Program PWSCF v.6.7MaX starts on 21Jan2021 at 2:18:48 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); "P. Giannozzi et al., J. Phys.:Condens. Matter 29 465901 (2017); 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 400 processors MPI processes distributed on 3 nodes R & G space division: proc/nbgrp/npool/nimage = 400 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: /lfs/usrhome/phd/ph19d005/ss/lamno_trail/bands/aiida.save/ Atomic positions from file used, from input discarded Message from routine read_pp_mesh: mismatch in mesh size, discarding the one in header file O.pbesol-n-kjpaw_psl.0.1.UPF: wavefunction(s) 2P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Message from routine setup: using ibrav=0 with symmetry is DISCOURAGED, use correct ibrav instead Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 25 8 2 2575 492 68 Max 26 9 3 2583 505 81 Sum 10079 3357 927 1031615 198681 28657 bravais-lattice index = 0 lattice parameter (alat) = 10.5560 a.u. unit-cell volume = 1721.3796 (a.u.)^3 number of atoms/cell = 20 number of atomic types = 3 number of electrons = 176.00 number of Kohn-Sham states= 60 kinetic-energy cutoff = 90.0000 Ry charge density cutoff = 1080.0000 Ry Exchange-correlation= SLA PW PSX PSC ( 1 4 10 8 0 0 0) celldm(1)= 10.556003 celldm(2)= 0.000000 celldm(3)= 0.000000 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.051098 0.000000 ) a(3) = ( 0.000000 0.000000 1.392307 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.000000 0.000000 ) b(2) = ( 0.000000 0.951386 0.000000 ) b(3) = ( 0.000000 0.000000 0.718233 ) PseudoPot. # 1 for La read from file: /lfs/usrhome/phd/ph19d005/pseudo/La.GGA-PBESOL-paw.UPF MD5 check sum: a1a790900c8df0bafb4cc781052d7078 Pseudo is Projector augmented-wave + core cor, Zval = 11.0 Generated using ATOMPAW code Shape of augmentation charge: BESSEL Using radial grid of 1101 points, 8 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 2 l(6) = 2 l(7) = 3 l(8) = 3 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Mn read from file: /lfs/usrhome/phd/ph19d005/pseudo/mn_pbesol_v1.5.uspp.F.UPF MD5 check sum: 0716d5f563e6e95a34f9080f4c78c109 Pseudo is Ultrasoft + core correction, Zval = 15.0 Generated by new atomic code, or converted to UPF format Using radial grid of 859 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 2 l(6) = 2 Q(r) pseudized with 8 coefficients, rinner = 0.950 0.950 0.950 0.950 0.950 PseudoPot. # 3 for O read from file: /lfs/usrhome/phd/ph19d005/pseudo/O.pbesol-n-kjpaw_psl.0.1.UPF MD5 check sum: 126339daddaa87477ab44acfa0b5aa00 Pseudo is Projector augmented-wave + core cor, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.6.0 svn rev. 13079 Shape of augmentation charge: BESSEL Using radial grid of 1095 points, 4 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential La 11.00 138.90550 La( 1.00) Mn 15.00 54.93800 Mn( 1.00) O 6.00 15.99940 O ( 1.00) Starting magnetic structure atomic species magnetization La 0.455 Mn 0.333 O 0.100 8 Sym. Ops., with inversion, found ( 6 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 ) ( -0.6961534 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.5255491 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.6961534 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5255491 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.6961534 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( 1.0000000 0.0000000 0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5255491 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6961534 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.5255491 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) Cartesian axes site n. atom positions (alat units) 1 La tau( 1) = ( 0.4891918 0.0627712 0.3480767 ) 2 La tau( 2) = ( 0.5108082 0.9883269 1.0442301 ) 3 La tau( 3) = ( 0.0108082 0.5883203 0.3480767 ) 4 La tau( 4) = ( 0.9891918 0.4627779 1.0442301 ) 5 Mn tau( 5) = ( 0.0000000 0.0000000 0.0000000 ) 6 Mn tau( 6) = ( 0.0000000 0.0000000 0.6961534 ) 7 Mn tau( 7) = ( 0.5000000 0.5255491 0.6961534 ) 8 Mn tau( 8) = ( 0.5000000 0.5255491 0.0000000 ) 9 O tau( 9) = ( 0.5787206 0.5049600 0.3480767 ) 10 O tau( 10) = ( 0.4212794 0.5461371 1.0442301 ) 11 O tau( 11) = ( 0.9212794 1.0305101 0.3480767 ) 12 O tau( 12) = ( 0.0787206 0.0205891 1.0442301 ) 13 O tau( 13) = ( 0.2212685 0.3220981 0.0569426 ) 14 O tau( 14) = ( 0.7787315 0.7289990 0.7530960 ) 15 O tau( 15) = ( 0.7787315 0.7289990 1.3353641 ) 16 O tau( 16) = ( 0.2212685 0.3220981 0.6392108 ) 17 O tau( 17) = ( 0.2787315 0.8476482 0.6392108 ) 18 O tau( 18) = ( 0.7212685 0.2034499 1.3353641 ) 19 O tau( 19) = ( 0.7212685 0.2034499 0.7530960 ) 20 O tau( 20) = ( 0.2787315 0.8476482 0.0569426 ) Crystallographic axes site n. atom positions (cryst. coord.) 1 La tau( 1) = ( 0.4891918 0.0597197 0.2500000 ) 2 La tau( 2) = ( 0.5108082 0.9402803 0.7500000 ) 3 La tau( 3) = ( 0.0108082 0.5597197 0.2500000 ) 4 La tau( 4) = ( 0.9891918 0.4402803 0.7500000 ) 5 Mn tau( 5) = ( 0.0000000 0.0000000 0.0000000 ) 6 Mn tau( 6) = ( 0.0000000 0.0000000 0.5000000 ) 7 Mn tau( 7) = ( 0.5000000 0.5000000 0.5000000 ) 8 Mn tau( 8) = ( 0.5000000 0.5000000 0.0000000 ) 9 O tau( 9) = ( 0.5787206 0.4804118 0.2500000 ) 10 O tau( 10) = ( 0.4212794 0.5195872 0.7500000 ) 11 O tau( 11) = ( 0.9212794 0.9804128 0.2500000 ) 12 O tau( 12) = ( 0.0787206 0.0195882 0.7500000 ) 13 O tau( 13) = ( 0.2212685 0.3064396 0.0408980 ) 14 O tau( 14) = ( 0.7787315 0.6935594 0.5408980 ) 15 O tau( 15) = ( 0.7787315 0.6935594 0.9591020 ) 16 O tau( 16) = ( 0.2212685 0.3064396 0.4591020 ) 17 O tau( 17) = ( 0.2787315 0.8064406 0.4591020 ) 18 O tau( 18) = ( 0.7212685 0.1935594 0.9591020 ) 19 O tau( 19) = ( 0.7212685 0.1935594 0.5408980 ) 20 O tau( 20) = ( 0.2787315 0.8064406 0.0408980 ) number of k points= 141 Marzari-Vanderbilt smearing, width (Ry)= 0.0147 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0070922 k( 2) = ( 0.0267532 0.0192150 0.0201969), wk = 0.0070922 k( 3) = ( 0.0535065 0.0384301 0.0403938), wk = 0.0070922 k( 4) = ( 0.0802597 0.0576451 0.0605907), wk = 0.0070922 k( 5) = ( 0.1070129 0.0768601 0.0807876), wk = 0.0070922 k( 6) = ( 0.1337661 0.0960752 0.1009844), wk = 0.0070922 k( 7) = ( 0.1605194 0.1152902 0.1211813), wk = 0.0070922 k( 8) = ( 0.1872726 0.1345052 0.1413782), wk = 0.0070922 k( 9) = ( 0.2140258 0.1537203 0.1615751), wk = 0.0070922 k( 10) = ( 0.2407791 0.1729353 0.1817720), wk = 0.0070922 k( 11) = ( 0.2675323 0.1921503 0.2019689), wk = 0.0070922 k( 12) = ( 0.2942855 0.2113654 0.2221658), wk = 0.0070922 k( 13) = ( 0.3210388 0.2305804 0.2423627), wk = 0.0070922 k( 14) = ( 0.3477920 0.2497954 0.2625596), wk = 0.0070922 k( 15) = ( 0.3745452 0.2690104 0.2827564), wk = 0.0070922 k( 16) = ( 0.4012984 0.2882255 0.3029533), wk = 0.0070922 k( 17) = ( 0.4280517 0.3074405 0.3231502), wk = 0.0070922 k( 18) = ( 0.4548049 0.3266555 0.3433471), wk = 0.0070922 k( 19) = ( 0.4815581 0.3458706 0.3635440), wk = 0.0070922 k( 20) = ( 0.5083114 0.3650856 0.3837409), wk = 0.0070922 k( 21) = ( 0.5350646 0.3843006 0.4039378), wk = 0.0070922 k( 22) = ( 0.5350646 0.3843006 0.3837409), wk = 0.0070922 k( 23) = ( 0.5350646 0.3843006 0.3635440), wk = 0.0070922 k( 24) = ( 0.5350646 0.3843006 0.3433471), wk = 0.0070922 k( 25) = ( 0.5350646 0.3843006 0.3231502), wk = 0.0070922 k( 26) = ( 0.5350646 0.3843006 0.3029533), wk = 0.0070922 k( 27) = ( 0.5350646 0.3843006 0.2827564), wk = 0.0070922 k( 28) = ( 0.5350646 0.3843006 0.2625596), wk = 0.0070922 k( 29) = ( 0.5350646 0.3843006 0.2423627), wk = 0.0070922 k( 30) = ( 0.5350646 0.3843006 0.2221658), wk = 0.0070922 k( 31) = ( 0.5350646 0.3843006 0.2019689), wk = 0.0070922 k( 32) = ( 0.5350646 0.3843006 0.1817720), wk = 0.0070922 k( 33) = ( 0.5350646 0.3843006 0.1615751), wk = 0.0070922 k( 34) = ( 0.5350646 0.3843006 0.1413782), wk = 0.0070922 k( 35) = ( 0.5350646 0.3843006 0.1211813), wk = 0.0070922 k( 36) = ( 0.5350646 0.3843006 0.1009844), wk = 0.0070922 k( 37) = ( 0.5350646 0.3843006 0.0807876), wk = 0.0070922 k( 38) = ( 0.5350646 0.3843006 0.0605907), wk = 0.0070922 k( 39) = ( 0.5350646 0.3843006 0.0403938), wk = 0.0070922 k( 40) = ( 0.5350646 0.3843006 0.0201969), wk = 0.0070922 k( 41) = ( 0.5350646 0.3843006 0.0000000), wk = 0.0070922 k( 42) = ( 0.5083114 0.3843006 0.0201969), wk = 0.0070922 k( 43) = ( 0.4815581 0.3843006 0.0403938), wk = 0.0070922 k( 44) = ( 0.4548049 0.3843006 0.0605907), wk = 0.0070922 k( 45) = ( 0.4280517 0.3843006 0.0807876), wk = 0.0070922 k( 46) = ( 0.4012984 0.3843006 0.1009844), wk = 0.0070922 k( 47) = ( 0.3745452 0.3843006 0.1211813), wk = 0.0070922 k( 48) = ( 0.3477920 0.3843006 0.1413782), wk = 0.0070922 k( 49) = ( 0.3210388 0.3843006 0.1615751), wk = 0.0070922 k( 50) = ( 0.2942855 0.3843006 0.1817720), wk = 0.0070922 k( 51) = ( 0.2675323 0.3843006 0.2019689), wk = 0.0070922 k( 52) = ( 0.2407791 0.3843006 0.2221658), wk = 0.0070922 k( 53) = ( 0.2140258 0.3843006 0.2423627), wk = 0.0070922 k( 54) = ( 0.1872726 0.3843006 0.2625596), wk = 0.0070922 k( 55) = ( 0.1605194 0.3843006 0.2827564), wk = 0.0070922 k( 56) = ( 0.1337661 0.3843006 0.3029533), wk = 0.0070922 k( 57) = ( 0.1070129 0.3843006 0.3231502), wk = 0.0070922 k( 58) = ( 0.0802597 0.3843006 0.3433471), wk = 0.0070922 k( 59) = ( 0.0535065 0.3843006 0.3635440), wk = 0.0070922 k( 60) = ( 0.0267532 0.3843006 0.3837409), wk = 0.0070922 k( 61) = ( 0.0000000 0.3843006 0.4039378), wk = 0.0070922 k( 62) = ( 0.0267532 0.3650856 0.4039378), wk = 0.0070922 k( 63) = ( 0.0535065 0.3458706 0.4039378), wk = 0.0070922 k( 64) = ( 0.0802597 0.3266555 0.4039378), wk = 0.0070922 k( 65) = ( 0.1070129 0.3074405 0.4039378), wk = 0.0070922 k( 66) = ( 0.1337661 0.2882255 0.4039378), wk = 0.0070922 k( 67) = ( 0.1605194 0.2690104 0.4039378), wk = 0.0070922 k( 68) = ( 0.1872726 0.2497954 0.4039378), wk = 0.0070922 k( 69) = ( 0.2140258 0.2305804 0.4039378), wk = 0.0070922 k( 70) = ( 0.2407791 0.2113654 0.4039378), wk = 0.0070922 k( 71) = ( 0.2675323 0.1921503 0.4039378), wk = 0.0070922 k( 72) = ( 0.2942855 0.1729353 0.4039378), wk = 0.0070922 k( 73) = ( 0.3210388 0.1537203 0.4039378), wk = 0.0070922 k( 74) = ( 0.3477920 0.1345052 0.4039378), wk = 0.0070922 k( 75) = ( 0.3745452 0.1152902 0.4039378), wk = 0.0070922 k( 76) = ( 0.4012984 0.0960752 0.4039378), wk = 0.0070922 k( 77) = ( 0.4280517 0.0768601 0.4039378), wk = 0.0070922 k( 78) = ( 0.4548049 0.0576451 0.4039378), wk = 0.0070922 k( 79) = ( 0.4815581 0.0384301 0.4039378), wk = 0.0070922 k( 80) = ( 0.5083114 0.0192150 0.4039378), wk = 0.0070922 k( 81) = ( 0.5350646 0.0000000 0.4039378), wk = 0.0070922 k( 82) = ( 0.5350646 0.0000000 0.3837409), wk = 0.0070922 k( 83) = ( 0.5350646 0.0000000 0.3635440), wk = 0.0070922 k( 84) = ( 0.5350646 0.0000000 0.3433471), wk = 0.0070922 k( 85) = ( 0.5350646 0.0000000 0.3231502), wk = 0.0070922 k( 86) = ( 0.5350646 0.0000000 0.3029533), wk = 0.0070922 k( 87) = ( 0.5350646 0.0000000 0.2827564), wk = 0.0070922 k( 88) = ( 0.5350646 0.0000000 0.2625596), wk = 0.0070922 k( 89) = ( 0.5350646 0.0000000 0.2423627), wk = 0.0070922 k( 90) = ( 0.5350646 0.0000000 0.2221658), wk = 0.0070922 k( 91) = ( 0.5350646 0.0000000 0.2019689), wk = 0.0070922 k( 92) = ( 0.5350646 0.0000000 0.1817720), wk = 0.0070922 k( 93) = ( 0.5350646 0.0000000 0.1615751), wk = 0.0070922 k( 94) = ( 0.5350646 0.0000000 0.1413782), wk = 0.0070922 k( 95) = ( 0.5350646 0.0000000 0.1211813), wk = 0.0070922 k( 96) = ( 0.5350646 0.0000000 0.1009844), wk = 0.0070922 k( 97) = ( 0.5350646 0.0000000 0.0807876), wk = 0.0070922 k( 98) = ( 0.5350646 0.0000000 0.0605907), wk = 0.0070922 k( 99) = ( 0.5350646 0.0000000 0.0403938), wk = 0.0070922 k( 100) = ( 0.5350646 0.0000000 0.0201969), wk = 0.0070922 k( 101) = ( 0.5350646 0.0000000 0.0000000), wk = 0.0070922 k( 102) = ( 0.5083114 0.0192150 0.0000000), wk = 0.0070922 k( 103) = ( 0.4815581 0.0384301 0.0000000), wk = 0.0070922 k( 104) = ( 0.4548049 0.0576451 0.0000000), wk = 0.0070922 k( 105) = ( 0.4280517 0.0768601 0.0000000), wk = 0.0070922 k( 106) = ( 0.4012984 0.0960752 0.0000000), wk = 0.0070922 k( 107) = ( 0.3745452 0.1152902 0.0000000), wk = 0.0070922 k( 108) = ( 0.3477920 0.1345052 0.0000000), wk = 0.0070922 k( 109) = ( 0.3210388 0.1537203 0.0000000), wk = 0.0070922 k( 110) = ( 0.2942855 0.1729353 0.0000000), wk = 0.0070922 k( 111) = ( 0.2675323 0.1921503 0.0000000), wk = 0.0070922 k( 112) = ( 0.2407791 0.2113654 0.0000000), wk = 0.0070922 k( 113) = ( 0.2140258 0.2305804 0.0000000), wk = 0.0070922 k( 114) = ( 0.1872726 0.2497954 0.0000000), wk = 0.0070922 k( 115) = ( 0.1605194 0.2690104 0.0000000), wk = 0.0070922 k( 116) = ( 0.1337661 0.2882255 0.0000000), wk = 0.0070922 k( 117) = ( 0.1070129 0.3074405 0.0000000), wk = 0.0070922 k( 118) = ( 0.0802597 0.3266555 0.0000000), wk = 0.0070922 k( 119) = ( 0.0535065 0.3458706 0.0000000), wk = 0.0070922 k( 120) = ( 0.0267532 0.3650856 0.0000000), wk = 0.0070922 k( 121) = ( 0.0000000 0.3843006 0.0000000), wk = 0.0070922 k( 122) = ( 0.0000000 0.3650856 0.0201969), wk = 0.0070922 k( 123) = ( 0.0000000 0.3458706 0.0403938), wk = 0.0070922 k( 124) = ( 0.0000000 0.3266555 0.0605907), wk = 0.0070922 k( 125) = ( 0.0000000 0.3074405 0.0807876), wk = 0.0070922 k( 126) = ( 0.0000000 0.2882255 0.1009844), wk = 0.0070922 k( 127) = ( 0.0000000 0.2690104 0.1211813), wk = 0.0070922 k( 128) = ( 0.0000000 0.2497954 0.1413782), wk = 0.0070922 k( 129) = ( 0.0000000 0.2305804 0.1615751), wk = 0.0070922 k( 130) = ( 0.0000000 0.2113654 0.1817720), wk = 0.0070922 k( 131) = ( 0.0000000 0.1921503 0.2019689), wk = 0.0070922 k( 132) = ( 0.0000000 0.1729353 0.2221658), wk = 0.0070922 k( 133) = ( 0.0000000 0.1537203 0.2423627), wk = 0.0070922 k( 134) = ( 0.0000000 0.1345052 0.2625596), wk = 0.0070922 k( 135) = ( 0.0000000 0.1152902 0.2827564), wk = 0.0070922 k( 136) = ( 0.0000000 0.0960752 0.3029533), wk = 0.0070922 k( 137) = ( 0.0000000 0.0768601 0.3231502), wk = 0.0070922 k( 138) = ( 0.0000000 0.0576451 0.3433471), wk = 0.0070922 k( 139) = ( 0.0000000 0.0384301 0.3635440), wk = 0.0070922 k( 140) = ( 0.0000000 0.0192150 0.3837409), wk = 0.0070922 k( 141) = ( 0.0000000 0.0000000 0.4039378), wk = 0.0070922 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0070922 k( 2) = ( 0.0267532 0.0201969 0.0281203), wk = 0.0070922 k( 3) = ( 0.0535065 0.0403938 0.0562405), wk = 0.0070922 k( 4) = ( 0.0802597 0.0605907 0.0843608), wk = 0.0070922 k( 5) = ( 0.1070129 0.0807875 0.1124811), wk = 0.0070922 k( 6) = ( 0.1337661 0.1009844 0.1406013), wk = 0.0070922 k( 7) = ( 0.1605194 0.1211813 0.1687216), wk = 0.0070922 k( 8) = ( 0.1872726 0.1413782 0.1968419), wk = 0.0070922 k( 9) = ( 0.2140258 0.1615751 0.2249621), wk = 0.0070922 k( 10) = ( 0.2407791 0.1817720 0.2530824), wk = 0.0070922 k( 11) = ( 0.2675323 0.2019688 0.2812027), wk = 0.0070922 k( 12) = ( 0.2942855 0.2221657 0.3093229), wk = 0.0070922 k( 13) = ( 0.3210388 0.2423626 0.3374432), wk = 0.0070922 k( 14) = ( 0.3477920 0.2625595 0.3655634), wk = 0.0070922 k( 15) = ( 0.3745452 0.2827564 0.3936837), wk = 0.0070922 k( 16) = ( 0.4012984 0.3029533 0.4218040), wk = 0.0070922 k( 17) = ( 0.4280517 0.3231502 0.4499242), wk = 0.0070922 k( 18) = ( 0.4548049 0.3433470 0.4780445), wk = 0.0070922 k( 19) = ( 0.4815581 0.3635439 0.5061648), wk = 0.0070922 k( 20) = ( 0.5083114 0.3837408 0.5342850), wk = 0.0070922 k( 21) = ( 0.5350646 0.4039377 0.5624053), wk = 0.0070922 k( 22) = ( 0.5350646 0.4039377 0.5342850), wk = 0.0070922 k( 23) = ( 0.5350646 0.4039377 0.5061648), wk = 0.0070922 k( 24) = ( 0.5350646 0.4039377 0.4780445), wk = 0.0070922 k( 25) = ( 0.5350646 0.4039377 0.4499242), wk = 0.0070922 k( 26) = ( 0.5350646 0.4039377 0.4218040), wk = 0.0070922 k( 27) = ( 0.5350646 0.4039377 0.3936837), wk = 0.0070922 k( 28) = ( 0.5350646 0.4039377 0.3655634), wk = 0.0070922 k( 29) = ( 0.5350646 0.4039377 0.3374432), wk = 0.0070922 k( 30) = ( 0.5350646 0.4039377 0.3093229), wk = 0.0070922 k( 31) = ( 0.5350646 0.4039377 0.2812027), wk = 0.0070922 k( 32) = ( 0.5350646 0.4039377 0.2530824), wk = 0.0070922 k( 33) = ( 0.5350646 0.4039377 0.2249621), wk = 0.0070922 k( 34) = ( 0.5350646 0.4039377 0.1968419), wk = 0.0070922 k( 35) = ( 0.5350646 0.4039377 0.1687216), wk = 0.0070922 k( 36) = ( 0.5350646 0.4039377 0.1406013), wk = 0.0070922 k( 37) = ( 0.5350646 0.4039377 0.1124811), wk = 0.0070922 k( 38) = ( 0.5350646 0.4039377 0.0843608), wk = 0.0070922 k( 39) = ( 0.5350646 0.4039377 0.0562405), wk = 0.0070922 k( 40) = ( 0.5350646 0.4039377 0.0281203), wk = 0.0070922 k( 41) = ( 0.5350646 0.4039377 0.0000000), wk = 0.0070922 k( 42) = ( 0.5083114 0.4039377 0.0281203), wk = 0.0070922 k( 43) = ( 0.4815581 0.4039377 0.0562405), wk = 0.0070922 k( 44) = ( 0.4548049 0.4039377 0.0843608), wk = 0.0070922 k( 45) = ( 0.4280517 0.4039377 0.1124811), wk = 0.0070922 k( 46) = ( 0.4012984 0.4039377 0.1406013), wk = 0.0070922 k( 47) = ( 0.3745452 0.4039377 0.1687216), wk = 0.0070922 k( 48) = ( 0.3477920 0.4039377 0.1968419), wk = 0.0070922 k( 49) = ( 0.3210388 0.4039377 0.2249621), wk = 0.0070922 k( 50) = ( 0.2942855 0.4039377 0.2530824), wk = 0.0070922 k( 51) = ( 0.2675323 0.4039377 0.2812027), wk = 0.0070922 k( 52) = ( 0.2407791 0.4039377 0.3093229), wk = 0.0070922 k( 53) = ( 0.2140258 0.4039377 0.3374432), wk = 0.0070922 k( 54) = ( 0.1872726 0.4039377 0.3655634), wk = 0.0070922 k( 55) = ( 0.1605194 0.4039377 0.3936837), wk = 0.0070922 k( 56) = ( 0.1337661 0.4039377 0.4218040), wk = 0.0070922 k( 57) = ( 0.1070129 0.4039377 0.4499242), wk = 0.0070922 k( 58) = ( 0.0802597 0.4039377 0.4780445), wk = 0.0070922 k( 59) = ( 0.0535065 0.4039377 0.5061648), wk = 0.0070922 k( 60) = ( 0.0267532 0.4039377 0.5342850), wk = 0.0070922 k( 61) = ( 0.0000000 0.4039377 0.5624053), wk = 0.0070922 k( 62) = ( 0.0267532 0.3837408 0.5624053), wk = 0.0070922 k( 63) = ( 0.0535065 0.3635439 0.5624053), wk = 0.0070922 k( 64) = ( 0.0802597 0.3433470 0.5624053), wk = 0.0070922 k( 65) = ( 0.1070129 0.3231502 0.5624053), wk = 0.0070922 k( 66) = ( 0.1337661 0.3029533 0.5624053), wk = 0.0070922 k( 67) = ( 0.1605194 0.2827564 0.5624053), wk = 0.0070922 k( 68) = ( 0.1872726 0.2625595 0.5624053), wk = 0.0070922 k( 69) = ( 0.2140258 0.2423626 0.5624053), wk = 0.0070922 k( 70) = ( 0.2407791 0.2221657 0.5624053), wk = 0.0070922 k( 71) = ( 0.2675323 0.2019688 0.5624053), wk = 0.0070922 k( 72) = ( 0.2942855 0.1817720 0.5624053), wk = 0.0070922 k( 73) = ( 0.3210388 0.1615751 0.5624053), wk = 0.0070922 k( 74) = ( 0.3477920 0.1413782 0.5624053), wk = 0.0070922 k( 75) = ( 0.3745452 0.1211813 0.5624053), wk = 0.0070922 k( 76) = ( 0.4012984 0.1009844 0.5624053), wk = 0.0070922 k( 77) = ( 0.4280517 0.0807875 0.5624053), wk = 0.0070922 k( 78) = ( 0.4548049 0.0605907 0.5624053), wk = 0.0070922 k( 79) = ( 0.4815581 0.0403938 0.5624053), wk = 0.0070922 k( 80) = ( 0.5083114 0.0201969 0.5624053), wk = 0.0070922 k( 81) = ( 0.5350646 0.0000000 0.5624053), wk = 0.0070922 k( 82) = ( 0.5350646 0.0000000 0.5342850), wk = 0.0070922 k( 83) = ( 0.5350646 0.0000000 0.5061648), wk = 0.0070922 k( 84) = ( 0.5350646 0.0000000 0.4780445), wk = 0.0070922 k( 85) = ( 0.5350646 0.0000000 0.4499242), wk = 0.0070922 k( 86) = ( 0.5350646 0.0000000 0.4218040), wk = 0.0070922 k( 87) = ( 0.5350646 0.0000000 0.3936837), wk = 0.0070922 k( 88) = ( 0.5350646 0.0000000 0.3655634), wk = 0.0070922 k( 89) = ( 0.5350646 0.0000000 0.3374432), wk = 0.0070922 k( 90) = ( 0.5350646 0.0000000 0.3093229), wk = 0.0070922 k( 91) = ( 0.5350646 0.0000000 0.2812027), wk = 0.0070922 k( 92) = ( 0.5350646 0.0000000 0.2530824), wk = 0.0070922 k( 93) = ( 0.5350646 0.0000000 0.2249621), wk = 0.0070922 k( 94) = ( 0.5350646 0.0000000 0.1968419), wk = 0.0070922 k( 95) = ( 0.5350646 0.0000000 0.1687216), wk = 0.0070922 k( 96) = ( 0.5350646 0.0000000 0.1406013), wk = 0.0070922 k( 97) = ( 0.5350646 0.0000000 0.1124811), wk = 0.0070922 k( 98) = ( 0.5350646 0.0000000 0.0843608), wk = 0.0070922 k( 99) = ( 0.5350646 0.0000000 0.0562405), wk = 0.0070922 k( 100) = ( 0.5350646 0.0000000 0.0281203), wk = 0.0070922 k( 101) = ( 0.5350646 0.0000000 0.0000000), wk = 0.0070922 k( 102) = ( 0.5083114 0.0201969 0.0000000), wk = 0.0070922 k( 103) = ( 0.4815581 0.0403938 0.0000000), wk = 0.0070922 k( 104) = ( 0.4548049 0.0605907 0.0000000), wk = 0.0070922 k( 105) = ( 0.4280517 0.0807875 0.0000000), wk = 0.0070922 k( 106) = ( 0.4012984 0.1009844 0.0000000), wk = 0.0070922 k( 107) = ( 0.3745452 0.1211813 0.0000000), wk = 0.0070922 k( 108) = ( 0.3477920 0.1413782 0.0000000), wk = 0.0070922 k( 109) = ( 0.3210388 0.1615751 0.0000000), wk = 0.0070922 k( 110) = ( 0.2942855 0.1817720 0.0000000), wk = 0.0070922 k( 111) = ( 0.2675323 0.2019688 0.0000000), wk = 0.0070922 k( 112) = ( 0.2407791 0.2221657 0.0000000), wk = 0.0070922 k( 113) = ( 0.2140258 0.2423626 0.0000000), wk = 0.0070922 k( 114) = ( 0.1872726 0.2625595 0.0000000), wk = 0.0070922 k( 115) = ( 0.1605194 0.2827564 0.0000000), wk = 0.0070922 k( 116) = ( 0.1337661 0.3029533 0.0000000), wk = 0.0070922 k( 117) = ( 0.1070129 0.3231502 0.0000000), wk = 0.0070922 k( 118) = ( 0.0802597 0.3433470 0.0000000), wk = 0.0070922 k( 119) = ( 0.0535065 0.3635439 0.0000000), wk = 0.0070922 k( 120) = ( 0.0267532 0.3837408 0.0000000), wk = 0.0070922 k( 121) = ( 0.0000000 0.4039377 0.0000000), wk = 0.0070922 k( 122) = ( 0.0000000 0.3837408 0.0281203), wk = 0.0070922 k( 123) = ( 0.0000000 0.3635439 0.0562405), wk = 0.0070922 k( 124) = ( 0.0000000 0.3433470 0.0843608), wk = 0.0070922 k( 125) = ( 0.0000000 0.3231502 0.1124811), wk = 0.0070922 k( 126) = ( 0.0000000 0.3029533 0.1406013), wk = 0.0070922 k( 127) = ( 0.0000000 0.2827564 0.1687216), wk = 0.0070922 k( 128) = ( 0.0000000 0.2625595 0.1968419), wk = 0.0070922 k( 129) = ( 0.0000000 0.2423626 0.2249621), wk = 0.0070922 k( 130) = ( 0.0000000 0.2221657 0.2530824), wk = 0.0070922 k( 131) = ( 0.0000000 0.2019688 0.2812027), wk = 0.0070922 k( 132) = ( 0.0000000 0.1817720 0.3093229), wk = 0.0070922 k( 133) = ( 0.0000000 0.1615751 0.3374432), wk = 0.0070922 k( 134) = ( 0.0000000 0.1413782 0.3655634), wk = 0.0070922 k( 135) = ( 0.0000000 0.1211813 0.3936837), wk = 0.0070922 k( 136) = ( 0.0000000 0.1009844 0.4218040), wk = 0.0070922 k( 137) = ( 0.0000000 0.0807875 0.4499242), wk = 0.0070922 k( 138) = ( 0.0000000 0.0605907 0.4780445), wk = 0.0070922 k( 139) = ( 0.0000000 0.0403938 0.5061648), wk = 0.0070922 k( 140) = ( 0.0000000 0.0201969 0.5342850), wk = 0.0070922 k( 141) = ( 0.0000000 0.0000000 0.5624053), wk = 0.0070922 Dense grid: 1031615 G-vectors FFT dimensions: ( 120, 120, 160) Smooth grid: 198681 G-vectors FFT dimensions: ( 64, 72, 90) Dynamical RAM for wfc: 0.06 MB Dynamical RAM for wfc (w. buffer): 0.06 MB Dynamical RAM for str. fact: 0.12 MB Dynamical RAM for local pot: 0.00 MB Dynamical RAM for nlocal pot: 0.28 MB Dynamical RAM for qrad: 18.98 MB Dynamical RAM for rho,v,vnew: 0.90 MB Dynamical RAM for G-vectors: 0.15 MB Dynamical RAM for h,s,v(r/c): 0.66 MB Dynamical RAM for : 0.27 MB Dynamical RAM for psi: 0.11 MB Dynamical RAM for hpsi: 0.11 MB Dynamical RAM for spsi: 0.11 MB Dynamical RAM for wfcinit/wfcrot: 1.62 MB Dynamical RAM for addusdens: 22.37 MB Estimated static dynamical RAM per process > 21.29 MB Estimated max dynamical RAM per process > 43.66 MB Estimated total dynamical RAM > 17.06 GB Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Message from routine sym_rho_init: some processors have no G-vectors for symmetrization Check: negative core charge= -0.000006 Generating pointlists ... new r_m : 0.1815 (alat units) 1.9162 (a.u.) for type 1 new r_m : 0.1443 (alat units) 1.5229 (a.u.) for type 2 new r_m : 0.1443 (alat units) 1.5229 (a.u.) for type 3 The potential is recalculated from file : /lfs/usrhome/phd/ph19d005/ss/lamno_trail/bands/aiida.save/charge-density negative rho (up, down): 0.000E+00 1.628E-04 Starting wfcs are 228 randomized atomic wfcs Checking if some PAW data can be deallocated... PAW data deallocated on 320 nodes for type: 1 PAW data deallocated on 160 nodes for type: 3 Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 245.4 secs Computing kpt #: 2 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 267.5 secs Computing kpt #: 3 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 289.5 secs Computing kpt #: 4 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 311.4 secs Computing kpt #: 5 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 333.0 secs Computing kpt #: 6 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 355.0 secs Computing kpt #: 7 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 377.2 secs Computing kpt #: 8 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 399.3 secs Computing kpt #: 9 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 421.6 secs Computing kpt #: 10 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 443.5 secs Computing kpt #: 11 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 465.3 secs Computing kpt #: 12 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 487.3 secs Computing kpt #: 13 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 509.6 secs Computing kpt #: 14 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 531.5 secs Computing kpt #: 15 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 553.3 secs Computing kpt #: 16 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 574.8 secs Computing kpt #: 17 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 596.5 secs Computing kpt #: 18 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 618.3 secs Computing kpt #: 19 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 639.9 secs Computing kpt #: 20 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 662.1 secs Computing kpt #: 21 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 683.5 secs Computing kpt #: 22 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 704.7 secs Computing kpt #: 23 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 725.9 secs Computing kpt #: 24 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 747.5 secs Computing kpt #: 25 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 769.3 secs Computing kpt #: 26 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 790.7 secs Computing kpt #: 27 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 812.1 secs Computing kpt #: 28 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 833.4 secs Computing kpt #: 29 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 854.7 secs Computing kpt #: 30 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 876.1 secs Computing kpt #: 31 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 898.1 secs Computing kpt #: 32 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 919.9 secs Computing kpt #: 33 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 941.4 secs Computing kpt #: 34 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 963.0 secs Computing kpt #: 35 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 984.5 secs Computing kpt #: 36 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1006.4 secs Computing kpt #: 37 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1027.9 secs Computing kpt #: 38 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1049.5 secs Computing kpt #: 39 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1071.0 secs Computing kpt #: 40 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1092.2 secs Computing kpt #: 41 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1113.2 secs Computing kpt #: 42 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1135.1 secs Computing kpt #: 43 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 1156.7 secs Computing kpt #: 44 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1178.0 secs Computing kpt #: 45 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1199.5 secs Computing kpt #: 46 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1221.0 secs Computing kpt #: 47 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1242.8 secs Computing kpt #: 48 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1265.0 secs Computing kpt #: 49 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1286.6 secs Computing kpt #: 50 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1308.2 secs Computing kpt #: 51 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1329.7 secs Computing kpt #: 52 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1351.6 secs Computing kpt #: 53 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1373.6 secs Computing kpt #: 54 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1396.1 secs Computing kpt #: 55 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1417.9 secs Computing kpt #: 56 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1440.0 secs Computing kpt #: 57 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1461.7 secs Computing kpt #: 58 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1483.8 secs Computing kpt #: 59 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 1506.4 secs Computing kpt #: 60 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1528.3 secs Computing kpt #: 61 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1550.4 secs Computing kpt #: 62 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1572.0 secs Computing kpt #: 63 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1594.3 secs Computing kpt #: 64 of 282 c_bands: 12 eigenvalues not converged total cpu time spent up to now is 1617.0 secs Computing kpt #: 65 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1638.9 secs Computing kpt #: 66 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1660.9 secs Computing kpt #: 67 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1682.6 secs Computing kpt #: 68 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1704.7 secs Computing kpt #: 69 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1726.7 secs Computing kpt #: 70 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1749.1 secs Computing kpt #: 71 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1771.1 secs Computing kpt #: 72 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1792.8 secs Computing kpt #: 73 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1814.4 secs Computing kpt #: 74 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1836.2 secs Computing kpt #: 75 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 1858.7 secs Computing kpt #: 76 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 1880.7 secs Computing kpt #: 77 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 1902.7 secs Computing kpt #: 78 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1925.0 secs Computing kpt #: 79 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 1946.9 secs Computing kpt #: 80 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 1968.9 secs Computing kpt #: 81 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 1991.4 secs Computing kpt #: 82 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2013.4 secs Computing kpt #: 83 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2035.3 secs Computing kpt #: 84 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2057.5 secs Computing kpt #: 85 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2079.5 secs Computing kpt #: 86 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2102.1 secs Computing kpt #: 87 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 2124.1 secs Computing kpt #: 88 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2145.7 secs Computing kpt #: 89 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2167.7 secs Computing kpt #: 90 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2189.8 secs Computing kpt #: 91 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 2211.9 secs Computing kpt #: 92 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2234.6 secs Computing kpt #: 93 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2256.4 secs Computing kpt #: 94 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2278.4 secs Computing kpt #: 95 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2300.1 secs Computing kpt #: 96 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2322.2 secs Computing kpt #: 97 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2344.4 secs Computing kpt #: 98 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2366.7 secs Computing kpt #: 99 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2388.5 secs Computing kpt #: 100 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2410.3 secs Computing kpt #: 101 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2431.9 secs Computing kpt #: 102 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2454.0 secs Computing kpt #: 103 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2476.7 secs Computing kpt #: 104 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2498.5 secs Computing kpt #: 105 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2520.7 secs Computing kpt #: 106 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2542.6 secs Computing kpt #: 107 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2564.3 secs Computing kpt #: 108 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2586.6 secs Computing kpt #: 109 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2608.2 secs Computing kpt #: 110 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2630.0 secs Computing kpt #: 111 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2651.8 secs Computing kpt #: 112 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 2673.7 secs Computing kpt #: 113 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 2695.0 secs Computing kpt #: 114 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 2717.0 secs Computing kpt #: 115 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2738.4 secs Computing kpt #: 116 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2760.3 secs Computing kpt #: 117 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2782.2 secs Computing kpt #: 118 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2803.7 secs Computing kpt #: 119 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2826.5 secs Computing kpt #: 120 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2848.8 secs Computing kpt #: 121 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 2872.4 secs Computing kpt #: 122 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2894.0 secs Computing kpt #: 123 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2915.7 secs Computing kpt #: 124 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 2937.8 secs Computing kpt #: 125 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 2960.1 secs Computing kpt #: 126 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 2982.0 secs Computing kpt #: 127 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3003.9 secs Computing kpt #: 128 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3025.6 secs Computing kpt #: 129 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3047.4 secs Computing kpt #: 130 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3069.9 secs Computing kpt #: 131 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 3092.2 secs Computing kpt #: 132 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3114.2 secs Computing kpt #: 133 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3136.6 secs Computing kpt #: 134 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3158.7 secs Computing kpt #: 135 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3180.9 secs Computing kpt #: 136 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3203.1 secs Computing kpt #: 137 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3225.1 secs Computing kpt #: 138 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3247.2 secs Computing kpt #: 139 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3269.2 secs Computing kpt #: 140 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3291.6 secs Computing kpt #: 141 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3313.8 secs Computing kpt #: 142 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3335.5 secs Computing kpt #: 143 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3356.8 secs Computing kpt #: 144 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3378.2 secs Computing kpt #: 145 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3399.7 secs Computing kpt #: 146 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3421.3 secs Computing kpt #: 147 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3443.8 secs Computing kpt #: 148 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3465.6 secs Computing kpt #: 149 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3487.2 secs Computing kpt #: 150 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3508.6 secs Computing kpt #: 151 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 3530.0 secs Computing kpt #: 152 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3551.8 secs Computing kpt #: 153 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3573.4 secs Computing kpt #: 154 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3594.9 secs Computing kpt #: 155 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 3616.3 secs Computing kpt #: 156 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3638.0 secs Computing kpt #: 157 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3659.3 secs Computing kpt #: 158 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 3681.2 secs Computing kpt #: 159 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 3702.6 secs Computing kpt #: 160 of 282 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 3723.8 secs Computing kpt #: 161 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 3745.0 secs Computing kpt #: 162 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3766.7 secs Computing kpt #: 163 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 3788.1 secs Computing kpt #: 164 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 3809.5 secs Computing kpt #: 165 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 3830.8 secs Computing kpt #: 166 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3852.2 secs Computing kpt #: 167 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3873.7 secs Computing kpt #: 168 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3895.6 secs Computing kpt #: 169 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3917.9 secs Computing kpt #: 170 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3939.5 secs Computing kpt #: 171 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3960.6 secs Computing kpt #: 172 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 3981.7 secs Computing kpt #: 173 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 4002.9 secs Computing kpt #: 174 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 4024.2 secs Computing kpt #: 175 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 4045.5 secs Computing kpt #: 176 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 4067.1 secs Computing kpt #: 177 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4088.3 secs Computing kpt #: 178 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 4109.5 secs Computing kpt #: 179 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4130.6 secs Computing kpt #: 180 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 4151.9 secs Computing kpt #: 181 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 4173.9 secs Computing kpt #: 182 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4194.9 secs Computing kpt #: 183 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4216.4 secs Computing kpt #: 184 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 4237.8 secs Computing kpt #: 185 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4259.2 secs Computing kpt #: 186 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4280.8 secs Computing kpt #: 187 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 4302.0 secs Computing kpt #: 188 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4323.3 secs Computing kpt #: 189 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4344.7 secs Computing kpt #: 190 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4365.9 secs Computing kpt #: 191 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4387.5 secs Computing kpt #: 192 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4409.8 secs Computing kpt #: 193 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4431.4 secs Computing kpt #: 194 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 4452.9 secs Computing kpt #: 195 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4474.1 secs Computing kpt #: 196 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4495.6 secs Computing kpt #: 197 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4517.3 secs Computing kpt #: 198 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4539.5 secs Computing kpt #: 199 of 282 c_bands: 12 eigenvalues not converged total cpu time spent up to now is 4561.2 secs Computing kpt #: 200 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4582.8 secs Computing kpt #: 201 of 282 c_bands: 12 eigenvalues not converged total cpu time spent up to now is 4604.3 secs Computing kpt #: 202 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4625.8 secs Computing kpt #: 203 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 4647.9 secs Computing kpt #: 204 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 4669.8 secs Computing kpt #: 205 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 4691.5 secs Computing kpt #: 206 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4712.9 secs Computing kpt #: 207 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4734.2 secs Computing kpt #: 208 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4756.0 secs Computing kpt #: 209 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4777.6 secs Computing kpt #: 210 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4799.3 secs Computing kpt #: 211 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 4820.4 secs Computing kpt #: 212 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4841.8 secs Computing kpt #: 213 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 4863.2 secs Computing kpt #: 214 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4885.0 secs Computing kpt #: 215 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 4907.1 secs Computing kpt #: 216 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 4928.6 secs Computing kpt #: 217 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 4950.0 secs Computing kpt #: 218 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 4971.3 secs Computing kpt #: 219 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 4993.1 secs Computing kpt #: 220 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 5014.8 secs Computing kpt #: 221 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 5036.7 secs Computing kpt #: 222 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5058.0 secs Computing kpt #: 223 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5079.4 secs Computing kpt #: 224 of 282 c_bands: 12 eigenvalues not converged total cpu time spent up to now is 5100.8 secs Computing kpt #: 225 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 5122.4 secs Computing kpt #: 226 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5144.1 secs Computing kpt #: 227 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5165.2 secs Computing kpt #: 228 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 5186.2 secs Computing kpt #: 229 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5207.7 secs Computing kpt #: 230 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 5229.1 secs Computing kpt #: 231 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 5250.6 secs Computing kpt #: 232 of 282 c_bands: 11 eigenvalues not converged total cpu time spent up to now is 5272.6 secs Computing kpt #: 233 of 282 c_bands: 12 eigenvalues not converged total cpu time spent up to now is 5293.8 secs Computing kpt #: 234 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 5315.2 secs Computing kpt #: 235 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5336.4 secs Computing kpt #: 236 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5357.8 secs Computing kpt #: 237 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5379.5 secs Computing kpt #: 238 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5401.0 secs Computing kpt #: 239 of 282 c_bands: 12 eigenvalues not converged total cpu time spent up to now is 5422.4 secs Computing kpt #: 240 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5443.7 secs Computing kpt #: 241 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5465.2 secs Computing kpt #: 242 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5486.7 secs Computing kpt #: 243 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5508.5 secs Computing kpt #: 244 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5529.8 secs Computing kpt #: 245 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5550.8 secs Computing kpt #: 246 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 5572.6 secs Computing kpt #: 247 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 5593.9 secs Computing kpt #: 248 of 282 c_bands: 8 eigenvalues not converged total cpu time spent up to now is 5615.9 secs Computing kpt #: 249 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 5637.6 secs Computing kpt #: 250 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 5658.9 secs Computing kpt #: 251 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 5679.9 secs Computing kpt #: 252 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5700.9 secs Computing kpt #: 253 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 5722.0 secs Computing kpt #: 254 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5743.5 secs Computing kpt #: 255 of 282 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 5765.1 secs Computing kpt #: 256 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 5786.2 secs Computing kpt #: 257 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5807.8 secs Computing kpt #: 258 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5829.0 secs Computing kpt #: 259 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5850.5 secs Computing kpt #: 260 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 5871.8 secs Computing kpt #: 261 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5893.3 secs Computing kpt #: 262 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 5914.1 secs Computing kpt #: 263 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 5935.6 secs Computing kpt #: 264 of 282 c_bands: 5 eigenvalues not converged total cpu time spent up to now is 5956.7 secs Computing kpt #: 265 of 282 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 5977.8 secs Computing kpt #: 266 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 5999.4 secs Computing kpt #: 267 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 6020.7 secs Computing kpt #: 268 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 6042.2 secs Computing kpt #: 269 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 6063.3 secs Computing kpt #: 270 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 6084.5 secs Computing kpt #: 271 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 6106.2 secs Computing kpt #: 272 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 6127.6 secs Computing kpt #: 273 of 282 c_bands: 6 eigenvalues not converged total cpu time spent up to now is 6149.1 secs Computing kpt #: 274 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 6170.1 secs Computing kpt #: 275 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 6191.9 secs Computing kpt #: 276 of 282 c_bands: 7 eigenvalues not converged total cpu time spent up to now is 6213.6 secs Computing kpt #: 277 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 6235.9 secs Computing kpt #: 278 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 6257.4 secs Computing kpt #: 279 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 6279.1 secs Computing kpt #: 280 of 282 c_bands: 9 eigenvalues not converged total cpu time spent up to now is 6300.9 secs Computing kpt #: 281 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 6322.6 secs Computing kpt #: 282 of 282 c_bands: 10 eigenvalues not converged total cpu time spent up to now is 6344.9 secs ethr = 2.27E-12, avg # of iterations =120.0 total cpu time spent up to now is 6345.0 secs End of band structure calculation ------ SPIN UP ------------ k = 0.0000 0.0000 0.0000 ( 24815 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2849 -38.2843 -38.2842 -38.2836 -38.2624 -38.2619 -38.2586 -38.2581 -38.1767 -38.1763 -38.1756 -38.1753 -19.6704 -19.6104 -19.5739 -19.5302 -7.0873 -6.6711 -6.6478 -6.6184 -6.6090 -6.1618 -5.9585 -5.8302 -5.8211 -5.7967 -5.7568 -5.7145 -3.4405 -3.4119 -3.3946 -3.3573 -3.1532 -3.1132 -3.0803 -2.9002 -2.8088 -2.4417 -2.2581 -2.2558 5.2354 5.6337 5.7306 6.1466 6.2161 6.4146 6.5057 6.8486 6.9955 7.0458 7.1632 7.1828 7.3021 7.3958 7.4202 7.4720 k = 0.0268 0.0192 0.0202 ( 24790 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2849 -38.2843 -38.2842 -38.2836 -38.2624 -38.2619 -38.2586 -38.2581 -38.1767 -38.1763 -38.1756 -38.1753 -19.6700 -19.6103 -19.5740 -19.5305 -7.0838 -6.6954 -6.6538 -6.6061 -6.5925 -6.1641 -5.9565 -5.8494 -5.8094 -5.8052 -5.7569 -5.7074 -3.4404 -3.4118 -3.3946 -3.3502 -3.1483 -3.1140 -3.0755 -2.8990 -2.8082 -2.4432 -2.2654 -2.2534 5.2402 5.6356 5.7342 6.1533 6.2181 6.4155 6.5068 6.8461 6.9949 7.0437 7.1649 7.1794 7.3019 7.3887 7.4187 7.4551 k = 0.0535 0.0384 0.0404 ( 24784 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2849 -38.2843 -38.2842 -38.2836 -38.2624 -38.2618 -38.2586 -38.2582 -38.1767 -38.1763 -38.1756 -38.1753 -19.6688 -19.6100 -19.5745 -19.5314 -7.0732 -6.7347 -6.6677 -6.5970 -6.5529 -6.1699 -5.9526 -5.8767 -5.8283 -5.8018 -5.7544 -5.6928 -3.4423 -3.4098 -3.3912 -3.3319 -3.1350 -3.1160 -3.0605 -2.8957 -2.8064 -2.4477 -2.2782 -2.2547 5.2544 5.6412 5.7445 6.1731 6.2242 6.4183 6.5101 6.8384 6.9921 7.0383 7.1584 7.1787 7.3012 7.3692 7.4110 7.4165 k = 0.0803 0.0576 0.0606 ( 24774 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2849 -38.2843 -38.2842 -38.2836 -38.2623 -38.2618 -38.2586 -38.2582 -38.1766 -38.1763 -38.1756 -38.1753 -19.6669 -19.6095 -19.5752 -19.5328 -7.0559 -6.7748 -6.6875 -6.5861 -6.5125 -6.1769 -5.9540 -5.9047 -5.8559 -5.8010 -5.7497 -5.6773 -3.4484 -3.4042 -3.3812 -3.3073 -3.1181 -3.1141 -3.0354 -2.8913 -2.8032 -2.4552 -2.2953 -2.2600 5.2775 5.6504 5.7608 6.2054 6.2337 6.4227 6.5160 6.8255 6.9829 7.0307 7.1365 7.1833 7.2980 7.3409 7.3647 7.4042 k = 0.1070 0.0769 0.0808 ( 24780 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2849 -38.2843 -38.2842 -38.2836 -38.2623 -38.2618 -38.2587 -38.2583 -38.1766 -38.1763 -38.1756 -38.1753 -19.6642 -19.6089 -19.5761 -19.5349 -7.0324 -6.8135 -6.7121 -6.5753 -6.4736 -6.1828 -5.9713 -5.9344 -5.8739 -5.8033 -5.7450 -5.6638 -3.4560 -3.3947 -3.3676 -3.2821 -3.1126 -3.0891 -3.0025 -2.8866 -2.7987 -2.4654 -2.3159 -2.2681 5.3086 5.6630 5.7817 6.2452 6.2495 6.4283 6.5248 6.8078 6.9591 7.0215 7.1094 7.1801 7.2811 7.3154 7.3252 7.3909 k = 0.1338 0.0961 0.1010 ( 24794 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2843 -38.2842 -38.2836 -38.2622 -38.2617 -38.2587 -38.2583 -38.1766 -38.1763 -38.1756 -38.1753 -19.6609 -19.6082 -19.5773 -19.5374 -7.0032 -6.8500 -6.7406 -6.5673 -6.4367 -6.1857 -6.0010 -5.9740 -5.8747 -5.8059 -5.7407 -5.6537 -3.4621 -3.3818 -3.3548 -3.2631 -3.0949 -3.0568 -2.9671 -2.8806 -2.7935 -2.4776 -2.3393 -2.2778 5.3465 5.6787 5.8055 6.2594 6.3019 6.4344 6.5364 6.7877 6.9123 7.0096 7.0827 7.1663 7.2438 7.2873 7.3160 7.3764 k = 0.1605 0.1153 0.1212 ( 24809 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2843 -38.2842 -38.2837 -38.2621 -38.2617 -38.2588 -38.2584 -38.1766 -38.1763 -38.1757 -38.1754 -19.6570 -19.6073 -19.5787 -19.5405 -6.9695 -6.8837 -6.7720 -6.5650 -6.4018 -6.1861 -6.0345 -6.0174 -5.8689 -5.8071 -5.7368 -5.6479 -3.4647 -3.3664 -3.3460 -3.2535 -3.0612 -3.0181 -2.9392 -2.8664 -2.7893 -2.4906 -2.3645 -2.2877 5.3896 5.6970 5.8304 6.2737 6.3607 6.4400 6.5498 6.7688 6.8445 6.9920 7.0547 7.1534 7.2025 7.2589 7.3082 7.3645 k = 0.1873 0.1345 0.1414 ( 24811 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2843 -38.2842 -38.2837 -38.2620 -38.2616 -38.2589 -38.2585 -38.1765 -38.1762 -38.1757 -38.1754 -19.6525 -19.6063 -19.5801 -19.5439 -6.9332 -6.9136 -6.8047 -6.5714 -6.3685 -6.1884 -6.0714 -6.0503 -5.8627 -5.8054 -5.7330 -5.6469 -3.4630 -3.3524 -3.3402 -3.2495 -3.0156 -2.9771 -2.9269 -2.8348 -2.7884 -2.5028 -2.3901 -2.2969 5.4364 5.7176 5.8544 6.2878 6.4130 6.4519 6.5626 6.7559 6.7651 6.9613 7.0324 7.1491 7.1628 7.2264 7.2870 7.3593 k = 0.2140 0.1537 0.1616 ( 24812 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2842 -38.2837 -38.2619 -38.2615 -38.2590 -38.2587 -38.1765 -38.1762 -38.1757 -38.1755 -19.6477 -19.6053 -19.5816 -19.5478 -6.9420 -6.8943 -6.8368 -6.5874 -6.3387 -6.2007 -6.1045 -6.0645 -5.8577 -5.8008 -5.7293 -5.6506 -3.4568 -3.3514 -3.3261 -3.2461 -2.9694 -2.9522 -2.9042 -2.7952 -2.7900 -2.5135 -2.4136 -2.3051 5.4850 5.7396 5.8758 6.3017 6.4214 6.5000 6.5707 6.6809 6.7553 6.9189 7.0235 7.1247 7.1493 7.1910 7.2549 7.3598 k = 0.2408 0.1729 0.1818 ( 24829 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2842 -38.2838 -38.2617 -38.2614 -38.2591 -38.2588 -38.1764 -38.1762 -38.1758 -38.1755 -19.6424 -19.6043 -19.5831 -19.5520 -6.9652 -6.8763 -6.8498 -6.6126 -6.3200 -6.2200 -6.1252 -6.0609 -5.8531 -5.7941 -5.7260 -5.6589 -3.4461 -3.3575 -3.3080 -3.2411 -2.9701 -2.9140 -2.8565 -2.8013 -2.7466 -2.5246 -2.4306 -2.3121 5.5339 5.7623 5.8932 6.3156 6.4065 6.5518 6.5715 6.6036 6.7681 6.8775 7.0190 7.0921 7.1303 7.1765 7.2199 7.3622 k = 0.2675 0.1922 0.2020 ( 24832 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2843 -38.2842 -38.2838 -38.2616 -38.2613 -38.2592 -38.2589 -38.1764 -38.1762 -38.1758 -38.1756 -19.6370 -19.6033 -19.5845 -19.5565 -6.9845 -6.9024 -6.8219 -6.6451 -6.3237 -6.2302 -6.1289 -6.0463 -5.8480 -5.7864 -5.7238 -5.6711 -3.4316 -3.3642 -3.2906 -3.2342 -2.9889 -2.8873 -2.8088 -2.7949 -2.7011 -2.5400 -2.4364 -2.3180 5.5816 5.7847 5.9061 6.3300 6.3752 6.5348 6.5585 6.6016 6.7951 6.8443 6.9973 7.0750 7.0953 7.1858 7.1889 7.3617 k = 0.2943 0.2114 0.2222 ( 24828 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2843 -38.2842 -38.2839 -38.2615 -38.2612 -38.2593 -38.2591 -38.1763 -38.1761 -38.1758 -38.1756 -19.6313 -19.6023 -19.5858 -19.5611 -6.9996 -6.9287 -6.8014 -6.6831 -6.3402 -6.2347 -6.1122 -6.0274 -5.8412 -5.7787 -5.7238 -5.6856 -3.4139 -3.3683 -3.2755 -3.2253 -3.0118 -2.8965 -2.7823 -2.7447 -2.6567 -2.5603 -2.4308 -2.3229 5.6271 5.8058 5.9146 6.3172 6.3520 6.4997 6.5423 6.6217 6.8117 6.8377 6.9542 7.0548 7.0812 7.1639 7.2012 7.3598 k = 0.3210 0.2306 0.2424 ( 24827 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2843 -38.2842 -38.2839 -38.2613 -38.2611 -38.2595 -38.2592 -38.1763 -38.1761 -38.1758 -38.1757 -19.6257 -19.6015 -19.5869 -19.5659 -7.0104 -6.9512 -6.7968 -6.7244 -6.3496 -6.2406 -6.0815 -6.0084 -5.8323 -5.7718 -5.7282 -5.6990 -3.3940 -3.3678 -3.2635 -3.2156 -3.0354 -2.9249 -2.7554 -2.6941 -2.6145 -2.5801 -2.4179 -2.3270 5.6698 5.8244 5.9197 6.2513 6.3713 6.4874 6.5261 6.6243 6.7875 6.8537 6.9242 7.0274 7.0765 7.1498 7.2086 7.3687 k = 0.3478 0.2498 0.2626 ( 24820 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2842 -38.2842 -38.2840 -38.2611 -38.2609 -38.2596 -38.2594 -38.1762 -38.1761 -38.1759 -38.1757 -19.6201 -19.6008 -19.5878 -19.5706 -7.0165 -6.9690 -6.8106 -6.7672 -6.3437 -6.2457 -6.0464 -5.9916 -5.8211 -5.7670 -5.7382 -5.7075 -3.3733 -3.3613 -3.2546 -3.2076 -3.0564 -2.9585 -2.7364 -2.6622 -2.5900 -2.5695 -2.4015 -2.3305 5.7097 5.8395 5.9233 6.1810 6.3959 6.4893 6.5148 6.6164 6.7577 6.8129 6.9335 7.0131 7.0618 7.1435 7.2065 7.3692 k = 0.3745 0.2690 0.2828 ( 24816 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2842 -38.2842 -38.2840 -38.2610 -38.2608 -38.2597 -38.2596 -38.1762 -38.1761 -38.1759 -38.1758 -19.6147 -19.6002 -19.5885 -19.5754 -7.0180 -6.9816 -6.8393 -6.8107 -6.3239 -6.2476 -6.0139 -5.9783 -5.8080 -5.7682 -5.7456 -5.7127 -3.3543 -3.3470 -3.2487 -3.2052 -3.0704 -2.9916 -2.7276 -2.6694 -2.5600 -2.5325 -2.3845 -2.3336 5.7469 5.8499 5.9269 6.1137 6.4240 6.4975 6.5133 6.6053 6.7232 6.7578 6.9149 7.0092 7.0522 7.1415 7.2015 7.3034 k = 0.4013 0.2882 0.3030 ( 24828 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2608 -38.2606 -38.2599 -38.2597 -38.1761 -38.1760 -38.1759 -38.1758 -19.6095 -19.5997 -19.5891 -19.5800 -7.0147 -6.9884 -6.8758 -6.8550 -6.2959 -6.2457 -5.9899 -5.9698 -5.7942 -5.7732 -5.7446 -5.7175 -3.3364 -3.3273 -3.2458 -3.2117 -3.0742 -3.0201 -2.7285 -2.6935 -2.5193 -2.4984 -2.3690 -2.3365 5.7817 5.8556 5.9310 6.0524 6.4538 6.5034 6.5278 6.5965 6.6862 6.7043 6.8739 6.9559 7.0814 7.1422 7.1971 7.2511 k = 0.4281 0.3074 0.3232 ( 24844 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2841 -38.2606 -38.2605 -38.2600 -38.2599 -38.1761 -38.1760 -38.1759 -38.1758 -19.6048 -19.5992 -19.5895 -19.5843 -7.0067 -6.9895 -6.9143 -6.8995 -6.2654 -6.2396 -5.9781 -5.9676 -5.7811 -5.7708 -5.7407 -5.7229 -3.3163 -3.3080 -3.2461 -3.2256 -3.0687 -3.0405 -2.7374 -2.7208 -2.4811 -2.4692 -2.3562 -2.3395 5.8142 5.8578 5.9342 5.9990 6.4834 6.5100 6.5514 6.5919 6.6499 6.6575 6.8266 6.8800 7.1135 7.1456 7.1929 7.2178 k = 0.4548 0.3267 0.3433 ( 24827 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2841 -38.2605 -38.2603 -38.2602 -38.2601 -38.1761 -38.1760 -38.1759 -38.1759 -19.6007 -19.5988 -19.5899 -19.5881 -6.9941 -6.9848 -6.9512 -6.9425 -6.2373 -6.2297 -5.9769 -5.9732 -5.7666 -5.7614 -5.7361 -5.7287 -3.2954 -3.2912 -3.2498 -3.2424 -3.0579 -3.0498 -2.7524 -2.7477 -2.4497 -2.4459 -2.3470 -2.3419 5.8423 5.8577 5.9348 5.9555 6.5099 6.5185 6.5714 6.5847 6.6209 6.6263 6.7827 6.8026 7.1406 7.1513 7.1892 7.1975 k = 0.4816 0.3459 0.3635 ( 24848 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2842 -38.2604 -38.2603 -38.2602 -38.2602 -38.1760 -38.1760 -38.1759 -38.1759 -19.5984 -19.5981 -19.5905 -19.5902 -6.9892 -6.9867 -6.9727 -6.9702 -6.2167 -6.2158 -5.9836 -5.9830 -5.7523 -5.7511 -5.7327 -5.7314 -3.2786 -3.2776 -3.2566 -3.2553 -3.0468 -3.0459 -2.7717 -2.7712 -2.4293 -2.4288 -2.3419 -2.3413 5.8557 5.8577 5.9299 5.9325 6.5190 6.5199 6.5716 6.5733 6.6123 6.6132 6.7520 6.7546 7.1584 7.1601 7.1853 7.1868 k = 0.5083 0.3651 0.3837 ( 24846 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2841 -38.2605 -38.2604 -38.2601 -38.2600 -38.1761 -38.1760 -38.1759 -38.1759 -19.5987 -19.5982 -19.5903 -19.5898 -7.0201 -7.0187 -6.9545 -6.9532 -6.2044 -6.2022 -5.9941 -5.9926 -5.7485 -5.7459 -5.7274 -5.7244 -3.2761 -3.2738 -3.2577 -3.2547 -3.0352 -3.0330 -2.7916 -2.7903 -2.4218 -2.4207 -2.3385 -2.3371 5.8469 5.8506 5.9294 5.9343 6.4983 6.4994 6.5531 6.5578 6.6174 6.6176 6.7535 6.7586 7.1616 7.1656 7.1856 7.1889 k = 0.5351 0.3843 0.4039 ( 24835 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2607 -38.2606 -38.2600 -38.2598 -38.1761 -38.1760 -38.1759 -38.1759 -19.6010 -19.5985 -19.5899 -19.5874 -7.0504 -7.0451 -6.9318 -6.9272 -6.2046 -6.1888 -6.0073 -5.9960 -5.7546 -5.7426 -5.7253 -5.7113 -3.2832 -3.2762 -3.2557 -3.2440 -3.0274 -3.0123 -2.8110 -2.8012 -2.4279 -2.4213 -2.3372 -2.3291 5.8236 5.8401 5.9299 5.9535 6.4665 6.4723 6.5014 6.5223 6.6489 6.6514 6.7762 6.8014 7.1523 7.1725 7.1843 7.2001 k = 0.5351 0.3843 0.3837 ( 24842 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2841 -38.2605 -38.2604 -38.2601 -38.2600 -38.1761 -38.1760 -38.1759 -38.1759 -19.5991 -19.5972 -19.5913 -19.5893 -7.0255 -7.0205 -6.9598 -6.9552 -6.1918 -6.1824 -6.0133 -6.0065 -5.7492 -5.7412 -5.7245 -5.7153 -3.2821 -3.2782 -3.2535 -3.2469 -3.0199 -3.0112 -2.8146 -2.8089 -2.4174 -2.4129 -2.3435 -2.3381 5.8468 5.8609 5.9206 5.9388 6.4978 6.5007 6.5419 6.5619 6.6157 6.6163 6.7293 6.7495 7.1550 7.1667 7.1835 7.1928 k = 0.5351 0.3843 0.3635 ( 24842 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2842 -38.2604 -38.2603 -38.2602 -38.2602 -38.1760 -38.1760 -38.1759 -38.1759 -19.5975 -19.5971 -19.5914 -19.5909 -7.0003 -6.9964 -6.9855 -6.9817 -6.1836 -6.1818 -6.0144 -6.0131 -5.7447 -5.7432 -5.7213 -5.7195 -3.2807 -3.2800 -3.2510 -3.2498 -3.0145 -3.0129 -2.8147 -2.8137 -2.4109 -2.4100 -2.3452 -2.3441 5.8635 5.8670 5.9204 5.9246 6.5218 6.5221 6.5623 6.5667 6.6052 6.6062 6.7060 6.7112 7.1590 7.1611 7.1858 7.1875 k = 0.5351 0.3843 0.3433 ( 24840 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2841 -38.2605 -38.2603 -38.2602 -38.2601 -38.1761 -38.1760 -38.1759 -38.1759 -19.5984 -19.5969 -19.5915 -19.5901 -7.0144 -7.0095 -6.9718 -6.9671 -6.1875 -6.1814 -6.0145 -6.0100 -5.7471 -5.7418 -5.7233 -5.7171 -3.2815 -3.2791 -3.2524 -3.2482 -3.0172 -3.0116 -2.8151 -2.8114 -2.4139 -2.4108 -2.3449 -2.3412 5.8552 5.8660 5.9187 5.9322 6.5104 6.5120 6.5547 6.5702 6.6072 6.6075 6.7142 6.7298 7.1566 7.1641 7.1842 7.1902 k = 0.5351 0.3843 0.3232 ( 24837 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2841 -38.2606 -38.2605 -38.2600 -38.2599 -38.1761 -38.1760 -38.1759 -38.1759 -19.6002 -19.5978 -19.5906 -19.5883 -7.0396 -7.0344 -6.9442 -6.9396 -6.1985 -6.1854 -6.0105 -6.0010 -5.7522 -5.7416 -5.7253 -5.7130 -3.2827 -3.2771 -3.2548 -3.2453 -3.0239 -3.0115 -2.8130 -2.8049 -2.4229 -2.4171 -2.3404 -2.3333 5.8343 5.8504 5.9253 5.9472 6.4803 6.4849 6.5201 6.5413 6.6333 6.6346 6.7543 6.7779 7.1533 7.1700 7.1834 7.1967 k = 0.5351 0.3843 0.3030 ( 24838 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2608 -38.2607 -38.2599 -38.2597 -38.1761 -38.1760 -38.1759 -38.1759 -19.6022 -19.5995 -19.5889 -19.5863 -7.0639 -7.0585 -6.9157 -6.9111 -6.2133 -6.1945 -6.0023 -5.9890 -5.7579 -5.7448 -5.7248 -5.7092 -3.2836 -3.2750 -3.2568 -3.2422 -3.0323 -3.0140 -2.8076 -2.7957 -2.4348 -2.4276 -2.3325 -2.3234 5.8088 5.8253 5.9359 5.9611 6.4493 6.4562 6.4773 6.4971 6.6702 6.6740 6.8056 6.8322 7.1514 7.1752 7.1870 7.2052 k = 0.5351 0.3843 0.2828 ( 24847 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2610 -38.2608 -38.2597 -38.2596 -38.1761 -38.1760 -38.1759 -38.1758 -19.6042 -19.6013 -19.5870 -19.5844 -7.0869 -7.0813 -6.8866 -6.8820 -6.2303 -6.2072 -5.9918 -5.9756 -5.7641 -5.7498 -5.7229 -5.7058 -3.2843 -3.2728 -3.2581 -3.2391 -3.0420 -3.0188 -2.7995 -2.7846 -2.4483 -2.4405 -2.3234 -2.3129 5.7802 5.7961 5.9460 5.9729 6.4191 6.4252 6.4394 6.4529 6.7099 6.7155 6.8592 6.8870 7.1513 7.1795 7.1959 7.2164 k = 0.5351 0.3843 0.2626 ( 24845 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2842 -38.2840 -38.2611 -38.2610 -38.2596 -38.2594 -38.1761 -38.1760 -38.1760 -38.1758 -19.6061 -19.6032 -19.5851 -19.5824 -7.1087 -7.1028 -6.8571 -6.8524 -6.2487 -6.2219 -5.9808 -5.9621 -5.7704 -5.7553 -5.7207 -5.7028 -3.2846 -3.2708 -3.2586 -3.2359 -3.0523 -3.0251 -2.7894 -2.7720 -2.4627 -2.4546 -2.3139 -2.3025 5.7494 5.7644 5.9544 5.9822 6.3831 6.3933 6.4104 6.4165 6.7500 6.7568 6.9115 6.9393 7.1537 7.1848 7.2090 7.2313 k = 0.5351 0.3843 0.2424 ( 24843 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2843 -38.2841 -38.2840 -38.2613 -38.2611 -38.2594 -38.2593 -38.1761 -38.1760 -38.1760 -38.1758 -19.6080 -19.6051 -19.5832 -19.5805 -7.1291 -7.1230 -6.8273 -6.8225 -6.2675 -6.2377 -5.9707 -5.9496 -5.7764 -5.7604 -5.7184 -5.7003 -3.2847 -3.2694 -3.2578 -3.2327 -3.0628 -3.0327 -2.7780 -2.7586 -2.4774 -2.4693 -2.3046 -2.2924 5.7172 5.7315 5.9609 5.9889 6.3446 6.3599 6.3832 6.3947 6.7894 6.7967 6.9596 6.9856 7.1596 7.1922 7.2267 7.2517 k = 0.5351 0.3843 0.2222 ( 24837 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2844 -38.2841 -38.2840 -38.2614 -38.2613 -38.2593 -38.2591 -38.1761 -38.1760 -38.1759 -38.1758 -19.6098 -19.6068 -19.5814 -19.5787 -7.1480 -7.1418 -6.7976 -6.7926 -6.2864 -6.2537 -5.9627 -5.9391 -5.7817 -5.7645 -5.7162 -5.6981 -3.2846 -3.2687 -3.2554 -3.2295 -3.0733 -3.0410 -2.7658 -2.7446 -2.4923 -2.4841 -2.2959 -2.2830 5.6845 5.6981 5.9655 5.9931 6.3088 6.3255 6.3630 6.3776 6.8272 6.8344 7.0002 7.0221 7.1698 7.2016 7.2507 7.2797 k = 0.5351 0.3843 0.2020 ( 24832 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2844 -38.2841 -38.2839 -38.2615 -38.2614 -38.2591 -38.2590 -38.1761 -38.1760 -38.1759 -38.1758 -19.6116 -19.6085 -19.5796 -19.5770 -7.1655 -7.1590 -6.7680 -6.7628 -6.3050 -6.2695 -5.9576 -5.9314 -5.7857 -5.7669 -5.7139 -5.6961 -3.2843 -3.2684 -3.2519 -3.2262 -3.0836 -3.0498 -2.7533 -2.7306 -2.5069 -2.4987 -2.2877 -2.2742 5.6519 5.6652 5.9680 5.9948 6.2766 6.2940 6.3468 6.3632 6.8627 6.8692 7.0311 7.0469 7.1836 7.2124 7.2837 7.3160 k = 0.5351 0.3843 0.1818 ( 24843 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2616 -38.2615 -38.2590 -38.2589 -38.1762 -38.1760 -38.1759 -38.1758 -19.6131 -19.6101 -19.5780 -19.5754 -7.1815 -7.1748 -6.7389 -6.7334 -6.3229 -6.2847 -5.9559 -5.9272 -5.7880 -5.7675 -5.7116 -5.6943 -3.2839 -3.2681 -3.2474 -3.2227 -3.0933 -3.0589 -2.7410 -2.7168 -2.5211 -2.5130 -2.2803 -2.2662 5.6202 5.6333 5.9686 5.9940 6.2485 6.2667 6.3335 6.3512 6.8955 6.9008 7.0522 7.0619 7.1982 7.2233 7.3258 7.3569 k = 0.5351 0.3843 0.1616 ( 24832 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2618 -38.2616 -38.2589 -38.2588 -38.1762 -38.1760 -38.1759 -38.1758 -19.6146 -19.6115 -19.5765 -19.5739 -7.1958 -7.1890 -6.7106 -6.7048 -6.3401 -6.2989 -5.9577 -5.9264 -5.7886 -5.7662 -5.7092 -5.6925 -3.2834 -3.2678 -3.2425 -3.2192 -3.1025 -3.0680 -2.7292 -2.7035 -2.5347 -2.5266 -2.2737 -2.2590 5.5901 5.6031 5.9674 5.9910 6.2246 6.2439 6.3225 6.3412 6.9254 6.9289 7.0644 7.0717 7.2117 7.2337 7.3726 7.3902 k = 0.5351 0.3843 0.1414 ( 24827 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2839 -38.2619 -38.2617 -38.2588 -38.2586 -38.1762 -38.1760 -38.1759 -38.1758 -19.6159 -19.6128 -19.5752 -19.5726 -7.2086 -7.2016 -6.6834 -6.6774 -6.3564 -6.3120 -5.9624 -5.9288 -5.7877 -5.7635 -5.7067 -5.6908 -3.2829 -3.2673 -3.2371 -3.2154 -3.1111 -3.0772 -2.7181 -2.6910 -2.5474 -2.5394 -2.2679 -2.2526 5.5622 5.5753 5.9645 5.9861 6.2049 6.2256 6.3136 6.3329 6.9521 6.9537 7.0698 7.0794 7.2236 7.2429 7.4011 7.4081 k = 0.5351 0.3843 0.1212 ( 24826 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2839 -38.2619 -38.2618 -38.2587 -38.2586 -38.1762 -38.1760 -38.1759 -38.1757 -19.6171 -19.6140 -19.5740 -19.5714 -7.2197 -7.2126 -6.6578 -6.6514 -6.3716 -6.3239 -5.9692 -5.9335 -5.7859 -5.7599 -5.7042 -5.6889 -3.2824 -3.2667 -3.2318 -3.2112 -3.1189 -3.0862 -2.7081 -2.6796 -2.5590 -2.5512 -2.2629 -2.2471 5.5370 5.5502 5.9604 5.9801 6.1891 6.2114 6.3063 6.3261 6.9751 6.9757 7.0718 7.0849 7.2337 7.2508 7.3999 7.4127 k = 0.5351 0.3843 0.1010 ( 24827 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2839 -38.2620 -38.2619 -38.2586 -38.2585 -38.1762 -38.1760 -38.1759 -38.1757 -19.6181 -19.6150 -19.5730 -19.5704 -7.2291 -7.2219 -6.6343 -6.6274 -6.3858 -6.3343 -5.9773 -5.9395 -5.7838 -5.7560 -5.7017 -5.6869 -3.2819 -3.2660 -3.2266 -3.2065 -3.1260 -3.0950 -2.6992 -2.6693 -2.5693 -2.5618 -2.2586 -2.2424 5.5149 5.5283 5.9555 5.9735 6.1769 6.2007 6.3005 6.3206 6.9935 6.9961 7.0723 7.0885 7.2422 7.2572 7.3952 7.4076 k = 0.5351 0.3843 0.0808 ( 24823 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2839 -38.2621 -38.2619 -38.2586 -38.2584 -38.1762 -38.1761 -38.1759 -38.1757 -19.6189 -19.6158 -19.5721 -19.5695 -7.2369 -7.2296 -6.6135 -6.6059 -6.3987 -6.3431 -5.9856 -5.9458 -5.7817 -5.7524 -5.6994 -5.6850 -3.2815 -3.2654 -3.2220 -3.2014 -3.1322 -3.1033 -2.6916 -2.6604 -2.5781 -2.5710 -2.2552 -2.2386 5.4964 5.5099 5.9504 5.9670 6.1678 6.1930 6.2959 6.3164 7.0087 7.0133 7.0719 7.0906 7.2491 7.2623 7.3897 7.4020 k = 0.5351 0.3843 0.0606 ( 24809 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2621 -38.2620 -38.2585 -38.2584 -38.1762 -38.1761 -38.1759 -38.1757 -19.6196 -19.6165 -19.5715 -19.5689 -7.2429 -7.2355 -6.5962 -6.5873 -6.4101 -6.3502 -5.9932 -5.9517 -5.7799 -5.7494 -5.6975 -5.6832 -3.2812 -3.2648 -3.2183 -3.1960 -3.1375 -3.1109 -2.6856 -2.6531 -2.5852 -2.5785 -2.2525 -2.2356 5.4817 5.4953 5.9457 5.9614 6.1613 6.1876 6.2926 6.3132 7.0208 7.0273 7.0709 7.0917 7.2544 7.2661 7.3843 7.3976 k = 0.5351 0.3843 0.0404 ( 24817 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6201 -19.6169 -19.5710 -19.5684 -7.2472 -7.2398 -6.5832 -6.5726 -6.4193 -6.3555 -5.9993 -5.9565 -5.7786 -5.7471 -5.6960 -5.6817 -3.2809 -3.2643 -3.2155 -3.1909 -3.1416 -3.1171 -2.6811 -2.6475 -2.5904 -2.5843 -2.2506 -2.2335 5.4711 5.4848 5.9419 5.9571 6.1570 6.1841 6.2902 6.3109 7.0297 7.0380 7.0697 7.0921 7.2582 7.2687 7.3797 7.3946 k = 0.5351 0.3843 0.0202 ( 24820 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6204 -19.6172 -19.5707 -19.5681 -7.2498 -7.2424 -6.5751 -6.5630 -6.4255 -6.3587 -6.0032 -5.9595 -5.7778 -5.7458 -5.6951 -5.6807 -3.2807 -3.2640 -3.2138 -3.1870 -3.1445 -3.1214 -2.6784 -2.6439 -2.5937 -2.5879 -2.2495 -2.2322 5.4646 5.4784 5.9394 5.9544 6.1545 6.1822 6.2888 6.3096 7.0353 7.0449 7.0684 7.0921 7.2604 7.2702 7.3767 7.3928 k = 0.5351 0.3843 0.0000 ( 24821 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6205 -19.6173 -19.5706 -19.5680 -7.2507 -7.2432 -6.5723 -6.5595 -6.4278 -6.3598 -6.0046 -5.9606 -5.7776 -5.7453 -5.6948 -5.6803 -3.2807 -3.2639 -3.2132 -3.1855 -3.1455 -3.1229 -2.6775 -2.6427 -2.5948 -2.5892 -2.2491 -2.2318 5.4625 5.4763 5.9386 5.9535 6.1537 6.1816 6.2884 6.3092 7.0372 7.0474 7.0677 7.0921 7.2612 7.2707 7.3756 7.3922 k = 0.5083 0.3843 0.0202 ( 24816 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6191 -19.6184 -19.5697 -19.5691 -7.2501 -7.2483 -6.5727 -6.5698 -6.3976 -6.3815 -5.9903 -5.9797 -5.7624 -5.7548 -5.6871 -5.6837 -3.2731 -3.2688 -3.2076 -3.2008 -3.1349 -3.1294 -2.6652 -2.6570 -2.5881 -2.5867 -2.2406 -2.2365 5.4686 5.4719 5.9404 5.9439 6.1623 6.1689 6.2949 6.2998 7.0382 7.0406 7.0774 7.0831 7.2657 7.2679 7.3836 7.3874 k = 0.4816 0.3843 0.0404 ( 24817 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6193 -19.6176 -19.5704 -19.5690 -7.2479 -7.2439 -6.5822 -6.5765 -6.4027 -6.3687 -5.9920 -5.9692 -5.7688 -5.7521 -5.6908 -5.6832 -3.2762 -3.2668 -3.2126 -3.1989 -3.1356 -3.1228 -2.6730 -2.6553 -2.5864 -2.5832 -2.2448 -2.2357 5.4733 5.4805 5.9419 5.9499 6.1612 6.1756 6.2937 6.3046 7.0312 7.0355 7.0749 7.0868 7.2620 7.2672 7.3838 7.3915 k = 0.4548 0.3843 0.0606 ( 24811 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2621 -38.2620 -38.2585 -38.2584 -38.1762 -38.1761 -38.1759 -38.1757 -19.6201 -19.6160 -19.5719 -19.5685 -7.2418 -7.2323 -6.5963 -6.5850 -6.4194 -6.3434 -5.9963 -5.9438 -5.7865 -5.7474 -5.7012 -5.6827 -3.2840 -3.2642 -3.2186 -3.1915 -3.1408 -3.1070 -2.6903 -2.6487 -2.5883 -2.5798 -2.2566 -2.2348 5.4808 5.4982 5.9465 5.9670 6.1596 6.1933 6.2908 6.3174 7.0204 7.0286 7.0681 7.0945 7.2513 7.2668 7.3819 7.3990 k = 0.4281 0.3843 0.0808 ( 24819 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2621 -38.2619 -38.2586 -38.2584 -38.1762 -38.1760 -38.1759 -38.1757 -19.6207 -19.6143 -19.5735 -19.5682 -7.2303 -7.2154 -6.6125 -6.5983 -6.4285 -6.3227 -5.9929 -5.9172 -5.8069 -5.7494 -5.7143 -5.6845 -3.2914 -3.2664 -3.2197 -3.1873 -3.1429 -3.0862 -2.7083 -2.6464 -2.5923 -2.5774 -2.2717 -2.2379 5.4941 5.5212 5.9557 5.9914 6.1655 6.2150 6.2913 6.3332 7.0090 7.0177 7.0623 7.0995 7.2349 7.2646 7.3803 7.4070 k = 0.4013 0.3843 0.1010 ( 24821 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2839 -38.2620 -38.2619 -38.2586 -38.2585 -38.1762 -38.1760 -38.1759 -38.1757 -19.6211 -19.6124 -19.5754 -19.5681 -7.2134 -7.1934 -6.6316 -6.6144 -6.4294 -6.3060 -5.9841 -5.8933 -5.8273 -5.7578 -5.7297 -5.6876 -3.2986 -3.2711 -3.2221 -3.1829 -3.1403 -3.0605 -2.7267 -2.6489 -2.5979 -2.5758 -2.2902 -2.2453 5.5133 5.5493 5.9673 6.0223 6.1803 6.2409 6.2952 6.3520 6.9973 7.0034 7.0569 7.0998 7.2143 7.2598 7.3754 7.4160 k = 0.3745 0.3843 0.1212 ( 24821 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2839 -38.2620 -38.2618 -38.2587 -38.2586 -38.1762 -38.1760 -38.1759 -38.1757 -19.6213 -19.6104 -19.5775 -19.5683 -7.1913 -7.1667 -6.6536 -6.6310 -6.4232 -6.2920 -5.9743 -5.8839 -5.8373 -5.7704 -5.7469 -5.6921 -3.3062 -3.2758 -3.2291 -3.1750 -3.1327 -3.0313 -2.7452 -2.6564 -2.6046 -2.5750 -2.3119 -2.2571 5.5381 5.5823 5.9791 6.0582 6.2046 6.2705 6.3035 6.3736 6.9848 6.9858 7.0505 7.0939 7.1939 7.2505 7.3617 7.4166 k = 0.3478 0.3843 0.1414 ( 24815 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2619 -38.2617 -38.2588 -38.2586 -38.1762 -38.1760 -38.1759 -38.1757 -19.6213 -19.6084 -19.5797 -19.5686 -7.1642 -7.1356 -6.6765 -6.6471 -6.4115 -6.2789 -5.9701 -5.8981 -5.8285 -5.7837 -5.7640 -5.6984 -3.3149 -3.2787 -3.2385 -3.1650 -3.1197 -3.0003 -2.7634 -2.6685 -2.6119 -2.5753 -2.3368 -2.2735 5.5681 5.6197 5.9899 6.0971 6.2378 6.2996 6.3211 6.3981 6.9650 6.9701 7.0395 7.0832 7.1790 7.2348 7.3292 7.3927 k = 0.3210 0.3843 0.1616 ( 24824 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2618 -38.2616 -38.2589 -38.2587 -38.1762 -38.1760 -38.1760 -38.1757 -19.6212 -19.6062 -19.5820 -19.5691 -7.1327 -7.1006 -6.6986 -6.6623 -6.3956 -6.2655 -5.9786 -5.9187 -5.8222 -5.7946 -5.7748 -5.7070 -3.3241 -3.2790 -3.2477 -3.1547 -3.1016 -2.9686 -2.7811 -2.6845 -2.6196 -2.5771 -2.3647 -2.2943 5.6029 5.6611 5.9995 6.1358 6.2780 6.3199 6.3573 6.4259 6.9411 6.9498 7.0202 7.0755 7.1710 7.2108 7.2877 7.3802 k = 0.2943 0.3843 0.1818 ( 24823 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2617 -38.2615 -38.2590 -38.2589 -38.1762 -38.1760 -38.1760 -38.1757 -19.6208 -19.6040 -19.5845 -19.5698 -7.0970 -7.0625 -6.7184 -6.6762 -6.3764 -6.2512 -6.0003 -5.9405 -5.8326 -5.7990 -5.7741 -5.7183 -3.3323 -3.2764 -3.2552 -3.1452 -3.0790 -2.9374 -2.7980 -2.7036 -2.6274 -2.5807 -2.3953 -2.3193 5.6419 5.7060 6.0082 6.1710 6.3197 6.3433 6.4029 6.4584 6.9145 6.9196 6.9987 7.0738 7.1677 7.1791 7.2506 7.3666 k = 0.2675 0.3843 0.2020 ( 24815 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2615 -38.2614 -38.2591 -38.2590 -38.1762 -38.1760 -38.1759 -38.1757 -19.6202 -19.6018 -19.5871 -19.5707 -7.0578 -7.0218 -6.7352 -6.6886 -6.3547 -6.2358 -6.0294 -5.9662 -5.8523 -5.7993 -5.7703 -5.7319 -3.3378 -3.2712 -3.2600 -3.1370 -3.0530 -2.9074 -2.8137 -2.7249 -2.6350 -2.5863 -2.4280 -2.3484 5.6844 5.7541 6.0162 6.2002 6.3498 6.3845 6.4499 6.4992 6.8790 6.8867 6.9822 7.0755 7.1430 7.1672 7.2186 7.3420 k = 0.2408 0.3843 0.2222 ( 24823 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2843 -38.2841 -38.2839 -38.2614 -38.2612 -38.2593 -38.2591 -38.1762 -38.1760 -38.1759 -38.1757 -19.6194 -19.5995 -19.5897 -19.5718 -7.0158 -6.9796 -6.7486 -6.6990 -6.3313 -6.2196 -6.0607 -5.9957 -5.8731 -5.8007 -5.7711 -5.7467 -3.3388 -3.2659 -3.2592 -3.1311 -3.0246 -2.8797 -2.8281 -2.7472 -2.6425 -2.5944 -2.4620 -2.3809 5.7295 5.8047 6.0235 6.2219 6.3752 6.4326 6.4931 6.5516 6.8337 6.8587 6.9715 7.0783 7.1081 7.1671 7.1892 7.3113 k = 0.2140 0.3843 0.2424 ( 24807 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2843 -38.2842 -38.2840 -38.2613 -38.2611 -38.2594 -38.2593 -38.1762 -38.1760 -38.1759 -38.1757 -19.6184 -19.5974 -19.5922 -19.5731 -6.9718 -6.9369 -6.7584 -6.7073 -6.3075 -6.2032 -6.0915 -6.0269 -5.8921 -5.8068 -5.7801 -5.7601 -3.3342 -3.2636 -3.2493 -3.1281 -2.9950 -2.8563 -2.8398 -2.7691 -2.6497 -2.6053 -2.4959 -2.4164 5.7763 5.8571 6.0300 6.2360 6.4018 6.4758 6.5347 6.6113 6.7882 6.8342 6.9668 7.0775 7.0803 7.1562 7.1721 7.2847 k = 0.1873 0.3843 0.2626 ( 24821 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2842 -38.2840 -38.2611 -38.2609 -38.2596 -38.2594 -38.1762 -38.1761 -38.1759 -38.1758 -19.6172 -19.5966 -19.5934 -19.5745 -6.9269 -6.8949 -6.7647 -6.7133 -6.2848 -6.1872 -6.1200 -6.0572 -5.9070 -5.8201 -5.7960 -5.7730 -3.3236 -3.2595 -3.2354 -3.1287 -2.9655 -2.8586 -2.8292 -2.7885 -2.6567 -2.6194 -2.5278 -2.4541 5.8235 5.9108 6.0351 6.2426 6.4292 6.5097 6.5736 6.6677 6.7498 6.8191 6.9694 7.0537 7.0789 7.1305 7.1736 7.2657 k = 0.1605 0.3843 0.2828 ( 24815 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2840 -38.2610 -38.2608 -38.2597 -38.2596 -38.1762 -38.1761 -38.1759 -38.1758 -19.6158 -19.5987 -19.5917 -19.5761 -6.8825 -6.8549 -6.7679 -6.7173 -6.2660 -6.1729 -6.1445 -6.0834 -5.9160 -5.8403 -5.8147 -5.7888 -3.3070 -3.2524 -3.2193 -3.1332 -2.9382 -2.8740 -2.8106 -2.8026 -2.6637 -2.6362 -2.5559 -2.4930 5.8699 5.9651 6.0382 6.2417 6.4564 6.5350 6.6001 6.6788 6.7573 6.8225 6.9806 7.0380 7.0711 7.1106 7.1783 7.2533 k = 0.1338 0.3843 0.3030 ( 24814 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2608 -38.2606 -38.2599 -38.2597 -38.1762 -38.1761 -38.1759 -38.1758 -19.6142 -19.6014 -19.5895 -19.5778 -6.8405 -6.8176 -6.7682 -6.7197 -6.2540 -6.1747 -6.1510 -6.1012 -5.9176 -5.8641 -5.8364 -5.8086 -3.2850 -3.2425 -3.2022 -3.1412 -2.9180 -2.8913 -2.8099 -2.7946 -2.6709 -2.6532 -2.5792 -2.5318 5.9141 6.0188 6.0389 6.2328 6.4826 6.5535 6.6067 6.6473 6.8067 6.8493 7.0001 7.0310 7.0584 7.0981 7.1866 7.2449 k = 0.1070 0.3843 0.3232 ( 24813 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2607 -38.2605 -38.2601 -38.2599 -38.1762 -38.1761 -38.1758 -38.1758 -19.6124 -19.6041 -19.5871 -19.5796 -6.8044 -6.7830 -6.7665 -6.7212 -6.2489 -6.1978 -6.1360 -6.1074 -5.9120 -5.8874 -5.8612 -5.8320 -3.2587 -3.2303 -3.1863 -3.1517 -2.9162 -2.9029 -2.8070 -2.7831 -2.6773 -2.6668 -2.5984 -2.5692 5.9547 6.0338 6.0736 6.2155 6.5080 6.5665 6.5973 6.6159 6.8577 6.8895 7.0189 7.0369 7.0496 7.0875 7.1993 7.2379 k = 0.0803 0.3843 0.3433 ( 24814 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2841 -38.2841 -38.2605 -38.2603 -38.2602 -38.2600 -38.1762 -38.1761 -38.1758 -38.1758 -19.6105 -19.6068 -19.5848 -19.5815 -6.7775 -6.7649 -6.7489 -6.7228 -6.2467 -6.2237 -6.1184 -6.1053 -5.9089 -5.9007 -5.8848 -5.8583 -3.2304 -3.2172 -3.1741 -3.1627 -2.9275 -2.9152 -2.7932 -2.7776 -2.6801 -2.6753 -2.6144 -2.6029 5.9904 6.0253 6.1254 6.1897 6.5330 6.5699 6.5818 6.5950 6.9070 6.9264 7.0274 7.0427 7.0637 7.0783 7.2152 7.2310 k = 0.0535 0.3843 0.3635 ( 24817 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2841 -38.2841 -38.2604 -38.2603 -38.2602 -38.2601 -38.1762 -38.1761 -38.1758 -38.1758 -19.6094 -19.6084 -19.5834 -19.5825 -6.7626 -6.7597 -6.7262 -6.7191 -6.2491 -6.2424 -6.1034 -6.0989 -5.9222 -5.9169 -5.8860 -5.8759 -3.2086 -3.2045 -3.1685 -3.1664 -2.9380 -2.9328 -2.7810 -2.7757 -2.6776 -2.6764 -2.6305 -2.6279 6.0106 6.0204 6.1561 6.1746 6.5474 6.5584 6.5831 6.5870 6.9473 6.9545 7.0295 7.0359 7.0842 7.0856 7.2246 7.2291 k = 0.0268 0.3843 0.3837 ( 24821 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2841 -38.2841 -38.2606 -38.2604 -38.2602 -38.2600 -38.1762 -38.1761 -38.1758 -38.1758 -19.6119 -19.6062 -19.5855 -19.5803 -6.7626 -6.7493 -6.7331 -6.6943 -6.2713 -6.2330 -6.1082 -6.0772 -5.9505 -5.9166 -5.9107 -5.8548 -3.2143 -3.1923 -3.1647 -3.1516 -2.9649 -2.9287 -2.7946 -2.7632 -2.6715 -2.6663 -2.6492 -2.6388 5.9894 6.0440 6.1164 6.2196 6.5244 6.5745 6.5859 6.5962 6.9545 6.9956 7.0033 7.0418 7.0889 7.1086 7.2025 7.2466 k = 0.0000 0.3843 0.4039 ( 24818 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2607 -38.2605 -38.2600 -38.2598 -38.1762 -38.1761 -38.1758 -38.1758 -19.6143 -19.6039 -19.5876 -19.5781 -6.7666 -6.7450 -6.7442 -6.6751 -6.2883 -6.2181 -6.1196 -6.0578 -5.9727 -5.9409 -5.8985 -5.8315 -3.2288 -3.2012 -3.1497 -3.1326 -2.9874 -2.9173 -2.8164 -2.7607 -2.6684 -2.6506 -2.6479 -2.6454 5.9615 6.0613 6.0721 6.2587 6.5049 6.5701 6.6085 6.6131 6.9555 6.9570 7.0407 7.0415 7.0759 7.1284 7.1691 7.2708 k = 0.0268 0.3651 0.4039 ( 24814 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2841 -38.2840 -38.2607 -38.2605 -38.2600 -38.2598 -38.1762 -38.1761 -38.1758 -38.1757 -19.6170 -19.6065 -19.5849 -19.5756 -6.7702 -6.7537 -6.7439 -6.6718 -6.3019 -6.2330 -6.1049 -6.0541 -5.9591 -5.9280 -5.8974 -5.8202 -3.2406 -3.2110 -3.1587 -3.1475 -2.9970 -2.9357 -2.8012 -2.7546 -2.6719 -2.6562 -2.6403 -2.6203 5.9449 6.0390 6.0815 6.2782 6.4963 6.5688 6.6044 6.6129 6.9179 6.9702 6.9900 7.0488 7.0752 7.1222 7.1891 7.2676 k = 0.0535 0.3459 0.4039 ( 24812 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1762 -38.1762 -38.1758 -38.1757 -19.6194 -19.6088 -19.5825 -19.5732 -6.7786 -6.7649 -6.7483 -6.6743 -6.3086 -6.2420 -6.0978 -6.0647 -5.9321 -5.9099 -5.8863 -5.8080 -3.2600 -3.2297 -3.1726 -3.1629 -2.9926 -2.9480 -2.7898 -2.7509 -2.6803 -2.6626 -2.6218 -2.5892 5.9246 6.0142 6.0887 6.2934 6.4881 6.5650 6.5993 6.6155 6.8775 6.9353 6.9829 7.0454 7.0825 7.1137 7.2194 7.2636 k = 0.0803 0.3267 0.4039 ( 24798 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1758 -38.1757 -19.6215 -19.6109 -19.5802 -19.5711 -6.7908 -6.7769 -6.7572 -6.6820 -6.3087 -6.2448 -6.1013 -6.0793 -5.9087 -5.8807 -5.8661 -5.7951 -3.2879 -3.2537 -3.1974 -3.1664 -2.9798 -2.9533 -2.7832 -2.7483 -2.6917 -2.6650 -2.5981 -2.5565 5.9011 5.9876 6.0933 6.3039 6.4810 6.5603 6.5933 6.6209 6.8387 6.8899 6.9884 7.0394 7.0875 7.1098 7.2387 7.2671 k = 0.1070 0.3074 0.4039 ( 24803 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1757 -38.1757 -19.6233 -19.6126 -19.5783 -19.5692 -6.8058 -6.7891 -6.7687 -6.6936 -6.3037 -6.2418 -6.1150 -6.0931 -5.8895 -5.8456 -5.8408 -5.7816 -3.3201 -3.2833 -3.2153 -3.1715 -2.9645 -2.9502 -2.7821 -2.7455 -2.7039 -2.6634 -2.5716 -2.5243 5.8756 5.9604 6.0952 6.3097 6.4754 6.5563 6.5864 6.6295 6.8024 6.8547 6.9824 7.0378 7.0895 7.1108 7.2328 7.2857 k = 0.1338 0.2882 0.4039 ( 24793 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1757 -38.1756 -19.6247 -19.6140 -19.5768 -19.5677 -6.8224 -6.8010 -6.7812 -6.7075 -6.2954 -6.2345 -6.1334 -6.1072 -5.8706 -5.8143 -5.8125 -5.7673 -3.3522 -3.3156 -3.2271 -3.1788 -2.9540 -2.9358 -2.7861 -2.7442 -2.7124 -2.6582 -2.5445 -2.4938 5.8497 5.9340 6.0940 6.3107 6.4712 6.5538 6.5785 6.6413 6.7697 6.8281 6.9684 7.0390 7.0906 7.1140 7.2216 7.2894 k = 0.1605 0.2690 0.4039 ( 24794 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1757 -38.1756 -19.6257 -19.6149 -19.5756 -19.5666 -6.8393 -6.8122 -6.7937 -6.7221 -6.2858 -6.2250 -6.1521 -6.1220 -5.8516 -5.7898 -5.7851 -5.7519 -3.3813 -3.3463 -3.2355 -3.1880 -2.9459 -2.9164 -2.7931 -2.7500 -2.7100 -2.6498 -2.5182 -2.4660 5.8249 5.9098 6.0895 6.3073 6.4678 6.5530 6.5705 6.6564 6.7416 6.8078 6.9533 7.0386 7.0921 7.1164 7.2116 7.2868 k = 0.1873 0.2498 0.4039 ( 24799 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2844 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2597 -38.1763 -38.1762 -38.1757 -38.1756 -19.6262 -19.6155 -19.5749 -19.5660 -6.8553 -6.8224 -6.8051 -6.7362 -6.2771 -6.2171 -6.1672 -6.1358 -5.8328 -5.7696 -5.7650 -5.7358 -3.4055 -3.3730 -3.2418 -3.1985 -2.9389 -2.8985 -2.8000 -2.7594 -2.6985 -2.6388 -2.4939 -2.4415 5.8029 5.8889 6.0817 6.2993 6.4648 6.5518 6.5656 6.6744 6.7190 6.7918 6.9407 7.0356 7.0934 7.1162 7.2049 7.2862 k = 0.2140 0.2306 0.4039 ( 24800 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2844 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2597 -38.1763 -38.1762 -38.1757 -38.1756 -19.6263 -19.6156 -19.5746 -19.5657 -6.8694 -6.8316 -6.8148 -6.7488 -6.2720 -6.2183 -6.1723 -6.1455 -5.8145 -5.7542 -5.7515 -5.7218 -3.4236 -3.3945 -3.2466 -3.2098 -2.9353 -2.8874 -2.8026 -2.7647 -2.6827 -2.6257 -2.4723 -2.4208 5.7846 5.8723 6.0704 6.2866 6.4622 6.5465 6.5685 6.6914 6.7050 6.7792 6.9324 7.0306 7.0933 7.1138 7.2016 7.2893 k = 0.2408 0.2114 0.4039 ( 24808 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2844 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2597 -38.1763 -38.1762 -38.1757 -38.1756 -19.6259 -19.6153 -19.5747 -19.5659 -6.8810 -6.8400 -6.8221 -6.7596 -6.2731 -6.2305 -6.1679 -6.1460 -5.7971 -5.7446 -5.7428 -5.7126 -3.4351 -3.4101 -3.2502 -3.2213 -2.9377 -2.8886 -2.7961 -2.7610 -2.6643 -2.6112 -2.4541 -2.4042 5.7707 5.8602 6.0561 6.2693 6.4606 6.5406 6.5767 6.6848 6.7204 6.7699 6.9291 7.0241 7.0913 7.1114 7.2010 7.2953 k = 0.2675 0.1922 0.4039 ( 24815 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1757 -38.1756 -19.6250 -19.6145 -19.5753 -19.5665 -6.8897 -6.8477 -6.8265 -6.7682 -6.2811 -6.2474 -6.1606 -6.1363 -5.7811 -5.7443 -5.7356 -5.7084 -3.4398 -3.4200 -3.2527 -3.2322 -2.9468 -2.9019 -2.7805 -2.7472 -2.6443 -2.5959 -2.4396 -2.3920 5.7613 5.8526 6.0390 6.2476 6.4611 6.5375 6.5876 6.6754 6.7413 6.7649 6.9317 7.0166 7.0875 7.1107 7.2023 7.3028 k = 0.2943 0.1729 0.4039 ( 24815 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1757 -38.1757 -19.6237 -19.6134 -19.5763 -19.5676 -6.8954 -6.8547 -6.8280 -6.7747 -6.2939 -6.2664 -6.1498 -6.1215 -5.7682 -5.7497 -5.7345 -5.7062 -3.4382 -3.4247 -3.2552 -3.2405 -2.9616 -2.9226 -2.7587 -2.7258 -2.6236 -2.5806 -2.4291 -2.3843 5.7562 5.8493 6.0200 6.2220 6.4649 6.5389 6.6000 6.6687 6.7518 6.7720 6.9413 7.0088 7.0821 7.1134 7.2051 7.3105 k = 0.3210 0.1537 0.4039 ( 24829 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2845 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1763 -38.1762 -38.1757 -38.1757 -19.6220 -19.6119 -19.5778 -19.5691 -6.8982 -6.8607 -6.8268 -6.7792 -6.3087 -6.2861 -6.1355 -6.1048 -5.7695 -5.7532 -5.7385 -5.7026 -3.4315 -3.4252 -3.2598 -3.2429 -2.9805 -2.9473 -2.7329 -2.7000 -2.6030 -2.5659 -2.4228 -2.3813 5.7549 5.8492 6.0001 6.1934 6.4730 6.5455 6.6130 6.6644 6.7530 6.7882 6.9576 7.0025 7.0749 7.1204 7.2088 7.3179 k = 0.3478 0.1345 0.4039 ( 24840 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2841 -38.2840 -38.2608 -38.2605 -38.2600 -38.2598 -38.1762 -38.1762 -38.1758 -38.1757 -19.6199 -19.6101 -19.5795 -19.5710 -6.8983 -6.8657 -6.8233 -6.7819 -6.3239 -6.3058 -6.1184 -6.0872 -5.7867 -5.7662 -5.7322 -5.6978 -3.4227 -3.4213 -3.2649 -3.2395 -3.0021 -2.9740 -2.7048 -2.6716 -2.5831 -2.5525 -2.4208 -2.3828 5.7567 5.8511 5.9809 6.1627 6.4858 6.5571 6.6255 6.6629 6.7555 6.8023 6.9723 7.0059 7.0663 7.1316 7.2133 7.3250 k = 0.3745 0.1153 0.4039 ( 24852 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2607 -38.2605 -38.2600 -38.2598 -38.1762 -38.1761 -38.1758 -38.1757 -19.6175 -19.6081 -19.5814 -19.5732 -6.8963 -6.8695 -6.8179 -6.7833 -6.3382 -6.3246 -6.0992 -6.0693 -5.8094 -5.7892 -5.7219 -5.6932 -3.4184 -3.4101 -3.2667 -3.2322 -3.0257 -3.0013 -2.6753 -2.6422 -2.5646 -2.5410 -2.4229 -2.3888 5.7612 5.8528 5.9650 6.1310 6.5028 6.5721 6.6363 6.6658 6.7612 6.8129 6.9724 7.0256 7.0630 7.1463 7.2189 7.3316 k = 0.4013 0.0961 0.4039 ( 24853 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2607 -38.2605 -38.2600 -38.2598 -38.1762 -38.1761 -38.1758 -38.1758 -19.6148 -19.6062 -19.5834 -19.5757 -6.8927 -6.8722 -6.8112 -6.7837 -6.3511 -6.3416 -6.0783 -6.0513 -5.8350 -5.8167 -5.7120 -5.6895 -3.4135 -3.4007 -3.2627 -3.2219 -3.0504 -3.0284 -2.6456 -2.6131 -2.5481 -2.5317 -2.4288 -2.3989 5.7680 5.8514 5.9558 6.0993 6.5224 6.5867 6.6460 6.6740 6.7708 6.8204 6.9680 7.0262 7.0902 7.1639 7.2260 7.3363 k = 0.4281 0.0769 0.4039 ( 24850 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2841 -38.2607 -38.2605 -38.2600 -38.2598 -38.1761 -38.1761 -38.1759 -38.1758 -19.6120 -19.6046 -19.5850 -19.5783 -6.8880 -6.8739 -6.8039 -6.7836 -6.3619 -6.3560 -6.0565 -6.0339 -5.8614 -5.8462 -5.7032 -5.6868 -3.4087 -3.3954 -3.2515 -3.2099 -3.0749 -3.0540 -2.6169 -2.5861 -2.5340 -2.5246 -2.4378 -2.4128 5.7768 5.8444 5.9561 6.0685 6.5426 6.5953 6.6591 6.6846 6.7846 6.8251 6.9652 7.0127 7.1365 7.1854 7.2347 7.3374 k = 0.4548 0.0576 0.4039 ( 24844 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2607 -38.2606 -38.2600 -38.2598 -38.1761 -38.1760 -38.1759 -38.1758 -19.6093 -19.6038 -19.5859 -19.5809 -6.8829 -6.8747 -6.7965 -6.7836 -6.3700 -6.3670 -6.0350 -6.0187 -5.8857 -5.8750 -5.6956 -5.6853 -3.4047 -3.3945 -3.2341 -3.1991 -3.0961 -3.0774 -2.5907 -2.5651 -2.5224 -2.5181 -2.4485 -2.4296 5.7874 5.8328 5.9656 6.0395 6.5614 6.5963 6.6758 6.6935 6.8012 6.8272 6.9658 6.9971 7.1853 7.2152 7.2461 7.3333 k = 0.4816 0.0384 0.4039 ( 24832 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2607 -38.2606 -38.2600 -38.2598 -38.1761 -38.1760 -38.1759 -38.1759 -19.6067 -19.6042 -19.5856 -19.5833 -6.8778 -6.8748 -6.7896 -6.7843 -6.3751 -6.3740 -6.0173 -6.0099 -5.9030 -5.8983 -5.6893 -5.6851 -3.4017 -3.3972 -3.2139 -3.1960 -3.1072 -3.0967 -2.5697 -2.5571 -2.5120 -2.5098 -2.4577 -2.4478 5.7997 5.8188 5.9823 6.0132 6.5777 6.5921 6.6910 6.6979 6.8172 6.8270 6.9700 6.9828 7.2270 7.2458 7.2743 7.3227 k = 0.5083 0.0192 0.4039 ( 24835 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2607 -38.2606 -38.2600 -38.2598 -38.1761 -38.1760 -38.1759 -38.1759 -19.6059 -19.6048 -19.5851 -19.5840 -6.8744 -6.8731 -6.7860 -6.7836 -6.3768 -6.3764 -6.0141 -6.0109 -5.9078 -5.9060 -5.6862 -5.6843 -3.4020 -3.4000 -3.2059 -3.1974 -3.1074 -3.1024 -2.5643 -2.5588 -2.5040 -2.5017 -2.4644 -2.4586 5.8048 5.8135 5.9903 6.0043 6.5845 6.5908 6.6967 6.6993 6.8247 6.8285 6.9719 6.9775 7.2561 7.2650 7.2989 7.3203 k = 0.5351 0.0000 0.4039 ( 24851 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2607 -38.2606 -38.2600 -38.2598 -38.1761 -38.1760 -38.1759 -38.1758 -19.6084 -19.6039 -19.5858 -19.5817 -6.8738 -6.8688 -6.7892 -6.7786 -6.3753 -6.3735 -6.0318 -6.0207 -5.8986 -5.8940 -5.6886 -5.6808 -3.4081 -3.4002 -3.2238 -3.1936 -3.1020 -3.0858 -2.5822 -2.5631 -2.5082 -2.4945 -2.4723 -2.4476 5.7916 5.8277 5.9719 6.0304 6.5740 6.6000 6.6898 6.6985 6.8202 6.8335 6.9646 6.9880 7.2436 7.2555 7.2847 7.3278 k = 0.5351 0.0000 0.3837 ( 24856 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2841 -38.2605 -38.2604 -38.2601 -38.2600 -38.1761 -38.1761 -38.1759 -38.1759 -19.6068 -19.6042 -19.5856 -19.5832 -6.8549 -6.8526 -6.8054 -6.7992 -6.3730 -6.3721 -6.0328 -6.0266 -5.8934 -5.8910 -5.6889 -5.6844 -3.4059 -3.4012 -3.2210 -3.2041 -3.0972 -3.0884 -2.5739 -2.5623 -2.5044 -2.4968 -2.4701 -2.4556 5.8162 5.8414 5.9678 6.0056 6.6003 6.6214 6.6735 6.6863 6.8240 6.8331 6.9684 6.9836 7.2380 7.2465 7.2953 7.3232 k = 0.5351 0.0000 0.3635 ( 24846 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2841 -38.2841 -38.2604 -38.2603 -38.2602 -38.2602 -38.1761 -38.1761 -38.1759 -38.1759 -19.6055 -19.6050 -19.5849 -19.5845 -6.8398 -6.8397 -6.8174 -6.8159 -6.3718 -6.3717 -6.0318 -6.0306 -5.8906 -5.8902 -5.6879 -5.6871 -3.4037 -3.4029 -3.2157 -3.2127 -3.0931 -3.0915 -2.5673 -2.5651 -2.5010 -2.4996 -2.4653 -2.4626 5.8348 5.8400 5.9763 5.9838 6.6233 6.6292 6.6657 6.6703 6.8293 6.8311 6.9742 6.9771 7.2380 7.2398 7.3076 7.3130 k = 0.5351 0.0000 0.3433 ( 24854 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2843 -38.2843 -38.2842 -38.2841 -38.2605 -38.2603 -38.2602 -38.2601 -38.1761 -38.1761 -38.1759 -38.1759 -19.6062 -19.6045 -19.5854 -19.5838 -6.8471 -6.8460 -6.8119 -6.8075 -6.3724 -6.3718 -6.0326 -6.0286 -5.8919 -5.8903 -5.6886 -5.6857 -3.4050 -3.4019 -3.2190 -3.2081 -3.0953 -3.0897 -2.5707 -2.5632 -2.5029 -2.4980 -2.4683 -2.4588 5.8253 5.8427 5.9699 5.9954 6.6112 6.6281 6.6674 6.6792 6.8264 6.8325 6.9708 6.9809 7.2373 7.2431 7.3006 7.3192 k = 0.5351 0.0000 0.3232 ( 24850 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2841 -38.2606 -38.2605 -38.2600 -38.2599 -38.1761 -38.1760 -38.1759 -38.1759 -19.6077 -19.6040 -19.5858 -19.5824 -6.8654 -6.8616 -6.7964 -6.7878 -6.3742 -6.3728 -6.0325 -6.0235 -5.8961 -5.8924 -5.6889 -5.6825 -3.4072 -3.4006 -3.2229 -3.1984 -3.0998 -3.0869 -2.5784 -2.5623 -2.5064 -2.4954 -2.4717 -2.4512 5.8029 5.8354 5.9687 6.0194 6.5856 6.6099 6.6828 6.6941 6.8213 6.8334 6.9660 6.9865 7.2405 7.2514 7.2890 7.3265 k = 0.5351 0.0000 0.3030 ( 24855 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2842 -38.2842 -38.2841 -38.2608 -38.2606 -38.2599 -38.2597 -38.1761 -38.1760 -38.1759 -38.1758 -19.6094 -19.6040 -19.5857 -19.5808 -6.8844 -6.8780 -6.7798 -6.7667 -6.3769 -6.3748 -6.0303 -6.0166 -5.9025 -5.8964 -5.6880 -5.6786 -3.4091 -3.3999 -3.2245 -3.1870 -3.1051 -3.0844 -2.5874 -2.5650 -2.5107 -2.4935 -2.4722 -2.4430 5.7763 5.8149 5.9782 6.0445 6.5592 6.5871 6.6971 6.7013 6.8209 6.8343 6.9633 6.9889 7.2484 7.2610 7.2804 7.3277 k = 0.5351 0.0000 0.2828 ( 24848 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2610 -38.2608 -38.2597 -38.2596 -38.1761 -38.1760 -38.1759 -38.1758 -19.6111 -19.6045 -19.5851 -19.5791 -6.9030 -6.8942 -6.7634 -6.7453 -6.3806 -6.3777 -6.0260 -6.0085 -5.9105 -5.9019 -5.6863 -5.6745 -3.4104 -3.3998 -3.2241 -3.1743 -3.1111 -3.0822 -2.5973 -2.5709 -2.5160 -2.4924 -2.4697 -2.4345 5.7472 5.7873 5.9927 6.0688 6.5339 6.5644 6.6977 6.7042 6.8286 6.8388 6.9623 6.9877 7.2547 7.2707 7.2795 7.3234 k = 0.5351 0.0000 0.2626 ( 24836 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2844 -38.2843 -38.2842 -38.2840 -38.2611 -38.2610 -38.2596 -38.2594 -38.1761 -38.1760 -38.1760 -38.1758 -19.6129 -19.6054 -19.5842 -19.5774 -6.9207 -6.9099 -6.7474 -6.7238 -6.3849 -6.3812 -6.0201 -5.9997 -5.9194 -5.9083 -5.6842 -5.6707 -3.4107 -3.3999 -3.2225 -3.1607 -3.1179 -3.0798 -2.6075 -2.5791 -2.5223 -2.4922 -2.4650 -2.4259 5.7168 5.7564 6.0084 6.0910 6.5112 6.5431 6.6856 6.7025 6.8428 6.8489 6.9629 6.9837 7.2528 7.2795 7.2897 7.3167 k = 0.5351 0.0000 0.2424 ( 24833 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2843 -38.2841 -38.2840 -38.2613 -38.2611 -38.2594 -38.2593 -38.1762 -38.1760 -38.1760 -38.1758 -19.6147 -19.6065 -19.5830 -19.5757 -6.9376 -6.9249 -6.7321 -6.7024 -6.3899 -6.3853 -6.0128 -5.9915 -5.9275 -5.9148 -5.6822 -5.6676 -3.4097 -3.3999 -3.2204 -3.1469 -3.1254 -3.0769 -2.6180 -2.5888 -2.5295 -2.4928 -2.4589 -2.4175 5.6856 5.7244 6.0235 6.1103 6.4922 6.5241 6.6691 6.6937 6.8594 6.8640 6.9657 6.9781 7.2478 7.2862 7.3038 7.3101 k = 0.5351 0.0000 0.2222 ( 24817 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2843 -38.2841 -38.2840 -38.2614 -38.2612 -38.2593 -38.2591 -38.1762 -38.1760 -38.1760 -38.1758 -19.6164 -19.6078 -19.5816 -19.5740 -6.9535 -6.9392 -6.7178 -6.6814 -6.3954 -6.3896 -6.0049 -5.9861 -5.9325 -5.9207 -5.6805 -5.6656 -3.4072 -3.3994 -3.2186 -3.1366 -3.1301 -3.0733 -2.6283 -2.5993 -2.5373 -2.4942 -2.4521 -2.4094 5.6545 5.6922 6.0370 6.1259 6.4775 6.5078 6.6510 6.6806 6.8746 6.8818 6.9716 6.9721 7.2427 7.2884 7.3067 7.3165 k = 0.5351 0.0000 0.2020 ( 24803 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2845 -38.2844 -38.2841 -38.2839 -38.2615 -38.2614 -38.2591 -38.2590 -38.1762 -38.1760 -38.1760 -38.1758 -19.6181 -19.6091 -19.5802 -19.5724 -6.9682 -6.9525 -6.7045 -6.6608 -6.4013 -6.3938 -5.9972 -5.9864 -5.9310 -5.9249 -5.6796 -5.6649 -3.4031 -3.3980 -3.2179 -3.1441 -3.1182 -3.0686 -2.6383 -2.6102 -2.5456 -2.4963 -2.4450 -2.4017 5.6238 5.6608 6.0486 6.1377 6.4677 6.4945 6.6328 6.6653 6.8859 6.9002 6.9671 6.9820 7.2378 7.2847 7.3084 7.3095 k = 0.5351 0.0000 0.1818 ( 24816 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2617 -38.2615 -38.2590 -38.2589 -38.1762 -38.1760 -38.1759 -38.1758 -19.6196 -19.6104 -19.5788 -19.5708 -6.9818 -6.9648 -6.6924 -6.6408 -6.4076 -6.3979 -5.9925 -5.9913 -5.9261 -5.9232 -5.6797 -5.6656 -3.3972 -3.3955 -3.2187 -3.1540 -3.1051 -3.0628 -2.6478 -2.6211 -2.5542 -2.4991 -2.4381 -2.3944 5.5942 5.6308 6.0580 6.1456 6.4627 6.4844 6.6154 6.6492 6.8926 6.9165 6.9653 6.9969 7.2331 7.2790 7.3027 7.3120 k = 0.5351 0.0000 0.1616 ( 24817 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2841 -38.2839 -38.2618 -38.2616 -38.2589 -38.2587 -38.1762 -38.1760 -38.1759 -38.1758 -19.6211 -19.6116 -19.5775 -19.5694 -6.9941 -6.9760 -6.6816 -6.6215 -6.4141 -6.4017 -6.0014 -5.9884 -5.9228 -5.9117 -5.6808 -5.6679 -3.3918 -3.3897 -3.2215 -3.1648 -3.0929 -3.0559 -2.6564 -2.6316 -2.5628 -2.5024 -2.4314 -2.3876 5.5661 5.6026 6.0652 6.1501 6.4618 6.4772 6.5990 6.6333 6.8954 6.9264 6.9709 7.0149 7.2285 7.2735 7.2959 7.3157 k = 0.5351 0.0000 0.1414 ( 24819 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2840 -38.2839 -38.2619 -38.2617 -38.2588 -38.2586 -38.1762 -38.1760 -38.1759 -38.1757 -19.6224 -19.6127 -19.5763 -19.5682 -7.0051 -6.9861 -6.6723 -6.6031 -6.4209 -6.4049 -6.0110 -5.9886 -5.9153 -5.8986 -5.6831 -5.6717 -3.3868 -3.3806 -3.2262 -3.1764 -3.0819 -3.0481 -2.6640 -2.6415 -2.5714 -2.5061 -2.4251 -2.3815 5.5402 5.5767 6.0705 6.1519 6.4641 6.4729 6.5840 6.6179 6.8958 6.9284 6.9851 7.0344 7.2237 7.2686 7.2895 7.3194 k = 0.5351 0.0000 0.1212 ( 24845 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2840 -38.2839 -38.2620 -38.2618 -38.2587 -38.2586 -38.1762 -38.1760 -38.1759 -38.1757 -19.6235 -19.6138 -19.5752 -19.5670 -7.0147 -6.9950 -6.6643 -6.5857 -6.4280 -6.4077 -6.0205 -5.9909 -5.9047 -5.8849 -5.6864 -5.6768 -3.3806 -3.3699 -3.2325 -3.1888 -3.0721 -3.0401 -2.6705 -2.6504 -2.5797 -2.5099 -2.4195 -2.3760 5.5167 5.5534 6.0741 6.1518 6.4686 6.4709 6.5705 6.6036 6.8948 6.9266 7.0035 7.0538 7.2186 7.2644 7.2829 7.3238 k = 0.5351 0.0000 0.1010 ( 24847 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2838 -38.2620 -38.2619 -38.2586 -38.2585 -38.1762 -38.1760 -38.1759 -38.1757 -19.6245 -19.6147 -19.5742 -19.5660 -7.0230 -7.0025 -6.6577 -6.5694 -6.4352 -6.4099 -6.0291 -5.9942 -5.8926 -5.8714 -5.6907 -5.6830 -3.3733 -3.3580 -3.2403 -3.2018 -3.0639 -3.0322 -2.6759 -2.6583 -2.5875 -2.5137 -2.4145 -2.3713 5.4962 5.5332 6.0763 6.1507 6.4708 6.4743 6.5587 6.5906 6.8931 6.9239 7.0230 7.0721 7.2127 7.2608 7.2767 7.3294 k = 0.5351 0.0000 0.0808 ( 24840 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2838 -38.2621 -38.2619 -38.2586 -38.2584 -38.1762 -38.1760 -38.1759 -38.1757 -19.6254 -19.6154 -19.5734 -19.5652 -7.0297 -7.0088 -6.6525 -6.5545 -6.4426 -6.4116 -6.0365 -5.9975 -5.8802 -5.8587 -5.6956 -5.6898 -3.3651 -3.3451 -3.2490 -3.2154 -3.0571 -3.0249 -2.6800 -2.6649 -2.5944 -2.5173 -2.4104 -2.3674 5.4790 5.5162 6.0776 6.1490 6.4721 6.4804 6.5485 6.5791 6.8913 6.9213 7.0424 7.0882 7.2059 7.2578 7.2715 7.3341 k = 0.5351 0.0000 0.0606 ( 24852 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2621 -38.2620 -38.2585 -38.2584 -38.1762 -38.1760 -38.1759 -38.1757 -19.6260 -19.6160 -19.5728 -19.5646 -7.0350 -7.0137 -6.6485 -6.5412 -6.4499 -6.4128 -6.0424 -6.0003 -5.8687 -5.8474 -5.7007 -5.6966 -3.3567 -3.3315 -3.2580 -3.2292 -3.0520 -3.0186 -2.6830 -2.6701 -2.6001 -2.5204 -2.4071 -2.3643 5.4652 5.5028 6.0782 6.1473 6.4741 6.4861 6.5401 6.5695 6.8897 6.9192 7.0604 7.1015 7.1983 7.2553 7.2673 7.3317 k = 0.5351 0.0000 0.0404 ( 24857 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1762 -38.1760 -38.1759 -38.1757 -19.6265 -19.6165 -19.5723 -19.5641 -7.0388 -7.0172 -6.6457 -6.5301 -6.4566 -6.4136 -6.0468 -6.0026 -5.8592 -5.8383 -5.7052 -5.7027 -3.3488 -3.3180 -3.2664 -3.2429 -3.0483 -3.0139 -2.6850 -2.6738 -2.6045 -2.5228 -2.4047 -2.3620 5.4553 5.4931 6.0785 6.1460 6.4762 6.4910 6.5337 6.5620 6.8884 6.9177 7.0759 7.1113 7.1906 7.2533 7.2643 7.3296 k = 0.5351 0.0000 0.0202 ( 24868 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2584 -38.2583 -38.1762 -38.1760 -38.1759 -38.1757 -19.6268 -19.6167 -19.5721 -19.5638 -7.0411 -7.0193 -6.6441 -6.5223 -6.4618 -6.4141 -6.0495 -6.0039 -5.8528 -5.8324 -5.7084 -5.7069 -3.3427 -3.3061 -3.2727 -3.2547 -3.0462 -3.0109 -2.6862 -2.6761 -2.6073 -2.5243 -2.4032 -2.3606 5.4492 5.4872 6.0786 6.1451 6.4779 6.4944 6.5294 6.5573 6.8876 6.9167 7.0870 7.1174 7.1844 7.2520 7.2624 7.3283 k = 0.5351 0.0000 0.0000 ( 24862 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1760 -38.1759 -38.1757 -19.6269 -19.6168 -19.5720 -19.5637 -7.0419 -7.0201 -6.6436 -6.5194 -6.4638 -6.4142 -6.0504 -6.0044 -5.8505 -5.8303 -5.7096 -5.7085 -3.3404 -3.3006 -3.2752 -3.2603 -3.0455 -3.0099 -2.6866 -2.6768 -2.6082 -2.5249 -2.4027 -2.3602 5.4472 5.4852 6.0786 6.1448 6.4785 6.4957 6.5279 6.5557 6.8873 6.9164 7.0912 7.1195 7.1818 7.2515 7.2618 7.3279 k = 0.5083 0.0192 0.0000 ( 24874 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6230 -19.6206 -19.5688 -19.5669 -7.0375 -7.0323 -6.5965 -6.5670 -6.4461 -6.4343 -6.0311 -6.0198 -5.8420 -5.8367 -5.7104 -5.7093 -3.3248 -3.3153 -3.2676 -3.2640 -3.0326 -3.0239 -2.6789 -2.6764 -2.5758 -2.5560 -2.3860 -2.3757 5.4621 5.4711 6.1027 6.1182 6.4880 6.4999 6.5192 6.5337 6.9062 6.9145 7.0997 7.1067 7.2416 7.2515 7.2670 7.3115 k = 0.4816 0.0384 0.0000 ( 24876 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1761 -38.1759 -38.1757 -19.6244 -19.6191 -19.5700 -19.5657 -7.0438 -7.0323 -6.6124 -6.5471 -6.4542 -6.4284 -6.0358 -6.0103 -5.8424 -5.8297 -5.7152 -5.7105 -3.3282 -3.3072 -3.2703 -3.2618 -3.0410 -3.0212 -2.6806 -2.6752 -2.5889 -2.5452 -2.3896 -2.3667 5.4566 5.4765 6.0918 6.1258 6.4757 6.5019 6.5048 6.5374 6.9034 6.9218 7.0970 7.1123 7.2137 7.2518 7.2686 7.3436 k = 0.4548 0.0576 0.0000 ( 24851 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2621 -38.2584 -38.2583 -38.1762 -38.1760 -38.1759 -38.1757 -19.6281 -19.6154 -19.5731 -19.5627 -7.0541 -7.0260 -6.6551 -6.4961 -6.4730 -6.4113 -6.0519 -5.9881 -5.8481 -5.8142 -5.7266 -5.7095 -3.3391 -3.2878 -3.2792 -3.2579 -3.0610 -3.0105 -2.6887 -2.6759 -2.6233 -2.5170 -2.4016 -2.3461 5.4420 5.4905 6.0656 6.1476 6.4577 6.4707 6.5187 6.5509 6.8891 6.9268 7.0907 7.1270 7.1511 7.2604 7.2741 7.3270 k = 0.4281 0.0769 0.0000 ( 24840 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1763 -38.1760 -38.1759 -38.1757 -19.6317 -19.6119 -19.5760 -19.5597 -7.0629 -7.0188 -6.6947 -6.4901 -6.4438 -6.3952 -6.0675 -5.9654 -5.8536 -5.7967 -5.7431 -5.7073 -3.3481 -3.2902 -3.2668 -3.2566 -3.0823 -3.0000 -2.6997 -2.6813 -2.6587 -2.4913 -2.4117 -2.3252 5.4276 5.5041 6.0395 6.1682 6.4341 6.4479 6.5369 6.5606 6.8745 6.9101 7.0877 7.1100 7.1415 7.2706 7.2933 7.3101 k = 0.4013 0.0961 0.0000 ( 24828 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1763 -38.1760 -38.1760 -38.1756 -19.6351 -19.6087 -19.5787 -19.5570 -7.0697 -7.0105 -6.7310 -6.5047 -6.3910 -6.3803 -6.0821 -5.9449 -5.8576 -5.7786 -5.7641 -5.7040 -3.3551 -3.3026 -3.2592 -3.2445 -3.1019 -2.9898 -2.7131 -2.6947 -2.6913 -2.4684 -2.4205 -2.3054 5.4138 5.5173 6.0140 6.1879 6.3979 6.4470 6.5544 6.5677 6.8614 6.8705 7.0875 7.0958 7.1545 7.2808 7.2916 7.3231 k = 0.3745 0.1153 0.0000 ( 24844 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1763 -38.1760 -38.1759 -38.1756 -19.6382 -19.6058 -19.5811 -19.5545 -7.0743 -7.0010 -6.7637 -6.5162 -6.3667 -6.3386 -6.0954 -5.9310 -5.8570 -5.7889 -5.7615 -5.6996 -3.3602 -3.3157 -3.2674 -3.2212 -3.1163 -2.9801 -2.7309 -2.7280 -2.7052 -2.4487 -2.4285 -2.2878 5.4013 5.5301 5.9897 6.2073 6.3645 6.4542 6.5686 6.5732 6.8202 6.8541 7.0896 7.0970 7.1656 7.2704 7.2898 7.3608 k = 0.3478 0.1345 0.0000 ( 24840 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2583 -38.1764 -38.1760 -38.1759 -38.1756 -19.6410 -19.6033 -19.5832 -19.5523 -7.0760 -6.9903 -6.7926 -6.5243 -6.3546 -6.2876 -6.1071 -5.9283 -5.8492 -5.8163 -5.7462 -5.6943 -3.3636 -3.3286 -3.2811 -3.1976 -3.1233 -2.9716 -2.7667 -2.7437 -2.7218 -2.4365 -2.4322 -2.2733 5.3909 5.5425 5.9677 6.2272 6.3355 6.4676 6.5761 6.5778 6.7742 6.8528 7.0937 7.1045 7.1747 7.2460 7.2964 7.4023 k = 0.3210 0.1537 0.0000 ( 24826 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1759 -38.1755 -19.6434 -19.6013 -19.5849 -19.5505 -7.0745 -6.9783 -6.8175 -6.5284 -6.3444 -6.2398 -6.1169 -5.9348 -5.8447 -5.8379 -5.7337 -5.6882 -3.3653 -3.3402 -3.2983 -3.1741 -3.1232 -2.9652 -2.8014 -2.7594 -2.7397 -2.4449 -2.4192 -2.2627 5.3832 5.5543 5.9489 6.2484 6.3121 6.4843 6.5748 6.5824 6.7376 6.8605 7.0992 7.1148 7.1809 7.2197 7.2997 7.4309 k = 0.2943 0.1729 0.0000 ( 24837 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1759 -38.1755 -19.6454 -19.5998 -19.5863 -19.5490 -7.0694 -6.9650 -6.8381 -6.5285 -6.3365 -6.1980 -6.1246 -5.9464 -5.8712 -5.8291 -5.7243 -5.6815 -3.3654 -3.3497 -3.3154 -3.1515 -3.1177 -2.9619 -2.8341 -2.7749 -2.7567 -2.4543 -2.4097 -2.2565 5.3791 5.5656 5.9346 6.2711 6.2948 6.5003 6.5684 6.5873 6.7111 6.8773 7.1059 7.1262 7.1749 7.2014 7.2996 7.4070 k = 0.2675 0.1922 0.0000 ( 24822 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1758 -38.1755 -19.6469 -19.5986 -19.5874 -19.5480 -7.0605 -6.9505 -6.8544 -6.5243 -6.3318 -6.1664 -6.1298 -5.9602 -5.8914 -5.8269 -5.7185 -5.6744 -3.3642 -3.3563 -3.3295 -3.1310 -3.1086 -2.9624 -2.8634 -2.7911 -2.7698 -2.4647 -2.4039 -2.2553 5.3792 5.5761 5.9253 6.2841 6.2950 6.5095 6.5678 6.5932 6.6918 6.9006 7.1132 7.1371 7.1468 7.2019 7.2966 7.3766 k = 0.2408 0.2114 0.0000 ( 24820 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1758 -38.1755 -19.6479 -19.5978 -19.5882 -19.5473 -7.0477 -6.9350 -6.8663 -6.5159 -6.3307 -6.1513 -6.1321 -5.9751 -5.8993 -5.8331 -5.7168 -5.6670 -3.3616 -3.3595 -3.3386 -3.1144 -3.0973 -2.9664 -2.8875 -2.8080 -2.7778 -2.4761 -2.4017 -2.2593 5.3838 5.5856 5.9217 6.2802 6.3195 6.5095 6.5805 6.6005 6.6770 6.9265 7.1129 7.1210 7.1449 7.2047 7.2923 7.3469 k = 0.2140 0.2306 0.0000 ( 24824 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1765 -38.1761 -38.1758 -38.1755 -19.6484 -19.5971 -19.5890 -19.5471 -7.0310 -6.9188 -6.8736 -6.5033 -6.3336 -6.1562 -6.1317 -5.9899 -5.8912 -5.8479 -5.7201 -5.6596 -3.3588 -3.3580 -3.3420 -3.1040 -3.0849 -2.9726 -2.9036 -2.8242 -2.7817 -2.4883 -2.4032 -2.2686 5.3930 5.5941 5.9240 6.2832 6.3442 6.5084 6.6009 6.6093 6.6661 6.9507 7.0785 7.1277 7.1462 7.2054 7.2891 7.3204 k = 0.1873 0.2498 0.0000 ( 24814 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1765 -38.1761 -38.1758 -38.1755 -19.6483 -19.5966 -19.5898 -19.5473 -7.0107 -6.9023 -6.8764 -6.4870 -6.3403 -6.1780 -6.1290 -6.0042 -5.8703 -5.8703 -5.7291 -5.6525 -3.3540 -3.3533 -3.3397 -3.1020 -3.0726 -2.9785 -2.9094 -2.8382 -2.7835 -2.5007 -2.4082 -2.2830 5.4065 5.6013 5.9322 6.2935 6.3694 6.5113 6.6198 6.6202 6.6639 6.9691 7.0443 7.1321 7.1387 7.2027 7.2882 7.2995 k = 0.1605 0.2690 0.0000 ( 24817 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1758 -38.1755 -19.6478 -19.5962 -19.5904 -19.5479 -6.9873 -6.8861 -6.8746 -6.4674 -6.3498 -6.2104 -6.1251 -6.0175 -5.8983 -5.8429 -5.7440 -5.6460 -3.3478 -3.3457 -3.3326 -3.1082 -3.0619 -2.9803 -2.9045 -2.8494 -2.7851 -2.5128 -2.4165 -2.3024 5.4236 5.6071 5.9460 6.3114 6.3962 6.5174 6.6267 6.6320 6.6813 6.9778 7.0114 7.1235 7.1308 7.1984 7.2850 7.2860 k = 0.1338 0.2882 0.0000 ( 24824 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1758 -38.1755 -19.6468 -19.5964 -19.5905 -19.5489 -6.9619 -6.8710 -6.8683 -6.4455 -6.3603 -6.2483 -6.1217 -6.0299 -5.9291 -5.8141 -5.7643 -5.6404 -3.3414 -3.3349 -3.3217 -3.1204 -3.0542 -2.9745 -2.8912 -2.8573 -2.7880 -2.5240 -2.4280 -2.3262 5.4434 5.6116 5.9649 6.3372 6.4256 6.5240 6.6267 6.6454 6.7125 6.9744 6.9806 7.1046 7.1200 7.1972 7.2731 7.2751 k = 0.1070 0.3074 0.0000 ( 24830 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2848 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1759 -38.1755 -19.6453 -19.5975 -19.5899 -19.5503 -6.9357 -6.8579 -6.8574 -6.4233 -6.3688 -6.2888 -6.1206 -6.0424 -5.9581 -5.7890 -5.7867 -5.6360 -3.3343 -3.3230 -3.3089 -3.1354 -3.0488 -2.9597 -2.8723 -2.8618 -2.7936 -2.5335 -2.4425 -2.3537 5.4646 5.6147 5.9883 6.3710 6.4559 6.5303 6.6295 6.6595 6.7475 6.9530 6.9599 7.0851 7.0998 7.2005 7.2405 7.2667 k = 0.0803 0.3267 0.0000 ( 24810 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2841 -38.2837 -38.2623 -38.2620 -38.2585 -38.2582 -38.1764 -38.1761 -38.1759 -38.1755 -19.6434 -19.5993 -19.5885 -19.5520 -6.9108 -6.8480 -6.8421 -6.4059 -6.3692 -6.3300 -6.1237 -6.0573 -5.9795 -5.8161 -5.7624 -5.6332 -3.3264 -3.3110 -3.2961 -3.1508 -3.0427 -2.9373 -2.8630 -2.8499 -2.8025 -2.5411 -2.4597 -2.3835 5.4858 5.6164 6.0155 6.4121 6.4763 6.5448 6.6369 6.6731 6.7796 6.9299 6.9411 7.0656 7.0735 7.1908 7.2059 7.2576 k = 0.0535 0.3459 0.0000 ( 24804 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2840 -38.2837 -38.2623 -38.2620 -38.2585 -38.2583 -38.1764 -38.1760 -38.1759 -38.1756 -19.6411 -19.6015 -19.5867 -19.5539 -6.8900 -6.8424 -6.8225 -6.3983 -6.3709 -6.3562 -6.1320 -6.0747 -5.9900 -5.8429 -5.7423 -5.6323 -3.3177 -3.3000 -3.2849 -3.1654 -3.0331 -2.9100 -2.8615 -2.8254 -2.8148 -2.5470 -2.4792 -2.4137 5.5060 5.6167 6.0454 6.4589 6.4744 6.5781 6.6468 6.6853 6.8001 6.9130 6.9297 7.0435 7.0461 7.1340 7.2115 7.2463 k = 0.0268 0.3651 0.0000 ( 24803 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1763 -38.1760 -38.1759 -38.1756 -19.6385 -19.6041 -19.5846 -19.5561 -6.8765 -6.8417 -6.7987 -6.4106 -6.3917 -6.3389 -6.1447 -6.0910 -5.9920 -5.8657 -5.7266 -5.6339 -3.3079 -3.2906 -3.2762 -3.1784 -3.0191 -2.8813 -2.8587 -2.8285 -2.7996 -2.5516 -2.5009 -2.4415 5.5240 5.6157 6.0773 6.4574 6.5067 6.6163 6.6563 6.6955 6.8042 6.9032 6.9344 7.0125 7.0266 7.0821 7.2159 7.2330 k = 0.0000 0.3843 0.0000 ( 24812 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2845 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1763 -38.1760 -38.1760 -38.1756 -19.6357 -19.6069 -19.5823 -19.5585 -6.8732 -6.8463 -6.7710 -6.4486 -6.3796 -6.3253 -6.1575 -6.1052 -5.9877 -5.8814 -5.7156 -5.6385 -3.2969 -3.2832 -3.2701 -3.1895 -3.0010 -2.8642 -2.8554 -2.8335 -2.7731 -2.5552 -2.5243 -2.4630 5.5392 5.6131 6.1100 6.4319 6.5472 6.6314 6.6672 6.7041 6.8084 6.9001 6.9449 6.9864 7.0079 7.0500 7.2183 7.2192 k = 0.0000 0.3651 0.0202 ( 24810 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2840 -38.2838 -38.2622 -38.2620 -38.2585 -38.2583 -38.1763 -38.1760 -38.1759 -38.1756 -19.6385 -19.6040 -19.5848 -19.5562 -6.8698 -6.8381 -6.7996 -6.4168 -6.3944 -6.3313 -6.1447 -6.0929 -5.9946 -5.8712 -5.7252 -5.6333 -3.3125 -3.2845 -3.2772 -3.1754 -3.0215 -2.8738 -2.8591 -2.8393 -2.7953 -2.5521 -2.5012 -2.4466 5.5272 5.6185 6.0776 6.4579 6.5128 6.6346 6.6532 6.6990 6.8029 6.8969 6.9409 6.9968 7.0269 7.0764 7.2245 7.2249 k = 0.0000 0.3459 0.0404 ( 24802 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2840 -38.2837 -38.2622 -38.2620 -38.2585 -38.2583 -38.1764 -38.1760 -38.1759 -38.1756 -19.6411 -19.6009 -19.5874 -19.5541 -6.8641 -6.8293 -6.8250 -6.4086 -6.4062 -6.3164 -6.1297 -6.0857 -5.9982 -5.8635 -5.7365 -5.6300 -3.3284 -3.2869 -3.2831 -3.1551 -3.0436 -2.8925 -2.8735 -2.8442 -2.8021 -2.5484 -2.4810 -2.4319 5.5188 5.6281 6.0464 6.4772 6.4781 6.6290 6.6355 6.7022 6.8112 6.8904 6.9422 6.9994 7.0427 7.1148 7.2303 7.2312 k = 0.0000 0.3267 0.0606 ( 24813 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2841 -38.2837 -38.2622 -38.2619 -38.2586 -38.2583 -38.1764 -38.1761 -38.1759 -38.1755 -19.6433 -19.5978 -19.5903 -19.5523 -6.8560 -6.8495 -6.8173 -6.4219 -6.4166 -6.2805 -6.1135 -6.0870 -5.9953 -5.8580 -5.7492 -5.6283 -3.3422 -3.2970 -3.2815 -3.1307 -3.0670 -2.9137 -2.9008 -2.8478 -2.7968 -2.5446 -2.4644 -2.4191 5.5139 5.6419 6.0167 6.4450 6.4891 6.5996 6.6304 6.7181 6.8261 6.8856 6.9452 7.0001 7.0563 7.1553 7.2355 7.2409 k = 0.0000 0.3074 0.0808 ( 24826 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2841 -38.2837 -38.2622 -38.2619 -38.2586 -38.2583 -38.1764 -38.1761 -38.1758 -38.1755 -19.6453 -19.5946 -19.5932 -19.5507 -6.8697 -6.8458 -6.8057 -6.4346 -6.4344 -6.2368 -6.0975 -6.0968 -5.9859 -5.8545 -5.7630 -5.6283 -3.3537 -3.3067 -3.2803 -3.1034 -3.0910 -2.9390 -2.9299 -2.8498 -2.7880 -2.5411 -2.4522 -2.4080 5.5125 5.6600 5.9886 6.4145 6.4947 6.5698 6.6202 6.7450 6.8402 6.8869 6.9480 6.9993 7.0705 7.1886 7.2405 7.2590 k = 0.0000 0.2882 0.1010 ( 24806 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2841 -38.2837 -38.2621 -38.2618 -38.2587 -38.2584 -38.1764 -38.1761 -38.1758 -38.1755 -19.6469 -19.5963 -19.5913 -19.5494 -6.8867 -6.8335 -6.7934 -6.4547 -6.4458 -6.1908 -6.1146 -6.0801 -5.9727 -5.8526 -5.7777 -5.6295 -3.3631 -3.3152 -3.2797 -3.1164 -3.0729 -2.9709 -2.9545 -2.8497 -2.7786 -2.5384 -2.4447 -2.3985 5.5146 5.6825 5.9623 6.3876 6.4959 6.5423 6.6072 6.7775 6.8483 6.8967 6.9501 6.9972 7.0862 7.2093 7.2451 7.2898 k = 0.0000 0.2690 0.1212 ( 24813 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2842 -38.2837 -38.2621 -38.2617 -38.2588 -38.2585 -38.1765 -38.1762 -38.1758 -38.1755 -19.6482 -19.5995 -19.5880 -19.5483 -6.9001 -6.8193 -6.7811 -6.4753 -6.4562 -6.1446 -6.1360 -6.0637 -5.9580 -5.8519 -5.7927 -5.6319 -3.3706 -3.3225 -3.2797 -3.1416 -3.0412 -3.0043 -2.9777 -2.8468 -2.7695 -2.5370 -2.4420 -2.3911 5.5201 5.7095 5.9378 6.3648 6.4942 6.5190 6.5930 6.8105 6.8521 6.9113 6.9515 6.9940 7.1039 7.2229 7.2494 7.3267 k = 0.0000 0.2498 0.1414 ( 24788 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2842 -38.2837 -38.2620 -38.2616 -38.2589 -38.2586 -38.1765 -38.1762 -38.1757 -38.1755 -19.6492 -19.6029 -19.5847 -19.5474 -6.9100 -6.8033 -6.7691 -6.4956 -6.4655 -6.1603 -6.0998 -6.0477 -5.9433 -5.8517 -5.8077 -5.6352 -3.3763 -3.3285 -3.2805 -3.1668 -3.0370 -3.0083 -3.0005 -2.8407 -2.7608 -2.5373 -2.4439 -2.3862 5.5286 5.7412 5.9151 6.3468 6.4908 6.5012 6.5782 6.8378 6.8546 6.9257 6.9525 6.9916 7.1240 7.2358 7.2531 7.3589 k = 0.0000 0.2306 0.1616 ( 24798 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2842 -38.2837 -38.2619 -38.2615 -38.2590 -38.2586 -38.1765 -38.1762 -38.1757 -38.1755 -19.6499 -19.6063 -19.5813 -19.5468 -6.9163 -6.7859 -6.7580 -6.5152 -6.4737 -6.1866 -6.0590 -6.0312 -5.9292 -5.8511 -5.8220 -5.6393 -3.3805 -3.3333 -3.2823 -3.1918 -3.0679 -3.0229 -2.9749 -2.8307 -2.7525 -2.5394 -2.4500 -2.3842 5.5398 5.7774 5.8936 6.3342 6.4865 6.4901 6.5636 6.8514 6.8562 6.9372 6.9537 6.9946 7.1467 7.2505 7.2562 7.3736 k = 0.0000 0.2114 0.1818 ( 24802 PWs) bands (ev): -69.4034 -69.4033 -69.4032 -69.4031 -38.2847 -38.2842 -38.2842 -38.2837 -38.2618 -38.2614 -38.2591 -38.2588 -38.1765 -38.1763 -38.1757 -38.1754 -19.6502 -19.6098 -19.5780 -19.5464 -6.9190 -6.7673 -6.7485 -6.5337 -6.4806 -6.2142 -6.0299 -6.0086 -5.9163 -5.8485 -5.8352 -5.6438 -3.3835 -3.3373 -3.2853 -3.2161 -3.0962 -3.0445 -2.9418 -2.8161 -2.7445 -2.5437 -2.4601 -2.3853 5.5532 5.8184 5.8731 6.3275 6.4817 6.4863 6.5492 6.8452 6.8560 6.9446 6.9561 7.0069 7.1720 7.2586 7.2665 7.3673 k = 0.0000 0.1922 0.2020 ( 24814 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2842 -38.2837 -38.2617 -38.2612 -38.2593 -38.2589 -38.1765 -38.1763 -38.1756 -38.1754 -19.6502 -19.6133 -19.5748 -19.5463 -6.9182 -6.7479 -6.7412 -6.5510 -6.4861 -6.2426 -6.0145 -5.9805 -5.9049 -5.8468 -5.8417 -5.6486 -3.3854 -3.3407 -3.2901 -3.2396 -3.1209 -3.0652 -2.9096 -2.7963 -2.7366 -2.5501 -2.4738 -2.3899 5.5683 5.8532 5.8639 6.3273 6.4766 6.4905 6.5355 6.8208 6.8520 6.9475 6.9606 7.0260 7.1996 7.2600 7.2794 7.3556 k = 0.0000 0.1729 0.2222 ( 24805 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2841 -38.2838 -38.2615 -38.2611 -38.2594 -38.2590 -38.1765 -38.1763 -38.1756 -38.1754 -19.6499 -19.6169 -19.5716 -19.5464 -6.9140 -6.7370 -6.7282 -6.5668 -6.4897 -6.2712 -6.0036 -5.9593 -5.8950 -5.8565 -5.8282 -5.6534 -3.3866 -3.3437 -3.2970 -3.2618 -3.1414 -3.0847 -2.8788 -2.7714 -2.7285 -2.5586 -2.4909 -2.3980 5.5845 5.8334 5.9140 6.3343 6.4715 6.5029 6.5227 6.7831 6.8421 6.9458 6.9675 7.0473 7.2288 7.2589 7.2803 7.3283 k = 0.0000 0.1537 0.2424 ( 24804 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2847 -38.2843 -38.2841 -38.2838 -38.2614 -38.2610 -38.2595 -38.2591 -38.1765 -38.1764 -38.1756 -38.1754 -19.6492 -19.6205 -19.5684 -19.5467 -6.9065 -6.7366 -6.7086 -6.5811 -6.4910 -6.2995 -5.9947 -5.9478 -5.8867 -5.8638 -5.8077 -5.6580 -3.3871 -3.3465 -3.3063 -3.2826 -3.1570 -3.1029 -2.8490 -2.7418 -2.7200 -2.5691 -2.5110 -2.4095 5.6011 5.8133 5.9684 6.3490 6.4663 6.5108 6.5234 6.7360 6.8250 6.9390 6.9769 7.0684 7.2471 7.2577 7.2697 7.2927 k = 0.0000 0.1345 0.2626 ( 24792 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2847 -38.2844 -38.2841 -38.2838 -38.2613 -38.2608 -38.2597 -38.2593 -38.1765 -38.1764 -38.1755 -38.1754 -19.6483 -19.6241 -19.5654 -19.5472 -6.8961 -6.7407 -6.6897 -6.5936 -6.4895 -6.3272 -5.9872 -5.9439 -5.8802 -5.8687 -5.7830 -5.6624 -3.3870 -3.3491 -3.3178 -3.3016 -3.1678 -3.1196 -2.8196 -2.7108 -2.7088 -2.5813 -2.5339 -2.4244 5.6174 5.7928 6.0268 6.3718 6.4610 6.5000 6.5515 6.6821 6.7997 6.9266 6.9880 7.0884 7.2099 7.2496 7.2812 7.2916 k = 0.0000 0.1153 0.2828 ( 24789 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2844 -38.2840 -38.2838 -38.2611 -38.2606 -38.2599 -38.2594 -38.1765 -38.1764 -38.1755 -38.1754 -19.6471 -19.6276 -19.5625 -19.5480 -6.8830 -6.7493 -6.6721 -6.6044 -6.4851 -6.3539 -5.9809 -5.9447 -5.8758 -5.8709 -5.7575 -5.6665 -3.3863 -3.3518 -3.3308 -3.3185 -3.1744 -3.1347 -2.7899 -2.7008 -2.6738 -2.5949 -2.5590 -2.4426 5.6332 5.7716 6.0889 6.4027 6.4550 6.4906 6.5867 6.6241 6.7660 6.9075 7.0000 7.1073 7.1641 7.2319 7.2809 7.3224 k = 0.0000 0.0961 0.3030 ( 24793 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2838 -38.2610 -38.2605 -38.2600 -38.2596 -38.1765 -38.1764 -38.1755 -38.1754 -19.6456 -19.6311 -19.5596 -19.5489 -6.8675 -6.7624 -6.6564 -6.6132 -6.4775 -6.3793 -5.9752 -5.9479 -5.8738 -5.8699 -5.7335 -5.6705 -3.3850 -3.3545 -3.3443 -3.3332 -3.1777 -3.1482 -2.7596 -2.6897 -2.6384 -2.6097 -2.5855 -2.4639 5.6480 5.7497 6.1542 6.4415 6.4463 6.4829 6.5653 6.6278 6.7245 6.8805 7.0119 7.1216 7.1253 7.2147 7.2833 7.3394 k = 0.0000 0.0769 0.3232 ( 24795 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2846 -38.2845 -38.2840 -38.2839 -38.2608 -38.2603 -38.2602 -38.2597 -38.1765 -38.1765 -38.1755 -38.1754 -19.6438 -19.6345 -19.5569 -19.5501 -6.8501 -6.7793 -6.6432 -6.6200 -6.4670 -6.4032 -5.9698 -5.9521 -5.8721 -5.8681 -5.7124 -5.6746 -3.3831 -3.3574 -3.3570 -3.3454 -3.1788 -3.1600 -2.7284 -2.6774 -2.6250 -2.6201 -2.5965 -2.4880 5.6618 5.7269 6.2218 6.4281 6.4772 6.4876 6.5138 6.6712 6.6795 6.8450 7.0234 7.0863 7.1425 7.1985 7.2869 7.3168 k = 0.0000 0.0576 0.3433 ( 24798 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2846 -38.2845 -38.2839 -38.2839 -38.2606 -38.2604 -38.2602 -38.2599 -38.1765 -38.1765 -38.1754 -38.1754 -19.6418 -19.6377 -19.5544 -19.5514 -6.8312 -6.7990 -6.6331 -6.6250 -6.4539 -6.4257 -5.9644 -5.9566 -5.8693 -5.8670 -5.6947 -5.6792 -3.3805 -3.3695 -3.3594 -3.3551 -3.1782 -3.1702 -2.6964 -2.6640 -2.6473 -2.6406 -2.5638 -2.5147 5.6748 5.7033 6.2903 6.3876 6.4742 6.4840 6.5397 6.6248 6.7238 6.8017 7.0343 7.0591 7.1591 7.1832 7.2912 7.3018 k = 0.0000 0.0384 0.3635 ( 24798 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2846 -38.2845 -38.2839 -38.2839 -38.2605 -38.2605 -38.2601 -38.2600 -38.1765 -38.1765 -38.1754 -38.1754 -19.6408 -19.6396 -19.5529 -19.5520 -6.8207 -6.8115 -6.6281 -6.6264 -6.4466 -6.4386 -5.9607 -5.9585 -5.8666 -5.8658 -5.6848 -5.6807 -3.3801 -3.3771 -3.3623 -3.3613 -3.1786 -3.1764 -2.6779 -2.6640 -2.6561 -2.6495 -2.5435 -2.5296 5.6789 5.6869 6.3289 6.3565 6.4735 6.4759 6.5719 6.5961 6.7528 6.7752 7.0387 7.0450 7.1687 7.1753 7.2939 7.2962 k = 0.0000 0.0192 0.3837 ( 24774 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4032 -38.2846 -38.2845 -38.2839 -38.2839 -38.2607 -38.2603 -38.2602 -38.2598 -38.1765 -38.1765 -38.1754 -38.1754 -19.6437 -19.6373 -19.5546 -19.5499 -6.8433 -6.7914 -6.6299 -6.6227 -6.4658 -6.4212 -5.9643 -5.9520 -5.8666 -5.8618 -5.6919 -5.6701 -3.3890 -3.3728 -3.3671 -3.3624 -3.1852 -3.1736 -2.7092 -2.6711 -2.6340 -2.6315 -2.5743 -2.4969 5.6536 5.6986 6.2642 6.4082 6.4712 6.4934 6.5200 6.6532 6.7021 6.8261 7.0237 7.0564 7.1548 7.1914 7.2923 7.3025 k = 0.0000 0.0000 0.4039 ( 24780 PWs) bands (ev): -69.4033 -69.4033 -69.4032 -69.4031 -38.2846 -38.2845 -38.2840 -38.2838 -38.2609 -38.2604 -38.2601 -38.2597 -38.1765 -38.1765 -38.1755 -38.1754 -19.6464 -19.6347 -19.5564 -19.5479 -6.8660 -6.7719 -6.6319 -6.6209 -6.4831 -6.4020 -5.9673 -5.9448 -5.8666 -5.8579 -5.7012 -5.6625 -3.3963 -3.3701 -3.3679 -3.3621 -3.1899 -3.1699 -2.7406 -2.6852 -2.6179 -2.6064 -2.5993 -2.4662 5.6277 5.7100 6.1986 6.4295 6.4711 6.4723 6.5427 6.6438 6.7164 6.8734 7.0131 7.0702 7.1415 7.2075 7.2956 7.3121 ------ SPIN DOWN ---------- k = 0.0000 0.0000 0.0000 ( 24815 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3621 -34.3615 -34.3615 -34.3609 -34.1894 -34.1888 -34.1829 -34.1824 -33.8176 -33.8171 -33.8164 -33.8160 -19.6553 -19.5956 -19.5599 -19.5164 -6.9588 -6.5424 -6.5089 -6.4970 -6.4969 -6.0333 -5.8360 -5.6942 -5.6890 -5.6661 -5.6124 -5.5770 -3.3948 -3.3780 -3.3663 -3.3351 -3.1233 -3.0948 -3.0529 -2.8514 -2.7637 -2.3967 -2.2105 -2.2054 5.6205 6.2492 6.3310 6.7415 7.0481 7.2206 7.2397 7.4557 7.4680 7.5571 7.5712 7.6845 7.7831 7.8999 8.0333 8.1230 k = 0.0268 0.0192 0.0202 ( 24790 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3621 -34.3615 -34.3615 -34.3609 -34.1894 -34.1888 -34.1829 -34.1824 -33.8176 -33.8171 -33.8164 -33.8160 -19.6549 -19.5955 -19.5600 -19.5167 -6.9552 -6.5714 -6.5092 -6.4891 -6.4772 -6.0361 -5.8335 -5.7167 -5.6749 -5.6734 -5.6143 -5.5687 -3.3954 -3.3790 -3.3664 -3.3265 -3.1181 -3.0953 -3.0478 -2.8502 -2.7632 -2.3982 -2.2169 -2.2039 5.6250 6.2518 6.3305 6.7477 7.0474 7.2209 7.2398 7.4572 7.4706 7.5516 7.5751 7.6786 7.7827 7.8997 8.0213 8.1001 k = 0.0535 0.0384 0.0404 ( 24784 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3621 -34.3615 -34.3615 -34.3609 -34.1894 -34.1888 -34.1829 -34.1824 -33.8175 -33.8171 -33.8164 -33.8160 -19.6537 -19.5953 -19.5604 -19.5176 -6.9446 -6.6121 -6.5232 -6.4801 -6.4365 -6.0430 -5.8284 -5.7459 -5.6965 -5.6656 -5.6135 -5.5524 -3.4005 -3.3789 -3.3618 -3.3057 -3.1040 -3.0966 -3.0318 -2.8472 -2.7617 -2.4026 -2.2297 -2.2054 5.6383 6.2594 6.3290 6.7660 7.0448 7.2217 7.2399 7.4615 7.4770 7.5358 7.5864 7.6638 7.7799 7.8942 7.9892 8.0577 k = 0.0803 0.0576 0.0606 ( 24774 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3621 -34.3615 -34.3615 -34.3609 -34.1893 -34.1887 -34.1830 -34.1825 -33.8175 -33.8171 -33.8164 -33.8160 -19.6518 -19.5948 -19.5611 -19.5190 -6.9273 -6.6525 -6.5428 -6.4699 -6.3960 -6.0515 -5.8283 -5.7754 -5.7245 -5.6641 -5.6092 -5.5357 -3.4104 -3.3747 -3.3510 -3.2789 -3.0965 -3.0830 -3.0051 -2.8434 -2.7589 -2.4100 -2.2470 -2.2106 5.6601 6.2712 6.3264 6.7959 7.0393 7.2234 7.2396 7.4653 7.4800 7.5162 7.6044 7.6466 7.7711 7.8717 7.9358 8.0231 k = 0.1070 0.0769 0.0808 ( 24780 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3621 -34.3615 -34.3615 -34.3609 -34.1892 -34.1887 -34.1831 -34.1826 -33.8175 -33.8171 -33.8165 -33.8160 -19.6492 -19.5942 -19.5621 -19.5210 -6.9036 -6.6912 -6.5678 -6.4597 -6.3573 -6.0585 -5.8449 -5.8062 -5.7426 -5.6657 -5.6044 -5.5211 -3.4208 -3.3663 -3.3379 -3.2523 -3.0896 -3.0558 -2.9704 -2.8397 -2.7548 -2.4200 -2.2679 -2.2187 5.6896 6.2859 6.3230 6.8360 7.0293 7.2261 7.2388 7.4400 7.4806 7.5166 7.6232 7.6347 7.7526 7.8360 7.8590 8.0207 k = 0.1338 0.0961 0.1010 ( 24794 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3621 -34.3615 -34.3615 -34.3609 -34.1891 -34.1886 -34.1832 -34.1827 -33.8175 -33.8170 -33.8165 -33.8161 -19.6459 -19.5935 -19.5632 -19.5236 -6.8742 -6.7276 -6.5972 -6.4518 -6.3208 -6.0624 -5.8747 -5.8471 -5.7427 -5.6676 -5.6002 -5.5102 -3.4287 -3.3543 -3.3264 -3.2331 -3.0689 -3.0218 -2.9323 -2.8360 -2.7499 -2.4320 -2.2917 -2.2283 5.7260 6.3015 6.3194 6.8834 7.0142 7.2296 7.2374 7.3860 7.4846 7.5292 7.6127 7.6515 7.7237 7.7782 7.8094 8.0264 k = 0.1605 0.1153 0.1212 ( 24809 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3615 -34.3610 -34.1889 -34.1884 -34.1833 -34.1829 -33.8174 -33.8170 -33.8165 -33.8161 -19.6420 -19.5927 -19.5645 -19.5266 -6.8403 -6.7610 -6.6298 -6.4496 -6.2861 -6.0637 -5.9082 -5.8918 -5.7358 -5.6682 -5.5964 -5.5040 -3.4327 -3.3399 -3.3189 -3.2237 -3.0316 -2.9819 -2.8998 -2.8260 -2.7459 -2.4449 -2.3176 -2.2381 5.7680 6.3081 6.3243 6.9298 6.9977 7.2334 7.2365 7.3231 7.4835 7.5428 7.5892 7.6607 7.6963 7.7105 7.8012 8.0064 k = 0.1873 0.1345 0.1414 ( 24811 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3615 -34.3610 -34.1887 -34.1883 -34.1834 -34.1830 -33.8174 -33.8170 -33.8165 -33.8162 -19.6376 -19.5917 -19.5660 -19.5301 -6.8043 -6.7903 -6.6641 -6.4558 -6.2528 -6.0670 -5.9462 -5.9241 -5.7286 -5.6662 -5.5927 -5.5027 -3.4319 -3.3277 -3.3127 -3.2198 -2.9827 -2.9406 -2.8834 -2.7983 -2.7452 -2.4569 -2.3439 -2.2473 5.8144 6.3027 6.3397 6.9361 7.0121 7.2325 7.2394 7.2646 7.4731 7.5353 7.5763 7.6326 7.6676 7.6882 7.8126 7.9931 k = 0.2140 0.1537 0.1616 ( 24812 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3615 -34.3610 -34.1886 -34.1881 -34.1836 -34.1832 -33.8173 -33.8170 -33.8166 -33.8162 -19.6327 -19.5907 -19.5674 -19.5339 -6.8189 -6.7648 -6.6980 -6.4716 -6.2227 -6.0803 -5.9812 -5.9367 -5.7228 -5.6613 -5.5890 -5.5067 -3.4262 -3.3275 -3.2983 -3.2167 -2.9313 -2.9168 -2.8617 -2.7579 -2.7485 -2.4677 -2.3679 -2.2555 5.8639 6.2951 6.3550 6.8985 7.0502 7.2047 7.2421 7.2500 7.4438 7.5129 7.5836 7.5904 7.6417 7.6861 7.8316 7.9883 k = 0.2408 0.1729 0.1818 ( 24829 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3615 -34.3615 -34.3611 -34.1883 -34.1880 -34.1838 -34.1834 -33.8173 -33.8170 -33.8166 -33.8163 -19.6275 -19.5897 -19.5689 -19.5380 -6.8419 -6.7422 -6.7172 -6.4962 -6.2035 -6.1003 -6.0031 -5.9319 -5.7179 -5.6544 -5.5857 -5.5156 -3.4160 -3.3332 -3.2803 -3.2121 -2.9299 -2.8773 -2.8172 -2.7585 -2.7098 -2.4793 -2.3850 -2.2625 5.9149 6.2870 6.3682 6.8449 7.0673 7.1883 7.2425 7.2597 7.4024 7.5067 7.5438 7.6031 7.6088 7.6856 7.8443 7.9906 k = 0.2675 0.1922 0.2020 ( 24832 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3615 -34.3615 -34.3611 -34.1881 -34.1878 -34.1840 -34.1837 -33.8172 -33.8169 -33.8166 -33.8163 -19.6221 -19.5887 -19.5703 -19.5425 -6.8610 -6.7678 -6.6917 -6.5280 -6.2070 -6.1106 -6.0071 -5.9166 -5.7125 -5.6464 -5.5833 -5.5287 -3.4017 -3.3392 -3.2627 -3.2055 -2.9497 -2.8491 -2.7727 -2.7504 -2.6633 -2.4959 -2.3905 -2.2685 5.9662 6.2792 6.3787 6.7818 7.0606 7.2001 7.2376 7.2717 7.3680 7.5114 7.5135 7.5697 7.6128 7.6834 7.8440 7.9948 k = 0.2943 0.2114 0.2222 ( 24828 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3615 -34.3615 -34.3612 -34.1879 -34.1876 -34.1842 -34.1839 -33.8172 -33.8169 -33.8166 -33.8164 -19.6166 -19.5878 -19.5715 -19.5471 -6.8760 -6.7956 -6.6719 -6.5648 -6.2234 -6.1149 -5.9900 -5.8974 -5.7057 -5.6384 -5.5830 -5.5443 -3.3842 -3.3425 -3.2472 -3.1969 -2.9738 -2.8585 -2.7428 -2.7042 -2.6176 -2.5176 -2.3844 -2.2736 6.0169 6.2729 6.3859 6.7143 7.0533 7.2156 7.2271 7.2797 7.3475 7.4926 7.5177 7.5349 7.6162 7.6792 7.8301 7.9953 k = 0.3210 0.2306 0.2424 ( 24827 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3615 -34.3615 -34.3612 -34.1876 -34.1873 -34.1844 -34.1842 -33.8171 -33.8169 -33.8167 -33.8164 -19.6110 -19.5870 -19.5726 -19.5518 -6.8867 -6.8198 -6.6690 -6.6045 -6.2323 -6.1205 -5.9583 -5.8782 -5.6965 -5.6313 -5.5872 -5.5587 -3.3645 -3.3412 -3.2348 -3.1872 -2.9988 -2.8876 -2.7158 -2.6541 -2.5738 -2.5389 -2.3710 -2.2779 6.0663 6.2693 6.3900 6.6475 7.0555 7.2038 7.2357 7.2834 7.3360 7.4724 7.4842 7.5495 7.6126 7.6736 7.8052 7.9843 k = 0.3478 0.2498 0.2626 ( 24820 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3615 -34.3615 -34.3612 -34.1873 -34.1871 -34.1847 -34.1844 -33.8171 -33.8169 -33.8167 -33.8165 -19.6054 -19.5863 -19.5735 -19.5565 -6.8928 -6.8392 -6.6853 -6.6453 -6.2255 -6.1252 -5.9220 -5.8615 -5.6847 -5.6264 -5.5979 -5.5673 -3.3442 -3.3340 -3.2258 -3.1788 -3.0214 -2.9222 -2.6974 -2.6220 -2.5487 -2.5283 -2.3544 -2.2817 6.1142 6.2693 6.3912 6.5846 7.0684 7.1872 7.2441 7.2855 7.3273 7.4248 7.4792 7.5632 7.6036 7.6670 7.7733 7.9436 k = 0.3745 0.2690 0.2828 ( 24816 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3615 -34.3613 -34.1870 -34.1868 -34.1849 -34.1847 -33.8170 -33.8169 -33.8167 -33.8165 -19.6001 -19.5858 -19.5742 -19.5612 -6.8943 -6.8533 -6.7162 -6.6872 -6.2046 -6.1269 -5.8883 -5.8490 -5.6706 -5.6280 -5.6055 -5.5721 -3.3261 -3.3188 -3.2199 -3.1761 -3.0368 -2.9563 -2.6893 -2.6299 -2.5185 -2.4901 -2.3373 -2.2851 6.1607 6.2735 6.3902 6.5278 7.0903 7.1752 7.2452 7.2877 7.3187 7.3770 7.4812 7.5546 7.5998 7.6596 7.7375 7.8723 k = 0.4013 0.2882 0.3030 ( 24828 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3615 -34.3615 -34.3613 -34.1868 -34.1866 -34.1852 -34.1850 -33.8170 -33.8168 -33.8167 -33.8166 -19.5950 -19.5853 -19.5747 -19.5657 -6.8911 -6.8616 -6.7536 -6.7310 -6.1756 -6.1246 -5.8634 -5.8415 -5.6554 -5.6338 -5.6041 -5.5765 -3.3084 -3.2991 -3.2170 -3.1825 -3.0413 -2.9858 -2.6906 -2.6548 -2.4769 -2.4553 -2.3217 -2.2884 6.2059 6.2817 6.3880 6.4779 7.1172 7.1686 7.2406 7.2863 7.3085 7.3372 7.4837 7.5240 7.6030 7.6513 7.6998 7.7935 k = 0.4281 0.3074 0.3232 ( 24844 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1865 -34.1863 -34.1854 -34.1853 -33.8169 -33.8168 -33.8167 -33.8166 -19.5903 -19.5848 -19.5752 -19.5700 -6.8833 -6.8640 -6.7921 -6.7756 -6.1442 -6.1181 -5.8513 -5.8404 -5.6410 -5.6311 -5.5998 -5.5816 -3.2886 -3.2804 -3.2176 -3.1970 -3.0359 -3.0069 -2.6999 -2.6828 -2.4378 -2.4255 -2.3089 -2.2918 6.2496 6.2931 6.3857 6.4355 7.1432 7.1666 7.2328 7.2650 7.3037 7.3171 7.4729 7.4874 7.6061 7.6418 7.6685 7.7288 k = 0.4548 0.3267 0.3433 ( 24827 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1862 -34.1860 -34.1857 -34.1856 -33.8169 -33.8168 -33.8167 -33.8167 -19.5862 -19.5843 -19.5755 -19.5737 -6.8710 -6.8606 -6.8285 -6.8188 -6.1156 -6.1079 -5.8504 -5.8467 -5.6257 -5.6204 -5.5949 -5.5873 -3.2684 -3.2643 -3.2218 -3.2144 -3.0247 -3.0164 -2.7150 -2.7102 -2.4057 -2.4017 -2.2997 -2.2946 6.2895 6.3050 6.3852 6.4023 7.1597 7.1657 7.2236 7.2340 7.3050 7.3091 7.4422 7.4491 7.6146 7.6335 7.6562 7.6824 k = 0.4816 0.3459 0.3635 ( 24848 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1860 -34.1859 -34.1859 -34.1857 -33.8169 -33.8168 -33.8167 -33.8167 -19.5839 -19.5837 -19.5761 -19.5758 -6.8663 -6.8635 -6.8495 -6.8468 -6.0947 -6.0938 -5.8574 -5.8569 -5.6103 -5.6090 -5.5915 -5.5900 -3.2525 -3.2516 -3.2291 -3.2279 -3.0132 -3.0122 -2.7345 -2.7339 -2.3848 -2.3843 -2.2947 -2.2941 6.3127 6.3147 6.3881 6.3902 7.1560 7.1567 7.2144 7.2155 7.3034 7.3038 7.4145 7.4156 7.6257 7.6296 7.6537 7.6583 k = 0.5083 0.3651 0.3837 ( 24846 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1863 -34.1862 -34.1856 -34.1855 -33.8169 -33.8168 -33.8167 -33.8167 -19.5843 -19.5837 -19.5759 -19.5754 -6.8966 -6.8951 -6.8321 -6.8307 -6.0823 -6.0800 -5.8680 -5.8665 -5.6062 -5.6033 -5.5858 -5.5825 -3.2506 -3.2486 -3.2308 -3.2280 -3.0013 -2.9990 -2.7544 -2.7530 -2.3771 -2.3759 -2.2912 -2.2898 6.3082 6.3115 6.4043 6.4079 7.1284 7.1303 7.2116 7.2136 7.2956 7.2963 7.4047 7.4070 7.6119 7.6162 7.6677 7.6736 k = 0.5351 0.3843 0.4039 ( 24835 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1866 -34.1864 -34.1853 -34.1852 -33.8169 -33.8168 -33.8167 -33.8167 -19.5866 -19.5841 -19.5756 -19.5731 -6.9268 -6.9210 -6.8102 -6.8051 -6.0828 -6.0670 -5.8806 -5.8695 -5.6127 -5.5999 -5.5837 -5.5685 -3.2579 -3.2513 -3.2294 -3.2181 -2.9936 -2.9784 -2.7735 -2.7635 -2.3831 -2.3763 -2.2898 -2.2814 6.2873 6.3016 6.4261 6.4427 7.0835 7.0960 7.2121 7.2219 7.2868 7.2898 7.4100 7.4236 7.5903 7.6065 7.6806 7.7059 k = 0.5351 0.3843 0.3837 ( 24842 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1863 -34.1862 -34.1856 -34.1855 -33.8169 -33.8168 -33.8167 -33.8167 -19.5847 -19.5827 -19.5769 -19.5750 -6.9024 -6.8968 -6.8377 -6.8326 -6.0694 -6.0600 -5.8875 -5.8807 -5.6071 -5.5985 -5.5827 -5.5727 -3.2569 -3.2533 -3.2272 -3.2209 -2.9857 -2.9769 -2.7775 -2.7717 -2.3723 -2.3676 -2.2963 -2.2908 6.3142 6.3266 6.4035 6.4172 7.1204 7.1283 7.2053 7.2118 7.2940 7.2963 7.3823 7.3923 7.6042 7.6204 7.6585 7.6802 k = 0.5351 0.3843 0.3635 ( 24842 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1860 -34.1859 -34.1859 -34.1857 -33.8169 -33.8168 -33.8167 -33.8167 -19.5831 -19.5827 -19.5770 -19.5766 -6.8776 -6.8733 -6.8627 -6.8585 -6.0610 -6.0592 -5.8889 -5.8876 -5.6024 -5.6008 -5.5791 -5.5772 -3.2556 -3.2549 -3.2248 -3.2236 -2.9800 -2.9784 -2.7778 -2.7767 -2.3657 -2.3647 -2.2981 -2.2970 6.3350 6.3386 6.3929 6.3966 7.1439 7.1455 7.1999 7.2013 7.3000 7.3007 7.3693 7.3716 7.6209 7.6269 7.6506 7.6576 k = 0.5351 0.3843 0.3433 ( 24840 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3615 -34.3614 -34.1862 -34.1860 -34.1857 -34.1856 -33.8169 -33.8168 -33.8167 -33.8167 -19.5839 -19.5825 -19.5771 -19.5757 -6.8914 -6.8860 -6.8494 -6.8443 -6.0650 -6.0588 -5.8889 -5.8844 -5.6049 -5.5992 -5.5813 -5.5746 -3.2564 -3.2540 -3.2262 -3.2221 -2.9829 -2.9772 -2.7781 -2.7743 -2.3687 -2.3655 -2.2978 -2.2940 6.3246 6.3346 6.3962 6.4070 7.1333 7.1386 7.2021 7.2067 7.2970 7.2990 7.3739 7.3812 7.6115 7.6264 7.6512 7.6697 k = 0.5351 0.3843 0.3232 ( 24837 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1865 -34.1863 -34.1854 -34.1853 -33.8169 -33.8168 -33.8167 -33.8167 -19.5857 -19.5834 -19.5762 -19.5740 -6.9162 -6.9105 -6.8224 -6.8173 -6.0764 -6.0632 -5.8842 -5.8748 -5.6102 -5.5988 -5.5836 -5.5703 -3.2575 -3.2522 -3.2285 -3.2193 -2.9899 -2.9774 -2.7757 -2.7674 -2.3780 -2.3720 -2.2931 -2.2858 6.2994 6.3132 6.4157 6.4313 7.1005 7.1112 7.2094 7.2180 7.2899 7.2925 7.3971 7.4093 7.5958 7.6120 7.6704 7.6944 k = 0.5351 0.3843 0.3030 ( 24838 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3615 -34.3615 -34.3614 -34.1867 -34.1866 -34.1852 -34.1850 -33.8169 -33.8168 -33.8168 -33.8166 -19.5877 -19.5850 -19.5746 -19.5720 -6.9401 -6.9341 -6.7944 -6.7894 -6.0918 -6.0730 -5.8750 -5.8620 -5.6161 -5.6022 -5.5830 -5.5663 -3.2583 -3.2501 -3.2305 -3.2164 -2.9989 -2.9804 -2.7699 -2.7578 -2.3903 -2.3829 -2.2850 -2.2756 6.2715 6.2861 6.4399 6.4572 7.0606 7.0751 7.2149 7.2259 7.2832 7.2868 7.4263 7.4419 7.5852 7.6025 7.6944 7.7212 k = 0.5351 0.3843 0.2828 ( 24847 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3615 -34.3613 -34.1870 -34.1869 -34.1849 -34.1847 -33.8169 -33.8168 -33.8168 -33.8166 -19.5896 -19.5868 -19.5727 -19.5701 -6.9627 -6.9565 -6.7659 -6.7609 -6.1095 -6.0864 -5.8632 -5.8475 -5.6225 -5.6077 -5.5809 -5.5627 -3.2589 -3.2479 -3.2321 -3.2135 -3.0092 -2.9857 -2.7612 -2.7460 -2.4042 -2.3961 -2.2754 -2.2647 6.2427 6.2577 6.4642 6.4827 7.0187 7.0359 7.2184 7.2305 7.2777 7.2827 7.4471 7.4686 7.5855 7.6074 7.7205 7.7498 k = 0.5351 0.3843 0.2626 ( 24845 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3615 -34.3613 -34.1873 -34.1871 -34.1846 -34.1845 -33.8169 -33.8168 -33.8168 -33.8166 -19.5916 -19.5887 -19.5708 -19.5681 -6.9842 -6.9777 -6.7370 -6.7319 -6.1285 -6.1019 -5.8506 -5.8327 -5.6292 -5.6137 -5.5785 -5.5597 -3.2593 -3.2457 -3.2330 -3.2105 -3.0202 -2.9929 -2.7505 -2.7328 -2.4190 -2.4106 -2.2656 -2.2540 6.2140 6.2293 6.4877 6.5071 6.9772 6.9966 7.2204 7.2331 7.2729 7.2795 7.4525 7.4783 7.6052 7.6300 7.7487 7.7804 k = 0.5351 0.3843 0.2424 ( 24843 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1875 -34.1874 -34.1844 -34.1842 -33.8170 -33.8168 -33.8167 -33.8166 -19.5935 -19.5905 -19.5689 -19.5663 -7.0042 -6.9976 -6.7079 -6.7027 -6.1480 -6.1184 -5.8388 -5.8186 -5.6357 -5.6195 -5.5761 -5.5570 -3.2594 -3.2438 -3.2328 -3.2075 -3.0315 -3.0012 -2.7383 -2.7187 -2.4341 -2.4257 -2.2560 -2.2436 6.1858 6.2014 6.5098 6.5297 6.9374 6.9588 7.2215 7.2345 7.2685 7.2768 7.4463 7.4723 7.6402 7.6641 7.7796 7.8132 k = 0.5351 0.3843 0.2222 ( 24837 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3613 -34.1878 -34.1876 -34.1841 -34.1840 -33.8170 -33.8168 -33.8167 -33.8166 -19.5953 -19.5923 -19.5671 -19.5645 -7.0229 -7.0160 -6.6788 -6.6735 -6.1674 -6.1351 -5.8288 -5.8063 -5.6417 -5.6243 -5.5737 -5.5547 -3.2593 -3.2426 -3.2311 -3.2045 -3.0428 -3.0102 -2.7255 -2.7041 -2.4493 -2.4408 -2.2469 -2.2338 6.1584 6.1744 6.5300 6.5501 6.9004 6.9239 7.2222 7.2350 7.2643 7.2744 7.4343 7.4594 7.6787 7.7026 7.8137 7.8481 k = 0.5351 0.3843 0.2020 ( 24832 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1880 -34.1879 -34.1839 -34.1838 -33.8170 -33.8168 -33.8167 -33.8165 -19.5970 -19.5940 -19.5654 -19.5628 -7.0401 -7.0331 -6.6500 -6.6445 -6.1865 -6.1514 -5.8216 -5.7966 -5.6466 -5.6277 -5.5713 -5.5527 -3.2591 -3.2421 -3.2280 -3.2013 -3.0537 -3.0197 -2.7124 -2.6894 -2.4644 -2.4559 -2.2385 -2.2247 6.1321 6.1487 6.5478 6.5678 6.8668 6.8927 7.2224 7.2351 7.2601 7.2723 7.4198 7.4442 7.7141 7.7408 7.8512 7.8842 k = 0.5351 0.3843 0.1818 ( 24843 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3617 -34.3614 -34.3612 -34.1882 -34.1881 -34.1837 -34.1835 -33.8170 -33.8169 -33.8167 -33.8165 -19.5985 -19.5955 -19.5638 -19.5612 -7.0558 -7.0486 -6.6218 -6.6160 -6.2049 -6.1671 -5.8176 -5.7900 -5.6501 -5.6292 -5.5689 -5.5508 -3.2587 -3.2418 -3.2239 -3.1981 -3.0642 -3.0295 -2.6995 -2.6750 -2.4789 -2.4705 -2.2308 -2.2164 6.1073 6.1246 6.5629 6.5821 6.8376 6.8663 7.2219 7.2350 7.2561 7.2709 7.4043 7.4285 7.7444 7.7759 7.8909 7.9194 k = 0.5351 0.3843 0.1616 ( 24832 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3617 -34.3613 -34.3612 -34.1884 -34.1883 -34.1835 -34.1833 -33.8170 -33.8169 -33.8167 -33.8165 -19.6000 -19.5969 -19.5624 -19.5597 -7.0699 -7.0625 -6.5944 -6.5883 -6.2224 -6.1818 -5.8170 -5.7870 -5.6518 -5.6288 -5.5664 -5.5490 -3.2583 -3.2414 -3.2191 -3.1947 -3.0741 -3.0393 -2.6872 -2.6613 -2.4928 -2.4844 -2.2239 -2.2090 6.0843 6.1022 6.5746 6.5926 6.8132 6.8452 7.2200 7.2355 7.2520 7.2706 7.3887 7.4131 7.7696 7.8063 7.9299 7.9512 k = 0.5351 0.3843 0.1414 ( 24827 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3617 -34.3613 -34.3612 -34.1886 -34.1884 -34.1833 -34.1832 -33.8170 -33.8169 -33.8167 -33.8165 -19.6013 -19.5982 -19.5610 -19.5584 -7.0825 -7.0749 -6.5682 -6.5618 -6.2389 -6.1954 -5.8196 -5.7873 -5.6519 -5.6267 -5.5639 -5.5473 -3.2579 -3.2410 -3.2140 -3.1909 -3.0833 -3.0491 -2.6757 -2.6484 -2.5058 -2.4975 -2.2179 -2.2024 6.0634 6.0818 6.5823 6.5991 6.7942 6.8301 7.2164 7.2371 7.2480 7.2717 7.3733 7.3983 7.7898 7.8319 7.9643 7.9778 k = 0.5351 0.3843 0.1212 ( 24826 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3612 -34.1887 -34.1886 -34.1832 -34.1830 -33.8170 -33.8169 -33.8166 -33.8165 -19.6024 -19.5994 -19.5599 -19.5573 -7.0934 -7.0858 -6.5436 -6.5369 -6.2543 -6.2075 -5.8245 -5.7901 -5.6508 -5.6235 -5.5614 -5.5455 -3.2574 -3.2405 -3.2088 -3.1867 -3.0917 -3.0587 -2.6652 -2.6365 -2.5176 -2.5095 -2.2126 -2.1967 6.0447 6.0637 6.5857 6.6019 6.7807 6.8208 7.2117 7.2392 7.2445 7.2744 7.3585 7.3841 7.8050 7.8530 7.9903 8.0018 k = 0.5351 0.3843 0.1010 ( 24827 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3612 -34.1889 -34.1887 -34.1830 -34.1829 -33.8171 -33.8169 -33.8166 -33.8165 -19.6034 -19.6004 -19.5589 -19.5563 -7.1027 -7.0949 -6.5212 -6.5139 -6.2684 -6.2182 -5.8309 -5.7946 -5.6490 -5.6198 -5.5589 -5.5436 -3.2570 -3.2399 -3.2038 -3.1820 -3.0993 -3.0680 -2.6559 -2.6260 -2.5281 -2.5203 -2.2082 -2.1918 6.0285 6.0481 6.5852 6.6017 6.7723 6.8163 7.2066 7.2376 7.2458 7.2784 7.3443 7.3706 7.8156 7.8697 8.0081 8.0255 k = 0.5351 0.3843 0.0808 ( 24823 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1890 -34.1888 -34.1829 -34.1828 -33.8171 -33.8169 -33.8166 -33.8165 -19.6043 -19.6012 -19.5580 -19.5554 -7.1104 -7.1025 -6.5015 -6.4933 -6.2812 -6.2271 -5.8377 -5.7998 -5.6471 -5.6162 -5.5567 -5.5418 -3.2566 -3.2393 -3.1994 -3.1767 -3.1059 -3.0769 -2.6481 -2.6168 -2.5371 -2.5296 -2.2046 -2.1878 6.0149 6.0350 6.5821 6.5997 6.7680 6.8153 7.2015 7.2338 7.2505 7.2836 7.3309 7.3579 7.8221 7.8820 8.0233 8.0476 k = 0.5351 0.3843 0.0606 ( 24809 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1891 -34.1889 -34.1828 -34.1827 -33.8171 -33.8169 -33.8166 -33.8165 -19.6049 -19.6018 -19.5574 -19.5548 -7.1163 -7.1084 -6.4853 -6.4758 -6.2922 -6.2344 -5.8442 -5.8048 -5.6454 -5.6131 -5.5548 -5.5401 -3.2563 -3.2388 -3.1958 -3.1711 -3.1115 -3.0849 -2.6418 -2.6093 -2.5444 -2.5373 -2.2019 -2.1848 6.0042 6.0247 6.5779 6.5968 6.7664 6.8162 7.1971 7.2303 7.2564 7.2898 7.3184 7.3459 7.8257 7.8905 8.0382 8.0672 k = 0.5351 0.3843 0.0404 ( 24817 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1891 -34.1890 -34.1828 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6054 -19.6023 -19.5569 -19.5543 -7.1206 -7.1126 -6.4731 -6.4621 -6.3009 -6.2396 -5.8494 -5.8089 -5.6441 -5.6107 -5.5534 -5.5387 -3.2561 -3.2384 -3.1930 -3.1658 -3.1160 -3.0916 -2.6372 -2.6035 -2.5497 -2.5432 -2.1999 -2.1826 5.9965 6.0173 6.5741 6.5940 6.7662 6.8178 7.1936 7.2275 7.2630 7.2970 7.3071 7.3346 7.8273 7.8957 8.0534 8.0824 k = 0.5351 0.3843 0.0202 ( 24820 PWs) bands (ev): -65.1746 -65.1744 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6057 -19.6025 -19.5566 -19.5540 -7.1231 -7.1151 -6.4655 -6.4532 -6.3067 -6.2429 -5.8528 -5.8116 -5.6433 -5.6093 -5.5526 -5.5378 -3.2559 -3.2381 -3.1913 -3.1618 -3.1190 -3.0961 -2.6344 -2.5999 -2.5530 -2.5469 -2.1987 -2.1813 5.9918 6.0128 6.5714 6.5920 6.7665 6.8191 7.1915 7.2258 7.2695 7.2977 7.3051 7.3241 7.8280 7.8984 8.0672 8.0896 k = 0.5351 0.3843 0.0000 ( 24821 PWs) bands (ev): -65.1746 -65.1744 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6058 -19.6026 -19.5565 -19.5539 -7.1240 -7.1159 -6.4630 -6.4501 -6.3088 -6.2440 -5.8540 -5.8125 -5.6431 -5.6088 -5.5523 -5.5375 -3.2559 -3.2380 -3.1908 -3.1603 -3.1201 -3.0978 -2.6334 -2.5986 -2.5542 -2.5481 -2.1983 -2.1808 5.9903 6.0113 6.5705 6.5913 6.7666 6.8196 7.1907 7.2252 7.2731 7.2933 7.3125 7.3160 7.8281 7.8992 8.0743 8.0897 k = 0.5083 0.3843 0.0202 ( 24816 PWs) bands (ev): -65.1746 -65.1744 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6044 -19.6037 -19.5556 -19.5550 -7.1232 -7.1213 -6.4631 -6.4602 -6.2800 -6.2646 -5.8408 -5.8308 -5.6269 -5.6188 -5.5445 -5.5410 -3.2479 -3.2432 -3.1844 -3.1769 -3.1096 -3.1040 -2.6212 -2.6129 -2.5474 -2.5459 -2.1897 -2.1856 5.9986 6.0036 6.5742 6.5791 6.7866 6.7992 7.2043 7.2127 7.2808 7.2893 7.3020 7.3086 7.8525 7.8691 8.0994 8.1109 k = 0.4816 0.3843 0.0404 ( 24817 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1891 -34.1890 -34.1828 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6046 -19.6030 -19.5563 -19.5549 -7.1211 -7.1168 -6.4721 -6.4662 -6.2849 -6.2523 -5.8426 -5.8210 -5.6337 -5.6159 -5.5481 -5.5404 -3.2511 -3.2410 -3.1898 -3.1746 -3.1100 -3.0972 -2.6291 -2.6114 -2.5456 -2.5423 -2.1940 -2.1849 6.0005 6.0114 6.5750 6.5855 6.7783 6.8057 7.2014 7.2196 7.2687 7.2868 7.3096 7.3246 7.8420 7.8777 8.0718 8.0921 k = 0.4548 0.3843 0.0606 ( 24811 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1891 -34.1889 -34.1828 -34.1827 -33.8171 -33.8169 -33.8166 -33.8165 -19.6054 -19.6014 -19.5577 -19.5544 -7.1153 -7.1050 -6.4854 -6.4732 -6.3013 -6.2278 -5.8472 -5.7972 -5.6524 -5.6110 -5.5585 -5.5396 -3.2592 -3.2382 -3.1960 -3.1663 -3.1149 -3.0810 -2.6465 -2.6049 -2.5475 -2.5385 -2.2060 -2.1840 6.0022 6.0285 6.5785 6.6028 6.7596 6.8231 7.1929 7.2342 7.2545 7.2968 7.3181 7.3526 7.8174 7.9010 8.0277 8.0602 k = 0.4281 0.3843 0.0808 ( 24819 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1890 -34.1888 -34.1829 -34.1828 -33.8171 -33.8169 -33.8166 -33.8165 -19.6060 -19.5997 -19.5594 -19.5541 -7.1040 -7.0879 -6.5002 -6.4847 -6.3108 -6.2072 -5.8449 -5.7723 -5.6735 -5.6131 -5.5717 -5.5410 -3.2667 -3.2410 -3.1961 -3.1615 -3.1167 -3.0594 -2.6648 -2.6028 -2.5514 -2.5358 -2.2214 -2.1872 6.0086 6.0496 6.5872 6.6236 6.7470 6.8389 7.1878 7.2363 7.2581 7.3111 7.3347 7.3837 7.7937 7.9145 7.9914 8.0222 k = 0.4013 0.3843 0.1010 ( 24821 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1889 -34.1887 -34.1830 -34.1829 -33.8171 -33.8169 -33.8167 -33.8165 -19.6064 -19.5978 -19.5612 -19.5540 -7.0873 -7.0657 -6.5172 -6.4995 -6.3123 -6.1902 -5.8382 -5.7515 -5.6931 -5.6216 -5.5874 -5.5440 -3.2737 -3.2464 -3.1967 -3.1566 -3.1137 -3.0329 -2.6835 -2.6055 -2.5566 -2.5339 -2.2402 -2.1948 6.0197 6.0743 6.5951 6.6450 6.7465 6.8545 7.1865 7.2315 7.2739 7.3291 7.3585 7.4172 7.7684 7.9061 7.9598 7.9972 k = 0.3745 0.3843 0.1212 ( 24821 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3612 -34.1887 -34.1886 -34.1832 -34.1830 -33.8171 -33.8169 -33.8167 -33.8165 -19.6066 -19.5959 -19.5633 -19.5542 -7.0654 -7.0387 -6.5365 -6.5152 -6.3067 -6.1754 -5.8318 -5.7487 -5.6980 -5.6342 -5.6050 -5.5485 -3.2810 -3.2513 -3.2025 -3.1480 -3.1056 -3.0028 -2.7023 -2.6133 -2.5628 -2.5329 -2.2623 -2.2069 6.0351 6.1023 6.5946 6.6659 6.7618 6.8738 7.1889 7.2302 7.2917 7.3501 7.3876 7.4519 7.7401 7.8848 7.9158 7.9877 k = 0.3478 0.3843 0.1414 ( 24815 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3617 -34.3613 -34.3612 -34.1886 -34.1884 -34.1833 -34.1832 -33.8171 -33.8169 -33.8167 -33.8165 -19.6066 -19.5938 -19.5654 -19.5545 -7.0385 -7.0074 -6.5571 -6.5305 -6.2953 -6.1615 -5.8325 -5.7656 -5.6869 -5.6473 -5.6225 -5.5552 -3.2889 -3.2541 -3.2110 -3.1369 -3.0922 -2.9709 -2.7210 -2.6257 -2.5696 -2.5330 -2.2876 -2.2234 6.0546 6.1331 6.5841 6.6836 6.7910 6.9011 7.1947 7.2328 7.3108 7.3730 7.4199 7.4868 7.7100 7.8582 7.8692 7.9621 k = 0.3210 0.3843 0.1616 ( 24824 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1884 -34.1883 -34.1835 -34.1833 -33.8171 -33.8168 -33.8167 -33.8165 -19.6065 -19.5917 -19.5678 -19.5550 -7.0071 -6.9721 -6.5771 -6.5447 -6.2793 -6.1473 -5.8465 -5.7857 -5.6815 -5.6577 -5.6333 -5.5645 -3.2972 -3.2540 -3.2196 -3.1253 -3.0733 -2.9383 -2.7393 -2.6419 -2.5768 -2.5347 -2.3159 -2.2445 6.0775 6.1663 6.5674 6.6923 6.8319 6.9386 7.2038 7.2388 7.3307 7.3971 7.4530 7.5195 7.6819 7.8130 7.8340 7.9365 k = 0.2943 0.3843 0.1818 ( 24823 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1882 -34.1881 -34.1837 -34.1835 -33.8171 -33.8168 -33.8167 -33.8165 -19.6061 -19.5895 -19.5702 -19.5557 -6.9716 -6.9336 -6.5953 -6.5576 -6.2598 -6.1322 -5.8720 -5.8079 -5.6943 -5.6607 -5.6328 -5.5767 -3.3045 -3.2507 -3.2266 -3.1143 -3.0500 -2.9061 -2.7568 -2.6612 -2.5842 -2.5383 -2.3469 -2.2698 6.1032 6.2014 6.5475 6.6906 6.8822 6.9843 7.2156 7.2471 7.3509 7.4207 7.4849 7.5460 7.6602 7.7655 7.8016 7.9235 k = 0.2675 0.3843 0.2020 ( 24815 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1880 -34.1878 -34.1839 -34.1837 -33.8171 -33.8168 -33.8168 -33.8165 -19.6055 -19.5873 -19.5727 -19.5566 -6.9325 -6.8926 -6.6108 -6.5689 -6.2376 -6.1161 -5.9031 -5.8348 -5.7158 -5.6606 -5.6297 -5.5916 -3.3088 -3.2442 -3.2310 -3.1046 -3.0231 -2.8753 -2.7733 -2.6826 -2.5917 -2.5441 -2.3800 -2.2990 6.1311 6.2378 6.5259 6.6808 6.9388 7.0344 7.2291 7.2568 7.3710 7.4414 7.5134 7.5629 7.6452 7.7323 7.7739 7.9167 k = 0.2408 0.3843 0.2222 ( 24823 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1878 -34.1876 -34.1841 -34.1840 -33.8170 -33.8168 -33.8168 -33.8165 -19.6047 -19.5851 -19.5753 -19.5577 -6.8905 -6.8500 -6.6229 -6.5783 -6.2137 -6.0993 -5.9356 -5.8657 -5.7382 -5.6623 -5.6314 -5.6078 -3.3087 -3.2357 -3.2315 -3.0972 -2.9938 -2.8464 -2.7884 -2.7051 -2.5992 -2.5524 -2.4144 -2.3319 6.1602 6.2749 6.5032 6.6656 6.9978 7.0856 7.2423 7.2671 7.3906 7.4555 7.5349 7.5766 7.6309 7.7225 7.7569 7.9102 k = 0.2140 0.3843 0.2424 ( 24807 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3615 -34.3614 -34.3612 -34.1876 -34.1874 -34.1844 -34.1842 -33.8170 -33.8168 -33.8167 -33.8165 -19.6037 -19.5830 -19.5778 -19.5589 -6.8464 -6.8069 -6.6316 -6.5856 -6.1891 -6.0823 -5.9672 -5.8982 -5.7585 -5.6690 -5.6422 -5.6223 -3.3031 -3.2321 -3.2208 -3.0929 -2.9632 -2.8207 -2.8018 -2.7272 -2.6066 -2.5636 -2.4488 -2.3676 6.1898 6.3122 6.4797 6.6470 7.0553 7.1349 7.2521 7.2779 7.4104 7.4599 7.5511 7.5896 7.6279 7.7205 7.7593 7.9026 k = 0.1873 0.3843 0.2626 ( 24821 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3615 -34.3613 -34.1873 -34.1871 -34.1846 -34.1845 -33.8170 -33.8168 -33.8167 -33.8165 -19.6025 -19.5822 -19.5790 -19.5603 -6.8013 -6.7645 -6.6369 -6.5907 -6.1656 -6.0659 -5.9961 -5.9299 -5.7746 -5.6832 -5.6601 -5.6359 -3.2915 -3.2271 -3.2054 -3.0925 -2.9327 -2.8184 -2.7949 -2.7466 -2.6140 -2.5781 -2.4813 -2.4057 6.2192 6.3491 6.4559 6.6260 7.1070 7.1793 7.2572 7.2883 7.4319 7.4582 7.5672 7.5951 7.6507 7.7179 7.7761 7.8962 k = 0.1605 0.3843 0.2828 ( 24815 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3615 -34.3613 -34.1870 -34.1868 -34.1849 -34.1847 -33.8170 -33.8169 -33.8167 -33.8165 -19.6011 -19.5842 -19.5774 -19.5619 -6.7563 -6.7242 -6.6390 -6.5937 -6.1460 -6.0509 -6.0211 -5.9576 -5.7843 -5.7049 -5.6804 -5.6526 -3.2739 -3.2191 -3.1878 -3.0963 -2.9044 -2.8339 -2.7749 -2.7606 -2.6215 -2.5953 -2.5101 -2.4451 6.2476 6.3850 6.4320 6.6035 7.1488 7.2123 7.2623 7.2960 7.4570 7.4585 7.5826 7.6096 7.6825 7.7194 7.7965 7.8923 k = 0.1338 0.3843 0.3030 ( 24814 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3614 -34.3613 -34.1868 -34.1866 -34.1852 -34.1850 -33.8170 -33.8169 -33.8167 -33.8165 -19.5995 -19.5869 -19.5751 -19.5635 -6.7134 -6.6873 -6.6384 -6.5952 -6.1335 -6.0513 -6.0288 -5.9766 -5.7863 -5.7305 -5.7034 -5.6734 -3.2509 -3.2082 -3.1695 -3.1040 -2.8829 -2.8513 -2.7672 -2.7577 -2.6293 -2.6129 -2.5342 -2.4847 6.2746 6.4058 6.4221 6.5800 7.1792 7.2246 7.2753 7.2995 7.4683 7.4863 7.6012 7.6325 7.7079 7.7300 7.8188 7.8908 k = 0.1070 0.3843 0.3232 ( 24813 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3616 -34.3614 -34.3613 -34.1865 -34.1863 -34.1855 -34.1853 -33.8170 -33.8169 -33.8166 -33.8166 -19.5978 -19.5896 -19.5728 -19.5653 -6.6753 -6.6541 -6.6358 -6.5958 -6.1282 -6.0749 -6.0134 -5.9835 -5.7808 -5.7554 -5.7295 -5.6980 -3.2238 -3.1950 -3.1523 -3.1146 -2.8780 -2.8643 -2.7640 -2.7447 -2.6366 -2.6272 -2.5541 -2.5230 6.2998 6.3829 6.4546 6.5558 7.1991 7.2237 7.2879 7.2994 7.4912 7.5168 7.6255 7.6560 7.7214 7.7484 7.8449 7.8906 k = 0.0803 0.3843 0.3433 ( 24814 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3613 -34.1862 -34.1860 -34.1858 -34.1856 -33.8170 -33.8169 -33.8166 -33.8166 -19.5959 -19.5923 -19.5705 -19.5672 -6.6462 -6.6335 -6.6214 -6.5967 -6.1258 -6.1018 -5.9952 -5.9816 -5.7787 -5.7691 -5.7540 -5.7252 -3.1946 -3.1810 -3.1390 -3.1261 -2.8878 -2.8761 -2.7507 -2.7373 -2.6402 -2.6361 -2.5706 -2.5581 6.3234 6.3592 6.4870 6.5311 7.2111 7.2198 7.2937 7.2973 7.5243 7.5418 7.6542 7.6718 7.7379 7.7578 7.8736 7.8917 k = 0.0535 0.3843 0.3635 ( 24817 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1860 -34.1859 -34.1858 -34.1857 -33.8170 -33.8169 -33.8166 -33.8166 -19.5949 -19.5938 -19.5692 -19.5682 -6.6302 -6.6275 -6.5995 -6.5926 -6.1283 -6.1213 -5.9796 -5.9749 -5.7929 -5.7875 -5.7540 -5.7435 -3.1722 -3.1678 -3.1326 -3.1302 -2.8980 -2.8928 -2.7388 -2.7341 -2.6380 -2.6371 -2.5875 -2.5845 6.3356 6.3455 6.5058 6.5181 7.2161 7.2181 7.2945 7.2954 7.5548 7.5614 7.6771 7.6823 7.7518 7.7595 7.8934 7.8991 k = 0.0268 0.3843 0.3837 ( 24821 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3613 -34.1863 -34.1861 -34.1856 -34.1854 -33.8170 -33.8169 -33.8166 -33.8166 -19.5974 -19.5917 -19.5712 -19.5660 -6.6294 -6.6168 -6.6058 -6.5681 -6.1516 -6.1115 -5.9846 -5.9524 -5.8227 -5.7861 -5.7809 -5.7214 -3.1786 -3.1558 -3.1271 -3.1150 -2.9246 -2.8886 -2.7513 -2.7232 -2.6312 -2.6259 -2.6077 -2.5957 6.3120 6.3665 6.4800 6.5481 7.2128 7.2223 7.2914 7.2964 7.5526 7.5959 7.6754 7.7009 7.7303 7.7820 7.8746 7.9250 k = 0.0000 0.3843 0.4039 ( 24818 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3615 -34.3614 -34.3613 -34.1866 -34.1864 -34.1854 -34.1851 -33.8170 -33.8169 -33.8166 -33.8165 -19.5997 -19.5894 -19.5732 -19.5639 -6.6328 -6.6174 -6.6120 -6.5492 -6.1694 -6.0959 -5.9964 -5.9321 -5.8459 -5.8107 -5.7687 -5.6972 -3.1941 -3.1653 -3.1103 -3.0960 -2.9474 -2.8774 -2.7728 -2.7221 -2.6280 -2.6116 -2.6068 -2.5995 6.2882 6.3867 6.4537 6.5771 7.2090 7.2253 7.2886 7.2977 7.5361 7.6178 7.6654 7.7017 7.7096 7.8001 7.8450 7.9489 k = 0.0268 0.3651 0.4039 ( 24814 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3616 -34.3614 -34.3613 -34.1866 -34.1864 -34.1854 -34.1851 -33.8170 -33.8169 -33.8166 -33.8165 -19.6023 -19.5919 -19.5706 -19.5614 -6.6362 -6.6213 -6.6165 -6.5467 -6.1833 -6.1112 -5.9814 -5.9287 -5.8316 -5.7969 -5.7676 -5.6852 -3.2063 -3.1754 -3.1199 -3.1118 -2.9578 -2.8963 -2.7581 -2.7156 -2.6312 -2.6152 -2.5989 -2.5746 6.2706 6.3700 6.4720 6.6011 7.2038 7.2217 7.2992 7.3086 7.5058 7.5746 7.6630 7.6822 7.7114 7.7807 7.8606 7.9495 k = 0.0535 0.3459 0.4039 ( 24812 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1866 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8166 -33.8165 -19.6047 -19.5942 -19.5682 -19.5590 -6.6453 -6.6323 -6.6207 -6.5500 -6.1900 -6.1205 -5.9743 -5.9400 -5.8029 -5.7778 -5.7560 -5.6722 -3.2258 -3.1947 -3.1386 -3.1250 -2.9539 -2.9094 -2.7470 -2.7116 -2.6389 -2.6222 -2.5789 -2.5425 6.2528 6.3543 6.4884 6.6238 7.1977 7.2187 7.3097 7.3202 7.4684 7.5244 7.6388 7.6746 7.7168 7.7621 7.8823 7.9498 k = 0.0803 0.3267 0.4039 ( 24798 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1867 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8166 -33.8165 -19.6068 -19.5963 -19.5660 -19.5569 -6.6590 -6.6445 -6.6286 -6.5585 -6.1900 -6.1232 -5.9784 -5.9550 -5.7774 -5.7479 -5.7349 -5.6586 -3.2538 -3.2197 -3.1649 -3.1299 -2.9417 -2.9151 -2.7400 -2.7092 -2.6498 -2.6251 -2.5537 -2.5090 6.2350 6.3397 6.5021 6.6438 7.1907 7.2161 7.3181 7.3327 7.4324 7.4781 7.6080 7.6633 7.7226 7.7469 7.8952 7.9564 k = 0.1070 0.3074 0.4039 ( 24803 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1867 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6086 -19.5980 -19.5641 -19.5551 -6.6759 -6.6570 -6.6388 -6.5708 -6.1848 -6.1201 -5.9928 -5.9691 -5.7566 -5.7114 -5.7083 -5.6445 -3.2867 -3.2508 -3.1840 -3.1364 -2.9277 -2.9117 -2.7380 -2.7066 -2.6620 -2.6235 -2.5260 -2.4761 6.2174 6.3259 6.5118 6.6596 7.1823 7.2136 7.3193 7.3456 7.4084 7.4399 7.5776 7.6434 7.7270 7.7347 7.8895 7.9596 k = 0.1338 0.2882 0.4039 ( 24793 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3612 -34.1867 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6100 -19.5993 -19.5626 -19.5537 -6.6944 -6.6693 -6.6501 -6.5851 -6.1763 -6.1127 -6.0118 -5.9835 -5.7365 -5.6805 -5.6763 -5.6298 -3.3198 -3.2845 -3.1967 -3.1450 -2.9181 -2.8974 -2.7416 -2.7035 -2.6719 -2.6181 -2.4980 -2.4452 6.2003 6.3128 6.5166 6.6697 7.1724 7.2114 7.3106 7.3561 7.4012 7.4141 7.5517 7.6178 7.7205 7.7322 7.8750 7.9477 k = 0.1605 0.2690 0.4039 ( 24794 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3612 -34.1867 -34.1863 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6109 -19.6003 -19.5614 -19.5526 -6.7130 -6.6810 -6.6615 -6.6000 -6.1665 -6.1032 -6.0309 -5.9985 -5.7165 -5.6548 -5.6469 -5.6140 -3.3500 -3.3166 -3.2058 -3.1555 -2.9102 -2.8787 -2.7488 -2.7063 -2.6717 -2.6095 -2.4712 -2.4171 6.1839 6.3004 6.5156 6.6727 7.1625 7.2101 7.2986 7.3573 7.3927 7.4155 7.5345 7.5907 7.7064 7.7338 7.8599 7.9375 k = 0.1873 0.2498 0.4039 ( 24799 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3612 -34.1867 -34.1863 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6115 -19.6008 -19.5607 -19.5519 -6.7302 -6.6916 -6.6723 -6.6141 -6.1576 -6.0957 -6.0461 -6.0124 -5.6969 -5.6334 -5.6252 -5.5976 -3.3752 -3.3444 -3.2127 -3.1671 -2.9031 -2.8614 -2.7562 -2.7143 -2.6607 -2.5983 -2.4465 -2.3925 6.1686 6.2883 6.5083 6.6676 7.1551 7.2108 7.2891 7.3492 7.3855 7.4297 7.5283 7.5670 7.6901 7.7338 7.8473 7.9317 k = 0.2140 0.2306 0.4039 ( 24800 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3612 -34.1867 -34.1863 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6115 -19.6009 -19.5604 -19.5516 -6.7452 -6.7011 -6.6819 -6.6266 -6.1523 -6.0977 -6.0509 -6.0217 -5.6779 -5.6170 -5.6109 -5.5833 -3.3940 -3.3666 -3.2180 -3.1794 -2.8989 -2.8505 -2.7595 -2.7193 -2.6448 -2.5852 -2.4248 -2.3717 6.1548 6.2767 6.4948 6.6542 7.1530 7.2140 7.2824 7.3401 7.3787 7.4429 7.5289 7.5536 7.6728 7.7324 7.8382 7.9311 k = 0.2408 0.2114 0.4039 ( 24808 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3612 -34.1867 -34.1863 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6111 -19.6006 -19.5606 -19.5518 -6.7574 -6.7095 -6.6896 -6.6372 -6.1534 -6.1103 -6.0465 -6.0217 -5.6600 -5.6054 -5.6030 -5.5738 -3.4059 -3.3826 -3.2218 -3.1918 -2.9003 -2.8509 -2.7542 -2.7164 -2.6262 -2.5708 -2.4065 -2.3553 6.1426 6.2655 6.4755 6.6331 7.1577 7.2198 7.2782 7.3329 7.3739 7.4484 7.5316 7.5546 7.6566 7.7299 7.8328 7.9358 k = 0.2675 0.1922 0.4039 ( 24815 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3612 -34.1867 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6103 -19.5999 -19.5612 -19.5525 -6.7663 -6.7170 -6.6948 -6.6455 -6.1616 -6.1275 -6.0390 -6.0116 -5.6437 -5.6039 -5.5962 -5.5698 -3.4106 -3.3926 -3.2244 -3.2033 -2.9083 -2.8631 -2.7398 -2.7039 -2.6062 -2.5557 -2.3921 -2.3433 6.1323 6.2547 6.4515 6.6054 7.1691 7.2277 7.2763 7.3277 7.3730 7.4474 7.5373 7.5613 7.6447 7.7266 7.8306 7.9456 k = 0.2943 0.1729 0.4039 ( 24815 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1867 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8164 -19.6090 -19.5987 -19.5622 -19.5535 -6.7720 -6.7237 -6.6971 -6.6517 -6.1745 -6.1465 -6.0277 -5.9965 -5.6310 -5.6090 -5.5952 -5.5679 -3.4088 -3.3971 -3.2266 -3.2121 -2.9222 -2.8829 -2.7189 -2.6838 -2.5855 -2.5406 -2.3819 -2.3359 6.1242 6.2445 6.4241 6.5729 7.1864 7.2369 7.2773 7.3246 7.3754 7.4478 7.5407 7.5674 7.6409 7.7229 7.8309 7.9592 k = 0.3210 0.1537 0.4039 ( 24829 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1867 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8165 -33.8165 -19.6073 -19.5973 -19.5636 -19.5550 -6.7746 -6.7296 -6.6967 -6.6560 -6.1896 -6.1664 -6.0128 -5.9794 -5.6327 -5.6121 -5.6004 -5.5641 -3.4016 -3.3971 -3.2311 -3.2144 -2.9404 -2.9070 -2.6938 -2.6589 -2.5649 -2.5262 -2.3759 -2.3332 6.1183 6.2349 6.3951 6.5371 7.2080 7.2473 7.2814 7.3232 7.3791 7.4543 7.5379 7.5710 7.6467 7.7200 7.8331 7.9747 k = 0.3478 0.1345 0.4039 ( 24840 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1866 -34.1864 -34.1854 -34.1851 -33.8171 -33.8170 -33.8166 -33.8165 -19.6052 -19.5955 -19.5653 -19.5569 -6.7745 -6.7345 -6.6937 -6.6584 -6.2049 -6.1863 -5.9951 -5.9614 -5.6503 -5.6273 -5.5935 -5.5590 -3.3943 -3.3906 -3.2361 -3.2103 -2.9617 -2.9334 -2.6661 -2.6313 -2.5451 -2.5130 -2.3742 -2.3351 6.1147 6.2256 6.3665 6.4997 7.2320 7.2592 7.2881 7.3234 7.3832 7.4658 7.5321 7.5714 7.6607 7.7196 7.8367 7.9885 k = 0.3745 0.1153 0.4039 ( 24852 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3616 -34.3614 -34.3613 -34.1866 -34.1864 -34.1854 -34.1851 -33.8170 -33.8169 -33.8166 -33.8165 -19.6028 -19.5936 -19.5672 -19.5590 -6.7719 -6.7386 -6.6887 -6.6595 -6.2194 -6.2053 -5.9752 -5.9429 -5.6740 -5.6519 -5.5829 -5.5543 -3.3896 -3.3789 -3.2375 -3.2019 -2.9851 -2.9607 -2.6369 -2.6025 -2.5267 -2.5017 -2.3767 -2.3415 6.1138 6.2162 6.3408 6.4623 7.2553 7.2743 7.2962 7.3252 7.3881 7.4752 7.5295 7.5686 7.6813 7.7242 7.8411 7.9958 k = 0.4013 0.0961 0.4039 ( 24853 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3616 -34.3614 -34.3613 -34.1866 -34.1864 -34.1854 -34.1851 -33.8170 -33.8169 -33.8166 -33.8165 -19.6002 -19.5917 -19.5691 -19.5615 -6.7676 -6.7416 -6.6823 -6.6596 -6.2324 -6.2225 -5.9535 -5.9244 -5.7009 -5.6810 -5.5729 -5.5504 -3.3843 -3.3694 -3.2324 -3.1904 -3.0098 -2.9878 -2.6074 -2.5740 -2.5102 -2.4924 -2.3830 -2.3521 6.1156 6.2052 6.3210 6.4263 7.2741 7.2939 7.3038 7.3292 7.3947 7.4753 7.5341 7.5637 7.7081 7.7368 7.8459 7.9917 k = 0.4281 0.0769 0.4039 ( 24850 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3615 -34.3615 -34.3613 -34.1866 -34.1864 -34.1853 -34.1852 -33.8170 -33.8169 -33.8167 -33.8166 -19.5975 -19.5901 -19.5707 -19.5640 -6.7622 -6.7438 -6.6752 -6.6590 -6.2434 -6.2372 -5.9308 -5.9063 -5.7285 -5.7120 -5.5640 -5.5477 -3.3794 -3.3643 -3.2197 -3.1771 -3.0346 -3.0138 -2.5789 -2.5478 -2.4960 -2.4851 -2.3923 -2.3663 6.1202 6.1917 6.3095 6.3928 7.2885 7.3092 7.3149 7.3356 7.4035 7.4679 7.5411 7.5580 7.7403 7.7597 7.8503 7.9737 k = 0.4548 0.0576 0.4039 ( 24844 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1866 -34.1864 -34.1853 -34.1852 -33.8169 -33.8168 -33.8167 -33.8166 -19.5947 -19.5893 -19.5716 -19.5666 -6.7563 -6.7452 -6.6683 -6.6583 -6.2517 -6.2486 -5.9083 -5.8906 -5.7540 -5.7421 -5.5564 -5.5461 -3.3752 -3.3640 -3.2007 -3.1651 -3.0561 -3.0375 -2.5531 -2.5280 -2.4841 -2.4783 -2.4030 -2.3833 6.1279 6.1757 6.3075 6.3630 7.2999 7.3122 7.3324 7.3428 7.4151 7.4576 7.5458 7.5530 7.7758 7.7928 7.8536 7.9434 k = 0.4816 0.0384 0.4039 ( 24832 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1866 -34.1864 -34.1853 -34.1852 -33.8169 -33.8168 -33.8167 -33.8166 -19.5922 -19.5897 -19.5713 -19.5690 -6.7503 -6.7460 -6.6621 -6.6580 -6.2568 -6.2558 -5.8898 -5.8816 -5.7720 -5.7667 -5.5501 -5.5459 -3.3720 -3.3671 -3.1793 -3.1612 -3.0675 -3.0571 -2.5327 -2.5208 -2.4732 -2.4702 -2.4117 -2.4015 6.1385 6.1587 6.3144 6.3377 7.3085 7.3132 7.3440 7.3477 7.4294 7.4470 7.5479 7.5497 7.8125 7.8279 7.8588 7.9045 k = 0.5083 0.0192 0.4039 ( 24835 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1866 -34.1864 -34.1853 -34.1852 -33.8169 -33.8168 -33.8167 -33.8167 -19.5914 -19.5903 -19.5708 -19.5697 -6.7464 -6.7445 -6.6587 -6.6569 -6.2586 -6.2582 -5.8864 -5.8828 -5.7770 -5.7749 -5.5470 -5.5451 -3.3723 -3.3701 -3.1709 -3.1624 -3.0677 -3.0626 -2.5278 -2.5225 -2.4654 -2.4628 -2.4177 -2.4119 6.1423 6.1514 6.3182 6.3288 7.3124 7.3145 7.3473 7.3489 7.4379 7.4456 7.5483 7.5488 7.8348 7.8428 7.8671 7.8882 k = 0.5351 0.0000 0.4039 ( 24851 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1866 -34.1864 -34.1853 -34.1852 -33.8169 -33.8168 -33.8167 -33.8166 -19.5939 -19.5894 -19.5715 -19.5675 -6.7467 -6.7392 -6.6608 -6.6530 -6.2570 -6.2554 -5.9050 -5.8927 -5.7677 -5.7619 -5.5493 -5.5416 -3.3787 -3.3700 -3.1896 -3.1589 -3.0617 -3.0456 -2.5453 -2.5267 -2.4699 -2.4559 -2.4251 -2.4012 6.1277 6.1658 6.3057 6.3497 7.3092 7.3179 7.3406 7.3477 7.4311 7.4623 7.5484 7.5498 7.8110 7.8224 7.8844 7.9294 k = 0.5351 0.0000 0.3837 ( 24856 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1863 -34.1862 -34.1856 -34.1855 -33.8169 -33.8168 -33.8167 -33.8167 -19.5923 -19.5897 -19.5713 -19.5689 -6.7280 -6.7235 -6.6767 -6.6730 -6.2547 -6.2538 -5.9059 -5.8990 -5.7620 -5.7589 -5.5500 -5.5455 -3.3761 -3.3709 -3.1868 -3.1697 -3.0568 -3.0482 -2.5369 -2.5258 -2.4660 -2.4583 -2.4232 -2.4091 6.1478 6.1727 6.2988 6.3271 7.3177 7.3236 7.3464 7.3489 7.4469 7.4706 7.5502 7.5516 7.8024 7.8129 7.8845 7.9092 k = 0.5351 0.0000 0.3635 ( 24846 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1860 -34.1859 -34.1859 -34.1857 -33.8169 -33.8169 -33.8167 -33.8167 -19.5910 -19.5905 -19.5706 -19.5702 -6.7127 -6.7117 -6.6890 -6.6885 -6.2536 -6.2534 -5.9046 -5.9033 -5.7588 -5.7583 -5.5492 -5.5483 -3.3735 -3.3726 -3.1816 -3.1784 -3.0528 -3.0513 -2.5304 -2.5283 -2.4626 -2.4612 -2.4187 -2.4161 6.1639 6.1688 6.3036 6.3091 7.3227 7.3238 7.3490 7.3493 7.4623 7.4671 7.5516 7.5519 7.8026 7.8049 7.8897 7.8941 k = 0.5351 0.0000 0.3433 ( 24854 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3616 -34.3614 -34.3614 -34.1862 -34.1860 -34.1857 -34.1856 -33.8169 -33.8169 -33.8167 -33.8167 -19.5917 -19.5900 -19.5711 -19.5695 -6.7204 -6.7172 -6.6831 -6.6810 -6.2541 -6.2535 -5.9056 -5.9011 -5.7603 -5.7583 -5.5498 -5.5469 -3.3749 -3.3715 -3.1848 -3.1738 -3.0550 -3.0494 -2.5338 -2.5265 -2.4645 -2.4595 -2.4215 -2.4123 6.1555 6.1724 6.2994 6.3184 7.3203 7.3242 7.3480 7.3492 7.4541 7.4705 7.5509 7.5519 7.8015 7.8091 7.8860 7.9017 k = 0.5351 0.0000 0.3232 ( 24850 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3616 -34.3615 -34.3615 -34.3614 -34.1865 -34.1863 -34.1854 -34.1853 -33.8169 -33.8168 -33.8167 -33.8166 -19.5932 -19.5895 -19.5715 -19.5681 -6.7384 -6.7322 -6.6679 -6.6619 -6.2559 -6.2546 -5.9057 -5.8956 -5.7649 -5.7604 -5.5498 -5.5434 -3.3775 -3.3703 -3.1887 -3.1639 -3.0594 -3.0467 -2.5414 -2.5258 -2.4681 -2.4569 -2.4246 -2.4047 6.1368 6.1700 6.3014 6.3394 7.3133 7.3213 7.3435 7.3483 7.4377 7.4673 7.5492 7.5508 7.8062 7.8182 7.8839 7.9201 k = 0.5351 0.0000 0.3030 ( 24855 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1744 -34.3617 -34.3615 -34.3615 -34.3613 -34.1867 -34.1866 -34.1852 -34.1850 -33.8169 -33.8168 -33.8167 -33.8166 -19.5948 -19.5895 -19.5714 -19.5666 -6.7571 -6.7482 -6.6517 -6.6413 -6.2587 -6.2567 -5.9035 -5.8884 -5.7719 -5.7645 -5.5485 -5.5391 -3.3800 -3.3699 -3.1901 -3.1522 -3.0647 -3.0443 -2.5506 -2.5288 -2.4723 -2.4549 -2.4249 -2.3965 6.1156 6.1582 6.3135 6.3635 7.3029 7.3105 7.3370 7.3469 7.4242 7.4534 7.5474 7.5483 7.8193 7.8280 7.8860 7.9414 k = 0.5351 0.0000 0.2828 ( 24848 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3615 -34.3613 -34.1870 -34.1869 -34.1849 -34.1847 -33.8169 -33.8168 -33.8168 -33.8166 -19.5966 -19.5900 -19.5708 -19.5649 -6.7754 -6.7641 -6.6355 -6.6203 -6.2624 -6.2598 -5.8994 -5.8798 -5.7806 -5.7701 -5.5462 -5.5345 -3.3818 -3.3701 -3.1895 -3.1392 -3.0708 -3.0421 -2.5606 -2.5348 -2.4774 -2.4536 -2.4224 -2.3879 6.0934 6.1411 6.3315 6.3890 7.2888 7.2889 7.3320 7.3450 7.4163 7.4330 7.5447 7.5454 7.8380 7.8381 7.8904 7.9604 k = 0.5351 0.0000 0.2626 ( 24836 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3615 -34.3615 -34.3613 -34.1873 -34.1871 -34.1846 -34.1845 -33.8170 -33.8168 -33.8168 -33.8166 -19.5983 -19.5909 -19.5699 -19.5632 -6.7928 -6.7796 -6.6199 -6.5992 -6.2669 -6.2636 -5.8935 -5.8705 -5.7901 -5.7765 -5.5435 -5.5301 -3.3827 -3.3708 -3.1875 -3.1254 -3.0776 -3.0399 -2.5712 -2.5431 -2.4835 -2.4531 -2.4178 -2.3792 6.0711 6.1218 6.3522 6.4147 7.2604 7.2711 7.3283 7.3426 7.4113 7.4125 7.5404 7.5433 7.8485 7.8588 7.8959 7.9728 k = 0.5351 0.0000 0.2424 ( 24833 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3617 -34.3616 -34.3614 -34.3613 -34.1875 -34.1874 -34.1844 -34.1842 -33.8170 -33.8168 -33.8168 -33.8166 -19.6001 -19.5920 -19.5687 -19.5615 -6.8095 -6.7943 -6.6049 -6.5782 -6.2720 -6.2679 -5.8863 -5.8618 -5.7989 -5.7831 -5.5408 -5.5265 -3.3822 -3.3714 -3.1850 -3.1113 -3.0852 -3.0371 -2.5820 -2.5530 -2.4903 -2.4533 -2.4118 -2.3707 6.0491 6.1021 6.3735 6.4399 7.2301 7.2496 7.3250 7.3398 7.3920 7.4106 7.5358 7.5412 7.8592 7.8783 7.9017 7.9773 k = 0.5351 0.0000 0.2222 ( 24817 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1878 -34.1876 -34.1841 -34.1840 -33.8170 -33.8168 -33.8167 -33.8165 -19.6018 -19.5933 -19.5673 -19.5598 -6.8251 -6.8083 -6.5909 -6.5576 -6.2776 -6.2725 -5.8784 -5.8563 -5.8041 -5.7890 -5.5385 -5.5239 -3.3802 -3.3714 -3.1829 -3.0994 -3.0914 -3.0336 -2.5927 -2.5637 -2.4977 -2.4543 -2.4051 -2.3625 6.0279 6.0828 6.3945 6.4639 7.2006 7.2251 7.3220 7.3365 7.3771 7.4094 7.5313 7.5390 7.8697 7.8933 7.9083 7.9762 k = 0.5351 0.0000 0.2020 ( 24803 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1880 -34.1879 -34.1839 -34.1837 -33.8170 -33.8168 -33.8167 -33.8165 -19.6034 -19.5946 -19.5659 -19.5582 -6.8396 -6.8215 -6.5779 -6.5374 -6.2837 -6.2771 -5.8710 -5.8573 -5.8021 -5.7930 -5.5369 -5.5226 -3.3765 -3.3706 -3.1820 -3.1046 -3.0818 -3.0291 -2.6030 -2.5748 -2.5056 -2.4560 -2.3981 -2.3546 6.0077 6.0644 6.4144 6.4862 7.1736 7.1991 7.3190 7.3330 7.3670 7.4086 7.5271 7.5367 7.8796 7.9001 7.9181 7.9718 k = 0.5351 0.0000 0.1818 ( 24816 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3616 -34.3614 -34.3612 -34.1882 -34.1881 -34.1837 -34.1835 -33.8170 -33.8168 -33.8167 -33.8165 -19.6050 -19.5958 -19.5646 -19.5567 -6.8530 -6.8336 -6.5661 -6.5177 -6.2901 -6.2816 -5.8652 -5.8642 -5.7939 -5.7934 -5.5364 -5.5229 -3.3710 -3.3687 -3.1827 -3.1147 -3.0688 -3.0234 -2.6128 -2.5858 -2.5137 -2.4583 -2.3912 -2.3472 5.9888 6.0473 6.4327 6.5063 7.1501 7.1733 7.3162 7.3293 7.3614 7.4082 7.5231 7.5341 7.8884 7.8998 7.9286 7.9669 k = 0.5351 0.0000 0.1616 ( 24817 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3617 -34.3613 -34.3612 -34.1884 -34.1883 -34.1835 -34.1833 -33.8170 -33.8169 -33.8167 -33.8165 -19.6064 -19.5971 -19.5633 -19.5553 -6.8651 -6.8447 -6.5556 -6.4987 -6.2968 -6.2857 -5.8739 -5.8624 -5.7905 -5.7812 -5.5370 -5.5248 -3.3654 -3.3638 -3.1855 -3.1258 -3.0566 -3.0166 -2.6217 -2.5965 -2.5219 -2.4611 -2.3845 -2.3404 5.9712 6.0315 6.4491 6.5238 7.1305 7.1490 7.3135 7.3255 7.3597 7.4083 7.5193 7.5310 7.8947 7.8955 7.9371 7.9621 k = 0.5351 0.0000 0.1414 ( 24819 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3618 -34.3617 -34.3613 -34.3612 -34.1886 -34.1884 -34.1833 -34.1832 -33.8171 -33.8169 -33.8167 -33.8165 -19.6077 -19.5982 -19.5621 -19.5540 -6.8759 -6.8546 -6.5465 -6.4806 -6.3038 -6.2893 -5.8842 -5.8625 -5.7829 -5.7674 -5.5387 -5.5282 -3.3608 -3.3548 -3.1902 -3.1378 -3.0455 -3.0090 -2.6296 -2.6065 -2.5301 -2.4642 -2.3783 -2.3342 5.9552 6.0173 6.4632 6.5384 7.1149 7.1270 7.3109 7.3219 7.3618 7.4095 7.5153 7.5270 7.8859 7.9005 7.9429 7.9592 k = 0.5351 0.0000 0.1212 ( 24845 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1888 -34.1886 -34.1832 -34.1830 -33.8171 -33.8169 -33.8167 -33.8165 -19.6089 -19.5992 -19.5610 -19.5529 -6.8854 -6.8633 -6.5387 -6.4634 -6.3111 -6.2924 -5.8942 -5.8647 -5.7723 -5.7531 -5.5417 -5.5330 -3.3548 -3.3442 -3.1967 -3.1506 -3.0358 -3.0010 -2.6364 -2.6156 -2.5379 -2.4675 -2.3727 -2.3288 5.9410 6.0047 6.4750 6.5501 7.1032 7.1079 7.3084 7.3185 7.3673 7.4120 7.5111 7.5219 7.8746 7.9033 7.9470 7.9557 k = 0.5351 0.0000 0.1010 ( 24847 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1889 -34.1887 -34.1830 -34.1829 -33.8171 -33.8169 -33.8167 -33.8165 -19.6099 -19.6001 -19.5600 -19.5519 -6.8935 -6.8708 -6.5323 -6.4472 -6.3186 -6.2949 -5.9032 -5.8678 -5.7602 -5.7392 -5.5456 -5.5389 -3.3477 -3.3323 -3.2047 -3.1640 -3.0276 -2.9932 -2.6419 -2.6236 -2.5453 -2.4708 -2.3678 -2.3240 5.9287 5.9940 6.4844 6.5592 7.0920 7.0949 7.3061 7.3155 7.3757 7.4159 7.5064 7.5153 7.8619 7.9040 7.9490 7.9546 k = 0.5351 0.0000 0.0808 ( 24840 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1890 -34.1888 -34.1829 -34.1828 -33.8171 -33.8169 -33.8166 -33.8165 -19.6107 -19.6009 -19.5592 -19.5511 -6.9002 -6.8770 -6.5272 -6.4322 -6.3264 -6.2968 -5.9109 -5.8711 -5.7478 -5.7261 -5.5501 -5.5454 -3.3398 -3.3194 -3.2135 -3.1779 -3.0209 -2.9860 -2.6463 -2.6302 -2.5518 -2.4739 -2.3636 -2.3200 5.9184 5.9851 6.4917 6.5658 7.0791 7.0894 7.3040 7.3129 7.3867 7.4212 7.5010 7.5072 7.8497 7.9032 7.9502 7.9550 k = 0.5351 0.0000 0.0606 ( 24852 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1891 -34.1889 -34.1828 -34.1827 -33.8171 -33.8169 -33.8166 -33.8165 -19.6113 -19.6015 -19.5586 -19.5504 -6.9054 -6.8818 -6.5234 -6.4187 -6.3341 -6.2982 -5.9171 -5.8739 -5.7363 -5.7146 -5.5548 -5.5521 -3.3317 -3.3060 -3.2226 -3.1919 -3.0158 -2.9799 -2.6495 -2.6355 -2.5573 -2.4766 -2.3603 -2.3169 5.9102 5.9781 6.4970 6.5703 7.0693 7.0860 7.3022 7.3108 7.3995 7.4275 7.4952 7.4975 7.8389 7.9017 7.9545 7.9582 k = 0.5351 0.0000 0.0404 ( 24857 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1891 -34.1890 -34.1828 -34.1826 -33.8171 -33.8169 -33.8166 -33.8164 -19.6118 -19.6019 -19.5581 -19.5500 -6.9092 -6.8853 -6.5207 -6.4071 -6.3416 -6.2992 -5.9217 -5.8761 -5.7268 -5.7055 -5.5590 -5.5579 -3.3241 -3.2930 -3.2308 -3.2053 -3.0122 -2.9752 -2.6516 -2.6393 -2.5614 -2.4786 -2.3579 -2.3147 5.9044 5.9730 6.5006 6.5732 7.0625 7.0840 7.3008 7.3092 7.4131 7.4342 7.4866 7.4892 7.8303 7.9000 7.9535 7.9568 k = 0.5351 0.0000 0.0202 ( 24868 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8164 -19.6121 -19.6022 -19.5579 -19.5497 -6.9115 -6.8874 -6.5191 -6.3986 -6.3475 -6.2997 -5.9245 -5.8775 -5.7205 -5.6995 -5.5620 -5.5619 -3.3184 -3.2823 -3.2369 -3.2162 -3.0100 -2.9723 -2.6528 -2.6416 -2.5640 -2.4800 -2.3565 -2.3133 5.9008 5.9700 6.5027 6.5748 7.0584 7.0831 7.2999 7.3083 7.4254 7.4398 7.4761 7.4841 7.8250 7.8988 7.9550 7.9570 k = 0.5351 0.0000 0.0000 ( 24862 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8164 -19.6122 -19.6022 -19.5578 -19.5496 -6.9122 -6.8881 -6.5186 -6.3953 -6.3500 -6.2999 -5.9254 -5.8779 -5.7183 -5.6974 -5.5634 -5.5631 -3.3163 -3.2778 -3.2392 -3.2208 -3.0093 -2.9713 -2.6532 -2.6424 -2.5649 -2.4804 -2.3560 -2.3128 5.8996 5.9690 6.5033 6.5753 7.0571 7.0828 7.2996 7.3080 7.4313 7.4421 7.4709 7.4820 7.8231 7.8984 7.9540 7.9560 k = 0.5083 0.0192 0.0000 ( 24874 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6083 -19.6060 -19.5547 -19.5527 -6.9070 -6.9013 -6.4719 -6.4426 -6.3321 -6.3202 -5.9054 -5.8938 -5.7096 -5.7042 -5.5646 -5.5635 -3.3012 -3.2921 -3.2301 -3.2256 -2.9958 -2.9866 -2.6451 -2.6423 -2.5320 -2.5120 -2.3390 -2.3286 5.9261 5.9425 6.5293 6.5463 7.0572 7.0633 7.3044 7.3064 7.4491 7.4553 7.4559 7.4667 7.8735 7.8920 7.9644 7.9668 k = 0.4816 0.0384 0.0000 ( 24876 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8165 -19.6097 -19.6045 -19.5559 -19.5516 -6.9137 -6.9010 -6.4877 -6.4229 -6.3404 -6.3143 -5.9103 -5.8838 -5.7100 -5.6968 -5.5695 -5.5647 -3.3044 -3.2841 -3.2336 -3.2232 -3.0047 -2.9835 -2.6469 -2.6408 -2.5453 -2.5011 -2.3426 -2.3194 5.9171 5.9533 6.5212 6.5585 7.0488 7.0624 7.3008 7.3047 7.4439 7.4468 7.4593 7.4720 7.8476 7.8988 7.9621 7.9653 k = 0.4548 0.0576 0.0000 ( 24851 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8166 -33.8164 -19.6134 -19.6008 -19.5589 -19.5486 -6.9249 -6.8940 -6.5300 -6.3723 -6.3595 -6.2971 -5.9269 -5.8608 -5.7155 -5.6805 -5.5810 -5.5637 -3.3148 -3.2650 -3.2445 -3.2187 -3.0255 -2.9718 -2.6552 -2.6410 -2.5801 -2.4724 -2.3547 -2.2984 5.8932 5.9810 6.5003 6.5897 7.0405 7.0725 7.2921 7.3003 7.4205 7.4342 7.4730 7.4841 7.7813 7.9184 7.9480 7.9521 k = 0.4281 0.0769 0.0000 ( 24840 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1826 -33.8171 -33.8169 -33.8167 -33.8164 -19.6170 -19.5974 -19.5618 -19.5457 -6.9346 -6.8861 -6.5694 -6.3768 -6.3204 -6.2810 -5.9431 -5.8373 -5.7206 -5.6621 -5.5977 -5.5615 -3.3231 -3.2576 -3.2442 -3.2177 -3.0471 -2.9603 -2.6664 -2.6459 -2.6159 -2.4463 -2.3649 -2.2772 5.8712 6.0088 6.4837 6.6218 7.0397 7.0869 7.2813 7.2921 7.3874 7.4265 7.4898 7.4936 7.7173 7.9249 7.9396 7.9532 k = 0.4013 0.0961 0.0000 ( 24828 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1825 -33.8172 -33.8168 -33.8167 -33.8164 -19.6203 -19.5942 -19.5644 -19.5430 -6.9424 -6.8771 -6.6054 -6.3917 -6.2682 -6.2660 -5.9583 -5.8162 -5.7237 -5.6430 -5.6191 -5.5581 -3.3296 -3.2722 -3.2219 -3.2216 -3.0665 -2.9489 -2.6798 -2.6555 -2.6524 -2.4231 -2.3737 -2.2571 5.8517 6.0366 6.4709 6.6535 7.0473 7.1045 7.2693 7.2814 7.3493 7.4202 7.5014 7.5087 7.6620 7.8945 7.9480 7.9774 k = 0.3745 0.1153 0.0000 ( 24844 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1825 -33.8172 -33.8168 -33.8167 -33.8163 -19.6234 -19.5913 -19.5668 -19.5405 -6.9477 -6.8670 -6.6379 -6.4034 -6.2524 -6.2163 -5.9723 -5.8022 -5.7216 -5.6441 -5.6248 -5.5538 -3.3341 -3.2872 -3.2319 -3.1987 -3.0799 -2.9383 -2.6947 -2.6890 -2.6689 -2.4030 -2.3817 -2.2392 5.8352 6.0639 6.4614 6.6839 7.0632 7.1227 7.2563 7.2701 7.3119 7.4154 7.5074 7.5289 7.6176 7.8587 7.9484 7.9763 k = 0.3478 0.1345 0.0000 ( 24840 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3617 -34.3613 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8172 -33.8168 -33.8168 -33.8163 -19.6262 -19.5889 -19.5689 -19.5384 -6.9501 -6.8557 -6.6665 -6.4116 -6.2403 -6.1659 -5.9846 -5.7992 -5.7124 -5.6717 -5.6086 -5.5485 -3.3369 -3.3016 -3.2484 -3.1750 -3.0857 -2.9290 -2.7252 -2.7101 -2.6851 -2.3896 -2.3862 -2.2244 5.8223 6.0906 6.4545 6.7128 7.0854 7.1348 7.2425 7.2597 7.2856 7.4121 7.5093 7.5496 7.5869 7.8194 7.9445 7.9694 k = 0.3210 0.1537 0.0000 ( 24826 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8173 -33.8168 -33.8167 -33.8163 -19.6285 -19.5869 -19.5706 -19.5366 -6.9492 -6.8431 -6.6911 -6.4158 -6.2300 -6.1189 -5.9950 -5.8053 -5.7001 -5.7001 -5.5952 -5.5425 -3.3381 -3.3143 -3.2680 -3.1513 -3.0846 -2.9222 -2.7603 -2.7255 -2.7026 -2.3980 -2.3728 -2.2136 5.8134 6.1162 6.4494 6.7412 7.1070 7.1357 7.2285 7.2512 7.2820 7.4106 7.5026 7.5699 7.5752 7.7784 7.9380 7.9574 k = 0.2943 0.1729 0.0000 ( 24837 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8173 -33.8168 -33.8167 -33.8162 -19.6305 -19.5854 -19.5720 -19.5351 -6.9446 -6.8294 -6.7116 -6.4158 -6.2221 -6.0778 -6.0032 -5.8165 -5.7265 -5.6908 -5.5849 -5.5358 -3.3378 -3.3244 -3.2871 -3.1286 -3.0787 -2.9187 -2.7932 -2.7404 -2.7192 -2.4074 -2.3631 -2.2074 5.8091 6.1404 6.4457 6.7701 7.1031 7.1502 7.2153 7.2448 7.2964 7.4107 7.4923 7.5807 7.5887 7.7377 7.9284 7.9409 k = 0.2675 0.1922 0.0000 ( 24822 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1889 -34.1828 -34.1825 -33.8173 -33.8168 -33.8167 -33.8162 -19.6320 -19.5842 -19.5730 -19.5341 -6.9360 -6.8145 -6.7277 -6.4116 -6.2172 -6.0469 -6.0088 -5.8301 -5.7468 -5.6886 -5.5784 -5.5287 -3.3362 -3.3311 -3.3025 -3.1079 -3.0695 -2.9194 -2.8228 -2.7558 -2.7319 -2.4178 -2.3570 -2.2062 5.8095 6.1627 6.4430 6.8005 7.0859 7.1758 7.2037 7.2408 7.3093 7.4122 7.4936 7.5957 7.6038 7.7005 7.9153 7.9207 k = 0.2408 0.2114 0.0000 ( 24820 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1889 -34.1828 -34.1825 -33.8173 -33.8169 -33.8167 -33.8162 -19.6329 -19.5834 -19.5739 -19.5334 -6.9233 -6.7986 -6.7394 -6.4030 -6.2159 -6.0315 -6.0115 -5.8447 -5.7555 -5.6953 -5.5761 -5.5214 -3.3340 -3.3334 -3.3121 -3.0910 -3.0585 -2.9239 -2.8470 -2.7721 -2.7393 -2.4293 -2.3546 -2.2102 5.8149 6.1826 6.4413 6.8329 7.0733 7.1945 7.1993 7.2394 7.3082 7.4147 7.5150 7.6083 7.6154 7.6744 7.8984 7.8991 k = 0.2140 0.2306 0.0000 ( 24824 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1889 -34.1828 -34.1825 -33.8173 -33.8169 -33.8167 -33.8162 -19.6334 -19.5827 -19.5747 -19.5332 -6.9066 -6.7820 -6.7467 -6.3903 -6.2187 -6.0349 -6.0113 -5.8596 -5.7492 -5.7111 -5.5792 -5.5142 -3.3327 -3.3295 -3.3150 -3.0802 -3.0467 -2.9308 -2.8634 -2.7879 -2.7424 -2.4416 -2.3558 -2.2196 5.8252 6.1996 6.4407 6.8677 7.0691 7.1880 7.2149 7.2405 7.2995 7.4174 7.5488 7.5918 7.6379 7.6701 7.8758 7.8802 k = 0.1873 0.2498 0.0000 ( 24814 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1889 -34.1828 -34.1825 -33.8173 -33.8169 -33.8167 -33.8162 -19.6334 -19.5821 -19.5754 -19.5334 -6.8860 -6.7652 -6.7494 -6.3737 -6.2253 -6.0549 -6.0087 -5.8740 -5.7349 -5.7302 -5.5883 -5.5072 -3.3273 -3.3248 -3.3111 -3.0774 -3.0351 -2.9372 -2.8697 -2.8018 -2.7435 -2.4542 -2.3606 -2.2342 5.8402 6.2134 6.4417 6.9050 7.0723 7.1846 7.2145 7.2444 7.3003 7.4194 7.5638 7.5808 7.6622 7.6788 7.8547 7.8596 k = 0.1605 0.2690 0.0000 ( 24817 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1889 -34.1828 -34.1825 -33.8173 -33.8169 -33.8167 -33.8162 -19.6329 -19.5818 -19.5760 -19.5340 -6.8622 -6.7488 -6.7475 -6.3538 -6.2346 -6.0859 -6.0047 -5.8877 -5.7645 -5.7043 -5.6037 -5.5009 -3.3192 -3.3181 -3.3017 -3.0829 -3.0253 -2.9397 -2.8653 -2.8130 -2.7445 -2.4665 -2.3688 -2.2538 5.8595 6.2235 6.4449 6.9441 7.0778 7.1841 7.2040 7.2511 7.3152 7.4193 7.5348 7.5984 7.6879 7.6904 7.8367 7.8384 k = 0.1338 0.2882 0.0000 ( 24824 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8173 -33.8168 -33.8167 -33.8162 -19.6319 -19.5820 -19.5761 -19.5350 -6.8360 -6.7412 -6.7335 -6.3315 -6.2450 -6.1229 -6.0011 -5.9008 -5.7968 -5.6763 -5.6249 -5.4955 -3.3129 -3.3057 -3.2885 -3.0944 -3.0186 -2.9347 -2.8522 -2.8209 -2.7472 -2.4779 -2.3803 -2.2779 5.8824 6.2299 6.4510 6.9814 7.0780 7.1866 7.2036 7.2606 7.3365 7.4159 7.5078 7.5959 7.7026 7.7119 7.8160 7.8231 k = 0.1070 0.3074 0.0000 ( 24830 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8173 -33.8168 -33.8167 -33.8163 -19.6304 -19.5831 -19.5755 -19.5363 -6.8088 -6.7303 -6.7205 -6.3090 -6.2535 -6.1628 -5.9997 -5.9144 -5.8272 -5.6507 -5.6493 -5.4913 -3.3060 -3.2915 -3.2736 -3.1089 -3.0139 -2.9207 -2.8332 -2.8253 -2.7528 -2.4876 -2.3948 -2.3056 5.9081 6.2325 6.4606 6.9988 7.0857 7.1916 7.2228 7.2726 7.3594 7.4080 7.4838 7.5753 7.7151 7.7294 7.7893 7.8146 k = 0.0803 0.3267 0.0000 ( 24810 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3613 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8173 -33.8168 -33.8167 -33.8163 -19.6285 -19.5849 -19.5741 -19.5380 -6.7828 -6.7150 -6.7107 -6.2913 -6.2541 -6.2038 -6.0024 -5.9307 -5.8494 -5.6790 -5.6250 -5.4887 -3.2983 -3.2772 -3.2589 -3.1242 -3.0084 -2.8992 -2.8264 -2.8104 -2.7621 -2.4953 -2.4120 -2.3357 5.9357 6.2313 6.4740 6.9789 7.1238 7.1986 7.2558 7.2870 7.3816 7.3951 7.4629 7.5421 7.7284 7.7379 7.7551 7.8108 k = 0.0535 0.3459 0.0000 ( 24804 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3616 -34.3613 -34.3610 -34.1893 -34.1890 -34.1828 -34.1825 -33.8172 -33.8168 -33.8168 -33.8163 -19.6263 -19.5871 -19.5724 -19.5399 -6.7607 -6.7052 -6.6955 -6.2835 -6.2446 -6.2412 -6.0106 -5.9496 -5.8603 -5.7068 -5.6047 -5.4881 -3.2898 -3.2640 -3.2461 -3.1387 -2.9993 -2.8726 -2.8246 -2.7853 -2.7750 -2.5012 -2.4318 -2.3662 5.9640 6.2264 6.4916 6.9426 7.1762 7.2066 7.2937 7.3033 7.3778 7.4012 7.4457 7.5039 7.7116 7.7398 7.7424 7.8104 k = 0.0268 0.3651 0.0000 ( 24803 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3610 -34.1892 -34.1890 -34.1827 -34.1825 -33.8172 -33.8168 -33.8168 -33.8163 -19.6237 -19.5897 -19.5703 -19.5421 -6.7461 -6.7048 -6.6718 -6.2843 -6.2770 -6.2240 -6.0232 -5.9670 -5.8622 -5.7306 -5.5886 -5.4901 -3.2804 -3.2531 -3.2363 -3.1517 -2.9853 -2.8444 -2.8208 -2.7901 -2.7588 -2.5058 -2.4537 -2.3941 5.9922 6.2181 6.5133 6.9019 7.2146 7.2307 7.3208 7.3235 7.3572 7.4189 7.4328 7.4707 7.6688 7.7318 7.7564 7.8119 k = 0.0000 0.3843 0.0000 ( 24812 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1892 -34.1890 -34.1827 -34.1825 -33.8172 -33.8168 -33.8167 -33.8164 -19.6209 -19.5925 -19.5680 -19.5444 -6.7421 -6.7098 -6.6441 -6.3222 -6.2650 -6.2107 -6.0359 -5.9820 -5.8575 -5.7469 -5.5771 -5.4950 -3.2697 -3.2448 -3.2297 -3.1629 -2.9668 -2.8242 -2.8199 -2.7971 -2.7315 -2.5092 -2.4774 -2.4158 6.0190 6.2063 6.5389 6.8607 7.2211 7.2736 7.3261 7.3275 7.3459 7.4250 7.4337 7.4648 7.6353 7.7169 7.7685 7.8138 k = 0.0000 0.3651 0.0202 ( 24810 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3610 -34.1892 -34.1890 -34.1828 -34.1825 -33.8172 -33.8168 -33.8168 -33.8163 -19.6237 -19.5895 -19.5704 -19.5422 -6.7392 -6.7011 -6.6726 -6.2912 -6.2797 -6.2155 -6.0232 -5.9690 -5.8652 -5.7363 -5.5873 -5.4894 -3.2840 -3.2475 -3.2377 -3.1480 -2.9880 -2.8381 -2.8187 -2.8023 -2.7545 -2.5064 -2.4541 -2.3993 5.9942 6.2204 6.5116 6.9008 7.2150 7.2458 7.3325 7.3342 7.3424 7.4201 7.4315 7.4621 7.6635 7.7336 7.7583 7.8121 k = 0.0000 0.3459 0.0404 ( 24802 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3616 -34.3613 -34.3610 -34.1892 -34.1889 -34.1828 -34.1826 -33.8172 -33.8168 -33.8168 -33.8163 -19.6262 -19.5865 -19.5731 -19.5401 -6.7341 -6.6991 -6.6906 -6.2937 -6.2842 -6.1966 -6.0082 -5.9604 -5.8700 -5.7282 -5.5992 -5.4859 -3.2995 -3.2488 -3.2464 -3.1265 -3.0108 -2.8571 -2.8330 -2.8065 -2.7615 -2.5029 -2.4338 -2.3845 5.9718 6.2361 6.4850 6.9392 7.2013 7.2231 7.3165 7.3409 7.3558 7.3964 7.4416 7.4829 7.6975 7.7387 7.7584 7.8113 k = 0.0000 0.3267 0.0606 ( 24813 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1892 -34.1889 -34.1829 -34.1826 -33.8173 -33.8168 -33.8167 -33.8163 -19.6284 -19.5834 -19.5758 -19.5383 -6.7267 -6.7219 -6.6796 -6.3069 -6.2970 -6.1578 -5.9918 -5.9604 -5.8686 -5.7224 -5.6126 -5.4841 -3.3133 -3.2603 -3.2445 -3.1009 -3.0348 -2.8783 -2.8612 -2.8093 -2.7559 -2.4993 -2.4173 -2.3714 5.9524 6.2536 6.4591 6.9751 7.1743 7.2144 7.3006 7.3464 7.3681 7.3757 7.4560 7.5079 7.7269 7.7361 7.7744 7.8126 k = 0.0000 0.3074 0.0808 ( 24826 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1891 -34.1888 -34.1830 -34.1827 -33.8173 -33.8169 -33.8167 -33.8163 -19.6304 -19.5802 -19.5788 -19.5367 -6.7418 -6.7171 -6.6676 -6.3191 -6.3158 -6.1126 -5.9748 -5.9701 -5.8599 -5.7186 -5.6272 -5.4840 -3.3249 -3.2711 -3.2427 -3.0727 -3.0595 -2.9032 -2.8921 -2.8103 -2.7466 -2.4960 -2.4053 -2.3598 5.9362 6.2732 6.4342 7.0072 7.1455 7.2100 7.2856 7.3515 7.3596 7.3791 7.4749 7.5313 7.7144 7.7685 7.8000 7.8176 k = 0.0000 0.2882 0.1010 ( 24806 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3616 -34.3614 -34.3610 -34.1890 -34.1886 -34.1831 -34.1828 -33.8173 -33.8169 -33.8166 -33.8162 -19.6320 -19.5818 -19.5770 -19.5354 -6.7583 -6.7055 -6.6550 -6.3363 -6.3303 -6.0656 -5.9872 -5.9577 -5.8468 -5.7166 -5.6427 -5.4852 -3.3343 -3.2807 -3.2413 -3.0855 -3.0417 -2.9350 -2.9183 -2.8090 -2.7367 -2.4934 -2.3982 -2.3500 5.9236 6.2952 6.4105 7.0347 7.1196 7.2073 7.2719 7.3479 7.3567 7.3889 7.4985 7.5504 7.7007 7.7880 7.8272 7.8415 k = 0.0000 0.2690 0.1212 ( 24813 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3614 -34.3610 -34.1889 -34.1885 -34.1833 -34.1829 -33.8173 -33.8169 -33.8166 -33.8162 -19.6333 -19.5850 -19.5737 -19.5343 -6.7713 -6.6920 -6.6423 -6.3571 -6.3405 -6.0187 -6.0090 -5.9407 -5.8318 -5.7158 -5.6585 -5.4876 -3.3417 -3.2889 -3.2407 -3.1113 -3.0095 -2.9695 -2.9422 -2.8048 -2.7270 -2.4921 -2.3959 -2.3422 5.9148 6.3200 6.3877 7.0566 7.0980 7.2060 7.2599 7.3398 7.3624 7.3976 7.5261 7.5637 7.6870 7.8012 7.8415 7.8906 k = 0.0000 0.2498 0.1414 ( 24788 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3615 -34.3610 -34.1887 -34.1883 -34.1834 -34.1831 -33.8173 -33.8170 -33.8166 -33.8162 -19.6343 -19.5883 -19.5705 -19.5335 -6.7806 -6.6767 -6.6300 -6.3774 -6.3497 -6.0340 -5.9734 -5.9238 -5.8165 -5.7155 -5.6742 -5.4909 -3.3473 -3.2959 -3.2409 -3.1372 -3.0035 -2.9763 -2.9655 -2.7972 -2.7178 -2.4923 -2.3981 -2.3369 5.9099 6.3478 6.3657 7.0724 7.0819 7.2065 7.2501 7.3345 7.3688 7.4056 7.5562 7.5712 7.6735 7.8118 7.8593 7.9425 k = 0.0000 0.2306 0.1616 ( 24798 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3615 -34.3610 -34.1886 -34.1881 -34.1836 -34.1832 -33.8174 -33.8170 -33.8165 -33.8162 -19.6349 -19.5917 -19.5672 -19.5329 -6.7862 -6.6600 -6.6185 -6.3970 -6.3579 -6.0612 -5.9331 -5.9053 -5.8018 -5.7148 -5.6891 -5.4950 -3.3512 -3.3017 -3.2424 -3.1629 -3.0359 -2.9883 -2.9428 -2.7854 -2.7089 -2.4943 -2.4045 -2.3346 5.9089 6.3439 6.3791 7.0723 7.0817 7.2088 7.2428 7.3315 7.3761 7.4132 7.5734 7.5863 7.6606 7.8213 7.8779 7.9942 k = 0.0000 0.2114 0.1818 ( 24802 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3620 -34.3615 -34.3614 -34.3610 -34.1884 -34.1879 -34.1838 -34.1834 -33.8174 -33.8170 -33.8165 -33.8162 -19.6352 -19.5951 -19.5639 -19.5325 -6.7882 -6.6422 -6.6085 -6.4155 -6.3651 -6.0899 -5.9060 -5.8793 -5.7881 -5.7121 -5.7028 -5.4995 -3.3538 -3.3066 -3.2456 -3.1879 -3.0654 -3.0103 -2.9096 -2.7691 -2.7003 -2.4983 -2.4149 -2.3355 5.9118 6.3219 6.4139 7.0699 7.0844 7.2124 7.2384 7.3304 7.3845 7.4209 7.5713 7.6134 7.6485 7.8307 7.8936 8.0402 k = 0.0000 0.1922 0.2020 ( 24814 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3616 -34.3614 -34.3610 -34.1882 -34.1877 -34.1840 -34.1836 -33.8174 -33.8171 -33.8165 -33.8162 -19.6352 -19.5986 -19.5607 -19.5324 -6.7867 -6.6236 -6.6007 -6.4328 -6.3709 -6.1194 -5.8904 -5.8501 -5.7759 -5.7148 -5.7050 -5.5043 -3.3553 -3.3109 -3.2511 -3.2120 -3.0910 -3.0315 -2.8773 -2.7477 -2.6918 -2.5044 -2.4289 -2.3399 5.9184 6.2990 6.4523 7.0754 7.0806 7.2163 7.2379 7.3310 7.3942 7.4289 7.5660 7.6328 7.6393 7.8414 7.9008 8.0593 k = 0.0000 0.1729 0.2222 ( 24805 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3616 -34.3614 -34.3610 -34.1880 -34.1875 -34.1843 -34.1838 -33.8174 -33.8171 -33.8164 -33.8162 -19.6349 -19.6022 -19.5575 -19.5325 -6.7816 -6.6046 -6.5958 -6.4486 -6.3750 -6.1493 -5.8788 -5.8284 -5.7652 -5.7246 -5.6909 -5.5091 -3.3559 -3.3148 -3.2594 -3.2348 -3.1118 -3.0515 -2.8458 -2.7215 -2.6831 -2.5126 -2.4463 -2.3478 5.9286 6.2746 6.4944 7.0701 7.0890 7.2191 7.2420 7.3336 7.4051 7.4372 7.5578 7.6260 7.6494 7.8547 7.8910 8.0286 k = 0.0000 0.1537 0.2424 ( 24804 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3616 -34.3614 -34.3611 -34.1877 -34.1872 -34.1845 -34.1841 -33.8174 -33.8171 -33.8164 -33.8162 -19.6343 -19.6057 -19.5544 -19.5328 -6.7733 -6.5949 -6.5858 -6.4628 -6.3769 -6.1789 -5.8692 -5.8168 -5.7562 -5.7320 -5.6697 -5.5137 -3.3559 -3.3184 -3.2708 -3.2562 -3.1272 -3.0701 -2.8151 -2.6913 -2.6739 -2.5226 -2.4668 -2.3592 5.9421 6.2486 6.5401 7.0533 7.1106 7.2214 7.2493 7.3388 7.4172 7.4460 7.5474 7.6169 7.6546 7.8586 7.8712 8.0128 k = 0.0000 0.1345 0.2626 ( 24792 PWs) bands (ev): -65.1746 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1875 -34.1870 -34.1848 -34.1843 -33.8174 -33.8172 -33.8163 -33.8162 -19.6333 -19.6093 -19.5514 -19.5334 -6.7620 -6.5987 -6.5676 -6.4752 -6.3759 -6.2078 -5.8610 -5.8129 -5.7489 -5.7369 -5.6440 -5.5180 -3.3555 -3.3219 -3.2846 -3.2757 -3.1374 -3.0872 -2.7844 -2.6642 -2.6579 -2.5344 -2.4900 -2.3740 5.9584 6.2205 6.5890 7.0304 7.1394 7.2244 7.2573 7.3472 7.4301 7.4552 7.5350 7.6087 7.6524 7.8093 7.8906 8.0070 k = 0.0000 0.1153 0.2828 ( 24789 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1872 -34.1867 -34.1851 -34.1846 -33.8174 -33.8172 -33.8163 -33.8162 -19.6321 -19.6128 -19.5485 -19.5341 -6.7479 -6.6074 -6.5507 -6.4859 -6.3716 -6.2357 -5.8539 -5.8139 -5.7437 -5.7390 -5.6174 -5.5222 -3.3547 -3.3254 -3.2996 -3.2931 -3.1435 -3.1027 -2.7534 -2.6536 -2.6229 -2.5476 -2.5155 -2.3921 5.9773 6.1904 6.6409 7.0018 7.1728 7.2289 7.2656 7.3590 7.4434 7.4644 7.5215 7.6017 7.6445 7.7505 7.9119 8.0038 k = 0.0000 0.0961 0.3030 ( 24793 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3613 -34.3611 -34.1869 -34.1864 -34.1853 -34.1848 -33.8174 -33.8172 -33.8163 -33.8162 -19.6306 -19.6162 -19.5457 -19.5350 -6.7314 -6.6208 -6.5357 -6.4946 -6.3641 -6.2622 -5.8476 -5.8173 -5.7412 -5.7377 -5.5923 -5.5262 -3.3536 -3.3287 -3.3145 -3.3082 -3.1466 -3.1166 -2.7217 -2.6420 -2.5877 -2.5619 -2.5423 -2.4132 5.9982 6.1585 6.6951 6.9681 7.2041 7.2353 7.2785 7.3727 7.4568 7.4734 7.5087 7.5962 7.6328 7.6868 7.9344 8.0014 k = 0.0000 0.0769 0.3232 ( 24795 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3618 -34.3612 -34.3611 -34.1867 -34.1861 -34.1856 -34.1851 -33.8173 -33.8173 -33.8163 -33.8162 -19.6289 -19.6196 -19.5430 -19.5362 -6.7129 -6.6384 -6.5231 -6.5013 -6.3534 -6.2872 -5.8415 -5.8219 -5.7392 -5.7354 -5.5701 -5.5304 -3.3522 -3.3319 -3.3284 -3.3208 -3.1475 -3.1286 -2.6892 -2.6294 -2.5769 -2.5768 -2.5464 -2.4372 6.0208 6.1252 6.7511 6.9298 7.2230 7.2408 7.3067 7.3836 7.4698 7.4815 7.5011 7.5925 7.6189 7.6212 7.9571 7.9995 k = 0.0000 0.0576 0.3433 ( 24798 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3618 -34.3612 -34.3611 -34.1864 -34.1859 -34.1858 -34.1854 -33.8173 -33.8173 -33.8162 -33.8162 -19.6269 -19.6228 -19.5405 -19.5375 -6.6929 -6.6590 -6.5135 -6.5060 -6.3399 -6.3106 -5.8354 -5.8267 -5.7363 -5.7340 -5.5515 -5.5352 -3.3503 -3.3405 -3.3347 -3.3307 -3.1470 -3.1390 -2.6561 -2.6157 -2.6056 -2.5923 -2.5128 -2.4637 6.0446 6.0909 6.8081 6.8877 7.2326 7.2408 7.3476 7.3845 7.4822 7.4880 7.5057 7.5586 7.5911 7.6039 7.9812 7.9981 k = 0.0000 0.0384 0.3635 ( 24798 PWs) bands (ev): -65.1745 -65.1745 -65.1743 -65.1743 -34.3618 -34.3618 -34.3612 -34.3612 -34.1862 -34.1861 -34.1857 -34.1855 -33.8173 -33.8173 -33.8162 -33.8162 -19.6259 -19.6247 -19.5390 -19.5381 -6.6816 -6.6719 -6.5088 -6.5073 -6.3322 -6.3240 -5.8313 -5.8289 -5.7333 -5.7326 -5.5410 -5.5367 -3.3505 -3.3479 -3.3380 -3.3371 -3.1475 -3.1454 -2.6371 -2.6227 -2.6076 -2.6010 -2.4925 -2.4787 6.0562 6.0692 6.8427 6.8653 7.2367 7.2391 7.3712 7.3799 7.4918 7.4936 7.5132 7.5257 7.5889 7.5928 7.9955 7.9964 k = 0.0000 0.0192 0.3837 ( 24774 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3618 -34.3618 -34.3612 -34.3611 -34.1865 -34.1860 -34.1858 -34.1853 -33.8173 -33.8173 -33.8162 -33.8162 -19.6288 -19.6224 -19.5406 -19.5360 -6.7053 -6.6507 -6.5100 -6.5044 -6.3521 -6.3059 -5.8354 -5.8218 -5.7333 -5.7285 -5.5486 -5.5255 -3.3584 -3.3448 -3.3428 -3.3385 -3.1543 -3.1427 -2.6692 -2.6225 -2.5893 -2.5855 -2.5231 -2.4459 6.0215 6.0942 6.7956 6.9217 7.2303 7.2437 7.3424 7.3738 7.4923 7.5035 7.5153 7.5590 7.5748 7.5978 7.9763 7.9963 k = 0.0000 0.0000 0.4039 ( 24780 PWs) bands (ev): -65.1745 -65.1745 -65.1744 -65.1743 -34.3619 -34.3617 -34.3612 -34.3611 -34.1868 -34.1862 -34.1855 -34.1850 -33.8174 -33.8173 -33.8162 -33.8162 -19.6315 -19.6198 -19.5425 -19.5340 -6.7290 -6.6301 -6.5111 -6.5035 -6.3701 -6.2859 -5.8389 -5.8140 -5.7334 -5.7246 -5.5585 -5.5174 -3.3645 -3.3456 -3.3406 -3.3385 -3.1592 -3.1391 -2.7016 -2.6368 -2.5695 -2.5564 -2.5552 -2.4152 5.9875 6.1192 6.7472 6.9763 7.2223 7.2441 7.2974 7.3496 7.4895 7.5106 7.5471 7.5633 7.6048 7.6059 7.9587 8.0021 Writing output data file /lfs/usrhome/phd/ph19d005/ss/lamno_trail/bands/aiida.save/ init_run : 3.09s CPU 13.35s WALL ( 1 calls) electrons : 1255.31s CPU 6121.25s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) wfcinit:atom : 0.02s CPU 0.03s WALL ( 282 calls) wfcinit:wfcr : 38.04s CPU 195.91s WALL ( 282 calls) potinit : 2.48s CPU 10.48s WALL ( 1 calls) hinit0 : 0.13s CPU 0.70s WALL ( 1 calls) Called by electrons: c_bands : 1255.28s CPU 6121.10s WALL ( 1 calls) v_of_rho : 0.05s CPU 0.26s WALL ( 1 calls) v_h : 0.01s CPU 0.07s WALL ( 1 calls) v_xc : 0.04s CPU 0.19s WALL ( 1 calls) newd : 0.05s CPU 0.26s WALL ( 1 calls) PAW_pot : 0.38s CPU 1.70s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.04s WALL ( 282 calls) cegterg : 1214.15s CPU 5914.49s WALL ( 1692 calls) Called by sum_band: Called by *egterg: cdiaghg : 173.43s CPU 720.95s WALL ( 34122 calls) cegterg:over : 32.98s CPU 210.17s WALL ( 33840 calls) cegterg:upda : 2.32s CPU 2.49s WALL ( 33840 calls) cegterg:last : 9.11s CPU 9.63s WALL ( 26667 calls) h_psi : 776.51s CPU 4102.43s WALL ( 35814 calls) s_psi : 8.73s CPU 9.47s WALL ( 35814 calls) g_psi : 0.33s CPU 0.35s WALL ( 33840 calls) Called by h_psi: h_psi:calbec : 23.28s CPU 173.56s WALL ( 35814 calls) vloc_psi : 740.51s CPU 3914.09s WALL ( 35814 calls) add_vuspsi : 12.27s CPU 14.30s WALL ( 35814 calls) General routines calbec : 23.16s CPU 173.46s WALL ( 35814 calls) fft : 0.03s CPU 0.32s WALL ( 23 calls) ffts : 0.00s CPU 0.01s WALL ( 2 calls) fftw : 719.14s CPU 3887.99s WALL ( 3090424 calls) interpolate : 0.00s CPU 0.02s WALL ( 2 calls) davcio : 0.08s CPU 0.47s WALL ( 564 calls) Parallel routines fft_scatt_xy : 25.05s CPU 31.02s WALL ( 3090449 calls) fft_scatt_yz : 567.21s CPU 3701.73s WALL ( 3090449 calls) PAW routines PAW_pot : 0.38s CPU 1.70s WALL ( 1 calls) PWSCF : 8h40m CPU 1d14h34m WALL This run was terminated on: 16:53:23 22Jan2021 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=