.0416 -1.6734 -1.6734 -1.6734 -1.6734 1.3689 1.3689 1.3689 1.3689 2.2810 2.2810 2.2810 2.2810 2.9079 2.9079 2.9079 2.9079 4.0525 4.0525 4.0525 4.0525 4.2270 4.2270 4.2270 4.2270 4.4146 4.4146 4.4146 4.4146 5.2435 5.2435 5.2435 5.2435 5.6070 5.6070 5.6070 5.6070 8.8585 8.8585 8.8585 8.8585 9.1276 9.1276 9.1276 9.1276 11.0238 11.0238 k =-0.2581 0.1487 0.5808 ( 12534 PWs) bands (ev): -14.3485 -14.3485 -14.3485 -14.3485 -11.4531 -11.4531 -11.4531 -11.4531 -3.2844 -3.2844 -3.2844 -3.2844 -2.0508 -2.0508 -2.0508 -2.0508 -1.6638 -1.6638 -1.6638 -1.6638 1.3790 1.3790 1.3790 1.3790 2.2742 2.2742 2.2742 2.2742 2.9083 2.9083 2.9083 2.9083 4.0533 4.0533 4.0533 4.0533 4.2317 4.2317 4.2317 4.2317 4.4212 4.4212 4.4212 4.4212 5.2423 5.2423 5.2423 5.2423 5.6084 5.6084 5.6084 5.6084 8.9081 8.9081 8.9081 8.9081 9.1399 9.1399 9.1399 9.1399 11.0576 11.0576 k =-0.2742 0.1580 0.5808 ( 12546 PWs) bands (ev): -14.3482 -14.3482 -14.3482 -14.3482 -11.4533 -11.4533 -11.4533 -11.4533 -3.2897 -3.2897 -3.2897 -3.2897 -2.0594 -2.0594 -2.0594 -2.0594 -1.6546 -1.6546 -1.6546 -1.6546 1.3888 1.3888 1.3888 1.3888 2.2677 2.2677 2.2677 2.2677 2.9087 2.9087 2.9087 2.9087 4.0543 4.0543 4.0543 4.0543 4.2362 4.2362 4.2362 4.2362 4.4279 4.4279 4.4279 4.4279 5.2410 5.2410 5.2410 5.2410 5.6097 5.6097 5.6097 5.6097 8.9599 8.9599 8.9599 8.9599 9.1518 9.1518 9.1518 9.1518 11.0918 11.0918 k =-0.2903 0.1673 0.5808 ( 12530 PWs) bands (ev): -14.3479 -14.3479 -14.3479 -14.3479 -11.4534 -11.4534 -11.4534 -11.4534 -3.2951 -3.2951 -3.2951 -3.2951 -2.0676 -2.0676 -2.0676 -2.0676 -1.6458 -1.6458 -1.6458 -1.6458 1.3982 1.3982 1.3982 1.3982 2.2615 2.2615 2.2615 2.2615 2.9092 2.9092 2.9092 2.9092 4.0553 4.0553 4.0553 4.0553 4.2405 4.2405 4.2405 4.2405 4.4346 4.4346 4.4346 4.4346 5.2399 5.2399 5.2399 5.2399 5.6111 5.6111 5.6111 5.6111 9.0136 9.0136 9.0136 9.0136 9.1633 9.1633 9.1633 9.1633 11.1250 11.1250 k =-0.3065 0.1766 0.5808 ( 12522 PWs) bands (ev): -14.3477 -14.3477 -14.3477 -14.3477 -11.4536 -11.4536 -11.4536 -11.4536 -3.3003 -3.3003 -3.3003 -3.3003 -2.0753 -2.0753 -2.0753 -2.0753 -1.6374 -1.6374 -1.6374 -1.6374 1.4070 1.4070 1.4070 1.4070 2.2556 2.2556 2.2556 2.2556 2.9096 2.9096 2.9096 2.9096 4.0565 4.0565 4.0565 4.0565 4.2446 4.2446 4.2446 4.2446 4.4413 4.4413 4.4413 4.4413 5.2387 5.2387 5.2387 5.2387 5.6124 5.6124 5.6124 5.6124 9.0687 9.0687 9.0687 9.0687 9.1746 9.1746 9.1746 9.1746 11.1541 11.1541 k =-0.3226 0.1859 0.5808 ( 12518 PWs) bands (ev): -14.3474 -14.3474 -14.3474 -14.3474 -11.4538 -11.4538 -11.4538 -11.4538 -3.3053 -3.3053 -3.3053 -3.3053 -2.0824 -2.0824 -2.0824 -2.0824 -1.6295 -1.6295 -1.6295 -1.6295 1.4152 1.4152 1.4152 1.4152 2.2501 2.2501 2.2501 2.2501 2.9099 2.9099 2.9099 2.9099 4.0577 4.0577 4.0577 4.0577 4.2485 4.2485 4.2485 4.2485 4.4479 4.4479 4.4479 4.4479 5.2376 5.2376 5.2376 5.2376 5.6137 5.6137 5.6137 5.6137 9.1239 9.1239 9.1239 9.1239 9.1864 9.1864 9.1864 9.1864 11.1722 11.1722 k =-0.3387 0.1952 0.5808 ( 12502 PWs) bands (ev): -14.3472 -14.3472 -14.3472 -14.3472 -11.4539 -11.4539 -11.4539 -11.4539 -3.3101 -3.3101 -3.3101 -3.3101 -2.0890 -2.0890 -2.0890 -2.0890 -1.6221 -1.6221 -1.6221 -1.6221 1.4228 1.4228 1.4228 1.4228 2.2451 2.2451 2.2451 2.2451 2.9103 2.9103 2.9103 2.9103 4.0589 4.0589 4.0589 4.0589 4.2521 4.2521 4.2521 4.2521 4.4543 4.4543 4.4543 4.4543 5.2366 5.2366 5.2366 5.2366 5.6149 5.6149 5.6149 5.6149 9.1717 9.1717 9.1717 9.1717 9.2057 9.2057 9.2057 9.2057 11.1679 11.1679 k =-0.3548 0.2045 0.5808 ( 12510 PWs) bands (ev): -14.3470 -14.3470 -14.3470 -14.3470 -11.4541 -11.4541 -11.4541 -11.4541 -3.3146 -3.3146 -3.3146 -3.3146 -2.0949 -2.0949 -2.0949 -2.0949 -1.6152 -1.6152 -1.6152 -1.6152 1.4296 1.4296 1.4296 1.4296 2.2406 2.2406 2.2406 2.2406 2.9107 2.9107 2.9107 2.9107 4.0601 4.0601 4.0601 4.0601 4.2554 4.2554 4.2554 4.2554 4.4604 4.4604 4.4604 4.4604 5.2356 5.2356 5.2356 5.2356 5.6160 5.6160 5.6160 5.6160 9.1927 9.1927 9.1927 9.1927 9.2512 9.2512 9.2512 9.2512 11.1404 11.1404 k =-0.3710 0.2137 0.5808 ( 12510 PWs) bands (ev): -14.3468 -14.3468 -14.3468 -14.3468 -11.4542 -11.4542 -11.4542 -11.4542 -3.3188 -3.3188 -3.3188 -3.3188 -2.1003 -2.1003 -2.1003 -2.1003 -1.6090 -1.6090 -1.6090 -1.6090 1.4358 1.4358 1.4358 1.4358 2.2365 2.2365 2.2365 2.2365 2.9110 2.9110 2.9110 2.9110 4.0613 4.0613 4.0613 4.0613 4.2585 4.2585 4.2585 4.2585 4.4661 4.4661 4.4661 4.4661 5.2347 5.2347 5.2347 5.2347 5.6171 5.6171 5.6171 5.6171 9.2024 9.2024 9.2024 9.2024 9.3069 9.3069 9.3069 9.3069 11.1024 11.1024 k =-0.3871 0.2230 0.5808 ( 12502 PWs) bands (ev): -14.3466 -14.3466 -14.3466 -14.3466 -11.4543 -11.4543 -11.4543 -11.4543 -3.3226 -3.3226 -3.3226 -3.3226 -2.1050 -2.1050 -2.1050 -2.1050 -1.6034 -1.6034 -1.6034 -1.6034 1.4412 1.4412 1.4412 1.4412 2.2329 2.2329 2.2329 2.2329 2.9113 2.9113 2.9113 2.9113 4.0624 4.0624 4.0624 4.0624 4.2612 4.2612 4.2612 4.2612 4.4714 4.4714 4.4714 4.4714 5.2339 5.2339 5.2339 5.2339 5.6180 5.6180 5.6180 5.6180 9.2094 9.2094 9.2094 9.2094 9.3631 9.3631 9.3631 9.3631 11.0632 11.0632 k =-0.4032 0.2323 0.5808 ( 12510 PWs) bands (ev): -14.3465 -14.3465 -14.3465 -14.3465 -11.4544 -11.4544 -11.4544 -11.4544 -3.3260 -3.3260 -3.3260 -3.3260 -2.1092 -2.1092 -2.1092 -2.1092 -1.5985 -1.5985 -1.5985 -1.5985 1.4458 1.4458 1.4458 1.4458 2.2299 2.2299 2.2299 2.2299 2.9115 2.9115 2.9115 2.9115 4.0634 4.0634 4.0634 4.0634 4.2636 4.2636 4.2636 4.2636 4.4762 4.4762 4.4762 4.4762 5.2332 5.2332 5.2332 5.2332 5.6188 5.6188 5.6188 5.6188 9.2152 9.2152 9.2152 9.2152 9.4174 9.4174 9.4174 9.4174 11.0265 11.0265 k =-0.4194 0.2416 0.5808 ( 12498 PWs) bands (ev): -14.3463 -14.3463 -14.3463 -14.3463 -11.4545 -11.4545 -11.4545 -11.4545 -3.3289 -3.3289 -3.3289 -3.3289 -2.1127 -2.1127 -2.1127 -2.1127 -1.5943 -1.5943 -1.5943 -1.5943 1.4497 1.4497 1.4497 1.4497 2.2273 2.2273 2.2273 2.2273 2.9117 2.9117 2.9117 2.9117 4.0642 4.0642 4.0642 4.0642 4.2657 4.2657 4.2657 4.2657 4.4804 4.4804 4.4804 4.4804 5.2326 5.2326 5.2326 5.2326 5.6196 5.6196 5.6196 5.6196 9.2198 9.2198 9.2198 9.2198 9.4681 9.4681 9.4681 9.4681 10.9940 10.9940 k =-0.4355 0.2509 0.5808 ( 12506 PWs) bands (ev): -14.3462 -14.3462 -14.3462 -14.3462 -11.4546 -11.4546 -11.4546 -11.4546 -3.3314 -3.3314 -3.3314 -3.3314 -2.1156 -2.1156 -2.1156 -2.1156 -1.5908 -1.5908 -1.5908 -1.5908 1.4529 1.4529 1.4529 1.4529 2.2252 2.2252 2.2252 2.2252 2.9119 2.9119 2.9119 2.9119 4.0650 4.0650 4.0650 4.0650 4.2674 4.2674 4.2674 4.2674 4.4840 4.4840 4.4840 4.4840 5.2321 5.2321 5.2321 5.2321 5.6202 5.6202 5.6202 5.6202 9.2235 9.2235 9.2235 9.2235 9.5136 9.5136 9.5136 9.5136 10.9667 10.9667 k =-0.4516 0.2602 0.5808 ( 12518 PWs) bands (ev): -14.3461 -14.3461 -14.3461 -14.3461 -11.4546 -11.4546 -11.4546 -11.4546 -3.3333 -3.3333 -3.3333 -3.3333 -2.1178 -2.1178 -2.1178 -2.1178 -1.5880 -1.5880 -1.5880 -1.5880 1.4553 1.4553 1.4553 1.4553 2.2236 2.2236 2.2236 2.2236 2.9121 2.9121 2.9121 2.9121 4.0656 4.0656 4.0656 4.0656 4.2687 4.2687 4.2687 4.2687 4.4868 4.4868 4.4868 4.4868 5.2317 5.2317 5.2317 5.2317 5.6206 5.6206 5.6206 5.6206 9.2263 9.2263 9.2263 9.2263 9.5521 9.5521 9.5521 9.5521 10.9448 10.9448 k =-0.4677 0.2695 0.5808 ( 12506 PWs) bands (ev): -14.3460 -14.3460 -14.3460 -14.3460 -11.4547 -11.4547 -11.4547 -11.4547 -3.3347 -3.3347 -3.3347 -3.3347 -2.1194 -2.1194 -2.1194 -2.1194 -1.5861 -1.5861 -1.5861 -1.5861 1.4571 1.4571 1.4571 1.4571 2.2225 2.2225 2.2225 2.2225 2.9122 2.9122 2.9122 2.9122 4.0660 4.0660 4.0660 4.0660 4.2697 4.2697 4.2697 4.2697 4.4889 4.4889 4.4889 4.4889 5.2314 5.2314 5.2314 5.2314 5.6210 5.6210 5.6210 5.6210 9.2283 9.2283 9.2283 9.2283 9.5814 9.5814 9.5814 9.5814 10.9289 10.9289 k =-0.4839 0.2788 0.5808 ( 12504 PWs) bands (ev): -14.3460 -14.3460 -14.3460 -14.3460 -11.4547 -11.4547 -11.4547 -11.4547 -3.3355 -3.3355 -3.3355 -3.3355 -2.1204 -2.1204 -2.1204 -2.1204 -1.5849 -1.5849 -1.5849 -1.5849 1.4581 1.4581 1.4581 1.4581 2.2218 2.2218 2.2218 2.2218 2.9122 2.9122 2.9122 2.9122 4.0663 4.0663 4.0663 4.0663 4.2702 4.2702 4.2702 4.2702 4.4901 4.4901 4.4901 4.4901 5.2312 5.2312 5.2312 5.2312 5.6212 5.6212 5.6212 5.6212 9.2294 9.2294 9.2294 9.2294 9.5999 9.5999 9.5999 9.5999 10.9192 10.9192 k =-0.5000 0.2881 0.5808 ( 12492 PWs) bands (ev): -14.3460 -14.3460 -14.3460 -14.3460 -11.4547 -11.4547 -11.4547 -11.4547 -3.3358 -3.3358 -3.3358 -3.3358 -2.1207 -2.1207 -2.1207 -2.1207 -1.5845 -1.5845 -1.5845 -1.5845 1.4584 1.4584 1.4584 1.4584 2.2216 2.2216 2.2216 2.2216 2.9122 2.9122 2.9122 2.9122 4.0664 4.0664 4.0664 4.0664 4.2704 4.2704 4.2704 4.2704 4.4905 4.4905 4.4905 4.4905 5.2311 5.2311 5.2311 5.2311 5.6213 5.6213 5.6213 5.6213 9.2298 9.2298 9.2298 9.2298 9.6062 9.6062 9.6062 9.6062 10.9159 10.9159 Writing output data file CsCuO.save init_run : 0.55s CPU 0.99s WALL ( 1 calls) electrons : 707.00s CPU 714.34s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.11s WALL ( 1 calls) potinit : 0.02s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 706.99s CPU 714.32s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.22s CPU 0.25s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.18s CPU 0.31s WALL ( 342 calls) cegterg : 666.32s CPU 671.89s WALL ( 1126 calls) Called by sum_band: Called by *egterg: h_psi : 403.64s CPU 407.11s WALL ( 21369 calls) s_psi : 21.46s CPU 21.59s WALL ( 21369 calls) g_psi : 1.27s CPU 1.33s WALL ( 19901 calls) cdiaghg : 161.02s CPU 162.12s WALL ( 20243 calls) cegterg:over : 35.83s CPU 36.18s WALL ( 19901 calls) cegterg:upda : 40.63s CPU 41.47s WALL ( 19901 calls) cegterg:last : 14.86s CPU 14.76s WALL ( 2152 calls) cdiaghg:chol : 9.46s CPU 9.39s WALL ( 20243 calls) cdiaghg:inve : 6.57s CPU 6.32s WALL ( 20243 calls) cdiaghg:para : 9.78s CPU 9.82s WALL ( 40486 calls) Called by h_psi: h_psi:vloc : 332.99s CPU 335.94s WALL ( 21369 calls) h_psi:vnl : 68.92s CPU 69.50s WALL ( 21369 calls) add_vuspsi : 38.96s CPU 39.27s WALL ( 21369 calls) General routines calbec : 29.90s CPU 30.17s WALL ( 21369 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 315.78s CPU 318.15s WALL ( 1541968 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.39s CPU 0.79s WALL ( 684 calls) Parallel routines fft_scatter : 98.26s CPU 99.20s WALL ( 1541991 calls) PWSCF : 12m27.48s CPU 12m55.71s WALL This run was terminated on: 17:47:58 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=