Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 19:26:56 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./AlxNF2x3.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 86 54 15 3209 1571 232 Max 87 55 16 3214 1595 235 Sum 3115 1945 547 115603 56905 8393 bravais-lattice index = 14 lattice parameter (alat) = 11.8979 a.u. unit-cell volume = 1190.9457 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.897864 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential F 7.00 18.99840 F( 1.00) Al 3.00 26.98150 Al( 1.00) N 5.00 14.00670 N( 1.00) 12 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 241 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041494 k( 2) = ( 0.0138889 -0.0080188 0.0113402), wk = 0.0041494 k( 3) = ( 0.0277778 -0.0160375 0.0226805), wk = 0.0041494 k( 4) = ( 0.0416667 -0.0240563 0.0340207), wk = 0.0041494 k( 5) = ( 0.0555556 -0.0320750 0.0453609), wk = 0.0041494 k( 6) = ( 0.0694444 -0.0400938 0.0567011), wk = 0.0041494 k( 7) = ( 0.0833333 -0.0481125 0.0680414), wk = 0.0041494 k( 8) = ( 0.0972222 -0.0561313 0.0793816), wk = 0.0041494 k( 9) = ( 0.1111111 -0.0641500 0.0907218), wk = 0.0041494 k( 10) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0041494 k( 11) = ( 0.1388889 -0.0801875 0.1134023), wk = 0.0041494 k( 12) = ( 0.1527778 -0.0882063 0.1247425), wk = 0.0041494 k( 13) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0041494 k( 14) = ( 0.1805556 -0.1042438 0.1474230), wk = 0.0041494 k( 15) = ( 0.1944444 -0.1122625 0.1587632), wk = 0.0041494 k( 16) = ( 0.2083333 -0.1202813 0.1701035), wk = 0.0041494 k( 17) = ( 0.2222222 -0.1283001 0.1814437), wk = 0.0041494 k( 18) = ( 0.2361111 -0.1363188 0.1927839), wk = 0.0041494 k( 19) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0041494 k( 20) = ( 0.2638889 -0.1523563 0.2154644), wk = 0.0041494 k( 21) = ( 0.2777778 -0.1603751 0.2268046), wk = 0.0041494 k( 22) = ( 0.2916667 -0.1683938 0.2381448), wk = 0.0041494 k( 23) = ( 0.3055556 -0.1764126 0.2494851), wk = 0.0041494 k( 24) = ( 0.3194444 -0.1844313 0.2608253), wk = 0.0041494 k( 25) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0041494 k( 26) = ( 0.3472222 -0.2004688 0.2835058), wk = 0.0041494 k( 27) = ( 0.3611111 -0.2084876 0.2948460), wk = 0.0041494 k( 28) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0041494 k( 29) = ( 0.3888889 -0.2245251 0.3175264), wk = 0.0041494 k( 30) = ( 0.4027778 -0.2325439 0.3288667), wk = 0.0041494 k( 31) = ( 0.4166667 -0.2405626 0.3402069), wk = 0.0041494 k( 32) = ( 0.4305556 -0.2485814 0.3515471), wk = 0.0041494 k( 33) = ( 0.4444444 -0.2566001 0.3628874), wk = 0.0041494 k( 34) = ( 0.4583333 -0.2646189 0.3742276), wk = 0.0041494 k( 35) = ( 0.4722222 -0.2726376 0.3855678), wk = 0.0041494 k( 36) = ( 0.4861111 -0.2806564 0.3969081), wk = 0.0041494 k( 37) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0041494 k( 38) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0041494 k( 39) = ( 0.5000000 -0.2726376 0.4195885), wk = 0.0041494 k( 40) = ( 0.5000000 -0.2566001 0.4309288), wk = 0.0041494 k( 41) = ( 0.5000000 -0.2405626 0.4422690), wk = 0.0041494 k( 42) = ( 0.5000000 -0.2245251 0.4536092), wk = 0.0041494 k( 43) = ( 0.5000000 -0.2084876 0.4649494), wk = 0.0041494 k( 44) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0041494 k( 45) = ( 0.5000000 -0.1764126 0.4876299), wk = 0.0041494 k( 46) = ( 0.5000000 -0.1603751 0.4989701), wk = 0.0041494 k( 47) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0041494 k( 48) = ( 0.5000000 -0.1283001 0.5216506), wk = 0.0041494 k( 49) = ( 0.5000000 -0.1122625 0.5329908), wk = 0.0041494 k( 50) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0041494 k( 51) = ( 0.5000000 -0.0801875 0.5556713), wk = 0.0041494 k( 52) = ( 0.5000000 -0.0641500 0.5670115), wk = 0.0041494 k( 53) = ( 0.5000000 -0.0481125 0.5783517), wk = 0.0041494 k( 54) = ( 0.5000000 -0.0320750 0.5896920), wk = 0.0041494 k( 55) = ( 0.5000000 -0.0160375 0.6010322), wk = 0.0041494 k( 56) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0041494 k( 57) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0041494 k( 58) = ( 0.4903846 0.0166543 0.6123724), wk = 0.0041494 k( 59) = ( 0.4807692 0.0333087 0.6123724), wk = 0.0041494 k( 60) = ( 0.4711538 0.0499630 0.6123724), wk = 0.0041494 k( 61) = ( 0.4615385 0.0666173 0.6123724), wk = 0.0041494 k( 62) = ( 0.4519231 0.0832717 0.6123724), wk = 0.0041494 k( 63) = ( 0.4423077 0.0999260 0.6123724), wk = 0.0041494 k( 64) = ( 0.4326923 0.1165803 0.6123724), wk = 0.0041494 k( 65) = ( 0.4230769 0.1332347 0.6123724), wk = 0.0041494 k( 66) = ( 0.4134615 0.1498890 0.6123724), wk = 0.0041494 k( 67) = ( 0.4038462 0.1665434 0.6123724), wk = 0.0041494 k( 68) = ( 0.3942308 0.1831977 0.6123724), wk = 0.0041494 k( 69) = ( 0.3846154 0.1998520 0.6123724), wk = 0.0041494 k( 70) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0041494 k( 71) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0041494 k( 72) = ( 0.3651316 0.2108088 0.5962574), wk = 0.0041494 k( 73) = ( 0.3552632 0.2051113 0.5801423), wk = 0.0041494 k( 74) = ( 0.3453947 0.1994137 0.5640272), wk = 0.0041494 k( 75) = ( 0.3355263 0.1937162 0.5479122), wk = 0.0041494 k( 76) = ( 0.3256579 0.1880187 0.5317971), wk = 0.0041494 k( 77) = ( 0.3157895 0.1823211 0.5156821), wk = 0.0041494 k( 78) = ( 0.3059211 0.1766236 0.4995670), wk = 0.0041494 k( 79) = ( 0.2960526 0.1709261 0.4834519), wk = 0.0041494 k( 80) = ( 0.2861842 0.1652285 0.4673369), wk = 0.0041494 k( 81) = ( 0.2763158 0.1595310 0.4512218), wk = 0.0041494 k( 82) = ( 0.2664474 0.1538335 0.4351067), wk = 0.0041494 k( 83) = ( 0.2565789 0.1481359 0.4189917), wk = 0.0041494 k( 84) = ( 0.2467105 0.1424384 0.4028766), wk = 0.0041494 k( 85) = ( 0.2368421 0.1367409 0.3867615), wk = 0.0041494 k( 86) = ( 0.2269737 0.1310433 0.3706465), wk = 0.0041494 k( 87) = ( 0.2171053 0.1253458 0.3545314), wk = 0.0041494 k( 88) = ( 0.2072368 0.1196482 0.3384163), wk = 0.0041494 k( 89) = ( 0.1973684 0.1139507 0.3223013), wk = 0.0041494 k( 90) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0041494 k( 91) = ( 0.1776316 0.1025556 0.2900712), wk = 0.0041494 k( 92) = ( 0.1677632 0.0968581 0.2739561), wk = 0.0041494 k( 93) = ( 0.1578947 0.0911606 0.2578410), wk = 0.0041494 k( 94) = ( 0.1480263 0.0854630 0.2417260), wk = 0.0041494 k( 95) = ( 0.1381579 0.0797655 0.2256109), wk = 0.0041494 k( 96) = ( 0.1282895 0.0740680 0.2094958), wk = 0.0041494 k( 97) = ( 0.1184210 0.0683704 0.1933808), wk = 0.0041494 k( 98) = ( 0.1085526 0.0626729 0.1772657), wk = 0.0041494 k( 99) = ( 0.0986842 0.0569754 0.1611506), wk = 0.0041494 k( 100) = ( 0.0888158 0.0512778 0.1450356), wk = 0.0041494 k( 101) = ( 0.0789474 0.0455803 0.1289205), wk = 0.0041494 k( 102) = ( 0.0690790 0.0398828 0.1128054), wk = 0.0041494 k( 103) = ( 0.0592105 0.0341852 0.0966904), wk = 0.0041494 k( 104) = ( 0.0493421 0.0284877 0.0805753), wk = 0.0041494 k( 105) = ( 0.0394737 0.0227901 0.0644603), wk = 0.0041494 k( 106) = ( 0.0296053 0.0170926 0.0483452), wk = 0.0041494 k( 107) = ( 0.0197368 0.0113951 0.0322301), wk = 0.0041494 k( 108) = ( 0.0098684 0.0056975 0.0161151), wk = 0.0041494 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041494 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041494 k( 111) = ( 0.0161290 0.0093121 0.0065846), wk = 0.0041494 k( 112) = ( 0.0322581 0.0186242 0.0131693), wk = 0.0041494 k( 113) = ( 0.0483871 0.0279363 0.0197540), wk = 0.0041494 k( 114) = ( 0.0645161 0.0372484 0.0263386), wk = 0.0041494 k( 115) = ( 0.0806452 0.0465605 0.0329232), wk = 0.0041494 k( 116) = ( 0.0967742 0.0558726 0.0395079), wk = 0.0041494 k( 117) = ( 0.1129032 0.0651847 0.0460926), wk = 0.0041494 k( 118) = ( 0.1290323 0.0744968 0.0526772), wk = 0.0041494 k( 119) = ( 0.1451613 0.0838089 0.0592618), wk = 0.0041494 k( 120) = ( 0.1612903 0.0931210 0.0658465), wk = 0.0041494 k( 121) = ( 0.1774194 0.1024331 0.0724311), wk = 0.0041494 k( 122) = ( 0.1935484 0.1117452 0.0790158), wk = 0.0041494 k( 123) = ( 0.2096774 0.1210573 0.0856004), wk = 0.0041494 k( 124) = ( 0.2258064 0.1303694 0.0921851), wk = 0.0041494 k( 125) = ( 0.2419355 0.1396815 0.0987697), wk = 0.0041494 k( 126) = ( 0.2580645 0.1489936 0.1053544), wk = 0.0041494 k( 127) = ( 0.2741936 0.1583057 0.1119390), wk = 0.0041494 k( 128) = ( 0.2903226 0.1676178 0.1185237), wk = 0.0041494 k( 129) = ( 0.3064516 0.1769299 0.1251083), wk = 0.0041494 k( 130) = ( 0.3225807 0.1862420 0.1316930), wk = 0.0041494 k( 131) = ( 0.3387097 0.1955541 0.1382776), wk = 0.0041494 k( 132) = ( 0.3548387 0.2048662 0.1448623), wk = 0.0041494 k( 133) = ( 0.3709677 0.2141783 0.1514469), wk = 0.0041494 k( 134) = ( 0.3870968 0.2234904 0.1580316), wk = 0.0041494 k( 135) = ( 0.4032258 0.2328025 0.1646162), wk = 0.0041494 k( 136) = ( 0.4193548 0.2421146 0.1712009), wk = 0.0041494 k( 137) = ( 0.4354839 0.2514267 0.1777855), wk = 0.0041494 k( 138) = ( 0.4516129 0.2607388 0.1843702), wk = 0.0041494 k( 139) = ( 0.4677419 0.2700509 0.1909548), wk = 0.0041494 k( 140) = ( 0.4838710 0.2793630 0.1975395), wk = 0.0041494 k( 141) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041494 k( 142) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041494 k( 143) = ( 0.5056818 0.2722731 0.2134025), wk = 0.0041494 k( 144) = ( 0.5113636 0.2558711 0.2226809), wk = 0.0041494 k( 145) = ( 0.5170455 0.2394691 0.2319593), wk = 0.0041494 k( 146) = ( 0.5227273 0.2230671 0.2412376), wk = 0.0041494 k( 147) = ( 0.5284091 0.2066652 0.2505160), wk = 0.0041494 k( 148) = ( 0.5340909 0.1902632 0.2597944), wk = 0.0041494 k( 149) = ( 0.5397727 0.1738612 0.2690727), wk = 0.0041494 k( 150) = ( 0.5454545 0.1574592 0.2783511), wk = 0.0041494 k( 151) = ( 0.5511364 0.1410572 0.2876295), wk = 0.0041494 k( 152) = ( 0.5568182 0.1246552 0.2969078), wk = 0.0041494 k( 153) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0041494 k( 154) = ( 0.5681818 0.0918512 0.3154646), wk = 0.0041494 k( 155) = ( 0.5738636 0.0754492 0.3247430), wk = 0.0041494 k( 156) = ( 0.5795455 0.0590472 0.3340213), wk = 0.0041494 k( 157) = ( 0.5852273 0.0426452 0.3432997), wk = 0.0041494 k( 158) = ( 0.5909091 0.0262432 0.3525781), wk = 0.0041494 k( 159) = ( 0.5965909 0.0098412 0.3618564), wk = 0.0041494 k( 160) = ( 0.6022727 -0.0065608 0.3711348), wk = 0.0041494 k( 161) = ( 0.6079545 -0.0229628 0.3804132), wk = 0.0041494 k( 162) = ( 0.6136364 -0.0393648 0.3896915), wk = 0.0041494 k( 163) = ( 0.6193182 -0.0557668 0.3989699), wk = 0.0041494 k( 164) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0041494 k( 165) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0041494 k( 166) = ( 0.6153846 -0.0666173 0.4239501), wk = 0.0041494 k( 167) = ( 0.6057692 -0.0610659 0.4396520), wk = 0.0041494 k( 168) = ( 0.5961538 -0.0555145 0.4553539), wk = 0.0041494 k( 169) = ( 0.5865385 -0.0499630 0.4710557), wk = 0.0041494 k( 170) = ( 0.5769231 -0.0444116 0.4867576), wk = 0.0041494 k( 171) = ( 0.5673077 -0.0388601 0.5024594), wk = 0.0041494 k( 172) = ( 0.5576923 -0.0333087 0.5181613), wk = 0.0041494 k( 173) = ( 0.5480769 -0.0277572 0.5338632), wk = 0.0041494 k( 174) = ( 0.5384615 -0.0222058 0.5495650), wk = 0.0041494 k( 175) = ( 0.5288462 -0.0166543 0.5652669), wk = 0.0041494 k( 176) = ( 0.5192308 -0.0111029 0.5809687), wk = 0.0041494 k( 177) = ( 0.5096154 -0.0055514 0.5966706), wk = 0.0041494 k( 178) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0041494 k( 179) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0041494 k( 180) = ( 0.5000000 0.0115470 0.5960425), wk = 0.0041494 k( 181) = ( 0.5000000 0.0230940 0.5797126), wk = 0.0041494 k( 182) = ( 0.5000000 0.0346410 0.5633826), wk = 0.0041494 k( 183) = ( 0.5000000 0.0461880 0.5470527), wk = 0.0041494 k( 184) = ( 0.5000000 0.0577350 0.5307228), wk = 0.0041494 k( 185) = ( 0.5000000 0.0692820 0.5143928), wk = 0.0041494 k( 186) = ( 0.5000000 0.0808290 0.4980629), wk = 0.0041494 k( 187) = ( 0.5000000 0.0923760 0.4817330), wk = 0.0041494 k( 188) = ( 0.5000000 0.1039230 0.4654031), wk = 0.0041494 k( 189) = ( 0.5000000 0.1154701 0.4490731), wk = 0.0041494 k( 190) = ( 0.5000000 0.1270171 0.4327432), wk = 0.0041494 k( 191) = ( 0.5000000 0.1385641 0.4164133), wk = 0.0041494 k( 192) = ( 0.5000000 0.1501111 0.4000833), wk = 0.0041494 k( 193) = ( 0.5000000 0.1616581 0.3837534), wk = 0.0041494 k( 194) = ( 0.5000000 0.1732051 0.3674235), wk = 0.0041494 k( 195) = ( 0.5000000 0.1847521 0.3510935), wk = 0.0041494 k( 196) = ( 0.5000000 0.1962991 0.3347636), wk = 0.0041494 k( 197) = ( 0.5000000 0.2078461 0.3184337), wk = 0.0041494 k( 198) = ( 0.5000000 0.2193931 0.3021037), wk = 0.0041494 k( 199) = ( 0.5000000 0.2309401 0.2857738), wk = 0.0041494 k( 200) = ( 0.5000000 0.2424871 0.2694439), wk = 0.0041494 k( 201) = ( 0.5000000 0.2540341 0.2531139), wk = 0.0041494 k( 202) = ( 0.5000000 0.2655811 0.2367840), wk = 0.0041494 k( 203) = ( 0.5000000 0.2771281 0.2204541), wk = 0.0041494 k( 204) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041494 k( 205) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041494 k( 206) = ( 0.4943182 0.2853947 0.2226809), wk = 0.0041494 k( 207) = ( 0.4886364 0.2821143 0.2412376), wk = 0.0041494 k( 208) = ( 0.4829545 0.2788339 0.2597944), wk = 0.0041494 k( 209) = ( 0.4772727 0.2755535 0.2783511), wk = 0.0041494 k( 210) = ( 0.4715909 0.2722731 0.2969078), wk = 0.0041494 k( 211) = ( 0.4659091 0.2689927 0.3154646), wk = 0.0041494 k( 212) = ( 0.4602273 0.2657123 0.3340213), wk = 0.0041494 k( 213) = ( 0.4545455 0.2624319 0.3525781), wk = 0.0041494 k( 214) = ( 0.4488636 0.2591515 0.3711348), wk = 0.0041494 k( 215) = ( 0.4431818 0.2558711 0.3896915), wk = 0.0041494 k( 216) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0041494 k( 217) = ( 0.4318182 0.2493103 0.4268050), wk = 0.0041494 k( 218) = ( 0.4261364 0.2460299 0.4453618), wk = 0.0041494 k( 219) = ( 0.4204545 0.2427495 0.4639185), wk = 0.0041494 k( 220) = ( 0.4147727 0.2394691 0.4824753), wk = 0.0041494 k( 221) = ( 0.4090909 0.2361887 0.5010320), wk = 0.0041494 k( 222) = ( 0.4034091 0.2329083 0.5195887), wk = 0.0041494 k( 223) = ( 0.3977273 0.2296279 0.5381455), wk = 0.0041494 k( 224) = ( 0.3920455 0.2263475 0.5567022), wk = 0.0041494 k( 225) = ( 0.3863636 0.2230672 0.5752590), wk = 0.0041494 k( 226) = ( 0.3806818 0.2197868 0.5938157), wk = 0.0041494 k( 227) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0041494 k( 228) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0041494 k( 229) = ( 0.6153846 -0.0888231 0.4082483), wk = 0.0041494 k( 230) = ( 0.6057692 -0.1054775 0.4082483), wk = 0.0041494 k( 231) = ( 0.5961538 -0.1221318 0.4082483), wk = 0.0041494 k( 232) = ( 0.5865385 -0.1387861 0.4082483), wk = 0.0041494 k( 233) = ( 0.5769231 -0.1554405 0.4082483), wk = 0.0041494 k( 234) = ( 0.5673077 -0.1720948 0.4082483), wk = 0.0041494 k( 235) = ( 0.5576923 -0.1887491 0.4082483), wk = 0.0041494 k( 236) = ( 0.5480769 -0.2054035 0.4082483), wk = 0.0041494 k( 237) = ( 0.5384615 -0.2220578 0.4082483), wk = 0.0041494 k( 238) = ( 0.5288462 -0.2387121 0.4082483), wk = 0.0041494 k( 239) = ( 0.5192308 -0.2553665 0.4082483), wk = 0.0041494 k( 240) = ( 0.5096154 -0.2720208 0.4082483), wk = 0.0041494 k( 241) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0041494 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041494 k( 2) = ( 0.0138889 0.0000000 0.0138889), wk = 0.0041494 k( 3) = ( 0.0277778 0.0000000 0.0277778), wk = 0.0041494 k( 4) = ( 0.0416667 0.0000000 0.0416667), wk = 0.0041494 k( 5) = ( 0.0555556 0.0000000 0.0555556), wk = 0.0041494 k( 6) = ( 0.0694444 0.0000000 0.0694444), wk = 0.0041494 k( 7) = ( 0.0833333 0.0000000 0.0833333), wk = 0.0041494 k( 8) = ( 0.0972222 0.0000000 0.0972222), wk = 0.0041494 k( 9) = ( 0.1111111 0.0000000 0.1111111), wk = 0.0041494 k( 10) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0041494 k( 11) = ( 0.1388889 0.0000000 0.1388889), wk = 0.0041494 k( 12) = ( 0.1527778 0.0000000 0.1527778), wk = 0.0041494 k( 13) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0041494 k( 14) = ( 0.1805556 0.0000000 0.1805556), wk = 0.0041494 k( 15) = ( 0.1944444 0.0000000 0.1944444), wk = 0.0041494 k( 16) = ( 0.2083333 0.0000000 0.2083333), wk = 0.0041494 k( 17) = ( 0.2222222 0.0000000 0.2222222), wk = 0.0041494 k( 18) = ( 0.2361111 0.0000000 0.2361111), wk = 0.0041494 k( 19) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0041494 k( 20) = ( 0.2638889 0.0000000 0.2638889), wk = 0.0041494 k( 21) = ( 0.2777778 0.0000000 0.2777778), wk = 0.0041494 k( 22) = ( 0.2916667 0.0000000 0.2916667), wk = 0.0041494 k( 23) = ( 0.3055556 0.0000000 0.3055556), wk = 0.0041494 k( 24) = ( 0.3194444 0.0000000 0.3194444), wk = 0.0041494 k( 25) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0041494 k( 26) = ( 0.3472222 0.0000000 0.3472222), wk = 0.0041494 k( 27) = ( 0.3611111 0.0000000 0.3611111), wk = 0.0041494 k( 28) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0041494 k( 29) = ( 0.3888889 0.0000000 0.3888889), wk = 0.0041494 k( 30) = ( 0.4027778 0.0000000 0.4027778), wk = 0.0041494 k( 31) = ( 0.4166667 0.0000000 0.4166667), wk = 0.0041494 k( 32) = ( 0.4305556 0.0000000 0.4305556), wk = 0.0041494 k( 33) = ( 0.4444444 0.0000000 0.4444444), wk = 0.0041494 k( 34) = ( 0.4583333 0.0000000 0.4583333), wk = 0.0041494 k( 35) = ( 0.4722222 0.0000000 0.4722222), wk = 0.0041494 k( 36) = ( 0.4861111 0.0000000 0.4861111), wk = 0.0041494 k( 37) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041494 k( 38) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041494 k( 39) = ( 0.5000000 0.0138889 0.5138889), wk = 0.0041494 k( 40) = ( 0.5000000 0.0277778 0.5277778), wk = 0.0041494 k( 41) = ( 0.5000000 0.0416667 0.5416667), wk = 0.0041494 k( 42) = ( 0.5000000 0.0555556 0.5555556), wk = 0.0041494 k( 43) = ( 0.5000000 0.0694444 0.5694444), wk = 0.0041494 k( 44) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0041494 k( 45) = ( 0.5000000 0.0972222 0.5972222), wk = 0.0041494 k( 46) = ( 0.5000000 0.1111111 0.6111111), wk = 0.0041494 k( 47) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0041494 k( 48) = ( 0.5000000 0.1388889 0.6388889), wk = 0.0041494 k( 49) = ( 0.5000000 0.1527778 0.6527778), wk = 0.0041494 k( 50) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0041494 k( 51) = ( 0.5000000 0.1805556 0.6805556), wk = 0.0041494 k( 52) = ( 0.5000000 0.1944444 0.6944444), wk = 0.0041494 k( 53) = ( 0.5000000 0.2083333 0.7083333), wk = 0.0041494 k( 54) = ( 0.5000000 0.2222222 0.7222222), wk = 0.0041494 k( 55) = ( 0.5000000 0.2361111 0.7361111), wk = 0.0041494 k( 56) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041494 k( 57) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041494 k( 58) = ( 0.4903846 0.2596154 0.7500000), wk = 0.0041494 k( 59) = ( 0.4807692 0.2692308 0.7500000), wk = 0.0041494 k( 60) = ( 0.4711538 0.2788462 0.7500000), wk = 0.0041494 k( 61) = ( 0.4615385 0.2884615 0.7500000), wk = 0.0041494 k( 62) = ( 0.4519231 0.2980769 0.7500000), wk = 0.0041494 k( 63) = ( 0.4423077 0.3076923 0.7500000), wk = 0.0041494 k( 64) = ( 0.4326923 0.3173077 0.7500000), wk = 0.0041494 k( 65) = ( 0.4230769 0.3269231 0.7500000), wk = 0.0041494 k( 66) = ( 0.4134615 0.3365385 0.7500000), wk = 0.0041494 k( 67) = ( 0.4038462 0.3461538 0.7500000), wk = 0.0041494 k( 68) = ( 0.3942308 0.3557692 0.7500000), wk = 0.0041494 k( 69) = ( 0.3846154 0.3653846 0.7500000), wk = 0.0041494 k( 70) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0041494 k( 71) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0041494 k( 72) = ( 0.3651316 0.3651316 0.7302632), wk = 0.0041494 k( 73) = ( 0.3552632 0.3552632 0.7105263), wk = 0.0041494 k( 74) = ( 0.3453947 0.3453947 0.6907895), wk = 0.0041494 k( 75) = ( 0.3355263 0.3355263 0.6710526), wk = 0.0041494 k( 76) = ( 0.3256579 0.3256579 0.6513158), wk = 0.0041494 k( 77) = ( 0.3157895 0.3157895 0.6315789), wk = 0.0041494 k( 78) = ( 0.3059211 0.3059211 0.6118421), wk = 0.0041494 k( 79) = ( 0.2960526 0.2960526 0.5921053), wk = 0.0041494 k( 80) = ( 0.2861842 0.2861842 0.5723684), wk = 0.0041494 k( 81) = ( 0.2763158 0.2763158 0.5526316), wk = 0.0041494 k( 82) = ( 0.2664474 0.2664474 0.5328947), wk = 0.0041494 k( 83) = ( 0.2565789 0.2565789 0.5131579), wk = 0.0041494 k( 84) = ( 0.2467105 0.2467105 0.4934211), wk = 0.0041494 k( 85) = ( 0.2368421 0.2368421 0.4736842), wk = 0.0041494 k( 86) = ( 0.2269737 0.2269737 0.4539474), wk = 0.0041494 k( 87) = ( 0.2171053 0.2171053 0.4342105), wk = 0.0041494 k( 88) = ( 0.2072368 0.2072368 0.4144737), wk = 0.0041494 k( 89) = ( 0.1973684 0.1973684 0.3947368), wk = 0.0041494 k( 90) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0041494 k( 91) = ( 0.1776316 0.1776316 0.3552632), wk = 0.0041494 k( 92) = ( 0.1677632 0.1677632 0.3355263), wk = 0.0041494 k( 93) = ( 0.1578947 0.1578947 0.3157895), wk = 0.0041494 k( 94) = ( 0.1480263 0.1480263 0.2960526), wk = 0.0041494 k( 95) = ( 0.1381579 0.1381579 0.2763158), wk = 0.0041494 k( 96) = ( 0.1282895 0.1282895 0.2565789), wk = 0.0041494 k( 97) = ( 0.1184210 0.1184210 0.2368421), wk = 0.0041494 k( 98) = ( 0.1085526 0.1085526 0.2171053), wk = 0.0041494 k( 99) = ( 0.0986842 0.0986842 0.1973684), wk = 0.0041494 k( 100) = ( 0.0888158 0.0888158 0.1776316), wk = 0.0041494 k( 101) = ( 0.0789474 0.0789474 0.1578947), wk = 0.0041494 k( 102) = ( 0.0690790 0.0690790 0.1381579), wk = 0.0041494 k( 103) = ( 0.0592105 0.0592105 0.1184210), wk = 0.0041494 k( 104) = ( 0.0493421 0.0493421 0.0986842), wk = 0.0041494 k( 105) = ( 0.0394737 0.0394737 0.0789474), wk = 0.0041494 k( 106) = ( 0.0296053 0.0296053 0.0592105), wk = 0.0041494 k( 107) = ( 0.0197368 0.0197368 0.0394737), wk = 0.0041494 k( 108) = ( 0.0098684 0.0098684 0.0197368), wk = 0.0041494 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041494 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041494 k( 111) = ( 0.0161290 0.0161290 0.0161290), wk = 0.0041494 k( 112) = ( 0.0322581 0.0322581 0.0322581), wk = 0.0041494 k( 113) = ( 0.0483871 0.0483871 0.0483871), wk = 0.0041494 k( 114) = ( 0.0645161 0.0645161 0.0645161), wk = 0.0041494 k( 115) = ( 0.0806452 0.0806452 0.0806452), wk = 0.0041494 k( 116) = ( 0.0967742 0.0967742 0.0967742), wk = 0.0041494 k( 117) = ( 0.1129032 0.1129032 0.1129032), wk = 0.0041494 k( 118) = ( 0.1290323 0.1290323 0.1290323), wk = 0.0041494 k( 119) = ( 0.1451613 0.1451613 0.1451613), wk = 0.0041494 k( 120) = ( 0.1612903 0.1612903 0.1612903), wk = 0.0041494 k( 121) = ( 0.1774194 0.1774194 0.1774194), wk = 0.0041494 k( 122) = ( 0.1935484 0.1935484 0.1935484), wk = 0.0041494 k( 123) = ( 0.2096774 0.2096774 0.2096774), wk = 0.0041494 k( 124) = ( 0.2258064 0.2258065 0.2258065), wk = 0.0041494 k( 125) = ( 0.2419355 0.2419355 0.2419355), wk = 0.0041494 k( 126) = ( 0.2580645 0.2580645 0.2580645), wk = 0.0041494 k( 127) = ( 0.2741936 0.2741936 0.2741936), wk = 0.0041494 k( 128) = ( 0.2903226 0.2903226 0.2903226), wk = 0.0041494 k( 129) = ( 0.3064516 0.3064516 0.3064516), wk = 0.0041494 k( 130) = ( 0.3225807 0.3225807 0.3225807), wk = 0.0041494 k( 131) = ( 0.3387097 0.3387097 0.3387097), wk = 0.0041494 k( 132) = ( 0.3548387 0.3548387 0.3548387), wk = 0.0041494 k( 133) = ( 0.3709677 0.3709677 0.3709677), wk = 0.0041494 k( 134) = ( 0.3870968 0.3870968 0.3870968), wk = 0.0041494 k( 135) = ( 0.4032258 0.4032258 0.4032258), wk = 0.0041494 k( 136) = ( 0.4193548 0.4193548 0.4193548), wk = 0.0041494 k( 137) = ( 0.4354839 0.4354839 0.4354839), wk = 0.0041494 k( 138) = ( 0.4516129 0.4516129 0.4516129), wk = 0.0041494 k( 139) = ( 0.4677419 0.4677419 0.4677419), wk = 0.0041494 k( 140) = ( 0.4838710 0.4838710 0.4838710), wk = 0.0041494 k( 141) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041494 k( 142) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041494 k( 143) = ( 0.5056818 0.4886364 0.5056818), wk = 0.0041494 k( 144) = ( 0.5113636 0.4772727 0.5113636), wk = 0.0041494 k( 145) = ( 0.5170455 0.4659091 0.5170455), wk = 0.0041494 k( 146) = ( 0.5227273 0.4545455 0.5227273), wk = 0.0041494 k( 147) = ( 0.5284091 0.4431818 0.5284091), wk = 0.0041494 k( 148) = ( 0.5340909 0.4318182 0.5340909), wk = 0.0041494 k( 149) = ( 0.5397727 0.4204545 0.5397727), wk = 0.0041494 k( 150) = ( 0.5454545 0.4090909 0.5454545), wk = 0.0041494 k( 151) = ( 0.5511364 0.3977273 0.5511364), wk = 0.0041494 k( 152) = ( 0.5568182 0.3863636 0.5568182), wk = 0.0041494 k( 153) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0041494 k( 154) = ( 0.5681818 0.3636364 0.5681818), wk = 0.0041494 k( 155) = ( 0.5738636 0.3522727 0.5738636), wk = 0.0041494 k( 156) = ( 0.5795455 0.3409091 0.5795455), wk = 0.0041494 k( 157) = ( 0.5852273 0.3295455 0.5852273), wk = 0.0041494 k( 158) = ( 0.5909091 0.3181818 0.5909091), wk = 0.0041494 k( 159) = ( 0.5965909 0.3068182 0.5965909), wk = 0.0041494 k( 160) = ( 0.6022727 0.2954545 0.6022727), wk = 0.0041494 k( 161) = ( 0.6079545 0.2840909 0.6079545), wk = 0.0041494 k( 162) = ( 0.6136364 0.2727273 0.6136364), wk = 0.0041494 k( 163) = ( 0.6193182 0.2613636 0.6193182), wk = 0.0041494 k( 164) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0041494 k( 165) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0041494 k( 166) = ( 0.6153846 0.2500000 0.6346154), wk = 0.0041494 k( 167) = ( 0.6057692 0.2500000 0.6442308), wk = 0.0041494 k( 168) = ( 0.5961538 0.2500000 0.6538462), wk = 0.0041494 k( 169) = ( 0.5865385 0.2500000 0.6634615), wk = 0.0041494 k( 170) = ( 0.5769231 0.2500000 0.6730769), wk = 0.0041494 k( 171) = ( 0.5673077 0.2500000 0.6826923), wk = 0.0041494 k( 172) = ( 0.5576923 0.2500000 0.6923077), wk = 0.0041494 k( 173) = ( 0.5480769 0.2500000 0.7019231), wk = 0.0041494 k( 174) = ( 0.5384615 0.2500000 0.7115385), wk = 0.0041494 k( 175) = ( 0.5288462 0.2500000 0.7211538), wk = 0.0041494 k( 176) = ( 0.5192308 0.2500000 0.7307692), wk = 0.0041494 k( 177) = ( 0.5096154 0.2500000 0.7403846), wk = 0.0041494 k( 178) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041494 k( 179) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041494 k( 180) = ( 0.5000000 0.2600000 0.7400000), wk = 0.0041494 k( 181) = ( 0.5000000 0.2700000 0.7300000), wk = 0.0041494 k( 182) = ( 0.5000000 0.2800000 0.7200000), wk = 0.0041494 k( 183) = ( 0.5000000 0.2900000 0.7100000), wk = 0.0041494 k( 184) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0041494 k( 185) = ( 0.5000000 0.3100000 0.6900000), wk = 0.0041494 k( 186) = ( 0.5000000 0.3200000 0.6800000), wk = 0.0041494 k( 187) = ( 0.5000000 0.3300000 0.6700000), wk = 0.0041494 k( 188) = ( 0.5000000 0.3400000 0.6600000), wk = 0.0041494 k( 189) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0041494 k( 190) = ( 0.5000000 0.3600000 0.6400000), wk = 0.0041494 k( 191) = ( 0.5000000 0.3700000 0.6300000), wk = 0.0041494 k( 192) = ( 0.5000000 0.3800000 0.6200000), wk = 0.0041494 k( 193) = ( 0.5000000 0.3900000 0.6100000), wk = 0.0041494 k( 194) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0041494 k( 195) = ( 0.5000000 0.4100000 0.5900000), wk = 0.0041494 k( 196) = ( 0.5000000 0.4200000 0.5800000), wk = 0.0041494 k( 197) = ( 0.5000000 0.4300000 0.5700000), wk = 0.0041494 k( 198) = ( 0.5000000 0.4400000 0.5600000), wk = 0.0041494 k( 199) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0041494 k( 200) = ( 0.5000000 0.4600000 0.5400000), wk = 0.0041494 k( 201) = ( 0.5000000 0.4700000 0.5300000), wk = 0.0041494 k( 202) = ( 0.5000000 0.4800000 0.5200000), wk = 0.0041494 k( 203) = ( 0.5000000 0.4900000 0.5100000), wk = 0.0041494 k( 204) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041494 k( 205) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041494 k( 206) = ( 0.4943182 0.4943182 0.5113636), wk = 0.0041494 k( 207) = ( 0.4886364 0.4886364 0.5227273), wk = 0.0041494 k( 208) = ( 0.4829545 0.4829546 0.5340909), wk = 0.0041494 k( 209) = ( 0.4772727 0.4772727 0.5454545), wk = 0.0041494 k( 210) = ( 0.4715909 0.4715909 0.5568182), wk = 0.0041494 k( 211) = ( 0.4659091 0.4659091 0.5681818), wk = 0.0041494 k( 212) = ( 0.4602273 0.4602273 0.5795455), wk = 0.0041494 k( 213) = ( 0.4545455 0.4545455 0.5909091), wk = 0.0041494 k( 214) = ( 0.4488636 0.4488636 0.6022727), wk = 0.0041494 k( 215) = ( 0.4431818 0.4431818 0.6136364), wk = 0.0041494 k( 216) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0041494 k( 217) = ( 0.4318182 0.4318182 0.6363636), wk = 0.0041494 k( 218) = ( 0.4261364 0.4261364 0.6477273), wk = 0.0041494 k( 219) = ( 0.4204545 0.4204545 0.6590909), wk = 0.0041494 k( 220) = ( 0.4147727 0.4147727 0.6704545), wk = 0.0041494 k( 221) = ( 0.4090909 0.4090909 0.6818182), wk = 0.0041494 k( 222) = ( 0.4034091 0.4034091 0.6931818), wk = 0.0041494 k( 223) = ( 0.3977273 0.3977273 0.7045455), wk = 0.0041494 k( 224) = ( 0.3920455 0.3920455 0.7159091), wk = 0.0041494 k( 225) = ( 0.3863636 0.3863636 0.7272727), wk = 0.0041494 k( 226) = ( 0.3806818 0.3806818 0.7386364), wk = 0.0041494 k( 227) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0041494 k( 228) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0041494 k( 229) = ( 0.6153846 0.2307692 0.6153846), wk = 0.0041494 k( 230) = ( 0.6057692 0.2115385 0.6057692), wk = 0.0041494 k( 231) = ( 0.5961538 0.1923077 0.5961538), wk = 0.0041494 k( 232) = ( 0.5865385 0.1730769 0.5865385), wk = 0.0041494 k( 233) = ( 0.5769231 0.1538462 0.5769231), wk = 0.0041494 k( 234) = ( 0.5673077 0.1346154 0.5673077), wk = 0.0041494 k( 235) = ( 0.5576923 0.1153846 0.5576923), wk = 0.0041494 k( 236) = ( 0.5480769 0.0961539 0.5480769), wk = 0.0041494 k( 237) = ( 0.5384615 0.0769231 0.5384615), wk = 0.0041494 k( 238) = ( 0.5288462 0.0576923 0.5288462), wk = 0.0041494 k( 239) = ( 0.5192308 0.0384615 0.5192308), wk = 0.0041494 k( 240) = ( 0.5096154 0.0192308 0.5096154), wk = 0.0041494 k( 241) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041494 Dense grid: 115603 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 56905 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.45 Mb ( 406, 72) NL pseudopotentials 0.50 Mb ( 203, 160) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 3213) G-vector shells 0.01 Mb ( 707) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.78 Mb ( 406, 288) Each subspace H/S matrix 0.08 Mb ( 72, 72) Each matrix 0.35 Mb ( 160, 2, 72) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./AlxNF2x3.save/charge-density.dat Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.7 secs Computing kpt #: 2 total cpu time spent up to now is 4.3 secs Computing kpt #: 3 total cpu time spent up to now is 5.0 secs Computing kpt #: 4 total cpu time spent up to now is 5.6 secs Computing kpt #: 5 total cpu time spent up to now is 6.2 secs Computing kpt #: 6 total cpu time spent up to now is 6.8 secs Computing kpt #: 7 total cpu time spent up to now is 7.5 secs Computing kpt #: 8 total cpu time spent up to now is 8.1 secs Computing kpt #: 9 total cpu time spent up to now is 8.7 secs Computing kpt #: 10 total cpu time spent up to now is 9.4 secs Computing kpt #: 11 total cpu time spent up to now is 10.0 secs Computing kpt #: 12 total cpu time spent up to now is 10.6 secs Computing kpt #: 13 total cpu time spent up to now is 11.3 secs Computing kpt #: 14 total cpu time spent up to now is 11.9 secs Computing kpt #: 15 total cpu time spent up to now is 12.5 secs Computing kpt #: 16 total cpu time spent up to now is 13.2 secs Computing kpt #: 17 total cpu time spent up to now is 13.8 secs Computing kpt #: 18 total cpu time spent up to now is 14.4 secs Computing kpt #: 19 total cpu time spent up to now is 15.1 secs Computing kpt #: 20 total cpu time spent up to now is 15.7 secs Computing kpt #: 21 total cpu time spent up to now is 16.4 secs Computing kpt #: 22 total cpu time spent up to now is 17.0 secs Computing kpt #: 23 total cpu time spent up to now is 17.7 secs Computing kpt #: 24 total cpu time spent up to now is 18.3 secs Computing kpt #: 25 total cpu time spent up to now is 18.9 secs Computing kpt #: 26 total cpu time spent up to now is 19.6 secs Computing kpt #: 27 total cpu time spent up to now is 20.2 secs Computing kpt #: 28 total cpu time spent up to now is 20.9 secs Computing kpt #: 29 total cpu time spent up to now is 21.5 secs Computing kpt #: 30 total cpu time spent up to now is 22.4 secs Computing kpt #: 31 total cpu time spent up to now is 23.3 secs Computing kpt #: 32 total cpu time spent up to now is 24.0 secs Computing kpt #: 33 total cpu time spent up to now is 24.6 secs Computing kpt #: 34 total cpu time spent up to now is 25.3 secs Computing kpt #: 35 total cpu time spent up to now is 25.9 secs Computing kpt #: 36 total cpu time spent up to now is 26.5 secs Computing kpt #: 37 total cpu time spent up to now is 27.2 secs Computing kpt #: 38 total cpu time spent up to now is 27.8 secs Computing kpt #: 39 total cpu time spent up to now is 28.5 secs Computing kpt #: 40 total cpu time spent up to now is 29.1 secs Computing kpt #: 41 total cpu time spent up to now is 29.7 secs Computing kpt #: 42 total cpu time spent up to now is 30.4 secs Computing kpt #: 43 total cpu time spent up to now is 31.0 secs Computing kpt #: 44 total cpu time spent up to now is 31.6 secs Computing kpt #: 45 total cpu time spent up to now is 32.3 secs Computing kpt #: 46 total cpu time spent up to now is 32.9 secs Computing kpt #: 47 total cpu time spent up to now is 33.6 secs Computing kpt #: 48 total cpu time spent up to now is 34.2 secs Computing kpt #: 49 total cpu time spent up to now is 34.8 secs Computing kpt #: 50 total cpu time spent up to now is 36.2 secs Computing kpt #: 51 total cpu time spent up to now is 36.8 secs Computing kpt #: 52 total cpu time spent up to now is 37.5 secs Computing kpt #: 53 total cpu time spent up to now is 38.1 secs Computing kpt #: 54 total cpu time spent up to now is 38.8 secs Computing kpt #: 55 total cpu time spent up to now is 39.4 secs Computing kpt #: 56 total cpu time spent up to now is 40.0 secs Computing kpt #: 57 total cpu time spent up to now is 40.7 secs Computing kpt #: 58 total cpu time spent up to now is 41.3 secs Computing kpt #: 59 total cpu time spent up to now is 42.0 secs Computing kpt #: 60 total cpu time spent up to now is 42.6 secs Computing kpt #: 61 total cpu time spent up to now is 43.3 secs Computing kpt #: 62 total cpu time spent up to now is 43.9 secs Computing kpt #: 63 total cpu time spent up to now is 44.5 secs Computing kpt #: 64 total cpu time spent up to now is 45.2 secs Computing kpt #: 65 total cpu time spent up to now is 45.8 secs Computing kpt #: 66 total cpu time spent up to now is 46.5 secs Computing kpt #: 67 total cpu time spent up to now is 47.1 secs Computing kpt #: 68 total cpu time spent up to now is 47.7 secs Computing kpt #: 69 total cpu time spent up to now is 48.4 secs Computing kpt #: 70 total cpu time spent up to now is 49.0 secs Computing kpt #: 71 total cpu time spent up to now is 49.7 secs Computing kpt #: 72 total cpu time spent up to now is 50.3 secs Computing kpt #: 73 total cpu time spent up to now is 50.9 secs Computing kpt #: 74 total cpu time spent up to now is 51.6 secs Computing kpt #: 75 total cpu time spent up to now is 52.2 secs Computing kpt #: 76 total cpu time spent up to now is 52.9 secs Computing kpt #: 77 total cpu time spent up to now is 53.5 secs Computing kpt #: 78 total cpu time spent up to now is 54.1 secs Computing kpt #: 79 total cpu time spent up to now is 54.8 secs Computing kpt #: 80 total cpu time spent up to now is 55.4 secs Computing kpt #: 81 total cpu time spent up to now is 56.1 secs Computing kpt #: 82 total cpu time spent up to now is 56.7 secs Computing kpt #: 83 total cpu time spent up to now is 57.3 secs Computing kpt #: 84 total cpu time spent up to now is 58.0 secs Computing kpt #: 85 total cpu time spent up to now is 58.6 secs Computing kpt #: 86 total cpu time spent up to now is 59.3 secs Computing kpt #: 87 total cpu time spent up to now is 59.9 secs Computing kpt #: 88 total cpu time spent up to now is 60.5 secs Computing kpt #: 89 total cpu time spent up to now is 61.2 secs Computing kpt #: 90 total cpu time spent up to now is 61.8 secs Computing kpt #: 91 total cpu time spent up to now is 62.5 secs Computing kpt #: 92 total cpu time spent up to now is 63.1 secs Computing kpt #: 93 total cpu time spent up to now is 63.7 secs Computing kpt #: 94 total cpu time spent up to now is 64.4 secs Computing kpt #: 95 total cpu time spent up to now is 65.0 secs Computing kpt #: 96 total cpu time spent up to now is 66.5 secs Computing kpt #: 97 total cpu time spent up to now is 67.2 secs Computing kpt #: 98 total cpu time spent up to now is 67.8 secs Computing kpt #: 99 total cpu time spent up to now is 68.4 secs Computing kpt #: 100 total cpu time spent up to now is 69.1 secs Computing kpt #: 101 total cpu time spent up to now is 69.7 secs Computing kpt #: 102 total cpu time spent up to now is 70.3 secs Computing kpt #: 103 total cpu time spent up to now is 71.0 secs Computing kpt #: 104 total cpu time spent up to now is 71.6 secs Computing kpt #: 105 total cpu time spent up to now is 72.2 secs Computing kpt #: 106 total cpu time spent up to now is 72.8 secs Computing kpt #: 107 total cpu time spent up to now is 73.5 secs Computing kpt #: 108 total cpu time spent up to now is 74.1 secs Computing kpt #: 109 total cpu time spent up to now is 74.7 secs Computing kpt #: 110 total cpu time spent up to now is 75.3 secs Computing kpt #: 111 total cpu time spent up to now is 76.0 secs Computing kpt #: 112 total cpu time spent up to now is 76.6 secs Computing kpt #: 113 total cpu time spent up to now is 77.2 secs Computing kpt #: 114 total cpu time spent up to now is 77.8 secs Computing kpt #: 115 total cpu time spent up to now is 78.5 secs Computing kpt #: 116 total cpu time spent up to now is 79.1 secs Computing kpt #: 117 total cpu time spent up to now is 79.7 secs Computing kpt #: 118 total cpu time spent up to now is 80.4 secs Computing kpt #: 119 total cpu time spent up to now is 81.0 secs Computing kpt #: 120 total cpu time spent up to now is 81.6 secs Computing kpt #: 121 total cpu time spent up to now is 82.3 secs Computing kpt #: 122 total cpu time spent up to now is 82.9 secs Computing kpt #: 123 total cpu time spent up to now is 83.5 secs Computing kpt #: 124 total cpu time spent up to now is 84.2 secs Computing kpt #: 125 total cpu time spent up to now is 84.8 secs Computing kpt #: 126 total cpu time spent up to now is 85.5 secs Computing kpt #: 127 total cpu time spent up to now is 86.1 secs Computing kpt #: 128 total cpu time spent up to now is 86.7 secs Computing kpt #: 129 total cpu time spent up to now is 87.4 secs Computing kpt #: 130 total cpu time spent up to now is 88.0 secs Computing kpt #: 131 total cpu time spent up to now is 88.7 secs Computing kpt #: 132 total cpu time spent up to now is 89.3 secs Computing kpt #: 133 total cpu time spent up to now is 89.9 secs Computing kpt #: 134 total cpu time spent up to now is 90.6 secs Computing kpt #: 135 total cpu time spent up to now is 91.2 secs Computing kpt #: 136 total cpu time spent up to now is 91.9 secs Computing kpt #: 137 total cpu time spent up to now is 92.5 secs Computing kpt #: 138 total cpu time spent up to now is 93.2 secs Computing kpt #: 139 total cpu time spent up to now is 93.8 secs Computing kpt #: 140 total cpu time spent up to now is 94.4 secs Computing kpt #: 141 total cpu time spent up to now is 95.1 secs Computing kpt #: 142 total cpu time spent up to now is 95.7 secs Computing kpt #: 143 total cpu time spent up to now is 96.4 secs Computing kpt #: 144 total cpu time spent up to now is 97.0 secs Computing kpt #: 145 total cpu time spent up to now is 97.7 secs Computing kpt #: 146 total cpu time spent up to now is 98.3 secs Computing kpt #: 147 total cpu time spent up to now is 98.9 secs Computing kpt #: 148 total cpu time spent up to now is 99.6 secs Computing kpt #: 149 total cpu time spent up to now is 100.2 secs Computing kpt #: 150 total cpu time spent up to now is 100.9 secs Computing kpt #: 151 total cpu time spent up to now is 101.5 secs Computing kpt #: 152 total cpu time spent up to now is 102.1 secs Computing kpt #: 153 total cpu time spent up to now is 102.8 secs Computing kpt #: 154 total cpu time spent up to now is 103.4 secs Computing kpt #: 155 total cpu time spent up to now is 104.0 secs Computing kpt #: 156 total cpu time spent up to now is 104.7 secs Computing kpt #: 157 total cpu time spent up to now is 105.3 secs Computing kpt #: 158 total cpu time spent up to now is 106.0 secs Computing kpt #: 159 total cpu time spent up to now is 106.6 secs Computing kpt #: 160 total cpu time spent up to now is 107.3 secs Computing kpt #: 161 total cpu time spent up to now is 107.9 secs Computing kpt #: 162 total cpu time spent up to now is 108.5 secs Computing kpt #: 163 total cpu time spent up to now is 109.2 secs Computing kpt #: 164 total cpu time spent up to now is 109.8 secs Computing kpt #: 165 total cpu time spent up to now is 110.5 secs Computing kpt #: 166 total cpu time spent up to now is 111.1 secs Computing kpt #: 167 total cpu time spent up to now is 111.8 secs Computing kpt #: 168 total cpu time spent up to now is 112.4 secs Computing kpt #: 169 total cpu time spent up to now is 113.0 secs Computing kpt #: 170 total cpu time spent up to now is 113.7 secs Computing kpt #: 171 total cpu time spent up to now is 114.3 secs Computing kpt #: 172 total cpu time spent up to now is 115.0 secs Computing kpt #: 173 total cpu time spent up to now is 115.6 secs Computing kpt #: 174 total cpu time spent up to now is 116.3 secs Computing kpt #: 175 total cpu time spent up to now is 116.9 secs Computing kpt #: 176 total cpu time spent up to now is 117.5 secs Computing kpt #: 177 total cpu time spent up to now is 118.2 secs Computing kpt #: 178 total cpu time spent up to now is 118.8 secs Computing kpt #: 179 total cpu time spent up to now is 119.5 secs Computing kpt #: 180 total cpu time spent up to now is 120.1 secs Computing kpt #: 181 total cpu time spent up to now is 120.8 secs Computing kpt #: 182 total cpu time spent up to now is 121.4 secs Computing kpt #: 183 total cpu time spent up to now is 122.0 secs Computing kpt #: 184 total cpu time spent up to now is 122.7 secs Computing kpt #: 185 total cpu time spent up to now is 123.3 secs Computing kpt #: 186 total cpu time spent up to now is 124.0 secs Computing kpt #: 187 total cpu time spent up to now is 124.6 secs Computing kpt #: 188 total cpu time spent up to now is 125.2 secs Computing kpt #: 189 total cpu time spent up to now is 125.9 secs Computing kpt #: 190 total cpu time spent up to now is 126.5 secs Computing kpt #: 191 total cpu time spent up to now is 127.1 secs Computing kpt #: 192 total cpu time spent up to now is 127.8 secs Computing kpt #: 193 total cpu time spent up to now is 128.4 secs Computing kpt #: 194 total cpu time spent up to now is 129.1 secs Computing kpt #: 195 total cpu time spent up to now is 129.7 secs Computing kpt #: 196 total cpu time spent up to now is 130.3 secs Computing kpt #: 197 total cpu time spent up to now is 131.0 secs Computing kpt #: 198 total cpu time spent up to now is 131.6 secs Computing kpt #: 199 total cpu time spent up to now is 132.3 secs Computing kpt #: 200 total cpu time spent up to now is 132.9 secs Computing kpt #: 201 total cpu time spent up to now is 133.5 secs Computing kpt #: 202 total cpu time spent up to now is 134.2 secs Computing kpt #: 203 total cpu time spent up to now is 134.8 secs Computing kpt #: 204 total cpu time spent up to now is 135.5 secs Computing kpt #: 205 total cpu time spent up to now is 136.1 secs Computing kpt #: 206 total cpu time spent up to now is 136.8 secs Computing kpt #: 207 total cpu time spent up to now is 137.4 secs Computing kpt #: 208 total cpu time spent up to now is 138.0 secs Computing kpt #: 209 total cpu time spent up to now is 138.7 secs Computing kpt #: 210 total cpu time spent up to now is 139.3 secs Computing kpt #: 211 total cpu time spent up to now is 140.0 secs Computing kpt #: 212 total cpu time spent up to now is 140.6 secs Computing kpt #: 213 total cpu time spent up to now is 141.2 secs Computing kpt #: 214 total cpu time spent up to now is 141.9 secs Computing kpt #: 215 total cpu time spent up to now is 142.5 secs Computing kpt #: 216 total cpu time spent up to now is 143.1 secs Computing kpt #: 217 total cpu time spent up to now is 143.8 secs Computing kpt #: 218 total cpu time spent up to now is 144.4 secs Computing kpt #: 219 total cpu time spent up to now is 145.1 secs Computing kpt #: 220 total cpu time spent up to now is 145.7 secs Computing kpt #: 221 total cpu time spent up to now is 146.3 secs Computing kpt #: 222 total cpu time spent up to now is 147.0 secs Computing kpt #: 223 total cpu time spent up to now is 147.6 secs Computing kpt #: 224 total cpu time spent up to now is 148.3 secs Computing kpt #: 225 total cpu time spent up to now is 148.9 secs Computing kpt #: 226 total cpu time spent up to now is 149.5 secs Computing kpt #: 227 total cpu time spent up to now is 150.2 secs Computing kpt #: 228 total cpu time spent up to now is 150.8 secs Computing kpt #: 229 total cpu time spent up to now is 151.5 secs Computing kpt #: 230 total cpu time spent up to now is 152.1 secs Computing kpt #: 231 total cpu time spent up to now is 152.8 secs Computing kpt #: 232 total cpu time spent up to now is 153.4 secs Computing kpt #: 233 total cpu time spent up to now is 154.0 secs Computing kpt #: 234 total cpu time spent up to now is 154.7 secs Computing kpt #: 235 total cpu time spent up to now is 155.3 secs Computing kpt #: 236 total cpu time spent up to now is 155.9 secs Computing kpt #: 237 total cpu time spent up to now is 156.6 secs Computing kpt #: 238 total cpu time spent up to now is 157.2 secs Computing kpt #: 239 total cpu time spent up to now is 157.9 secs Computing kpt #: 240 total cpu time spent up to now is 158.5 secs Computing kpt #: 241 total cpu time spent up to now is 159.1 secs ethr = 1.67E-08, avg # of iterations = 7.0 total cpu time spent up to now is 159.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7119 PWs) bands (ev): -23.9744 -23.9744 -23.1694 -23.1694 -23.1678 -23.1678 -23.1678 -23.1678 -22.8556 -22.8556 -22.8556 -22.8556 -14.8217 -14.8217 -14.5802 -14.5802 -14.5733 -14.5733 -7.0967 -7.0967 -6.0027 -6.0027 -6.0027 -6.0027 -5.9865 -5.9865 -5.3163 -5.3163 -5.3163 -5.3163 -5.2933 -5.2933 -4.5017 -4.5017 -4.5017 -4.5017 -3.9637 -3.9637 -3.9088 -3.9088 -3.9088 -3.9088 -3.7934 -3.7934 -3.7934 -3.7934 -3.7627 -3.7627 -3.1553 -3.1553 -3.1220 -3.1220 -3.1220 -3.1220 -2.9638 -2.9638 -2.9454 -2.9454 -2.9454 -2.9454 -2.7902 -2.7902 -2.7736 -2.7736 -2.7736 -2.7736 -2.6512 -2.6512 -2.6210 -2.6210 -2.6210 -2.6210 k = 0.0139-0.0080 0.0113 ( 7119 PWs) bands (ev): -23.9743 -23.9743 -23.1694 -23.1694 -23.1678 -23.1678 -23.1678 -23.1678 -22.8556 -22.8556 -22.8556 -22.8556 -14.8216 -14.8216 -14.5802 -14.5802 -14.5733 -14.5733 -7.0969 -7.0969 -6.0025 -6.0025 -6.0020 -6.0020 -5.9860 -5.9860 -5.3159 -5.3159 -5.3159 -5.3159 -5.2930 -5.2930 -4.5033 -4.5033 -4.5017 -4.5017 -3.9637 -3.9637 -3.9091 -3.9091 -3.9084 -3.9084 -3.7936 -3.7936 -3.7935 -3.7935 -3.7628 -3.7628 -3.1559 -3.1559 -3.1229 -3.1229 -3.1223 -3.1223 -2.9631 -2.9631 -2.9448 -2.9448 -2.9446 -2.9446 -2.7902 -2.7902 -2.7737 -2.7737 -2.7735 -2.7735 -2.6516 -2.6516 -2.6217 -2.6217 -2.6212 -2.6212 k = 0.0278-0.0160 0.0227 ( 7139 PWs) bands (ev): -23.9742 -23.9742 -23.1694 -23.1694 -23.1678 -23.1678 -23.1678 -23.1678 -22.8557 -22.8557 -22.8556 -22.8556 -14.8214 -14.8214 -14.5803 -14.5803 -14.5734 -14.5734 -7.0977 -7.0977 -6.0020 -6.0020 -5.9999 -5.9999 -5.9845 -5.9845 -5.3149 -5.3149 -5.3149 -5.3149 -5.2919 -5.2919 -4.5082 -4.5082 -4.5017 -4.5017 -3.9637 -3.9637 -3.9101 -3.9101 -3.9074 -3.9074 -3.7941 -3.7941 -3.7939 -3.7939 -3.7633 -3.7633 -3.1575 -3.1575 -3.1255 -3.1255 -3.1232 -3.1232 -2.9609 -2.9609 -2.9430 -2.9430 -2.9424 -2.9424 -2.7902 -2.7902 -2.7739 -2.7739 -2.7731 -2.7731 -2.6529 -2.6529 -2.6238 -2.6238 -2.6216 -2.6216 k = 0.0417-0.0241 0.0340 ( 7139 PWs) bands (ev): -23.9741 -23.9741 -23.1695 -23.1695 -23.1678 -23.1678 -23.1678 -23.1678 -22.8558 -22.8558 -22.8556 -22.8556 -14.8212 -14.8212 -14.5805 -14.5805 -14.5736 -14.5736 -7.0990 -7.0990 -6.0012 -6.0012 -5.9970 -5.9970 -5.9815 -5.9815 -5.3133 -5.3133 -5.3131 -5.3131 -5.2902 -5.2902 -4.5161 -4.5161 -4.5017 -4.5017 -3.9639 -3.9639 -3.9117 -3.9117 -3.9056 -3.9056 -3.7950 -3.7950 -3.7945 -3.7945 -3.7640 -3.7640 -3.1603 -3.1603 -3.1297 -3.1297 -3.1243 -3.1243 -2.9575 -2.9575 -2.9401 -2.9401 -2.9388 -2.9388 -2.7903 -2.7903 -2.7744 -2.7744 -2.7726 -2.7726 -2.6553 -2.6553 -2.6269 -2.6269 -2.6224 -2.6224 k = 0.0556-0.0321 0.0454 ( 7131 PWs) bands (ev): -23.9739 -23.9739 -23.1695 -23.1695 -23.1679 -23.1679 -23.1678 -23.1678 -22.8560 -22.8560 -22.8556 -22.8556 -14.8208 -14.8208 -14.5807 -14.5807 -14.5738 -14.5738 -7.1007 -7.1007 -6.0000 -6.0000 -5.9938 -5.9938 -5.9765 -5.9765 -5.3109 -5.3109 -5.3106 -5.3106 -5.2877 -5.2877 -4.5268 -4.5268 -4.5016 -4.5016 -3.9646 -3.9646 -3.9141 -3.9141 -3.9030 -3.9030 -3.7962 -3.7962 -3.7952 -3.7952 -3.7650 -3.7650 -3.1642 -3.1642 -3.1352 -3.1352 -3.1256 -3.1256 -2.9530 -2.9530 -2.9362 -2.9362 -2.9342 -2.9342 -2.7905 -2.7905 -2.7748 -2.7748 -2.7720 -2.7720 -2.6591 -2.6591 -2.6308 -2.6308 -2.6235 -2.6235 k = 0.0694-0.0401 0.0567 ( 7127 PWs) bands (ev): -23.9736 -23.9736 -23.1696 -23.1696 -23.1680 -23.1680 -23.1678 -23.1678 -22.8562 -22.8562 -22.8556 -22.8556 -14.8203 -14.8203 -14.5810 -14.5810 -14.5741 -14.5741 -7.1028 -7.1028 -5.9985 -5.9985 -5.9908 -5.9908 -5.9691 -5.9691 -5.3079 -5.3079 -5.3074 -5.3074 -5.2845 -5.2845 -4.5399 -4.5399 -4.5016 -4.5016 -3.9660 -3.9660 -3.9173 -3.9173 -3.8998 -3.8998 -3.7975 -3.7975 -3.7962 -3.7962 -3.7661 -3.7661 -3.1692 -3.1692 -3.1418 -3.1418 -3.1268 -3.1268 -2.9474 -2.9474 -2.9312 -2.9312 -2.9286 -2.9286 -2.7910 -2.7910 -2.7752 -2.7752 -2.7711 -2.7711 -2.6647 -2.6647 -2.6350 -2.6350 -2.6248 -2.6248 k = 0.0833-0.0481 0.0680 ( 7119 PWs) bands (ev): -23.9733 -23.9733 -23.1696 -23.1696 -23.1680 -23.1680 -23.1679 -23.1679 -22.8564 -22.8564 -22.8555 -22.8555 -14.8197 -14.8197 -14.5814 -14.5814 -14.5745 -14.5745 -7.1052 -7.1052 -5.9967 -5.9967 -5.9880 -5.9880 -5.9596 -5.9596 -5.3043 -5.3043 -5.3035 -5.3035 -5.2807 -5.2807 -4.5553 -4.5553 -4.5016 -4.5016 -3.9683 -3.9683 -3.9213 -3.9213 -3.8960 -3.8960 -3.7990 -3.7990 -3.7972 -3.7972 -3.7674 -3.7674 -3.1752 -3.1752 -3.1492 -3.1492 -3.1279 -3.1279 -2.9410 -2.9410 -2.9254 -2.9254 -2.9224 -2.9224 -2.7921 -2.7921 -2.7753 -2.7753 -2.7702 -2.7702 -2.6724 -2.6724 -2.6390 -2.6390 -2.6265 -2.6265 k = 0.0972-0.0561 0.0794 ( 7127 PWs) bands (ev): -23.9729 -23.9729 -23.1697 -23.1697 -23.1681 -23.1681 -23.1679 -23.1679 -22.8568 -22.8568 -22.8555 -22.8555 -14.8190 -14.8190 -14.5818 -14.5818 -14.5749 -14.5749 -7.1078 -7.1078 -5.9946 -5.9946 -5.9853 -5.9853 -5.9483 -5.9483 -5.3000 -5.3000 -5.2989 -5.2989 -5.2762 -5.2762 -4.5723 -4.5723 -4.5015 -4.5015 -3.9716 -3.9716 -3.9263 -3.9263 -3.8919 -3.8919 -3.8005 -3.8005 -3.7984 -3.7984 -3.7688 -3.7688 -3.1820 -3.1820 -3.1572 -3.1572 -3.1288 -3.1288 -2.9340 -2.9340 -2.9188 -2.9188 -2.9156 -2.9156 -2.7936 -2.7936 -2.7751 -2.7751 -2.7691 -2.7691 -2.6823 -2.6823 -2.6427 -2.6427 -2.6284 -2.6284 k = 0.1111-0.0642 0.0907 ( 7115 PWs) bands (ev): -23.9725 -23.9725 -23.1698 -23.1698 -23.1682 -23.1682 -23.1679 -23.1679 -22.8571 -22.8571 -22.8555 -22.8555 -14.8183 -14.8183 -14.5823 -14.5823 -14.5753 -14.5753 -7.1105 -7.1105 -5.9922 -5.9922 -5.9825 -5.9825 -5.9356 -5.9356 -5.2952 -5.2952 -5.2937 -5.2937 -5.2711 -5.2711 -4.5907 -4.5907 -4.5015 -4.5015 -3.9761 -3.9761 -3.9323 -3.9323 -3.8876 -3.8876 -3.8020 -3.8020 -3.7996 -3.7996 -3.7702 -3.7702 -3.1894 -3.1894 -3.1656 -3.1656 -3.1295 -3.1295 -2.9266 -2.9266 -2.9114 -2.9114 -2.9085 -2.9085 -2.7958 -2.7958 -2.7746 -2.7746 -2.7680 -2.7680 -2.6941 -2.6941 -2.6462 -2.6462 -2.6306 -2.6306 k = 0.1250-0.0722 0.1021 ( 7115 PWs) bands (ev): -23.9720 -23.9720 -23.1699 -23.1699 -23.1683 -23.1683 -23.1680 -23.1680 -22.8575 -22.8575 -22.8554 -22.8554 -14.8174 -14.8174 -14.5828 -14.5828 -14.5758 -14.5758 -7.1132 -7.1132 -5.9895 -5.9895 -5.9795 -5.9795 -5.9218 -5.9218 -5.2899 -5.2899 -5.2879 -5.2879 -5.2654 -5.2654 -4.6099 -4.6099 -4.5014 -4.5014 -3.9818 -3.9818 -3.9393 -3.9393 -3.8834 -3.8834 -3.8034 -3.8034 -3.8008 -3.8008 -3.7716 -3.7716 -3.1972 -3.1972 -3.1743 -3.1743 -3.1301 -3.1301 -2.9188 -2.9188 -2.9033 -2.9033 -2.9012 -2.9012 -2.7985 -2.7985 -2.7738 -2.7738 -2.7669 -2.7669 -2.7077 -2.7077 -2.6495 -2.6495 -2.6330 -2.6330 k = 0.1389-0.0802 0.1134 ( 7099 PWs) bands (ev): -23.9715 -23.9715 -23.1700 -23.1700 -23.1685 -23.1685 -23.1680 -23.1680 -22.8579 -22.8579 -22.8554 -22.8554 -14.8165 -14.8165 -14.5834 -14.5834 -14.5764 -14.5764 -7.1159 -7.1159 -5.9865 -5.9865 -5.9763 -5.9763 -5.9072 -5.9072 -5.2840 -5.2840 -5.2814 -5.2814 -5.2590 -5.2590 -4.6297 -4.6297 -4.5014 -4.5014 -3.9886 -3.9886 -3.9474 -3.9474 -3.8796 -3.8796 -3.8046 -3.8046 -3.8020 -3.8020 -3.7729 -3.7729 -3.2052 -3.2052 -3.1830 -3.1830 -3.1306 -3.1306 -2.9110 -2.9110 -2.8944 -2.8944 -2.8938 -2.8938 -2.8017 -2.8017 -2.7729 -2.7729 -2.7658 -2.7658 -2.7226 -2.7226 -2.6527 -2.6527 -2.6356 -2.6356 k = 0.1528-0.0882 0.1247 ( 7099 PWs) bands (ev): -23.9710 -23.9710 -23.1702 -23.1702 -23.1686 -23.1686 -23.1681 -23.1681 -22.8584 -22.8584 -22.8554 -22.8554 -14.8155 -14.8155 -14.5840 -14.5840 -14.5770 -14.5770 -7.1184 -7.1184 -5.9834 -5.9834 -5.9729 -5.9729 -5.8921 -5.8921 -5.2776 -5.2776 -5.2744 -5.2744 -5.2521 -5.2521 -4.6496 -4.6496 -4.5013 -4.5013 -3.9966 -3.9966 -3.9567 -3.9567 -3.8764 -3.8764 -3.8055 -3.8055 -3.8032 -3.8032 -3.7741 -3.7741 -3.2133 -3.2133 -3.1918 -3.1918 -3.1310 -3.1310 -2.9031 -2.9031 -2.8863 -2.8863 -2.8850 -2.8850 -2.8054 -2.8054 -2.7719 -2.7719 -2.7648 -2.7648 -2.7386 -2.7386 -2.6560 -2.6560 -2.6384 -2.6384 k = 0.1667-0.0962 0.1361 ( 7099 PWs) bands (ev): -23.9704 -23.9704 -23.1703 -23.1703 -23.1687 -23.1687 -23.1681 -23.1681 -22.8589 -22.8589 -22.8553 -22.8553 -14.8144 -14.8144 -14.5846 -14.5846 -14.5777 -14.5777 -7.1207 -7.1207 -5.9800 -5.9800 -5.9693 -5.9693 -5.8768 -5.8768 -5.2709 -5.2709 -5.2668 -5.2668 -5.2446 -5.2446 -4.6691 -4.6691 -4.5012 -4.5012 -4.0059 -4.0059 -3.9670 -3.9670 -3.8741 -3.8741 -3.8062 -3.8062 -3.8044 -3.8044 -3.7752 -3.7752 -3.2214 -3.2214 -3.2004 -3.2004 -3.1314 -3.1314 -2.8954 -2.8954 -2.8788 -2.8788 -2.8749 -2.8749 -2.8093 -2.8093 -2.7708 -2.7708 -2.7642 -2.7642 -2.7552 -2.7552 -2.6592 -2.6592 -2.6415 -2.6415 k = 0.1806-0.1042 0.1474 ( 7091 PWs) bands (ev): -23.9698 -23.9698 -23.1704 -23.1704 -23.1688 -23.1688 -23.1682 -23.1682 -22.8594 -22.8594 -22.8553 -22.8553 -14.8133 -14.8133 -14.5853 -14.5853 -14.5783 -14.5783 -7.1226 -7.1226 -5.9764 -5.9764 -5.9656 -5.9656 -5.8616 -5.8616 -5.2637 -5.2637 -5.2586 -5.2586 -5.2367 -5.2367 -4.6879 -4.6879 -4.5012 -4.5012 -4.0162 -4.0162 -3.9784 -3.9784 -3.8728 -3.8728 -3.8066 -3.8066 -3.8055 -3.8055 -3.7760 -3.7760 -3.2293 -3.2293 -3.2088 -3.2088 -3.1317 -3.1317 -2.8879 -2.8879 -2.8714 -2.8714 -2.8645 -2.8645 -2.8137 -2.8137 -2.7738 -2.7738 -2.7698 -2.7698 -2.7623 -2.7623 -2.6626 -2.6626 -2.6446 -2.6446 k = 0.1944-0.1123 0.1588 ( 7091 PWs) bands (ev): -23.9692 -23.9692 -23.1706 -23.1706 -23.1689 -23.1689 -23.1683 -23.1683 -22.8600 -22.8600 -22.8553 -22.8553 -14.8121 -14.8121 -14.5861 -14.5861 -14.5790 -14.5790 -7.1242 -7.1242 -5.9726 -5.9726 -5.9617 -5.9617 -5.8468 -5.8468 -5.2562 -5.2562 -5.2500 -5.2500 -5.2282 -5.2282 -4.7056 -4.7056 -4.5011 -4.5011 -4.0276 -4.0276 -3.9908 -3.9908 -3.8727 -3.8727 -3.8066 -3.8066 -3.8066 -3.8066 -3.7766 -3.7766 -3.2371 -3.2371 -3.2169 -3.2169 -3.1319 -3.1319 -2.8805 -2.8805 -2.8642 -2.8642 -2.8540 -2.8540 -2.8182 -2.8182 -2.7914 -2.7914 -2.7689 -2.7689 -2.7618 -2.7618 -2.6659 -2.6659 -2.6479 -2.6479 k = 0.2083-0.1203 0.1701 ( 7087 PWs) bands (ev): -23.9685 -23.9685 -23.1708 -23.1708 -23.1690 -23.1690 -23.1683 -23.1683 -22.8606 -22.8606 -22.8552 -22.8552 -14.8109 -14.8109 -14.5868 -14.5868 -14.5797 -14.5797 -7.1254 -7.1254 -5.9687 -5.9687 -5.9577 -5.9577 -5.8329 -5.8329 -5.2484 -5.2484 -5.2410 -5.2410 -5.2193 -5.2193 -4.7217 -4.7217 -4.5010 -4.5010 -4.0400 -4.0400 -4.0042 -4.0042 -3.8739 -3.8739 -3.8078 -3.8078 -3.8065 -3.8065 -3.7770 -3.7770 -3.2445 -3.2445 -3.2246 -3.2246 -3.1322 -3.1322 -2.8733 -2.8733 -2.8570 -2.8570 -2.8439 -2.8439 -2.8230 -2.8230 -2.8088 -2.8088 -2.7680 -2.7680 -2.7612 -2.7612 -2.6694 -2.6694 -2.6513 -2.6513 k = 0.2222-0.1283 0.1814 ( 7095 PWs) bands (ev): -23.9678 -23.9678 -23.1709 -23.1709 -23.1691 -23.1691 -23.1684 -23.1684 -22.8612 -22.8612 -22.8552 -22.8552 -14.8097 -14.8097 -14.5876 -14.5876 -14.5805 -14.5805 -7.1261 -7.1261 -5.9647 -5.9647 -5.9535 -5.9535 -5.8200 -5.8200 -5.2404 -5.2404 -5.2315 -5.2315 -5.2099 -5.2099 -4.7358 -4.7358 -4.5010 -4.5010 -4.0533 -4.0533 -4.0184 -4.0184 -3.8766 -3.8766 -3.8090 -3.8090 -3.8060 -3.8060 -3.7771 -3.7771 -3.2516 -3.2516 -3.2320 -3.2320 -3.1324 -3.1324 -2.8664 -2.8664 -2.8501 -2.8501 -2.8387 -2.8387 -2.8279 -2.8279 -2.8212 -2.8212 -2.7673 -2.7673 -2.7608 -2.7608 -2.6728 -2.6728 -2.6548 -2.6548 k = 0.2361-0.1363 0.1928 ( 7115 PWs) bands (ev): -23.9672 -23.9672 -23.1711 -23.1711 -23.1692 -23.1692 -23.1685 -23.1685 -22.8618 -22.8618 -22.8551 -22.8551 -14.8084 -14.8084 -14.5883 -14.5883 -14.5812 -14.5812 -7.1263 -7.1263 -5.9606 -5.9606 -5.9493 -5.9493 -5.8085 -5.8085 -5.2323 -5.2323 -5.2216 -5.2216 -5.2002 -5.2002 -4.7477 -4.7477 -4.5009 -4.5009 -4.0674 -4.0674 -4.0333 -4.0333 -3.8809 -3.8809 -3.8103 -3.8103 -3.8054 -3.8054 -3.7769 -3.7769 -3.2584 -3.2584 -3.2390 -3.2390 -3.1326 -3.1326 -2.8600 -2.8600 -2.8499 -2.8499 -2.8435 -2.8435 -2.8327 -2.8327 -2.8165 -2.8165 -2.7668 -2.7668 -2.7606 -2.7606 -2.6762 -2.6762 -2.6584 -2.6584 k = 0.2500-0.1443 0.2041 ( 7131 PWs) bands (ev): -23.9665 -23.9665 -23.1712 -23.1712 -23.1693 -23.1693 -23.1686 -23.1686 -22.8625 -22.8625 -22.8551 -22.8551 -14.8072 -14.8072 -14.5891 -14.5891 -14.5820 -14.5820 -7.1260 -7.1260 -5.9564 -5.9564 -5.9450 -5.9450 -5.7987 -5.7987 -5.2241 -5.2241 -5.2115 -5.2115 -5.1902 -5.1902 -4.7570 -4.7570 -4.5008 -4.5008 -4.0822 -4.0822 -4.0488 -4.0488 -3.8869 -3.8869 -3.8116 -3.8116 -3.8046 -3.8046 -3.7765 -3.7765 -3.2647 -3.2647 -3.2455 -3.2455 -3.1328 -3.1328 -2.8678 -2.8678 -2.8524 -2.8524 -2.8400 -2.8400 -2.8349 -2.8349 -2.8065 -2.8065 -2.7664 -2.7664 -2.7605 -2.7605 -2.6796 -2.6796 -2.6620 -2.6620 k = 0.2639-0.1524 0.2155 ( 7111 PWs) bands (ev): -23.9658 -23.9658 -23.1714 -23.1714 -23.1694 -23.1694 -23.1686 -23.1686 -22.8631 -22.8631 -22.8550 -22.8550 -14.8059 -14.8059 -14.5899 -14.5899 -14.5827 -14.5827 -7.1251 -7.1251 -5.9522 -5.9522 -5.9407 -5.9407 -5.7906 -5.7906 -5.2158 -5.2158 -5.2010 -5.2010 -5.1798 -5.1798 -4.7633 -4.7633 -4.5007 -4.5007 -4.0975 -4.0975 -4.0648 -4.0648 -3.8946 -3.8946 -3.8130 -3.8130 -3.8036 -3.8036 -3.7758 -3.7758 -3.2707 -3.2707 -3.2516 -3.2516 -3.1329 -3.1329 -2.8845 -2.8845 -2.8463 -2.8463 -2.8441 -2.8441 -2.8296 -2.8296 -2.7961 -2.7961 -2.7662 -2.7662 -2.7605 -2.7605 -2.6830 -2.6830 -2.6656 -2.6656 k = 0.2778-0.1604 0.2268 ( 7107 PWs) bands (ev): -23.9652 -23.9652 -23.1715 -23.1715 -23.1694 -23.1694 -23.1687 -23.1687 -22.8638 -22.8638 -22.8550 -22.8550 -14.8047 -14.8047 -14.5907 -14.5907 -14.5835 -14.5835 -7.1238 -7.1238 -5.9480 -5.9480 -5.9364 -5.9364 -5.7846 -5.7846 -5.2076 -5.2076 -5.1904 -5.1904 -5.1693 -5.1693 -4.7666 -4.7666 -4.5006 -4.5006 -4.1132 -4.1132 -4.0812 -4.0812 -3.9042 -3.9042 -3.8145 -3.8145 -3.8026 -3.8026 -3.7750 -3.7750 -3.2762 -3.2762 -3.2573 -3.2573 -3.1331 -3.1331 -2.9009 -2.9009 -2.8492 -2.8492 -2.8402 -2.8402 -2.8236 -2.8236 -2.7859 -2.7859 -2.7661 -2.7661 -2.7606 -2.7606 -2.6863 -2.6863 -2.6692 -2.6692 k = 0.2917-0.1684 0.2381 ( 7111 PWs) bands (ev): -23.9645 -23.9645 -23.1716 -23.1716 -23.1695 -23.1695 -23.1688 -23.1688 -22.8644 -22.8644 -22.8549 -22.8549 -14.8035 -14.8035 -14.5914 -14.5914 -14.5842 -14.5842 -7.1219 -7.1219 -5.9438 -5.9438 -5.9322 -5.9322 -5.7807 -5.7807 -5.1994 -5.1994 -5.1796 -5.1796 -5.1586 -5.1586 -4.7667 -4.7667 -4.5006 -4.5006 -4.1291 -4.1291 -4.0978 -4.0978 -3.9157 -3.9157 -3.8160 -3.8160 -3.8014 -3.8014 -3.7739 -3.7739 -3.2813 -3.2813 -3.2625 -3.2625 -3.1332 -3.1332 -2.9164 -2.9164 -2.8544 -2.8544 -2.8344 -2.8344 -2.8178 -2.8178 -2.7764 -2.7764 -2.7662 -2.7662 -2.7603 -2.7603 -2.6895 -2.6895 -2.6728 -2.6728 k = 0.3056-0.1764 0.2495 ( 7099 PWs) bands (ev): -23.9639 -23.9639 -23.1717 -23.1717 -23.1696 -23.1696 -23.1688 -23.1688 -22.8650 -22.8650 -22.8549 -22.8549 -14.8023 -14.8023 -14.5922 -14.5922 -14.5850 -14.5850 -7.1197 -7.1197 -5.9397 -5.9397 -5.9280 -5.9280 -5.7788 -5.7788 -5.1914 -5.1914 -5.1688 -5.1688 -5.1479 -5.1479 -4.7635 -4.7635 -4.5005 -4.5005 -4.1452 -4.1452 -4.1144 -4.1144 -3.9290 -3.9290 -3.8175 -3.8175 -3.8001 -3.8001 -3.7728 -3.7728 -3.2860 -3.2860 -3.2672 -3.2672 -3.1334 -3.1334 -2.9310 -2.9310 -2.8596 -2.8596 -2.8289 -2.8289 -2.8122 -2.8122 -2.7692 -2.7692 -2.7663 -2.7663 -2.7583 -2.7583 -2.6926 -2.6926 -2.6764 -2.6764 k = 0.3194-0.1844 0.2608 ( 7115 PWs) bands (ev): -23.9633 -23.9633 -23.1719 -23.1719 -23.1697 -23.1697 -23.1689 -23.1689 -22.8657 -22.8657 -22.8549 -22.8549 -14.8011 -14.8011 -14.5929 -14.5929 -14.5856 -14.5856 -7.1170 -7.1170 -5.9358 -5.9358 -5.9240 -5.9239 -5.7789 -5.7789 -5.1837 -5.1837 -5.1580 -5.1580 -5.1371 -5.1371 -4.7572 -4.7572 -4.5004 -4.5004 -4.1612 -4.1612 -4.1310 -4.1310 -3.9441 -3.9441 -3.8190 -3.8190 -3.7988 -3.7988 -3.7715 -3.7715 -3.2903 -3.2903 -3.2716 -3.2716 -3.1335 -3.1335 -2.9445 -2.9445 -2.8646 -2.8646 -2.8236 -2.8236 -2.8071 -2.8071 -2.7666 -2.7666 -2.7664 -2.7664 -2.7523 -2.7523 -2.6956 -2.6956 -2.6799 -2.6799 k = 0.3333-0.1925 0.2722 ( 7111 PWs) bands (ev): -23.9627 -23.9627 -23.1719 -23.1719 -23.1697 -23.1697 -23.1690 -23.1690 -22.8663 -22.8663 -22.8548 -22.8548 -14.8000 -14.8000 -14.5936 -14.5936 -14.5863 -14.5863 -7.1140 -7.1140 -5.9319 -5.9319 -5.9200 -5.9200 -5.7808 -5.7808 -5.1762 -5.1762 -5.1473 -5.1473 -5.1265 -5.1265 -4.7479 -4.7479 -4.5003 -4.5003 -4.1771 -4.1771 -4.1473 -4.1473 -3.9609 -3.9609 -3.8204 -3.8204 -3.7974 -3.7974 -3.7702 -3.7702 -3.2942 -3.2942 -3.2754 -3.2754 -3.1336 -3.1336 -2.9569 -2.9569 -2.8695 -2.8695 -2.8187 -2.8187 -2.8023 -2.8023 -2.7664 -2.7664 -2.7664 -2.7664 -2.7444 -2.7444 -2.6984 -2.6984 -2.6834 -2.6834 k = 0.3472-0.2005 0.2835 ( 7103 PWs) bands (ev): -23.9621 -23.9621 -23.1720 -23.1720 -23.1698 -23.1698 -23.1690 -23.1690 -22.8669 -22.8669 -22.8548 -22.8548 -14.7990 -14.7990 -14.5943 -14.5943 -14.5870 -14.5870 -7.1108 -7.1108 -5.9283 -5.9283 -5.9163 -5.9163 -5.7842 -5.7842 -5.1691 -5.1691 -5.1368 -5.1368 -5.1160 -5.1160 -4.7359 -4.7359 -4.5002 -4.5002 -4.1925 -4.1925 -4.1633 -4.1633 -3.9793 -3.9793 -3.8219 -3.8219 -3.7961 -3.7961 -3.7689 -3.7689 -3.2976 -3.2976 -3.2789 -3.2789 -3.1337 -3.1337 -2.9681 -2.9681 -2.8742 -2.8742 -2.8141 -2.8141 -2.7981 -2.7981 -2.7670 -2.7670 -2.7663 -2.7663 -2.7364 -2.7364 -2.7011 -2.7011 -2.6867 -2.6867 k = 0.3611-0.2085 0.2948 ( 7119 PWs) bands (ev): -23.9616 -23.9616 -23.1721 -23.1721 -23.1699 -23.1699 -23.1691 -23.1691 -22.8674 -22.8674 -22.8547 -22.8547 -14.7980 -14.7980 -14.5949 -14.5949 -14.5876 -14.5876 -7.1074 -7.1074 -5.9248 -5.9248 -5.9128 -5.9128 -5.7889 -5.7889 -5.1624 -5.1624 -5.1267 -5.1267 -5.1059 -5.1059 -4.7214 -4.7214 -4.5002 -4.5002 -4.2075 -4.2075 -4.1786 -4.1786 -3.9990 -3.9990 -3.8232 -3.8232 -3.7947 -3.7947 -3.7676 -3.7676 -3.3007 -3.3007 -3.2820 -3.2820 -3.1338 -3.1338 -2.9780 -2.9780 -2.8786 -2.8786 -2.8100 -2.8100 -2.7944 -2.7944 -2.7677 -2.7677 -2.7659 -2.7659 -2.7289 -2.7289 -2.7036 -2.7036 -2.6900 -2.6900 k = 0.3750-0.2165 0.3062 ( 7107 PWs) bands (ev): -23.9611 -23.9611 -23.1722 -23.1722 -23.1699 -23.1699 -23.1691 -23.1691 -22.8680 -22.8680 -22.8547 -22.8547 -14.7971 -14.7971 -14.5955 -14.5955 -14.5881 -14.5881 -7.1039 -7.1039 -5.9215 -5.9215 -5.9095 -5.9095 -5.7944 -5.7944 -5.1561 -5.1561 -5.1169 -5.1169 -5.0961 -5.0961 -4.7049 -4.7049 -4.5001 -4.5001 -4.2217 -4.2217 -4.1932 -4.1932 -4.0197 -4.0197 -3.8245 -3.8245 -3.7935 -3.7935 -3.7663 -3.7663 -3.3035 -3.3035 -3.2848 -3.2848 -3.1339 -3.1339 -2.9868 -2.9868 -2.8828 -2.8828 -2.8062 -2.8062 -2.7915 -2.7915 -2.7684 -2.7684 -2.7651 -2.7651 -2.7222 -2.7222 -2.7058 -2.7058 -2.6932 -2.6932 k = 0.3889-0.2245 0.3175 ( 7111 PWs) bands (ev): -23.9606 -23.9606 -23.1722 -23.1722 -23.1700 -23.1700 -23.1692 -23.1692 -22.8685 -22.8685 -22.8547 -22.8547 -14.7963 -14.7963 -14.5960 -14.5960 -14.5886 -14.5886 -7.1004 -7.1004 -5.9185 -5.9185 -5.9065 -5.9065 -5.8006 -5.8006 -5.1504 -5.1504 -5.1078 -5.1078 -5.0870 -5.0870 -4.6869 -4.6869 -4.5000 -4.5000 -4.2351 -4.2351 -4.2069 -4.2069 -4.0411 -4.0411 -3.8257 -3.8257 -3.7922 -3.7922 -3.7650 -3.7650 -3.3059 -3.3059 -3.2871 -3.2871 -3.1340 -3.1340 -2.9945 -2.9945 -2.8866 -2.8866 -2.8028 -2.8028 -2.7893 -2.7893 -2.7691 -2.7691 -2.7638 -2.7638 -2.7166 -2.7166 -2.7072 -2.7072 -2.6963 -2.6963 k = 0.4028-0.2325 0.3289 ( 7103 PWs) bands (ev): -23.9602 -23.9602 -23.1722 -23.1722 -23.1700 -23.1700 -23.1692 -23.1692 -22.8689 -22.8689 -22.8546 -22.8546 -14.7955 -14.7955 -14.5965 -14.5965 -14.5891 -14.5891 -7.0970 -7.0970 -5.9158 -5.9158 -5.9038 -5.9038 -5.8069 -5.8069 -5.1452 -5.1452 -5.0992 -5.0992 -5.0785 -5.0785 -4.6680 -4.6680 -4.5000 -4.5000 -4.2474 -4.2474 -4.2195 -4.2195 -4.0628 -4.0628 -3.8268 -3.8268 -3.7911 -3.7911 -3.7639 -3.7639 -3.3079 -3.3079 -3.2892 -3.2892 -3.1341 -3.1341 -3.0010 -3.0010 -2.8900 -2.8900 -2.8000 -2.8000 -2.7878 -2.7878 -2.7696 -2.7696 -2.7621 -2.7621 -2.7140 -2.7140 -2.7062 -2.7062 -2.6992 -2.6992 k = 0.4167-0.2406 0.3402 ( 7103 PWs) bands (ev): -23.9599 -23.9599 -23.1723 -23.1723 -23.1701 -23.1701 -23.1693 -23.1693 -22.8693 -22.8693 -22.8546 -22.8546 -14.7949 -14.7949 -14.5969 -14.5969 -14.5895 -14.5895 -7.0938 -7.0938 -5.9135 -5.9135 -5.9014 -5.9014 -5.8132 -5.8132 -5.1406 -5.1406 -5.0915 -5.0915 -5.0707 -5.0707 -4.6487 -4.6487 -4.4999 -4.4999 -4.2585 -4.2585 -4.2309 -4.2309 -4.0843 -4.0843 -3.8277 -3.8277 -3.7901 -3.7901 -3.7629 -3.7629 -3.3097 -3.3097 -3.2909 -3.2909 -3.1341 -3.1341 -3.0065 -3.0065 -2.8931 -2.8931 -2.7976 -2.7976 -2.7870 -2.7870 -2.7699 -2.7699 -2.7601 -2.7601 -2.7145 -2.7145 -2.7026 -2.7026 -2.7020 -2.7020 k = 0.4306-0.2486 0.3515 ( 7103 PWs) bands (ev): -23.9596 -23.9596 -23.1723 -23.1723 -23.1701 -23.1701 -23.1693 -23.1693 -22.8697 -22.8697 -22.8546 -22.8546 -14.7943 -14.7943 -14.5973 -14.5973 -14.5898 -14.5898 -7.0909 -7.0909 -5.9114 -5.9114 -5.8993 -5.8993 -5.8190 -5.8190 -5.1366 -5.1366 -5.0848 -5.0848 -5.0639 -5.0639 -4.6298 -4.6298 -4.4998 -4.4998 -4.2682 -4.2682 -4.2409 -4.2409 -4.1048 -4.1048 -3.8286 -3.8286 -3.7892 -3.7892 -3.7620 -3.7620 -3.3111 -3.3111 -3.2923 -3.2923 -3.1342 -3.1342 -3.0110 -3.0110 -2.8958 -2.8958 -2.7958 -2.7958 -2.7865 -2.7865 -2.7700 -2.7700 -2.7579 -2.7579 -2.7157 -2.7157 -2.7045 -2.7045 -2.6988 -2.6988 k = 0.4444-0.2566 0.3629 ( 7103 PWs) bands (ev): -23.9593 -23.9593 -23.1723 -23.1723 -23.1701 -23.1701 -23.1693 -23.1693 -22.8699 -22.8699 -22.8546 -22.8546 -14.7938 -14.7938 -14.5976 -14.5976 -14.5901 -14.5901 -7.0884 -7.0884 -5.9097 -5.9097 -5.8976 -5.8976 -5.8242 -5.8242 -5.1333 -5.1333 -5.0790 -5.0790 -5.0582 -5.0582 -4.6122 -4.6122 -4.4998 -4.4998 -4.2764 -4.2764 -4.2492 -4.2492 -4.1237 -4.1237 -3.8293 -3.8293 -3.7885 -3.7885 -3.7612 -3.7612 -3.3123 -3.3123 -3.2935 -3.2935 -3.1342 -3.1342 -3.0146 -3.0146 -2.8980 -2.8980 -2.7944 -2.7944 -2.7864 -2.7864 -2.7700 -2.7700 -2.7558 -2.7558 -2.7170 -2.7170 -2.7068 -2.7068 -2.6954 -2.6954 k = 0.4583-0.2646 0.3742 ( 7095 PWs) bands (ev): -23.9591 -23.9591 -23.1723 -23.1723 -23.1701 -23.1701 -23.1693 -23.1693 -22.8702 -22.8702 -22.8546 -22.8546 -14.7935 -14.7935 -14.5978 -14.5978 -14.5903 -14.5903 -7.0864 -7.0864 -5.9083 -5.9083 -5.8963 -5.8963 -5.8284 -5.8284 -5.1307 -5.1307 -5.0744 -5.0744 -5.0536 -5.0536 -4.5968 -4.5968 -4.4998 -4.4998 -4.2830 -4.2830 -4.2559 -4.2559 -4.1399 -4.1399 -3.8298 -3.8298 -3.7879 -3.7879 -3.7606 -3.7606 -3.3132 -3.3132 -3.2944 -3.2944 -3.1343 -3.1343 -3.0173 -3.0173 -2.8997 -2.8997 -2.7934 -2.7934 -2.7863 -2.7863 -2.7698 -2.7698 -2.7539 -2.7539 -2.7181 -2.7181 -2.7087 -2.7087 -2.6927 -2.6927 k = 0.4722-0.2726 0.3856 ( 7082 PWs) bands (ev): -23.9589 -23.9589 -23.1723 -23.1723 -23.1701 -23.1701 -23.1694 -23.1694 -22.8703 -22.8703 -22.8545 -22.8545 -14.7932 -14.7932 -14.5980 -14.5980 -14.5905 -14.5905 -7.0849 -7.0849 -5.9074 -5.9074 -5.8954 -5.8954 -5.8316 -5.8316 -5.1288 -5.1288 -5.0711 -5.0711 -5.0502 -5.0502 -4.5848 -4.5848 -4.4997 -4.4997 -4.2878 -4.2878 -4.2607 -4.2607 -4.1525 -4.1525 -3.8302 -3.8302 -3.7874 -3.7874 -3.7602 -3.7602 -3.3138 -3.3138 -3.2950 -3.2950 -3.1343 -3.1343 -3.0192 -3.0192 -2.9010 -2.9010 -2.7928 -2.7928 -2.7864 -2.7864 -2.7695 -2.7695 -2.7524 -2.7524 -2.7189 -2.7189 -2.7102 -2.7102 -2.6908 -2.6908 k = 0.4861-0.2807 0.3969 ( 7090 PWs) bands (ev): -23.9589 -23.9589 -23.1724 -23.1724 -23.1701 -23.1701 -23.1694 -23.1694 -22.8704 -22.8704 -22.8545 -22.8545 -14.7930 -14.7930 -14.5981 -14.5981 -14.5906 -14.5906 -7.0839 -7.0839 -5.9068 -5.9068 -5.8948 -5.8948 -5.8335 -5.8335 -5.1277 -5.1277 -5.0690 -5.0690 -5.0482 -5.0482 -4.5771 -4.5771 -4.4997 -4.4997 -4.2907 -4.2907 -4.2637 -4.2637 -4.1606 -4.1606 -3.8304 -3.8304 -3.7872 -3.7872 -3.7599 -3.7599 -3.3142 -3.3142 -3.2954 -3.2954 -3.1343 -3.1343 -3.0204 -3.0204 -2.9017 -2.9017 -2.7925 -2.7925 -2.7864 -2.7864 -2.7694 -2.7694 -2.7514 -2.7514 -2.7194 -2.7194 -2.7111 -2.7111 -2.6896 -2.6896 k = 0.5000-0.2887 0.4082 ( 7102 PWs) bands (ev): -23.9588 -23.9588 -23.1724 -23.1724 -23.1702 -23.1702 -23.1694 -23.1694 -22.8705 -22.8705 -22.8545 -22.8545 -14.7930 -14.7930 -14.5981 -14.5981 -14.5906 -14.5906 -7.0836 -7.0836 -5.9066 -5.9066 -5.8946 -5.8946 -5.8342 -5.8342 -5.1273 -5.1273 -5.0684 -5.0684 -5.0475 -5.0475 -4.5744 -4.5744 -4.4997 -4.4997 -4.2917 -4.2917 -4.2647 -4.2647 -4.1634 -4.1634 -3.8305 -3.8305 -3.7871 -3.7871 -3.7598 -3.7598 -3.3143 -3.3143 -3.2955 -3.2955 -3.1343 -3.1343 -3.0208 -3.0208 -2.9020 -2.9020 -2.7924 -2.7924 -2.7865 -2.7865 -2.7693 -2.7693 -2.7511 -2.7511 -2.7196 -2.7196 -2.7114 -2.7114 -2.6892 -2.6892 k = 0.5000-0.2887 0.4082 ( 7102 PWs) bands (ev): -23.9588 -23.9588 -23.1724 -23.1724 -23.1702 -23.1702 -23.1694 -23.1694 -22.8705 -22.8705 -22.8545 -22.8545 -14.7930 -14.7930 -14.5981 -14.5981 -14.5906 -14.5906 -7.0836 -7.0836 -5.9066 -5.9066 -5.8946 -5.8946 -5.8342 -5.8342 -5.1273 -5.1273 -5.0684 -5.0684 -5.0475 -5.0475 -4.5744 -4.5744 -4.4997 -4.4997 -4.2917 -4.2917 -4.2647 -4.2647 -4.1634 -4.1634 -3.8305 -3.8305 -3.7871 -3.7871 -3.7598 -3.7598 -3.3143 -3.3143 -3.2955 -3.2955 -3.1343 -3.1343 -3.0208 -3.0208 -2.9020 -2.9020 -2.7924 -2.7924 -2.7865 -2.7865 -2.7693 -2.7693 -2.7511 -2.7511 -2.7196 -2.7196 -2.7114 -2.7114 -2.6892 -2.6892 k = 0.5000-0.2726 0.4196 ( 7102 PWs) bands (ev): -23.9588 -23.9588 -23.1724 -23.1724 -23.1702 -23.1702 -23.1694 -23.1694 -22.8704 -22.8704 -22.8546 -22.8546 -14.7930 -14.7930 -14.5981 -14.5981 -14.5906 -14.5906 -7.0839 -7.0839 -5.9061 -5.9061 -5.8941 -5.8941 -5.8343 -5.8343 -5.1272 -5.1272 -5.0684 -5.0684 -5.0476 -5.0476 -4.5748 -4.5748 -4.5024 -4.5024 -4.2901 -4.2901 -4.2630 -4.2630 -4.1634 -4.1634 -3.8307 -3.8307 -3.7875 -3.7875 -3.7602 -3.7602 -3.3142 -3.3142 -3.2953 -3.2953 -3.1347 -3.1347 -3.0204 -3.0204 -2.9017 -2.9017 -2.7923 -2.7923 -2.7864 -2.7864 -2.7695 -2.7695 -2.7513 -2.7513 -2.7198 -2.7198 -2.7116 -2.7116 -2.6891 -2.6891 k = 0.5000-0.2566 0.4309 ( 7094 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1702 -23.1702 -23.1694 -23.1694 -22.8704 -22.8704 -22.8546 -22.8546 -14.7930 -14.7930 -14.5980 -14.5980 -14.5907 -14.5907 -7.0848 -7.0848 -5.9048 -5.9048 -5.8925 -5.8925 -5.8346 -5.8346 -5.1270 -5.1270 -5.0687 -5.0687 -5.0478 -5.0478 -4.5761 -4.5761 -4.5098 -4.5098 -4.2862 -4.2862 -4.2577 -4.2577 -4.1634 -4.1634 -3.8312 -3.8312 -3.7887 -3.7887 -3.7614 -3.7614 -3.3137 -3.3137 -3.2948 -3.2948 -3.1356 -3.1356 -3.0193 -3.0193 -2.9008 -2.9008 -2.7919 -2.7919 -2.7862 -2.7862 -2.7701 -2.7701 -2.7520 -2.7520 -2.7203 -2.7203 -2.7119 -2.7119 -2.6888 -2.6888 k = 0.5000-0.2406 0.4423 ( 7090 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1702 -23.1702 -23.1694 -23.1694 -22.8702 -22.8702 -22.8547 -22.8547 -14.7930 -14.7930 -14.5980 -14.5980 -14.5908 -14.5908 -7.0863 -7.0863 -5.9031 -5.9031 -5.8895 -5.8895 -5.8352 -5.8352 -5.1265 -5.1265 -5.0691 -5.0691 -5.0481 -5.0481 -4.5787 -4.5787 -4.5203 -4.5203 -4.2819 -4.2819 -4.2479 -4.2479 -4.1634 -4.1634 -3.8320 -3.8320 -3.7907 -3.7907 -3.7632 -3.7632 -3.3131 -3.3131 -3.2937 -3.2937 -3.1372 -3.1372 -3.0174 -3.0174 -2.8993 -2.8993 -2.7914 -2.7914 -2.7858 -2.7858 -2.7710 -2.7710 -2.7531 -2.7531 -2.7214 -2.7214 -2.7121 -2.7121 -2.6884 -2.6884 k = 0.5000-0.2245 0.4536 ( 7088 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1702 -23.1702 -23.1695 -23.1695 -22.8701 -22.8701 -22.8548 -22.8548 -14.7930 -14.7930 -14.5979 -14.5979 -14.5909 -14.5909 -7.0883 -7.0883 -5.9013 -5.9013 -5.8849 -5.8849 -5.8360 -5.8360 -5.1258 -5.1258 -5.0696 -5.0696 -5.0486 -5.0486 -4.5835 -4.5835 -4.5319 -4.5319 -4.2779 -4.2779 -4.2342 -4.2342 -4.1634 -4.1634 -3.8330 -3.8330 -3.7937 -3.7937 -3.7657 -3.7657 -3.3126 -3.3126 -3.2921 -3.2921 -3.1394 -3.1394 -3.0149 -3.0149 -2.8972 -2.8972 -2.7908 -2.7908 -2.7853 -2.7853 -2.7723 -2.7723 -2.7546 -2.7546 -2.7234 -2.7234 -2.7121 -2.7121 -2.6878 -2.6878 k = 0.5000-0.2085 0.4649 ( 7092 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1702 -23.1702 -23.1695 -23.1695 -22.8698 -22.8698 -22.8550 -22.8550 -14.7929 -14.7929 -14.5978 -14.5978 -14.5910 -14.5910 -7.0907 -7.0907 -5.8995 -5.8995 -5.8786 -5.8786 -5.8369 -5.8369 -5.1249 -5.1249 -5.0704 -5.0704 -5.0491 -5.0491 -4.5918 -4.5918 -4.5421 -4.5421 -4.2742 -4.2742 -4.2178 -4.2178 -4.1634 -4.1634 -3.8342 -3.8342 -3.7977 -3.7977 -3.7687 -3.7687 -3.3122 -3.3122 -3.2896 -3.2896 -3.1422 -3.1422 -3.0117 -3.0117 -2.8947 -2.8947 -2.7901 -2.7901 -2.7846 -2.7846 -2.7739 -2.7739 -2.7565 -2.7565 -2.7262 -2.7262 -2.7117 -2.7117 -2.6872 -2.6872 k = 0.5000-0.1925 0.4763 ( 7092 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1703 -23.1703 -23.1696 -23.1696 -22.8696 -22.8696 -22.8552 -22.8552 -14.7929 -14.7929 -14.5976 -14.5976 -14.5911 -14.5911 -7.0935 -7.0935 -5.8978 -5.8978 -5.8710 -5.8710 -5.8380 -5.8380 -5.1239 -5.1239 -5.0713 -5.0713 -5.0497 -5.0497 -4.6043 -4.6043 -4.5494 -4.5494 -4.2703 -4.2703 -4.1999 -4.1999 -4.1632 -4.1632 -3.8355 -3.8355 -3.8027 -3.8027 -3.7720 -3.7720 -3.3120 -3.3120 -3.2864 -3.2864 -3.1455 -3.1455 -3.0078 -3.0078 -2.8916 -2.8916 -2.7895 -2.7895 -2.7837 -2.7837 -2.7758 -2.7758 -2.7586 -2.7586 -2.7298 -2.7298 -2.7109 -2.7109 -2.6865 -2.6865 k = 0.5000-0.1764 0.4876 ( 7088 PWs) bands (ev): -23.9588 -23.9588 -23.1722 -23.1722 -23.1703 -23.1703 -23.1696 -23.1696 -22.8693 -22.8693 -22.8554 -22.8554 -14.7929 -14.7929 -14.5974 -14.5974 -14.5913 -14.5913 -7.0965 -7.0965 -5.8961 -5.8961 -5.8627 -5.8627 -5.8389 -5.8389 -5.1227 -5.1227 -5.0725 -5.0725 -5.0503 -5.0503 -4.6201 -4.6201 -4.5539 -4.5539 -4.2663 -4.2663 -4.1823 -4.1823 -4.1619 -4.1619 -3.8368 -3.8368 -3.8090 -3.8090 -3.7756 -3.7756 -3.3122 -3.3122 -3.2824 -3.2824 -3.1493 -3.1493 -3.0033 -3.0033 -2.8880 -2.8880 -2.7889 -2.7889 -2.7828 -2.7828 -2.7779 -2.7779 -2.7610 -2.7610 -2.7341 -2.7341 -2.7097 -2.7097 -2.6859 -2.6859 k = 0.5000-0.1604 0.4990 ( 7100 PWs) bands (ev): -23.9588 -23.9588 -23.1722 -23.1722 -23.1704 -23.1704 -23.1697 -23.1697 -22.8690 -22.8690 -22.8557 -22.8557 -14.7929 -14.7929 -14.5972 -14.5972 -14.5915 -14.5915 -7.0998 -7.0998 -5.8942 -5.8942 -5.8545 -5.8545 -5.8391 -5.8391 -5.1213 -5.1213 -5.0739 -5.0739 -5.0508 -5.0508 -4.6376 -4.6376 -4.5567 -4.5567 -4.2619 -4.2619 -4.1715 -4.1715 -4.1534 -4.1534 -3.8380 -3.8380 -3.8165 -3.8165 -3.7793 -3.7793 -3.3126 -3.3126 -3.2777 -3.2777 -3.1536 -3.1536 -2.9983 -2.9983 -2.8841 -2.8841 -2.7885 -2.7885 -2.7820 -2.7820 -2.7799 -2.7799 -2.7635 -2.7635 -2.7389 -2.7389 -2.7084 -2.7084 -2.6853 -2.6853 k = 0.5000-0.1443 0.5103 ( 7110 PWs) bands (ev): -23.9588 -23.9588 -23.1722 -23.1722 -23.1704 -23.1704 -23.1698 -23.1698 -22.8687 -22.8687 -22.8560 -22.8560 -14.7929 -14.7929 -14.5970 -14.5970 -14.5917 -14.5917 -7.1031 -7.1031 -5.8923 -5.8923 -5.8493 -5.8493 -5.8359 -5.8359 -5.1197 -5.1197 -5.0755 -5.0755 -5.0514 -5.0514 -4.6558 -4.6558 -4.5584 -4.5584 -4.2572 -4.2572 -4.1701 -4.1701 -4.1357 -4.1357 -3.8391 -3.8391 -3.8250 -3.8250 -3.7832 -3.7832 -3.3131 -3.3131 -3.2725 -3.2725 -3.1582 -3.1582 -2.9928 -2.9928 -2.8798 -2.8798 -2.7884 -2.7884 -2.7831 -2.7831 -2.7802 -2.7802 -2.7661 -2.7661 -2.7441 -2.7441 -2.7068 -2.7068 -2.6848 -2.6848 k = 0.5000-0.1283 0.5217 ( 7108 PWs) bands (ev): -23.9587 -23.9587 -23.1722 -23.1722 -23.1705 -23.1705 -23.1698 -23.1698 -22.8683 -22.8683 -22.8563 -22.8563 -14.7928 -14.7928 -14.5968 -14.5968 -14.5920 -14.5920 -7.1063 -7.1063 -5.8902 -5.8902 -5.8488 -5.8488 -5.8280 -5.8280 -5.1180 -5.1180 -5.0773 -5.0773 -5.0519 -5.0519 -4.6736 -4.6736 -4.5597 -4.5597 -4.2523 -4.2523 -4.1711 -4.1711 -4.1159 -4.1159 -3.8407 -3.8407 -3.8340 -3.8340 -3.7870 -3.7870 -3.3138 -3.3138 -3.2668 -3.2668 -3.1632 -3.1632 -2.9870 -2.9870 -2.8753 -2.8753 -2.7887 -2.7887 -2.7854 -2.7854 -2.7795 -2.7795 -2.7686 -2.7686 -2.7494 -2.7494 -2.7051 -2.7051 -2.6845 -2.6845 k = 0.5000-0.1123 0.5330 ( 7110 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1699 -23.1699 -22.8679 -22.8679 -22.8566 -22.8566 -14.7928 -14.7928 -14.5965 -14.5965 -14.5922 -14.5922 -7.1095 -7.1095 -5.8880 -5.8880 -5.8502 -5.8502 -5.8186 -5.8186 -5.1162 -5.1162 -5.0793 -5.0793 -5.0523 -5.0523 -4.6906 -4.6906 -4.5605 -4.5605 -4.2471 -4.2471 -4.1730 -4.1730 -4.0958 -4.0958 -3.8475 -3.8475 -3.8384 -3.8384 -3.7909 -3.7909 -3.3145 -3.3145 -3.2608 -3.2608 -3.1685 -3.1685 -2.9811 -2.9811 -2.8705 -2.8705 -2.7903 -2.7903 -2.7869 -2.7869 -2.7791 -2.7791 -2.7708 -2.7708 -2.7546 -2.7546 -2.7032 -2.7032 -2.6844 -2.6844 k = 0.5000-0.0962 0.5443 ( 7110 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1700 -23.1700 -22.8676 -22.8676 -22.8569 -22.8569 -14.7928 -14.7928 -14.5962 -14.5962 -14.5925 -14.5925 -7.1124 -7.1124 -5.8857 -5.8857 -5.8522 -5.8522 -5.8092 -5.8092 -5.1143 -5.1143 -5.0814 -5.0814 -5.0526 -5.0526 -4.7063 -4.7063 -4.5612 -4.5612 -4.2416 -4.2416 -4.1755 -4.1755 -4.0758 -4.0758 -3.8589 -3.8589 -3.8389 -3.8389 -3.7948 -3.7948 -3.3152 -3.3152 -3.2545 -3.2545 -3.1740 -3.1740 -2.9752 -2.9752 -2.8656 -2.8656 -2.7933 -2.7933 -2.7873 -2.7873 -2.7795 -2.7795 -2.7725 -2.7725 -2.7592 -2.7592 -2.7013 -2.7013 -2.6845 -2.6845 k = 0.5000-0.0802 0.5557 ( 7106 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1701 -23.1701 -22.8672 -22.8672 -22.8572 -22.8572 -14.7928 -14.7928 -14.5960 -14.5960 -14.5928 -14.5928 -7.1150 -7.1150 -5.8834 -5.8834 -5.8544 -5.8544 -5.8004 -5.8004 -5.1123 -5.1123 -5.0835 -5.0835 -5.0529 -5.0529 -4.7203 -4.7203 -4.5617 -4.5617 -4.2361 -4.2361 -4.1784 -4.1784 -4.0561 -4.0561 -3.8715 -3.8715 -3.8385 -3.8385 -3.7985 -3.7985 -3.3158 -3.3158 -3.2481 -3.2481 -3.1798 -3.1798 -2.9695 -2.9695 -2.8607 -2.8607 -2.7967 -2.7967 -2.7875 -2.7875 -2.7808 -2.7808 -2.7740 -2.7740 -2.7628 -2.7628 -2.6993 -2.6993 -2.6848 -2.6848 k = 0.5000-0.0642 0.5670 ( 7114 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1701 -23.1701 -22.8669 -22.8669 -22.8574 -22.8574 -14.7928 -14.7928 -14.5956 -14.5956 -14.5931 -14.5931 -7.1172 -7.1172 -5.8810 -5.8810 -5.8567 -5.8567 -5.7927 -5.7927 -5.1103 -5.1103 -5.0858 -5.0858 -5.0532 -5.0532 -4.7322 -4.7322 -4.5620 -4.5620 -4.2306 -4.2306 -4.1818 -4.1818 -4.0371 -4.0371 -3.8849 -3.8849 -3.8378 -3.8378 -3.8021 -3.8021 -3.3164 -3.3164 -3.2416 -3.2416 -3.1856 -3.1856 -2.9642 -2.9642 -2.8560 -2.8560 -2.8004 -2.8004 -2.7877 -2.7877 -2.7829 -2.7829 -2.7756 -2.7756 -2.7649 -2.7649 -2.6974 -2.6974 -2.6853 -2.6853 k = 0.5000-0.0481 0.5784 ( 7110 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1702 -23.1702 -22.8666 -22.8666 -22.8577 -22.8577 -14.7928 -14.7928 -14.5953 -14.5953 -14.5934 -14.5934 -7.1190 -7.1190 -5.8786 -5.8786 -5.8590 -5.8590 -5.7864 -5.7864 -5.1083 -5.1083 -5.0879 -5.0879 -5.0533 -5.0533 -4.7418 -4.7418 -4.5623 -4.5623 -4.2254 -4.2254 -4.1854 -4.1854 -4.0191 -4.0191 -3.8986 -3.8986 -3.8368 -3.8368 -3.8053 -3.8053 -3.3169 -3.3169 -3.2352 -3.2352 -3.1915 -3.1915 -2.9597 -2.9597 -2.8515 -2.8515 -2.8039 -2.8039 -2.7881 -2.7881 -2.7850 -2.7850 -2.7771 -2.7771 -2.7658 -2.7658 -2.6955 -2.6955 -2.6860 -2.6860 k = 0.5000-0.0321 0.5897 ( 7112 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1703 -23.1703 -22.8664 -22.8664 -22.8578 -22.8578 -14.7927 -14.7927 -14.5950 -14.5950 -14.5937 -14.5937 -7.1204 -7.1204 -5.8764 -5.8764 -5.8612 -5.8612 -5.7816 -5.7816 -5.1066 -5.1066 -5.0898 -5.0898 -5.0535 -5.0535 -4.7489 -4.7489 -4.5625 -4.5625 -4.2206 -4.2206 -4.1889 -4.1889 -4.0026 -4.0026 -3.9119 -3.9119 -3.8357 -3.8357 -3.8079 -3.8079 -3.3172 -3.3172 -3.2291 -3.2291 -3.1972 -3.1972 -2.9562 -2.9562 -2.8478 -2.8478 -2.8071 -2.8071 -2.7891 -2.7891 -2.7864 -2.7864 -2.7784 -2.7784 -2.7661 -2.7661 -2.6938 -2.6938 -2.6868 -2.6868 k = 0.5000-0.0160 0.6010 ( 7116 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1705 -23.1705 -23.1703 -23.1703 -22.8663 -22.8663 -22.8580 -22.8580 -14.7927 -14.7927 -14.5947 -14.5947 -14.5940 -14.5940 -7.1212 -7.1212 -5.8746 -5.8746 -5.8630 -5.8630 -5.7787 -5.7787 -5.1052 -5.1052 -5.0912 -5.0912 -5.0535 -5.0535 -4.7532 -4.7532 -4.5626 -4.5626 -4.2169 -4.2169 -4.1918 -4.1918 -3.9896 -3.9896 -3.9230 -3.9230 -3.8349 -3.8349 -3.8097 -3.8097 -3.3174 -3.3174 -3.2240 -3.2240 -3.2021 -3.2021 -2.9540 -2.9540 -2.8451 -2.8451 -2.8094 -2.8094 -2.7902 -2.7902 -2.7869 -2.7869 -2.7791 -2.7791 -2.7661 -2.7661 -2.6924 -2.6924 -2.6877 -2.6877 k = 0.5000 0.0000 0.6124 ( 7104 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1704 -23.1704 -23.1704 -23.1704 -22.8662 -22.8662 -22.8580 -22.8580 -14.7927 -14.7927 -14.5944 -14.5944 -14.5944 -14.5944 -7.1214 -7.1214 -5.8739 -5.8739 -5.8637 -5.8637 -5.7777 -5.7777 -5.1047 -5.1047 -5.0917 -5.0917 -5.0536 -5.0536 -4.7546 -4.7546 -4.5626 -4.5626 -4.2155 -4.2155 -4.1930 -4.1930 -3.9841 -3.9841 -3.9279 -3.9279 -3.8346 -3.8346 -3.8103 -3.8103 -3.3175 -3.3175 -3.2216 -3.2216 -3.2044 -3.2044 -2.9533 -2.9533 -2.8442 -2.8442 -2.8102 -2.8102 -2.7906 -2.7906 -2.7870 -2.7870 -2.7793 -2.7793 -2.7661 -2.7661 -2.6917 -2.6917 -2.6882 -2.6882 k = 0.5000 0.0000 0.6124 ( 7104 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1704 -23.1704 -23.1704 -23.1704 -22.8662 -22.8662 -22.8580 -22.8580 -14.7927 -14.7927 -14.5944 -14.5944 -14.5944 -14.5944 -7.1214 -7.1214 -5.8739 -5.8739 -5.8637 -5.8637 -5.7777 -5.7777 -5.1047 -5.1047 -5.0917 -5.0917 -5.0536 -5.0536 -4.7546 -4.7546 -4.5626 -4.5626 -4.2155 -4.2155 -4.1930 -4.1930 -3.9841 -3.9841 -3.9279 -3.9279 -3.8346 -3.8346 -3.8103 -3.8103 -3.3175 -3.3175 -3.2216 -3.2216 -3.2044 -3.2044 -2.9533 -2.9533 -2.8442 -2.8442 -2.8102 -2.8102 -2.7906 -2.7906 -2.7870 -2.7870 -2.7793 -2.7793 -2.7661 -2.7661 -2.6917 -2.6917 -2.6882 -2.6882 k = 0.4904 0.0167 0.6124 ( 7114 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1706 -23.1706 -23.1701 -23.1701 -22.8663 -22.8663 -22.8580 -22.8580 -14.7927 -14.7927 -14.5946 -14.5946 -14.5941 -14.5941 -7.1215 -7.1215 -5.8740 -5.8740 -5.8633 -5.8633 -5.7782 -5.7782 -5.1051 -5.1051 -5.0916 -5.0916 -5.0536 -5.0536 -4.7542 -4.7542 -4.5634 -4.5634 -4.2154 -4.2154 -4.1918 -4.1918 -3.9868 -3.9868 -3.9257 -3.9257 -3.8346 -3.8346 -3.8099 -3.8099 -3.3174 -3.3174 -3.2228 -3.2228 -3.2033 -3.2033 -2.9537 -2.9537 -2.8446 -2.8446 -2.8099 -2.8099 -2.7920 -2.7920 -2.7860 -2.7860 -2.7787 -2.7787 -2.7658 -2.7658 -2.6921 -2.6921 -2.6880 -2.6880 k = 0.4808 0.0333 0.6124 ( 7114 PWs) bands (ev): -23.9587 -23.9587 -23.1722 -23.1722 -23.1708 -23.1708 -23.1698 -23.1698 -22.8663 -22.8663 -22.8579 -22.8579 -14.7928 -14.7928 -14.5948 -14.5948 -14.5939 -14.5939 -7.1215 -7.1215 -5.8741 -5.8741 -5.8623 -5.8623 -5.7796 -5.7796 -5.1063 -5.1063 -5.0913 -5.0913 -5.0538 -5.0538 -4.7529 -4.7529 -4.5656 -4.5656 -4.2145 -4.2145 -4.1889 -4.1889 -3.9938 -3.9938 -3.9202 -3.9202 -3.8350 -3.8350 -3.8084 -3.8084 -3.3171 -3.3171 -3.2257 -3.2257 -3.2005 -3.2005 -2.9551 -2.9551 -2.8457 -2.8457 -2.8090 -2.8090 -2.7947 -2.7947 -2.7843 -2.7843 -2.7770 -2.7770 -2.7650 -2.7650 -2.6930 -2.6930 -2.6876 -2.6876 k = 0.4712 0.0500 0.6124 ( 7117 PWs) bands (ev): -23.9587 -23.9587 -23.1724 -23.1724 -23.1709 -23.1709 -23.1695 -23.1695 -22.8663 -22.8663 -22.8579 -22.8579 -14.7928 -14.7928 -14.5950 -14.5950 -14.5937 -14.5937 -7.1215 -7.1215 -5.8738 -5.8738 -5.8611 -5.8611 -5.7819 -5.7819 -5.1079 -5.1079 -5.0910 -5.0910 -5.0541 -5.0541 -4.7509 -4.7509 -4.5692 -4.5692 -4.2124 -4.2124 -4.1850 -4.1850 -4.0032 -4.0032 -3.9136 -3.9136 -3.8357 -3.8357 -3.8057 -3.8057 -3.3166 -3.3166 -3.2294 -3.2294 -3.1972 -3.1972 -2.9572 -2.9572 -2.8473 -2.8473 -2.8079 -2.8079 -2.7975 -2.7975 -2.7823 -2.7823 -2.7746 -2.7746 -2.7638 -2.7638 -2.6941 -2.6941 -2.6872 -2.6872 k = 0.4615 0.0666 0.6124 ( 7114 PWs) bands (ev): -23.9588 -23.9588 -23.1726 -23.1726 -23.1710 -23.1710 -23.1691 -23.1691 -22.8664 -22.8664 -22.8578 -22.8578 -14.7929 -14.7929 -14.5951 -14.5951 -14.5935 -14.5935 -7.1215 -7.1215 -5.8730 -5.8730 -5.8599 -5.8599 -5.7849 -5.7849 -5.1097 -5.1097 -5.0908 -5.0908 -5.0544 -5.0544 -4.7482 -4.7482 -4.5739 -4.5739 -4.2089 -4.2089 -4.1805 -4.1805 -4.0138 -4.0138 -3.9072 -3.9072 -3.8367 -3.8367 -3.8019 -3.8019 -3.3158 -3.3158 -3.2334 -3.2334 -3.1937 -3.1937 -2.9601 -2.9601 -2.8492 -2.8492 -2.8069 -2.8069 -2.8001 -2.8001 -2.7801 -2.7801 -2.7720 -2.7720 -2.7623 -2.7623 -2.6953 -2.6953 -2.6870 -2.6870 k = 0.4519 0.0833 0.6124 ( 7110 PWs) bands (ev): -23.9588 -23.9588 -23.1729 -23.1729 -23.1711 -23.1711 -23.1688 -23.1688 -22.8665 -22.8665 -22.8577 -22.8577 -14.7930 -14.7930 -14.5952 -14.5952 -14.5932 -14.5932 -7.1216 -7.1216 -5.8716 -5.8716 -5.8586 -5.8586 -5.7887 -5.7887 -5.1117 -5.1117 -5.0907 -5.0907 -5.0546 -5.0546 -4.7450 -4.7450 -4.5795 -4.5795 -4.2042 -4.2042 -4.1757 -4.1757 -4.0251 -4.0251 -3.9015 -3.9015 -3.8381 -3.8381 -3.7971 -3.7971 -3.3149 -3.3149 -3.2375 -3.2375 -3.1903 -3.1903 -2.9634 -2.9634 -2.8512 -2.8512 -2.8060 -2.8060 -2.8024 -2.8024 -2.7777 -2.7777 -2.7694 -2.7694 -2.7607 -2.7607 -2.6964 -2.6964 -2.6870 -2.6870 k = 0.4423 0.0999 0.6124 ( 7096 PWs) bands (ev): -23.9588 -23.9588 -23.1731 -23.1731 -23.1712 -23.1712 -23.1685 -23.1685 -22.8665 -22.8665 -22.8576 -22.8576 -14.7930 -14.7930 -14.5954 -14.5954 -14.5930 -14.5930 -7.1217 -7.1217 -5.8696 -5.8696 -5.8574 -5.8574 -5.7931 -5.7931 -5.1137 -5.1137 -5.0907 -5.0907 -5.0548 -5.0548 -4.7414 -4.7414 -4.5855 -4.5855 -4.1984 -4.1984 -4.1707 -4.1707 -4.0367 -4.0367 -3.8968 -3.8968 -3.8395 -3.8395 -3.7915 -3.7915 -3.3138 -3.3138 -3.2416 -3.2416 -3.1872 -3.1872 -2.9670 -2.9670 -2.8531 -2.8531 -2.8059 -2.8059 -2.8040 -2.8040 -2.7751 -2.7751 -2.7670 -2.7670 -2.7588 -2.7588 -2.6976 -2.6976 -2.6871 -2.6871 k = 0.4327 0.1166 0.6124 ( 7094 PWs) bands (ev): -23.9589 -23.9589 -23.1733 -23.1733 -23.1712 -23.1712 -23.1682 -23.1682 -22.8666 -22.8666 -22.8575 -22.8575 -14.7931 -14.7931 -14.5954 -14.5954 -14.5929 -14.5929 -7.1217 -7.1217 -5.8672 -5.8672 -5.8561 -5.8561 -5.7980 -5.7980 -5.1155 -5.1155 -5.0909 -5.0909 -5.0549 -5.0549 -4.7375 -4.7375 -4.5918 -4.5918 -4.1919 -4.1919 -4.1655 -4.1655 -4.0485 -4.0485 -3.8930 -3.8930 -3.8411 -3.8411 -3.7857 -3.7857 -3.3125 -3.3125 -3.2455 -3.2455 -3.1843 -3.1843 -2.9707 -2.9707 -2.8549 -2.8549 -2.8070 -2.8070 -2.8041 -2.8041 -2.7726 -2.7726 -2.7649 -2.7649 -2.7569 -2.7569 -2.6986 -2.6986 -2.6873 -2.6873 k = 0.4231 0.1332 0.6124 ( 7084 PWs) bands (ev): -23.9589 -23.9589 -23.1734 -23.1734 -23.1712 -23.1712 -23.1680 -23.1680 -22.8667 -22.8667 -22.8574 -22.8574 -14.7931 -14.7931 -14.5955 -14.5955 -14.5927 -14.5927 -7.1218 -7.1218 -5.8646 -5.8646 -5.8546 -5.8546 -5.8032 -5.8032 -5.1172 -5.1172 -5.0911 -5.0911 -5.0550 -5.0550 -4.7336 -4.7336 -4.5980 -4.5980 -4.1852 -4.1852 -4.1601 -4.1601 -4.0603 -4.0603 -3.8902 -3.8902 -3.8426 -3.8426 -3.7800 -3.7800 -3.3111 -3.3111 -3.2491 -3.2491 -3.1818 -3.1818 -2.9742 -2.9742 -2.8565 -2.8565 -2.8083 -2.8083 -2.8039 -2.8039 -2.7702 -2.7702 -2.7629 -2.7629 -2.7552 -2.7552 -2.6995 -2.6995 -2.6877 -2.6877 k = 0.4135 0.1499 0.6124 ( 7094 PWs) bands (ev): -23.9589 -23.9589 -23.1736 -23.1736 -23.1713 -23.1713 -23.1678 -23.1678 -22.8668 -22.8668 -22.8573 -22.8573 -14.7932 -14.7932 -14.5956 -14.5956 -14.5926 -14.5926 -7.1218 -7.1218 -5.8621 -5.8621 -5.8526 -5.8526 -5.8087 -5.8087 -5.1186 -5.1186 -5.0914 -5.0914 -5.0550 -5.0550 -4.7299 -4.7299 -4.6037 -4.6037 -4.1787 -4.1787 -4.1543 -4.1543 -4.0719 -4.0719 -3.8880 -3.8880 -3.8439 -3.8439 -3.7748 -3.7748 -3.3097 -3.3097 -3.2524 -3.2524 -3.1796 -3.1796 -2.9774 -2.9774 -2.8579 -2.8579 -2.8095 -2.8095 -2.8037 -2.8037 -2.7681 -2.7681 -2.7612 -2.7612 -2.7537 -2.7537 -2.7002 -2.7002 -2.6880 -2.6880 k = 0.4038 0.1665 0.6124 ( 7097 PWs) bands (ev): -23.9589 -23.9589 -23.1737 -23.1737 -23.1713 -23.1713 -23.1676 -23.1676 -22.8668 -22.8668 -22.8572 -22.8572 -14.7933 -14.7933 -14.5956 -14.5956 -14.5925 -14.5925 -7.1219 -7.1219 -5.8601 -5.8601 -5.8498 -5.8498 -5.8142 -5.8142 -5.1198 -5.1198 -5.0917 -5.0917 -5.0550 -5.0550 -4.7266 -4.7266 -4.6086 -4.6086 -4.1732 -4.1732 -4.1477 -4.1477 -4.0834 -4.0834 -3.8865 -3.8865 -3.8450 -3.8450 -3.7704 -3.7704 -3.3084 -3.3084 -3.2552 -3.2552 -3.1780 -3.1780 -2.9801 -2.9801 -2.8590 -2.8590 -2.8104 -2.8104 -2.8036 -2.8036 -2.7665 -2.7665 -2.7597 -2.7597 -2.7524 -2.7524 -2.7007 -2.7007 -2.6884 -2.6884 k = 0.3942 0.1832 0.6124 ( 7095 PWs) bands (ev): -23.9590 -23.9590 -23.1738 -23.1738 -23.1713 -23.1713 -23.1675 -23.1675 -22.8668 -22.8668 -22.8572 -22.8572 -14.7933 -14.7933 -14.5957 -14.5957 -14.5924 -14.5924 -7.1219 -7.1219 -5.8588 -5.8588 -5.8464 -5.8464 -5.8195 -5.8195 -5.1206 -5.1206 -5.0919 -5.0919 -5.0550 -5.0550 -4.7239 -4.7239 -4.6125 -4.6125 -4.1691 -4.1691 -4.1403 -4.1403 -4.0943 -4.0943 -3.8855 -3.8855 -3.8459 -3.8459 -3.7671 -3.7671 -3.3074 -3.3074 -3.2573 -3.2573 -3.1768 -3.1768 -2.9821 -2.9821 -2.8598 -2.8598 -2.8111 -2.8111 -2.8035 -2.8035 -2.7653 -2.7653 -2.7585 -2.7585 -2.7516 -2.7516 -2.7011 -2.7011 -2.6887 -2.6887 k = 0.3846 0.1999 0.6124 ( 7095 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8582 -5.8582 -5.8431 -5.8431 -5.8239 -5.8239 -5.1211 -5.1211 -5.0920 -5.0920 -5.0550 -5.0550 -4.7222 -4.7222 -4.6149 -4.6149 -4.1667 -4.1667 -4.1327 -4.1327 -4.1039 -4.1039 -3.8849 -3.8849 -3.8464 -3.8464 -3.7650 -3.7650 -3.3067 -3.3067 -3.2587 -3.2587 -3.1760 -3.1760 -2.9833 -2.9833 -2.8603 -2.8603 -2.8115 -2.8115 -2.8034 -2.8034 -2.7647 -2.7647 -2.7577 -2.7577 -2.7511 -2.7511 -2.7013 -2.7013 -2.6889 -2.6889 k = 0.3750 0.2165 0.6124 ( 7094 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8580 -5.8580 -5.8415 -5.8415 -5.8258 -5.8258 -5.1213 -5.1213 -5.0921 -5.0921 -5.0550 -5.0550 -4.7216 -4.7216 -4.6158 -4.6158 -4.1659 -4.1659 -4.1285 -4.1285 -4.1087 -4.1087 -3.8847 -3.8847 -3.8466 -3.8466 -3.7643 -3.7643 -3.3064 -3.3064 -3.2592 -3.2592 -3.1758 -3.1758 -2.9838 -2.9838 -2.8604 -2.8604 -2.8116 -2.8116 -2.8034 -2.8034 -2.7644 -2.7644 -2.7574 -2.7574 -2.7509 -2.7509 -2.7014 -2.7014 -2.6890 -2.6890 k = 0.3750 0.2165 0.6124 ( 7094 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8580 -5.8580 -5.8415 -5.8415 -5.8258 -5.8258 -5.1213 -5.1213 -5.0921 -5.0921 -5.0550 -5.0550 -4.7216 -4.7216 -4.6158 -4.6158 -4.1659 -4.1659 -4.1285 -4.1285 -4.1087 -4.1087 -3.8847 -3.8847 -3.8466 -3.8466 -3.7643 -3.7643 -3.3064 -3.3064 -3.2592 -3.2592 -3.1758 -3.1758 -2.9838 -2.9838 -2.8604 -2.8604 -2.8116 -2.8116 -2.8034 -2.8034 -2.7644 -2.7644 -2.7574 -2.7574 -2.7509 -2.7509 -2.7014 -2.7014 -2.6890 -2.6890 k = 0.3651 0.2108 0.5963 ( 7090 PWs) bands (ev): -23.9591 -23.9591 -23.1743 -23.1743 -23.1713 -23.1713 -23.1671 -23.1671 -22.8664 -22.8664 -22.8575 -22.8575 -14.7935 -14.7935 -14.5953 -14.5953 -14.5925 -14.5925 -7.1265 -7.1265 -5.8607 -5.8607 -5.8336 -5.8336 -5.8182 -5.8182 -5.1222 -5.1222 -5.0965 -5.0965 -5.0567 -5.0567 -4.7426 -4.7426 -4.6197 -4.6197 -4.1614 -4.1614 -4.1122 -4.1122 -4.0916 -4.0916 -3.8970 -3.8970 -3.8485 -3.8485 -3.7637 -3.7637 -3.3061 -3.3061 -3.2536 -3.2536 -3.1808 -3.1808 -2.9810 -2.9810 -2.8552 -2.8552 -2.8170 -2.8170 -2.8069 -2.8069 -2.7656 -2.7656 -2.7577 -2.7577 -2.7474 -2.7474 -2.7005 -2.7005 -2.6902 -2.6902 k = 0.3553 0.2051 0.5801 ( 7086 PWs) bands (ev): -23.9592 -23.9592 -23.1747 -23.1747 -23.1712 -23.1712 -23.1668 -23.1668 -22.8659 -22.8659 -22.8578 -22.8578 -14.7937 -14.7937 -14.5949 -14.5949 -14.5926 -14.5926 -7.1309 -7.1309 -5.8639 -5.8639 -5.8259 -5.8259 -5.8105 -5.8105 -5.1236 -5.1236 -5.1011 -5.1011 -5.0589 -5.0589 -4.7627 -4.7627 -4.6234 -4.6234 -4.1574 -4.1574 -4.0961 -4.0961 -4.0733 -4.0733 -3.9089 -3.9089 -3.8502 -3.8502 -3.7632 -3.7632 -3.3058 -3.3058 -3.2479 -3.2479 -3.1857 -3.1857 -2.9788 -2.9788 -2.8503 -2.8503 -2.8227 -2.8227 -2.8099 -2.8099 -2.7667 -2.7667 -2.7581 -2.7581 -2.7432 -2.7432 -2.6999 -2.6999 -2.6915 -2.6915 k = 0.3454 0.1994 0.5640 ( 7096 PWs) bands (ev): -23.9593 -23.9593 -23.1751 -23.1751 -23.1711 -23.1711 -23.1665 -23.1665 -22.8653 -22.8653 -22.8581 -22.8581 -14.7939 -14.7939 -14.5944 -14.5944 -14.5928 -14.5928 -7.1352 -7.1352 -5.8674 -5.8674 -5.8188 -5.8188 -5.8029 -5.8029 -5.1258 -5.1258 -5.1058 -5.1058 -5.0615 -5.0615 -4.7815 -4.7815 -4.6265 -4.6265 -4.1533 -4.1533 -4.0809 -4.0809 -4.0537 -4.0537 -3.9202 -3.9202 -3.8515 -3.8515 -3.7627 -3.7627 -3.3055 -3.3055 -3.2422 -3.2422 -3.1905 -3.1905 -2.9770 -2.9770 -2.8464 -2.8464 -2.8280 -2.8280 -2.8123 -2.8123 -2.7675 -2.7675 -2.7584 -2.7584 -2.7386 -2.7386 -2.6996 -2.6996 -2.6930 -2.6930 k = 0.3355 0.1937 0.5479 ( 7098 PWs) bands (ev): -23.9595 -23.9595 -23.1755 -23.1755 -23.1710 -23.1710 -23.1662 -23.1662 -22.8648 -22.8648 -22.8584 -22.8584 -14.7942 -14.7942 -14.5939 -14.5939 -14.5929 -14.5929 -7.1392 -7.1392 -5.8711 -5.8711 -5.8121 -5.8121 -5.7958 -5.7958 -5.1289 -5.1289 -5.1105 -5.1105 -5.0647 -5.0647 -4.7989 -4.7989 -4.6293 -4.6293 -4.1490 -4.1490 -4.0667 -4.0667 -4.0335 -4.0335 -3.9305 -3.9305 -3.8526 -3.8526 -3.7623 -3.7623 -3.3052 -3.3052 -3.2365 -3.2365 -3.1950 -3.1950 -2.9758 -2.9758 -2.8449 -2.8449 -2.8316 -2.8316 -2.8137 -2.8137 -2.7680 -2.7680 -2.7586 -2.7586 -2.7340 -2.7340 -2.6998 -2.6998 -2.6945 -2.6945 k = 0.3257 0.1880 0.5318 ( 7082 PWs) bands (ev): -23.9597 -23.9597 -23.1758 -23.1758 -23.1709 -23.1709 -23.1659 -23.1659 -22.8643 -22.8643 -22.8587 -22.8587 -14.7946 -14.7946 -14.5933 -14.5933 -14.5929 -14.5929 -7.1430 -7.1430 -5.8751 -5.8751 -5.8062 -5.8062 -5.7892 -5.7892 -5.1328 -5.1328 -5.1152 -5.1152 -5.0684 -5.0684 -4.8147 -4.8147 -4.6314 -4.6314 -4.1441 -4.1441 -4.0534 -4.0534 -4.0136 -4.0136 -3.9391 -3.9391 -3.8534 -3.8534 -3.7621 -3.7621 -3.3047 -3.3047 -3.2311 -3.2311 -3.1991 -3.1991 -2.9751 -2.9751 -2.8474 -2.8474 -2.8322 -2.8322 -2.8139 -2.8139 -2.7682 -2.7682 -2.7587 -2.7587 -2.7294 -2.7294 -2.7005 -2.7005 -2.6958 -2.6958 k = 0.3158 0.1823 0.5157 ( 7096 PWs) bands (ev): -23.9599 -23.9599 -23.1762 -23.1762 -23.1708 -23.1708 -23.1657 -23.1657 -22.8637 -22.8637 -22.8590 -22.8590 -14.7950 -14.7950 -14.5930 -14.5930 -14.5928 -14.5928 -7.1464 -7.1464 -5.8793 -5.8793 -5.8012 -5.8012 -5.7835 -5.7835 -5.1376 -5.1376 -5.1200 -5.1200 -5.0728 -5.0728 -4.8285 -4.8285 -4.6330 -4.6330 -4.1388 -4.1388 -4.0408 -4.0408 -3.9961 -3.9961 -3.9442 -3.9442 -3.8538 -3.8538 -3.7619 -3.7619 -3.3041 -3.3041 -3.2261 -3.2261 -3.2025 -3.2025 -2.9747 -2.9747 -2.8521 -2.8521 -2.8315 -2.8315 -2.8126 -2.8126 -2.7682 -2.7682 -2.7587 -2.7587 -2.7250 -2.7250 -2.7017 -2.7017 -2.6970 -2.6970 k = 0.3059 0.1766 0.4996 ( 7094 PWs) bands (ev): -23.9602 -23.9602 -23.1764 -23.1764 -23.1707 -23.1707 -23.1654 -23.1654 -22.8632 -22.8632 -22.8592 -22.8592 -14.7955 -14.7955 -14.5929 -14.5929 -14.5922 -14.5922 -7.1495 -7.1495 -5.8837 -5.8837 -5.7971 -5.7971 -5.7788 -5.7788 -5.1432 -5.1432 -5.1248 -5.1248 -5.0777 -5.0777 -4.8402 -4.8402 -4.6340 -4.6340 -4.1330 -4.1330 -4.0289 -4.0289 -3.9849 -3.9849 -3.9419 -3.9419 -3.8539 -3.8539 -3.7619 -3.7619 -3.3033 -3.3033 -3.2221 -3.2221 -3.2046 -3.2046 -2.9745 -2.9745 -2.8573 -2.8573 -2.8312 -2.8312 -2.8103 -2.8103 -2.7681 -2.7681 -2.7587 -2.7587 -2.7208 -2.7208 -2.7031 -2.7031 -2.6980 -2.6980 k = 0.2961 0.1709 0.4835 ( 7085 PWs) bands (ev): -23.9605 -23.9605 -23.1766 -23.1766 -23.1706 -23.1706 -23.1652 -23.1652 -22.8627 -22.8627 -22.8594 -22.8594 -14.7961 -14.7961 -14.5929 -14.5929 -14.5915 -14.5915 -7.1522 -7.1522 -5.8883 -5.8883 -5.7941 -5.7941 -5.7754 -5.7754 -5.1493 -5.1493 -5.1298 -5.1298 -5.0832 -5.0832 -4.8497 -4.8497 -4.6343 -4.6343 -4.1267 -4.1267 -4.0179 -4.0179 -3.9824 -3.9824 -3.9300 -3.9300 -3.8536 -3.8536 -3.7621 -3.7621 -3.3023 -3.3023 -3.2203 -3.2203 -3.2043 -3.2043 -2.9741 -2.9741 -2.8624 -2.8624 -2.8311 -2.8311 -2.8075 -2.8075 -2.7680 -2.7680 -2.7585 -2.7585 -2.7171 -2.7171 -2.7049 -2.7049 -2.6985 -2.6985 k = 0.2862 0.1652 0.4673 ( 7087 PWs) bands (ev): -23.9608 -23.9608 -23.1768 -23.1768 -23.1705 -23.1705 -23.1650 -23.1650 -22.8622 -22.8622 -22.8596 -22.8596 -14.7967 -14.7967 -14.5928 -14.5928 -14.5909 -14.5909 -7.1545 -7.1545 -5.8930 -5.8930 -5.7923 -5.7923 -5.7733 -5.7733 -5.1559 -5.1559 -5.1351 -5.1351 -5.0894 -5.0894 -4.8566 -4.8566 -4.6340 -4.6340 -4.1199 -4.1199 -4.0081 -4.0081 -3.9837 -3.9837 -3.9133 -3.9133 -3.8529 -3.8529 -3.7624 -3.7624 -3.3011 -3.3011 -3.2208 -3.2208 -3.2015 -3.2015 -2.9735 -2.9735 -2.8672 -2.8672 -2.8311 -2.8311 -2.8049 -2.8049 -2.7679 -2.7679 -2.7582 -2.7582 -2.7143 -2.7143 -2.7070 -2.7070 -2.6980 -2.6980 k = 0.2763 0.1595 0.4512 ( 7089 PWs) bands (ev): -23.9612 -23.9612 -23.1769 -23.1769 -23.1704 -23.1704 -23.1649 -23.1649 -22.8616 -22.8616 -22.8598 -22.8598 -14.7974 -14.7974 -14.5926 -14.5926 -14.5902 -14.5902 -7.1563 -7.1563 -5.8978 -5.8978 -5.7917 -5.7917 -5.7727 -5.7727 -5.1629 -5.1629 -5.1408 -5.1408 -5.0962 -5.0962 -4.8609 -4.8609 -4.6331 -4.6331 -4.1126 -4.1126 -4.0008 -4.0008 -3.9837 -3.9837 -3.8957 -3.8957 -3.8517 -3.8517 -3.7629 -3.7629 -3.2995 -3.2995 -3.2223 -3.2223 -3.1973 -3.1973 -2.9722 -2.9722 -2.8718 -2.8718 -2.8309 -2.8309 -2.8029 -2.8029 -2.7678 -2.7678 -2.7579 -2.7579 -2.7128 -2.7128 -2.7094 -2.7094 -2.6962 -2.6962 k = 0.2664 0.1538 0.4351 ( 7109 PWs) bands (ev): -23.9616 -23.9616 -23.1770 -23.1770 -23.1702 -23.1702 -23.1648 -23.1648 -22.8612 -22.8612 -22.8599 -22.8599 -14.7981 -14.7981 -14.5924 -14.5924 -14.5894 -14.5894 -7.1576 -7.1576 -5.9027 -5.9027 -5.7923 -5.7923 -5.7736 -5.7736 -5.1702 -5.1702 -5.1468 -5.1468 -5.1035 -5.1035 -4.8626 -4.8626 -4.6316 -4.6316 -4.1050 -4.1050 -3.9980 -3.9980 -3.9793 -3.9793 -3.8790 -3.8790 -3.8498 -3.8498 -3.7635 -3.7635 -3.2976 -3.2976 -3.2240 -3.2240 -3.1927 -3.1927 -2.9701 -2.9701 -2.8761 -2.8761 -2.8305 -2.8305 -2.8018 -2.8018 -2.7679 -2.7679 -2.7575 -2.7575 -2.7142 -2.7142 -2.7099 -2.7099 -2.6932 -2.6932 k = 0.2566 0.1481 0.4190 ( 7113 PWs) bands (ev): -23.9621 -23.9621 -23.1770 -23.1770 -23.1701 -23.1701 -23.1647 -23.1647 -22.8607 -22.8607 -22.8599 -22.8599 -14.7990 -14.7990 -14.5921 -14.5921 -14.5887 -14.5887 -7.1585 -7.1585 -5.9078 -5.9078 -5.7943 -5.7943 -5.7762 -5.7762 -5.1776 -5.1776 -5.1532 -5.1532 -5.1114 -5.1114 -4.8615 -4.8615 -4.6294 -4.6294 -4.0969 -4.0969 -3.9976 -3.9976 -3.9719 -3.9719 -3.8644 -3.8644 -3.8466 -3.8466 -3.7642 -3.7642 -3.2953 -3.2953 -3.2256 -3.2256 -3.1879 -3.1879 -2.9668 -2.9668 -2.8802 -2.8802 -2.8297 -2.8297 -2.8017 -2.8017 -2.7680 -2.7680 -2.7572 -2.7572 -2.7182 -2.7182 -2.7085 -2.7085 -2.6895 -2.6895 k = 0.2467 0.1424 0.4029 ( 7125 PWs) bands (ev): -23.9626 -23.9626 -23.1770 -23.1770 -23.1700 -23.1700 -23.1646 -23.1646 -22.8602 -22.8602 -22.8600 -22.8600 -14.7999 -14.7999 -14.5918 -14.5918 -14.5879 -14.5879 -7.1589 -7.1589 -5.9128 -5.9128 -5.7976 -5.7976 -5.7803 -5.7803 -5.1852 -5.1852 -5.1600 -5.1600 -5.1198 -5.1198 -4.8578 -4.8578 -4.6266 -4.6266 -4.0886 -4.0886 -3.9973 -3.9973 -3.9639 -3.9639 -3.8545 -3.8545 -3.8400 -3.8400 -3.7651 -3.7651 -3.2926 -3.2926 -3.2268 -3.2268 -3.1833 -3.1833 -2.9621 -2.9621 -2.8840 -2.8840 -2.8286 -2.8286 -2.8028 -2.8028 -2.7682 -2.7682 -2.7568 -2.7568 -2.7231 -2.7231 -2.7066 -2.7066 -2.6856 -2.6856 k = 0.2368 0.1367 0.3868 ( 7125 PWs) bands (ev): -23.9631 -23.9631 -23.1768 -23.1768 -23.1699 -23.1699 -23.1646 -23.1646 -22.8600 -22.8600 -22.8598 -22.8598 -14.8008 -14.8008 -14.5914 -14.5914 -14.5872 -14.5872 -7.1588 -7.1588 -5.9180 -5.9180 -5.8022 -5.8022 -5.7859 -5.7859 -5.1929 -5.1929 -5.1671 -5.1671 -5.1286 -5.1286 -4.8515 -4.8515 -4.6233 -4.6233 -4.0801 -4.0801 -3.9961 -3.9961 -3.9560 -3.9560 -3.8494 -3.8494 -3.8299 -3.8299 -3.7660 -3.7660 -3.2894 -3.2894 -3.2275 -3.2275 -3.1787 -3.1787 -2.9559 -2.9559 -2.8875 -2.8875 -2.8273 -2.8273 -2.8049 -2.8049 -2.7686 -2.7686 -2.7565 -2.7565 -2.7286 -2.7286 -2.7040 -2.7040 -2.6815 -2.6815 k = 0.2270 0.1310 0.3706 ( 7129 PWs) bands (ev): -23.9636 -23.9636 -23.1767 -23.1767 -23.1698 -23.1698 -23.1646 -23.1646 -22.8600 -22.8600 -22.8594 -22.8594 -14.8018 -14.8018 -14.5910 -14.5910 -14.5864 -14.5864 -7.1582 -7.1582 -5.9231 -5.9231 -5.8081 -5.8081 -5.7928 -5.7928 -5.2006 -5.2006 -5.1745 -5.1745 -5.1378 -5.1378 -4.8428 -4.8428 -4.6194 -4.6194 -4.0714 -4.0714 -3.9940 -3.9940 -3.9485 -3.9485 -3.8461 -3.8461 -3.8198 -3.8198 -3.7670 -3.7670 -3.2858 -3.2858 -3.2277 -3.2277 -3.1743 -3.1743 -2.9482 -2.9482 -2.8908 -2.8908 -2.8257 -2.8257 -2.8081 -2.8081 -2.7690 -2.7690 -2.7564 -2.7564 -2.7349 -2.7349 -2.7009 -2.7009 -2.6773 -2.6773 k = 0.2171 0.1253 0.3545 ( 7137 PWs) bands (ev): -23.9642 -23.9642 -23.1764 -23.1764 -23.1697 -23.1697 -23.1646 -23.1646 -22.8599 -22.8599 -22.8590 -22.8590 -14.8029 -14.8029 -14.5906 -14.5906 -14.5855 -14.5855 -7.1571 -7.1571 -5.9282 -5.9282 -5.8153 -5.8153 -5.8010 -5.8010 -5.2083 -5.2083 -5.1821 -5.1821 -5.1473 -5.1473 -4.8318 -4.8318 -4.6150 -4.6150 -4.0626 -4.0626 -3.9907 -3.9907 -3.9416 -3.9416 -3.8431 -3.8431 -3.8111 -3.8111 -3.7680 -3.7680 -3.2816 -3.2816 -3.2273 -3.2273 -3.1701 -3.1701 -2.9391 -2.9391 -2.8935 -2.8935 -2.8239 -2.8239 -2.8121 -2.8121 -2.7695 -2.7695 -2.7565 -2.7565 -2.7417 -2.7417 -2.6974 -2.6974 -2.6733 -2.6733 k = 0.2072 0.1196 0.3384 ( 7137 PWs) bands (ev): -23.9648 -23.9648 -23.1762 -23.1762 -23.1696 -23.1696 -23.1647 -23.1647 -22.8598 -22.8598 -22.8586 -22.8586 -14.8040 -14.8040 -14.5901 -14.5901 -14.5847 -14.5847 -7.1556 -7.1556 -5.9333 -5.9333 -5.8236 -5.8236 -5.8102 -5.8102 -5.2160 -5.2160 -5.1900 -5.1900 -5.1571 -5.1571 -4.8187 -4.8187 -4.6100 -4.6100 -4.0538 -4.0538 -3.9865 -3.9865 -3.9352 -3.9352 -3.8401 -3.8401 -3.8042 -3.8042 -3.7689 -3.7689 -3.2770 -3.2770 -3.2264 -3.2264 -3.1662 -3.1662 -2.9294 -2.9294 -2.8951 -2.8951 -2.8222 -2.8222 -2.8167 -2.8167 -2.7701 -2.7701 -2.7572 -2.7572 -2.7486 -2.7486 -2.6936 -2.6936 -2.6692 -2.6692 k = 0.1974 0.1140 0.3223 ( 7139 PWs) bands (ev): -23.9654 -23.9654 -23.1758 -23.1758 -23.1695 -23.1695 -23.1648 -23.1648 -22.8596 -22.8596 -22.8583 -22.8583 -14.8051 -14.8051 -14.5895 -14.5895 -14.5839 -14.5839 -7.1537 -7.1537 -5.9384 -5.9384 -5.8329 -5.8329 -5.8202 -5.8202 -5.2237 -5.2237 -5.1981 -5.1981 -5.1670 -5.1670 -4.8038 -4.8038 -4.6046 -4.6046 -4.0451 -4.0451 -3.9814 -3.9814 -3.9294 -3.9294 -3.8370 -3.8370 -3.7991 -3.7991 -3.7698 -3.7698 -3.2719 -3.2719 -3.2249 -3.2249 -3.1624 -3.1624 -2.9209 -2.9209 -2.8937 -2.8937 -2.8237 -2.8237 -2.8184 -2.8184 -2.7707 -2.7707 -2.7606 -2.7606 -2.7537 -2.7537 -2.6895 -2.6895 -2.6653 -2.6653 k = 0.1875 0.1083 0.3062 ( 7139 PWs) bands (ev): -23.9660 -23.9660 -23.1755 -23.1755 -23.1694 -23.1694 -23.1649 -23.1649 -22.8595 -22.8595 -22.8580 -22.8580 -14.8062 -14.8062 -14.5889 -14.5889 -14.5831 -14.5831 -7.1513 -7.1513 -5.9434 -5.9434 -5.8432 -5.8432 -5.8308 -5.8308 -5.2312 -5.2312 -5.2064 -5.2064 -5.1770 -5.1770 -4.7873 -4.7873 -4.5988 -4.5988 -4.0365 -4.0365 -3.9756 -3.9756 -3.9242 -3.9242 -3.8339 -3.8339 -3.7957 -3.7957 -3.7704 -3.7704 -3.2663 -3.2663 -3.2228 -3.2228 -3.1589 -3.1589 -2.9169 -2.9169 -2.8862 -2.8862 -2.8295 -2.8295 -2.8164 -2.8164 -2.7713 -2.7713 -2.7682 -2.7682 -2.7554 -2.7554 -2.6854 -2.6854 -2.6615 -2.6615 k = 0.1776 0.1026 0.2901 ( 7143 PWs) bands (ev): -23.9667 -23.9667 -23.1751 -23.1751 -23.1693 -23.1693 -23.1651 -23.1651 -22.8593 -22.8593 -22.8577 -22.8577 -14.8074 -14.8074 -14.5883 -14.5883 -14.5823 -14.5823 -7.1486 -7.1486 -5.9483 -5.9483 -5.8543 -5.8543 -5.8419 -5.8419 -5.2386 -5.2386 -5.2147 -5.2147 -5.1870 -5.1870 -4.7695 -4.7695 -4.5926 -4.5926 -4.0280 -4.0280 -3.9692 -3.9692 -3.9197 -3.9197 -3.8307 -3.8307 -3.7939 -3.7939 -3.7710 -3.7710 -3.2603 -3.2603 -3.2201 -3.2201 -3.1556 -3.1556 -2.9171 -2.9171 -2.8732 -2.8732 -2.8360 -2.8360 -2.8140 -2.8140 -2.7775 -2.7775 -2.7718 -2.7718 -2.7562 -2.7562 -2.6811 -2.6811 -2.6578 -2.6578 k = 0.1678 0.0969 0.2740 ( 7133 PWs) bands (ev): -23.9673 -23.9673 -23.1746 -23.1746 -23.1692 -23.1692 -23.1653 -23.1653 -22.8590 -22.8590 -22.8574 -22.8574 -14.8086 -14.8086 -14.5877 -14.5877 -14.5815 -14.5815 -7.1456 -7.1456 -5.9531 -5.9531 -5.8659 -5.8659 -5.8534 -5.8534 -5.2458 -5.2458 -5.2231 -5.2231 -5.1970 -5.1970 -4.7506 -4.7506 -4.5861 -4.5861 -4.0198 -4.0198 -3.9625 -3.9625 -3.9158 -3.9158 -3.8275 -3.8275 -3.7934 -3.7934 -3.7713 -3.7713 -3.2538 -3.2538 -3.2168 -3.2168 -3.1525 -3.1525 -2.9190 -2.9190 -2.8575 -2.8575 -2.8429 -2.8429 -2.8114 -2.8114 -2.7873 -2.7873 -2.7725 -2.7725 -2.7570 -2.7570 -2.6770 -2.6770 -2.6542 -2.6542 k = 0.1579 0.0912 0.2578 ( 7141 PWs) bands (ev): -23.9680 -23.9680 -23.1741 -23.1741 -23.1691 -23.1691 -23.1655 -23.1655 -22.8588 -22.8588 -22.8572 -22.8572 -14.8098 -14.8098 -14.5871 -14.5871 -14.5807 -14.5807 -7.1423 -7.1423 -5.9578 -5.9578 -5.8778 -5.8778 -5.8652 -5.8652 -5.2528 -5.2528 -5.2315 -5.2315 -5.2067 -5.2067 -4.7308 -4.7308 -4.5794 -4.5794 -4.0119 -4.0119 -3.9557 -3.9557 -3.9125 -3.9125 -3.8243 -3.8243 -3.7939 -3.7939 -3.7716 -3.7716 -3.2470 -3.2470 -3.2128 -3.2128 -3.1497 -3.1497 -2.9217 -2.9217 -2.8509 -2.8509 -2.8395 -2.8395 -2.8088 -2.8088 -2.7978 -2.7978 -2.7731 -2.7731 -2.7578 -2.7578 -2.6729 -2.6729 -2.6507 -2.6507 k = 0.1480 0.0855 0.2417 ( 7129 PWs) bands (ev): -23.9686 -23.9686 -23.1737 -23.1737 -23.1690 -23.1690 -23.1657 -23.1657 -22.8585 -22.8585 -22.8570 -22.8570 -14.8110 -14.8110 -14.5864 -14.5864 -14.5799 -14.5799 -7.1387 -7.1387 -5.9623 -5.9623 -5.8899 -5.8899 -5.8771 -5.8771 -5.2596 -5.2596 -5.2398 -5.2398 -5.2162 -5.2162 -4.7106 -4.7106 -4.5725 -4.5725 -4.0044 -4.0044 -3.9489 -3.9489 -3.9097 -3.9097 -3.8211 -3.8211 -3.7950 -3.7950 -3.7717 -3.7717 -3.2399 -3.2399 -3.2082 -3.2082 -3.1471 -3.1471 -2.9246 -2.9246 -2.8583 -2.8583 -2.8216 -2.8216 -2.8091 -2.8091 -2.8058 -2.8058 -2.7736 -2.7736 -2.7586 -2.7586 -2.6689 -2.6689 -2.6474 -2.6474 k = 0.1382 0.0798 0.2256 ( 7129 PWs) bands (ev): -23.9692 -23.9692 -23.1732 -23.1732 -23.1689 -23.1689 -23.1659 -23.1659 -22.8583 -22.8583 -22.8567 -22.8567 -14.8122 -14.8122 -14.5858 -14.5858 -14.5791 -14.5791 -7.1350 -7.1350 -5.9666 -5.9666 -5.9020 -5.9020 -5.8889 -5.8889 -5.2661 -5.2661 -5.2480 -5.2480 -5.2255 -5.2255 -4.6900 -4.6900 -4.5655 -4.5655 -3.9973 -3.9973 -3.9424 -3.9424 -3.9074 -3.9074 -3.8181 -3.8181 -3.7963 -3.7963 -3.7718 -3.7718 -3.2326 -3.2326 -3.2030 -3.2030 -3.1446 -3.1446 -2.9276 -2.9276 -2.8662 -2.8662 -2.8202 -2.8202 -2.8036 -2.8036 -2.8034 -2.8034 -2.7740 -2.7740 -2.7593 -2.7593 -2.6651 -2.6651 -2.6443 -2.6443 k = 0.1283 0.0741 0.2095 ( 7121 PWs) bands (ev): -23.9698 -23.9698 -23.1727 -23.1727 -23.1688 -23.1688 -23.1661 -23.1661 -22.8580 -22.8580 -22.8566 -22.8566 -14.8133 -14.8133 -14.5851 -14.5851 -14.5784 -14.5784 -7.1311 -7.1311 -5.9707 -5.9707 -5.9139 -5.9139 -5.9007 -5.9007 -5.2723 -5.2723 -5.2561 -5.2561 -5.2343 -5.2343 -4.6694 -4.6694 -4.5584 -4.5584 -3.9908 -3.9908 -3.9364 -3.9364 -3.9056 -3.9056 -3.8153 -3.8153 -3.7977 -3.7977 -3.7717 -3.7717 -3.2251 -3.2251 -3.1973 -3.1973 -3.1424 -3.1424 -2.9305 -2.9305 -2.8742 -2.8742 -2.8318 -2.8318 -2.8011 -2.8011 -2.7862 -2.7862 -2.7741 -2.7741 -2.7593 -2.7593 -2.6615 -2.6615 -2.6413 -2.6413 k = 0.1184 0.0684 0.1934 ( 7117 PWs) bands (ev): -23.9704 -23.9704 -23.1722 -23.1722 -23.1687 -23.1687 -23.1663 -23.1663 -22.8577 -22.8577 -22.8564 -22.8564 -14.8144 -14.8144 -14.5845 -14.5845 -14.5777 -14.5777 -7.1272 -7.1272 -5.9747 -5.9747 -5.9255 -5.9255 -5.9122 -5.9122 -5.2783 -5.2783 -5.2639 -5.2639 -5.2426 -5.2426 -4.6490 -4.6490 -4.5515 -4.5515 -3.9849 -3.9849 -3.9311 -3.9311 -3.9042 -3.9042 -3.8127 -3.8127 -3.7987 -3.7987 -3.7715 -3.7715 -3.2175 -3.2175 -3.1909 -3.1909 -3.1403 -3.1403 -2.9335 -2.9335 -2.8823 -2.8823 -2.8437 -2.8437 -2.7988 -2.7988 -2.7768 -2.7768 -2.7703 -2.7703 -2.7556 -2.7556 -2.6580 -2.6580 -2.6385 -2.6385 k = 0.1086 0.0627 0.1773 ( 7123 PWs) bands (ev): -23.9710 -23.9710 -23.1717 -23.1717 -23.1687 -23.1687 -23.1665 -23.1665 -22.8574 -22.8574 -22.8563 -22.8563 -14.8155 -14.8155 -14.5839 -14.5839 -14.5771 -14.5771 -7.1233 -7.1233 -5.9784 -5.9784 -5.9365 -5.9365 -5.9232 -5.9232 -5.2839 -5.2839 -5.2714 -5.2714 -5.2505 -5.2505 -4.6291 -4.6291 -4.5447 -4.5447 -3.9797 -3.9797 -3.9266 -3.9266 -3.9032 -3.9032 -3.8105 -3.8105 -3.7993 -3.7993 -3.7711 -3.7711 -3.2099 -3.2099 -3.1841 -3.1841 -3.1384 -3.1384 -2.9363 -2.9363 -2.8904 -2.8904 -2.8557 -2.8557 -2.7968 -2.7968 -2.7762 -2.7762 -2.7672 -2.7672 -2.7430 -2.7430 -2.6547 -2.6547 -2.6358 -2.6358 k = 0.0987 0.0570 0.1612 ( 7125 PWs) bands (ev): -23.9715 -23.9715 -23.1712 -23.1712 -23.1686 -23.1686 -23.1668 -23.1668 -22.8572 -22.8572 -22.8561 -22.8561 -14.8165 -14.8165 -14.5833 -14.5833 -14.5765 -14.5765 -7.1194 -7.1194 -5.9819 -5.9819 -5.9471 -5.9471 -5.9338 -5.9338 -5.2891 -5.2891 -5.2785 -5.2785 -5.2578 -5.2578 -4.6098 -4.6098 -4.5381 -4.5381 -3.9753 -3.9753 -3.9229 -3.9229 -3.9026 -3.9026 -3.8085 -3.8085 -3.7992 -3.7992 -3.7706 -3.7706 -3.2024 -3.2024 -3.1769 -3.1769 -3.1365 -3.1365 -2.9391 -2.9391 -2.8985 -2.8985 -2.8676 -2.8676 -2.7949 -2.7949 -2.7763 -2.7763 -2.7673 -2.7673 -2.7272 -2.7272 -2.6515 -2.6515 -2.6333 -2.6333 k = 0.0888 0.0513 0.1450 ( 7113 PWs) bands (ev): -23.9720 -23.9720 -23.1708 -23.1708 -23.1685 -23.1685 -23.1669 -23.1669 -22.8569 -22.8569 -22.8560 -22.8560 -14.8174 -14.8174 -14.5828 -14.5828 -14.5759 -14.5759 -7.1156 -7.1156 -5.9852 -5.9852 -5.9569 -5.9569 -5.9436 -5.9436 -5.2940 -5.2940 -5.2852 -5.2852 -5.2644 -5.2644 -4.5914 -4.5914 -4.5319 -4.5319 -3.9716 -3.9716 -3.9199 -3.9199 -3.9023 -3.9023 -3.8066 -3.8066 -3.7986 -3.7986 -3.7699 -3.7699 -3.1950 -3.1950 -3.1695 -3.1695 -3.1348 -3.1348 -2.9418 -2.9418 -2.9064 -2.9064 -2.8795 -2.8795 -2.7934 -2.7934 -2.7763 -2.7763 -2.7681 -2.7681 -2.7117 -2.7117 -2.6485 -2.6485 -2.6311 -2.6311 k = 0.0789 0.0456 0.1289 ( 7113 PWs) bands (ev): -23.9725 -23.9725 -23.1704 -23.1704 -23.1684 -23.1684 -23.1671 -23.1671 -22.8566 -22.8566 -22.8559 -22.8559 -14.8182 -14.8182 -14.5823 -14.5823 -14.5754 -14.5754 -7.1121 -7.1121 -5.9883 -5.9883 -5.9660 -5.9660 -5.9526 -5.9526 -5.2984 -5.2984 -5.2914 -5.2914 -5.2704 -5.2704 -4.5742 -4.5742 -4.5260 -4.5260 -3.9687 -3.9687 -3.9175 -3.9175 -3.9025 -3.9025 -3.8048 -3.8048 -3.7977 -3.7977 -3.7690 -3.7690 -3.1878 -3.1878 -3.1619 -3.1619 -3.1332 -3.1332 -2.9444 -2.9444 -2.9140 -2.9140 -2.8910 -2.8910 -2.7922 -2.7922 -2.7762 -2.7762 -2.7691 -2.7691 -2.6974 -2.6974 -2.6454 -2.6454 -2.6290 -2.6290 k = 0.0691 0.0399 0.1128 ( 7127 PWs) bands (ev): -23.9729 -23.9729 -23.1701 -23.1701 -23.1683 -23.1683 -23.1673 -23.1673 -22.8564 -22.8564 -22.8558 -22.8558 -14.8190 -14.8190 -14.5818 -14.5818 -14.5749 -14.5749 -7.1088 -7.1088 -5.9911 -5.9911 -5.9742 -5.9742 -5.9608 -5.9608 -5.3025 -5.3025 -5.2970 -5.2970 -5.2758 -5.2758 -4.5583 -4.5583 -4.5207 -4.5207 -3.9666 -3.9666 -3.9155 -3.9155 -3.9031 -3.9031 -3.8029 -3.8029 -3.7967 -3.7967 -3.7681 -3.7681 -3.1809 -3.1809 -3.1544 -3.1544 -3.1315 -3.1315 -2.9469 -2.9469 -2.9213 -2.9213 -2.9021 -2.9021 -2.7913 -2.7913 -2.7759 -2.7759 -2.7700 -2.7700 -2.6847 -2.6847 -2.6423 -2.6423 -2.6272 -2.6272 k = 0.0592 0.0342 0.0967 ( 7121 PWs) bands (ev): -23.9733 -23.9733 -23.1699 -23.1699 -23.1682 -23.1682 -23.1674 -23.1674 -22.8562 -22.8562 -22.8558 -22.8558 -14.8197 -14.8197 -14.5814 -14.5814 -14.5745 -14.5745 -7.1057 -7.1057 -5.9937 -5.9937 -5.9815 -5.9815 -5.9678 -5.9678 -5.3060 -5.3060 -5.3019 -5.3019 -5.2804 -5.2804 -4.5440 -4.5440 -4.5158 -4.5158 -3.9651 -3.9651 -3.9138 -3.9138 -3.9040 -3.9040 -3.8009 -3.8009 -3.7958 -3.7958 -3.7670 -3.7670 -3.1746 -3.1746 -3.1472 -3.1472 -3.1299 -3.1299 -2.9495 -2.9495 -2.9279 -2.9279 -2.9124 -2.9124 -2.7907 -2.7907 -2.7755 -2.7755 -2.7709 -2.7709 -2.6740 -2.6740 -2.6389 -2.6389 -2.6256 -2.6256 k = 0.0493 0.0285 0.0806 ( 7115 PWs) bands (ev): -23.9736 -23.9736 -23.1697 -23.1697 -23.1681 -23.1681 -23.1675 -23.1675 -22.8560 -22.8560 -22.8557 -22.8557 -14.8203 -14.8203 -14.5810 -14.5810 -14.5741 -14.5741 -7.1031 -7.1031 -5.9961 -5.9961 -5.9878 -5.9878 -5.9738 -5.9738 -5.3091 -5.3091 -5.3062 -5.3062 -5.2844 -5.2844 -4.5316 -4.5316 -4.5117 -4.5117 -3.9643 -3.9643 -3.9124 -3.9124 -3.9051 -3.9051 -3.7989 -3.7989 -3.7951 -3.7951 -3.7659 -3.7659 -3.1689 -3.1689 -3.1404 -3.1404 -3.1282 -3.1282 -2.9522 -2.9522 -2.9336 -2.9336 -2.9218 -2.9218 -2.7904 -2.7904 -2.7751 -2.7751 -2.7717 -2.7717 -2.6656 -2.6656 -2.6351 -2.6351 -2.6242 -2.6242 k = 0.0395 0.0228 0.0645 ( 7125 PWs) bands (ev): -23.9739 -23.9739 -23.1696 -23.1696 -23.1680 -23.1680 -23.1676 -23.1676 -22.8559 -22.8559 -22.8557 -22.8557 -14.8208 -14.8208 -14.5807 -14.5807 -14.5738 -14.5738 -7.1008 -7.1008 -5.9982 -5.9982 -5.9931 -5.9931 -5.9785 -5.9785 -5.3116 -5.3116 -5.3098 -5.3098 -5.2876 -5.2876 -4.5211 -4.5211 -4.5081 -4.5081 -3.9638 -3.9638 -3.9111 -3.9111 -3.9062 -3.9062 -3.7971 -3.7971 -3.7944 -3.7944 -3.7649 -3.7649 -3.1640 -3.1640 -3.1344 -3.1344 -3.1265 -3.1265 -2.9552 -2.9552 -2.9383 -2.9383 -2.9299 -2.9299 -2.7902 -2.7902 -2.7746 -2.7746 -2.7724 -2.7724 -2.6595 -2.6595 -2.6310 -2.6310 -2.6231 -2.6231 k = 0.0296 0.0171 0.0483 ( 7131 PWs) bands (ev): -23.9741 -23.9741 -23.1695 -23.1695 -23.1679 -23.1679 -23.1677 -23.1677 -22.8558 -22.8558 -22.8556 -22.8556 -14.8212 -14.8212 -14.5805 -14.5805 -14.5736 -14.5736 -7.0990 -7.0990 -6.0001 -6.0001 -5.9973 -5.9973 -5.9821 -5.9821 -5.3137 -5.3137 -5.3126 -5.3126 -5.2901 -5.2901 -4.5127 -4.5127 -4.5054 -4.5054 -3.9637 -3.9637 -3.9101 -3.9101 -3.9073 -3.9073 -3.7956 -3.7956 -3.7940 -3.7940 -3.7640 -3.7640 -3.1602 -3.1602 -3.1293 -3.1293 -3.1248 -3.1248 -2.9583 -2.9583 -2.9416 -2.9416 -2.9365 -2.9365 -2.7902 -2.7902 -2.7742 -2.7742 -2.7729 -2.7729 -2.6555 -2.6555 -2.6271 -2.6271 -2.6222 -2.6222 k = 0.0197 0.0114 0.0322 ( 7133 PWs) bands (ev): -23.9742 -23.9742 -23.1694 -23.1694 -23.1678 -23.1678 -23.1677 -23.1677 -22.8557 -22.8557 -22.8556 -22.8556 -14.8214 -14.8214 -14.5803 -14.5803 -14.5734 -14.5734 -7.0977 -7.0977 -6.0015 -6.0015 -6.0003 -6.0003 -5.9846 -5.9846 -5.3151 -5.3151 -5.3147 -5.3147 -5.2919 -5.2919 -4.5066 -4.5066 -4.5033 -4.5033 -3.9636 -3.9636 -3.9094 -3.9094 -3.9081 -3.9081 -3.7944 -3.7944 -3.7937 -3.7937 -3.7633 -3.7633 -3.1575 -3.1575 -3.1254 -3.1254 -3.1234 -3.1234 -2.9611 -2.9611 -2.9438 -2.9438 -2.9414 -2.9414 -2.7902 -2.7902 -2.7738 -2.7738 -2.7733 -2.7733 -2.6529 -2.6529 -2.6239 -2.6239 -2.6215 -2.6215 k = 0.0099 0.0057 0.0161 ( 7119 PWs) bands (ev): -23.9743 -23.9743 -23.1694 -23.1694 -23.1678 -23.1678 -23.1677 -23.1677 -22.8556 -22.8556 -22.8556 -22.8556 -14.8216 -14.8216 -14.5802 -14.5802 -14.5733 -14.5733 -7.0969 -7.0969 -6.0024 -6.0024 -6.0021 -6.0021 -5.9860 -5.9860 -5.3160 -5.3160 -5.3159 -5.3159 -5.2930 -5.2930 -4.5029 -4.5029 -4.5021 -4.5021 -3.9637 -3.9637 -3.9089 -3.9089 -3.9086 -3.9086 -3.7937 -3.7937 -3.7935 -3.7935 -3.7628 -3.7628 -3.1559 -3.1559 -3.1229 -3.1229 -3.1224 -3.1224 -2.9631 -2.9631 -2.9450 -2.9450 -2.9444 -2.9444 -2.7902 -2.7902 -2.7736 -2.7736 -2.7735 -2.7735 -2.6516 -2.6516 -2.6217 -2.6217 -2.6211 -2.6211 k = 0.0000 0.0000 0.0000 ( 7119 PWs) bands (ev): -23.9744 -23.9744 -23.1694 -23.1694 -23.1678 -23.1678 -23.1678 -23.1678 -22.8556 -22.8556 -22.8556 -22.8556 -14.8217 -14.8217 -14.5802 -14.5802 -14.5733 -14.5733 -7.0967 -7.0967 -6.0027 -6.0027 -6.0027 -6.0027 -5.9865 -5.9865 -5.3163 -5.3163 -5.3163 -5.3163 -5.2933 -5.2933 -4.5017 -4.5017 -4.5017 -4.5017 -3.9637 -3.9637 -3.9088 -3.9088 -3.9088 -3.9088 -3.7934 -3.7934 -3.7934 -3.7934 -3.7627 -3.7627 -3.1553 -3.1553 -3.1220 -3.1220 -3.1220 -3.1220 -2.9638 -2.9638 -2.9454 -2.9454 -2.9454 -2.9454 -2.7902 -2.7902 -2.7736 -2.7736 -2.7736 -2.7736 -2.6512 -2.6512 -2.6210 -2.6210 -2.6210 -2.6210 k = 0.0000 0.0000 0.0000 ( 7119 PWs) bands (ev): -23.9744 -23.9744 -23.1694 -23.1694 -23.1678 -23.1678 -23.1678 -23.1678 -22.8556 -22.8556 -22.8556 -22.8556 -14.8217 -14.8217 -14.5802 -14.5802 -14.5733 -14.5733 -7.0967 -7.0967 -6.0027 -6.0027 -6.0027 -6.0027 -5.9865 -5.9865 -5.3163 -5.3163 -5.3163 -5.3163 -5.2933 -5.2933 -4.5017 -4.5017 -4.5017 -4.5017 -3.9637 -3.9637 -3.9088 -3.9088 -3.9088 -3.9088 -3.7934 -3.7934 -3.7934 -3.7934 -3.7627 -3.7627 -3.1553 -3.1553 -3.1220 -3.1220 -3.1220 -3.1220 -2.9638 -2.9638 -2.9454 -2.9454 -2.9454 -2.9454 -2.7902 -2.7902 -2.7736 -2.7736 -2.7736 -2.7736 -2.6512 -2.6512 -2.6210 -2.6210 -2.6210 -2.6210 k = 0.0161 0.0093 0.0066 ( 7119 PWs) bands (ev): -23.9743 -23.9743 -23.1694 -23.1694 -23.1678 -23.1678 -23.1677 -23.1677 -22.8556 -22.8556 -22.8556 -22.8556 -14.8216 -14.8216 -14.5802 -14.5802 -14.5733 -14.5733 -7.0969 -7.0969 -6.0023 -6.0023 -6.0022 -6.0022 -5.9860 -5.9860 -5.3160 -5.3160 -5.3159 -5.3159 -5.2930 -5.2930 -4.5025 -4.5025 -4.5025 -4.5025 -3.9637 -3.9637 -3.9088 -3.9088 -3.9087 -3.9087 -3.7937 -3.7937 -3.7935 -3.7935 -3.7628 -3.7628 -3.1559 -3.1559 -3.1229 -3.1229 -3.1224 -3.1224 -2.9631 -2.9631 -2.9450 -2.9450 -2.9443 -2.9443 -2.7902 -2.7902 -2.7736 -2.7736 -2.7735 -2.7735 -2.6516 -2.6516 -2.6218 -2.6218 -2.6211 -2.6211 k = 0.0323 0.0186 0.0132 ( 7143 PWs) bands (ev): -23.9742 -23.9742 -23.1694 -23.1694 -23.1678 -23.1678 -23.1677 -23.1677 -22.8556 -22.8556 -22.8556 -22.8556 -14.8214 -14.8214 -14.5803 -14.5803 -14.5734 -14.5734 -7.0977 -7.0977 -6.0010 -6.0010 -6.0008 -6.0008 -5.9846 -5.9846 -5.3151 -5.3151 -5.3146 -5.3146 -5.2919 -5.2919 -4.5050 -4.5050 -4.5050 -4.5050 -3.9636 -3.9636 -3.9088 -3.9088 -3.9087 -3.9087 -3.7945 -3.7945 -3.7936 -3.7936 -3.7633 -3.7633 -3.1575 -3.1575 -3.1253 -3.1253 -3.1235 -3.1235 -2.9611 -2.9611 -2.9438 -2.9438 -2.9413 -2.9413 -2.7902 -2.7902 -2.7738 -2.7738 -2.7733 -2.7733 -2.6529 -2.6529 -2.6239 -2.6239 -2.6215 -2.6215 k = 0.0484 0.0279 0.0198 ( 7137 PWs) bands (ev): -23.9741 -23.9741 -23.1695 -23.1695 -23.1679 -23.1679 -23.1677 -23.1677 -22.8557 -22.8557 -22.8557 -22.8557 -14.8212 -14.8212 -14.5805 -14.5805 -14.5736 -14.5736 -7.0991 -7.0991 -5.9988 -5.9988 -5.9983 -5.9983 -5.9823 -5.9823 -5.3137 -5.3137 -5.3126 -5.3126 -5.2901 -5.2901 -4.5092 -4.5092 -4.5090 -4.5090 -3.9635 -3.9635 -3.9088 -3.9088 -3.9086 -3.9086 -3.7957 -3.7957 -3.7939 -3.7939 -3.7640 -3.7640 -3.1602 -3.1602 -3.1291 -3.1291 -3.1250 -3.1250 -2.9587 -2.9587 -2.9414 -2.9414 -2.9364 -2.9364 -2.7902 -2.7902 -2.7741 -2.7741 -2.7730 -2.7730 -2.6555 -2.6555 -2.6272 -2.6272 -2.6221 -2.6221 k = 0.0645 0.0372 0.0263 ( 7122 PWs) bands (ev): -23.9739 -23.9739 -23.1696 -23.1696 -23.1680 -23.1680 -23.1676 -23.1676 -22.8558 -22.8558 -22.8558 -22.8558 -14.8208 -14.8208 -14.5807 -14.5807 -14.5738 -14.5738 -7.1009 -7.1009 -5.9958 -5.9958 -5.9950 -5.9950 -5.9790 -5.9790 -5.3118 -5.3118 -5.3097 -5.3097 -5.2876 -5.2876 -4.5149 -4.5149 -4.5146 -4.5146 -3.9635 -3.9635 -3.9089 -3.9089 -3.9086 -3.9086 -3.7973 -3.7973 -3.7943 -3.7943 -3.7648 -3.7648 -3.1640 -3.1640 -3.1341 -3.1341 -3.1267 -3.1267 -2.9564 -2.9564 -2.9371 -2.9371 -2.9300 -2.9300 -2.7902 -2.7902 -2.7745 -2.7745 -2.7726 -2.7726 -2.6597 -2.6597 -2.6311 -2.6311 -2.6229 -2.6229 k = 0.0806 0.0466 0.0329 ( 7114 PWs) bands (ev): -23.9736 -23.9736 -23.1697 -23.1697 -23.1681 -23.1681 -23.1675 -23.1675 -22.8559 -22.8559 -22.8559 -22.8559 -14.8203 -14.8203 -14.5810 -14.5810 -14.5741 -14.5741 -7.1032 -7.1032 -5.9919 -5.9919 -5.9907 -5.9907 -5.9749 -5.9749 -5.3092 -5.3092 -5.3061 -5.3061 -5.2843 -5.2843 -4.5221 -4.5221 -4.5216 -4.5216 -3.9635 -3.9635 -3.9091 -3.9091 -3.9087 -3.9087 -3.7992 -3.7992 -3.7949 -3.7949 -3.7658 -3.7658 -3.1688 -3.1688 -3.1400 -3.1400 -3.1286 -3.1286 -2.9549 -2.9549 -2.9308 -2.9308 -2.9222 -2.9222 -2.7902 -2.7902 -2.7749 -2.7749 -2.7720 -2.7720 -2.6659 -2.6659 -2.6351 -2.6351 -2.6240 -2.6240 k = 0.0968 0.0559 0.0395 ( 7114 PWs) bands (ev): -23.9733 -23.9733 -23.1700 -23.1700 -23.1681 -23.1681 -23.1674 -23.1674 -22.8560 -22.8560 -22.8560 -22.8560 -14.8197 -14.8197 -14.5814 -14.5814 -14.5745 -14.5745 -7.1059 -7.1059 -5.9872 -5.9872 -5.9856 -5.9856 -5.9699 -5.9699 -5.3062 -5.3062 -5.3019 -5.3019 -5.2803 -5.2803 -4.5308 -4.5308 -4.5301 -4.5301 -3.9636 -3.9636 -3.9093 -3.9093 -3.9091 -3.9091 -3.8013 -3.8013 -3.7957 -3.7957 -3.7667 -3.7667 -3.1744 -3.1744 -3.1465 -3.1465 -3.1304 -3.1304 -2.9539 -2.9539 -2.9229 -2.9229 -2.9135 -2.9135 -2.7904 -2.7904 -2.7753 -2.7753 -2.7713 -2.7713 -2.6747 -2.6747 -2.6387 -2.6387 -2.6253 -2.6253 k = 0.1129 0.0652 0.0461 ( 7117 PWs) bands (ev): -23.9729 -23.9729 -23.1704 -23.1704 -23.1681 -23.1681 -23.1673 -23.1673 -22.8561 -22.8561 -22.8561 -22.8561 -14.8190 -14.8190 -14.5818 -14.5818 -14.5749 -14.5749 -7.1091 -7.1091 -5.9817 -5.9817 -5.9796 -5.9796 -5.9640 -5.9640 -5.3027 -5.3027 -5.2971 -5.2971 -5.2755 -5.2755 -4.5408 -4.5408 -4.5399 -4.5399 -3.9639 -3.9639 -3.9099 -3.9099 -3.9097 -3.9097 -3.8034 -3.8034 -3.7967 -3.7967 -3.7675 -3.7675 -3.1806 -3.1806 -3.1535 -3.1535 -3.1322 -3.1322 -2.9533 -2.9533 -2.9138 -2.9138 -2.9040 -2.9040 -2.7907 -2.7907 -2.7757 -2.7757 -2.7705 -2.7705 -2.6858 -2.6858 -2.6418 -2.6418 -2.6267 -2.6267 k = 0.1290 0.0745 0.0527 ( 7132 PWs) bands (ev): -23.9725 -23.9725 -23.1708 -23.1708 -23.1680 -23.1680 -23.1672 -23.1672 -22.8563 -22.8563 -22.8563 -22.8563 -14.8182 -14.8182 -14.5822 -14.5822 -14.5754 -14.5754 -7.1126 -7.1126 -5.9755 -5.9755 -5.9730 -5.9730 -5.9574 -5.9574 -5.2988 -5.2988 -5.2917 -5.2917 -5.2699 -5.2699 -4.5521 -4.5521 -4.5510 -4.5510 -3.9643 -3.9643 -3.9112 -3.9112 -3.9103 -3.9103 -3.8055 -3.8055 -3.7980 -3.7980 -3.7681 -3.7681 -3.1872 -3.1872 -3.1608 -3.1608 -3.1339 -3.1339 -2.9529 -2.9529 -2.9040 -2.9040 -2.8940 -2.8940 -2.7914 -2.7914 -2.7760 -2.7760 -2.7696 -2.7696 -2.6991 -2.6991 -2.6447 -2.6447 -2.6284 -2.6284 k = 0.1452 0.0838 0.0593 ( 7129 PWs) bands (ev): -23.9720 -23.9720 -23.1713 -23.1713 -23.1680 -23.1680 -23.1670 -23.1670 -22.8564 -22.8564 -22.8564 -22.8564 -14.8174 -14.8174 -14.5828 -14.5828 -14.5759 -14.5759 -7.1165 -7.1165 -5.9685 -5.9685 -5.9656 -5.9656 -5.9500 -5.9500 -5.2945 -5.2945 -5.2860 -5.2860 -5.2635 -5.2635 -4.5645 -4.5645 -4.5631 -4.5631 -3.9651 -3.9651 -3.9132 -3.9132 -3.9110 -3.9110 -3.8073 -3.8073 -3.7993 -3.7993 -3.7684 -3.7684 -3.1942 -3.1942 -3.1682 -3.1682 -3.1356 -3.1356 -2.9525 -2.9525 -2.8936 -2.8936 -2.8836 -2.8836 -2.7924 -2.7924 -2.7761 -2.7761 -2.7686 -2.7686 -2.7142 -2.7142 -2.6473 -2.6473 -2.6303 -2.6303 k = 0.1613 0.0931 0.0658 ( 7135 PWs) bands (ev): -23.9715 -23.9715 -23.1719 -23.1719 -23.1678 -23.1678 -23.1669 -23.1669 -22.8566 -22.8566 -22.8566 -22.8566 -14.8165 -14.8165 -14.5833 -14.5833 -14.5764 -14.5764 -7.1207 -7.1207 -5.9609 -5.9609 -5.9576 -5.9576 -5.9419 -5.9419 -5.2898 -5.2898 -5.2800 -5.2800 -5.2564 -5.2564 -4.5779 -4.5779 -4.5762 -4.5762 -3.9662 -3.9662 -3.9160 -3.9160 -3.9121 -3.9121 -3.8086 -3.8086 -3.8006 -3.8006 -3.7684 -3.7684 -3.2013 -3.2013 -3.1757 -3.1757 -3.1373 -3.1373 -2.9522 -2.9522 -2.8830 -2.8830 -2.8730 -2.8730 -2.7938 -2.7938 -2.7760 -2.7760 -2.7674 -2.7674 -2.7308 -2.7308 -2.6499 -2.6499 -2.6324 -2.6324 k = 0.1774 0.1024 0.0724 ( 7135 PWs) bands (ev): -23.9710 -23.9710 -23.1725 -23.1725 -23.1677 -23.1677 -23.1667 -23.1667 -22.8568 -22.8568 -22.8568 -22.8568 -14.8155 -14.8155 -14.5839 -14.5839 -14.5771 -14.5771 -7.1251 -7.1251 -5.9525 -5.9525 -5.9490 -5.9490 -5.9333 -5.9333 -5.2848 -5.2848 -5.2737 -5.2737 -5.2484 -5.2484 -4.5922 -4.5922 -4.5902 -4.5902 -3.9678 -3.9678 -3.9197 -3.9197 -3.9134 -3.9134 -3.8094 -3.8094 -3.8018 -3.8018 -3.7681 -3.7681 -3.2084 -3.2084 -3.1831 -3.1831 -3.1389 -3.1389 -2.9519 -2.9519 -2.8722 -2.8722 -2.8624 -2.8624 -2.7958 -2.7958 -2.7757 -2.7757 -2.7661 -2.7661 -2.7486 -2.7486 -2.6525 -2.6525 -2.6346 -2.6346 k = 0.1935 0.1117 0.0790 ( 7153 PWs) bands (ev): -23.9705 -23.9705 -23.1731 -23.1731 -23.1676 -23.1676 -23.1666 -23.1666 -22.8570 -22.8570 -22.8570 -22.8570 -14.8144 -14.8144 -14.5845 -14.5845 -14.5777 -14.5777 -7.1297 -7.1297 -5.9437 -5.9437 -5.9399 -5.9399 -5.9241 -5.9241 -5.2795 -5.2795 -5.2673 -5.2673 -5.2397 -5.2397 -4.6072 -4.6072 -4.6048 -4.6048 -3.9700 -3.9700 -3.9244 -3.9244 -3.9149 -3.9149 -3.8096 -3.8096 -3.8029 -3.8029 -3.7677 -3.7677 -3.2154 -3.2154 -3.1904 -3.1904 -3.1406 -3.1406 -2.9516 -2.9516 -2.8615 -2.8615 -2.8517 -2.8517 -2.7984 -2.7984 -2.7758 -2.7758 -2.7665 -2.7665 -2.7647 -2.7647 -2.6551 -2.6551 -2.6370 -2.6370 k = 0.2097 0.1211 0.0856 ( 7150 PWs) bands (ev): -23.9699 -23.9699 -23.1738 -23.1738 -23.1674 -23.1674 -23.1664 -23.1664 -22.8572 -22.8572 -22.8572 -22.8572 -14.8133 -14.8133 -14.5851 -14.5851 -14.5784 -14.5784 -7.1344 -7.1344 -5.9342 -5.9342 -5.9303 -5.9303 -5.9145 -5.9145 -5.2741 -5.2741 -5.2608 -5.2608 -5.2304 -5.2304 -4.6228 -4.6228 -4.6200 -4.6200 -3.9727 -3.9727 -3.9300 -3.9300 -3.9166 -3.9166 -3.8092 -3.8092 -3.8035 -3.8035 -3.7670 -3.7670 -3.2223 -3.2223 -3.1975 -3.1975 -3.1423 -3.1423 -2.9513 -2.9513 -2.8509 -2.8509 -2.8412 -2.8412 -2.8026 -2.8026 -2.7867 -2.7867 -2.7729 -2.7729 -2.7631 -2.7631 -2.6578 -2.6578 -2.6395 -2.6395 k = 0.2258 0.1304 0.0922 ( 7135 PWs) bands (ev): -23.9693 -23.9693 -23.1745 -23.1745 -23.1672 -23.1672 -23.1662 -23.1662 -22.8575 -22.8575 -22.8575 -22.8575 -14.8122 -14.8122 -14.5857 -14.5857 -14.5791 -14.5791 -7.1392 -7.1392 -5.9243 -5.9243 -5.9204 -5.9204 -5.9045 -5.9045 -5.2685 -5.2685 -5.2542 -5.2542 -5.2205 -5.2205 -4.6389 -4.6389 -4.6357 -4.6357 -3.9761 -3.9761 -3.9364 -3.9364 -3.9184 -3.9184 -3.8082 -3.8082 -3.8037 -3.8037 -3.7661 -3.7661 -3.2291 -3.2291 -3.2045 -3.2045 -3.1440 -3.1440 -2.9510 -2.9510 -2.8406 -2.8406 -2.8310 -2.8310 -2.8135 -2.8135 -2.7986 -2.7986 -2.7721 -2.7721 -2.7614 -2.7614 -2.6605 -2.6605 -2.6422 -2.6422 k = 0.2419 0.1397 0.0988 ( 7141 PWs) bands (ev): -23.9687 -23.9687 -23.1752 -23.1752 -23.1671 -23.1671 -23.1661 -23.1661 -22.8577 -22.8577 -22.8577 -22.8577 -14.8111 -14.8111 -14.5864 -14.5864 -14.5798 -14.5798 -7.1440 -7.1440 -5.9140 -5.9140 -5.9103 -5.9103 -5.8942 -5.8942 -5.2629 -5.2629 -5.2476 -5.2476 -5.2102 -5.2102 -4.6552 -4.6552 -4.6515 -4.6515 -3.9802 -3.9802 -3.9436 -3.9436 -3.9203 -3.9203 -3.8066 -3.8066 -3.8036 -3.8036 -3.7651 -3.7651 -3.2356 -3.2356 -3.2111 -3.2111 -3.1456 -3.1456 -2.9509 -2.9509 -2.8328 -2.8328 -2.8301 -2.8301 -2.8211 -2.8211 -2.8037 -2.8037 -2.7708 -2.7708 -2.7595 -2.7595 -2.6633 -2.6633 -2.6450 -2.6450 k = 0.2581 0.1490 0.1054 ( 7132 PWs) bands (ev): -23.9680 -23.9680 -23.1760 -23.1760 -23.1669 -23.1669 -23.1659 -23.1659 -22.8579 -22.8579 -22.8579 -22.8579 -14.8099 -14.8099 -14.5870 -14.5870 -14.5805 -14.5805 -7.1488 -7.1488 -5.9034 -5.9034 -5.8999 -5.8999 -5.8838 -5.8838 -5.2573 -5.2573 -5.2412 -5.2412 -5.1996 -5.1996 -4.6717 -4.6717 -4.6675 -4.6675 -3.9850 -3.9850 -3.9514 -3.9514 -3.9221 -3.9221 -3.8046 -3.8046 -3.8030 -3.8030 -3.7640 -3.7640 -3.2419 -3.2419 -3.2176 -3.2176 -3.1473 -3.1473 -2.9511 -2.9511 -2.8520 -2.8520 -2.8218 -2.8218 -2.8117 -2.8117 -2.8071 -2.8071 -2.7692 -2.7692 -2.7574 -2.7574 -2.6661 -2.6661 -2.6478 -2.6478 k = 0.2742 0.1583 0.1119 ( 7126 PWs) bands (ev): -23.9674 -23.9674 -23.1767 -23.1767 -23.1667 -23.1667 -23.1657 -23.1657 -22.8581 -22.8581 -22.8581 -22.8581 -14.8088 -14.8088 -14.5877 -14.5877 -14.5812 -14.5812 -7.1536 -7.1536 -5.8925 -5.8925 -5.8896 -5.8896 -5.8733 -5.8733 -5.2518 -5.2518 -5.2348 -5.2348 -5.1887 -5.1887 -4.6881 -4.6881 -4.6834 -4.6834 -3.9905 -3.9905 -3.9595 -3.9595 -3.9239 -3.9239 -3.8022 -3.8022 -3.8020 -3.8020 -3.7629 -3.7629 -3.2479 -3.2479 -3.2237 -3.2237 -3.1489 -3.1489 -2.9521 -2.9521 -2.8713 -2.8713 -2.8164 -2.8164 -2.8077 -2.8077 -2.8028 -2.8028 -2.7672 -2.7672 -2.7550 -2.7550 -2.6690 -2.6690 -2.6508 -2.6508 k = 0.2903 0.1676 0.1185 ( 7144 PWs) bands (ev): -23.9668 -23.9668 -23.1774 -23.1774 -23.1666 -23.1666 -23.1655 -23.1655 -22.8583 -22.8583 -22.8583 -22.8583 -14.8077 -14.8077 -14.5883 -14.5883 -14.5819 -14.5819 -7.1583 -7.1583 -5.8816 -5.8816 -5.8793 -5.8793 -5.8627 -5.8627 -5.2465 -5.2465 -5.2287 -5.2287 -5.1777 -5.1777 -4.7043 -4.7043 -4.6990 -4.6990 -3.9965 -3.9965 -3.9680 -3.9680 -3.9255 -3.9255 -3.8006 -3.8006 -3.7996 -3.7996 -3.7617 -3.7617 -3.2536 -3.2536 -3.2296 -3.2296 -3.1506 -3.1506 -2.9546 -2.9546 -2.8888 -2.8888 -2.8181 -2.8181 -2.8020 -2.8020 -2.7946 -2.7946 -2.7648 -2.7648 -2.7523 -2.7523 -2.6719 -2.6719 -2.6538 -2.6538 k = 0.3065 0.1769 0.1251 ( 7144 PWs) bands (ev): -23.9662 -23.9662 -23.1781 -23.1781 -23.1664 -23.1664 -23.1653 -23.1653 -22.8586 -22.8586 -22.8586 -22.8586 -14.8065 -14.8065 -14.5889 -14.5889 -14.5826 -14.5826 -7.1628 -7.1628 -5.8706 -5.8706 -5.8692 -5.8692 -5.8522 -5.8522 -5.2414 -5.2414 -5.2228 -5.2228 -5.1668 -5.1668 -4.7201 -4.7201 -4.7142 -4.7142 -4.0030 -4.0030 -3.9766 -3.9766 -3.9269 -3.9269 -3.7991 -3.7991 -3.7968 -3.7968 -3.7605 -3.7605 -3.2590 -3.2590 -3.2351 -3.2351 -3.1521 -3.1521 -2.9600 -2.9600 -2.9028 -2.9028 -2.8219 -2.8219 -2.7951 -2.7951 -2.7872 -2.7872 -2.7620 -2.7620 -2.7492 -2.7492 -2.6748 -2.6748 -2.6569 -2.6569 k = 0.3226 0.1862 0.1317 ( 7150 PWs) bands (ev): -23.9657 -23.9657 -23.1788 -23.1788 -23.1662 -23.1662 -23.1652 -23.1652 -22.8588 -22.8588 -22.8588 -22.8588 -14.8055 -14.8055 -14.5895 -14.5895 -14.5833 -14.5833 -7.1671 -7.1671 -5.8597 -5.8597 -5.8595 -5.8595 -5.8418 -5.8418 -5.2367 -5.2367 -5.2173 -5.2173 -5.1560 -5.1560 -4.7353 -4.7353 -4.7289 -4.7289 -4.0097 -4.0097 -3.9852 -3.9852 -3.9282 -3.9282 -3.7973 -3.7973 -3.7939 -3.7939 -3.7593 -3.7593 -3.2641 -3.2641 -3.2403 -3.2403 -3.1536 -3.1536 -2.9696 -2.9696 -2.9118 -2.9118 -2.8263 -2.8263 -2.7890 -2.7890 -2.7806 -2.7806 -2.7586 -2.7586 -2.7457 -2.7457 -2.6778 -2.6778 -2.6600 -2.6600 k = 0.3387 0.1956 0.1383 ( 7150 PWs) bands (ev): -23.9651 -23.9651 -23.1794 -23.1794 -23.1661 -23.1661 -23.1650 -23.1650 -22.8590 -22.8590 -22.8590 -22.8590 -14.8044 -14.8044 -14.5901 -14.5901 -14.5839 -14.5839 -7.1711 -7.1711 -5.8503 -5.8503 -5.8491 -5.8491 -5.8316 -5.8316 -5.2323 -5.2323 -5.2121 -5.2121 -5.1455 -5.1455 -4.7498 -4.7498 -4.7428 -4.7428 -4.0165 -4.0165 -3.9935 -3.9935 -3.9293 -3.9293 -3.7954 -3.7954 -3.7910 -3.7910 -3.7581 -3.7581 -3.2688 -3.2688 -3.2451 -3.2451 -3.1551 -3.1551 -2.9829 -2.9829 -2.9160 -2.9160 -2.8309 -2.8309 -2.7839 -2.7839 -2.7751 -2.7751 -2.7545 -2.7545 -2.7417 -2.7417 -2.6807 -2.6807 -2.6632 -2.6632 k = 0.3548 0.2049 0.1449 ( 7144 PWs) bands (ev): -23.9646 -23.9646 -23.1800 -23.1800 -23.1659 -23.1659 -23.1649 -23.1649 -22.8591 -22.8591 -22.8591 -22.8591 -14.8035 -14.8035 -14.5906 -14.5906 -14.5845 -14.5845 -7.1749 -7.1749 -5.8416 -5.8416 -5.8388 -5.8388 -5.8218 -5.8218 -5.2284 -5.2284 -5.2075 -5.2075 -5.1355 -5.1355 -4.7634 -4.7634 -4.7558 -4.7558 -4.0232 -4.0232 -4.0016 -4.0016 -3.9303 -3.9303 -3.7935 -3.7935 -3.7882 -3.7882 -3.7569 -3.7569 -3.2731 -3.2731 -3.2496 -3.2496 -3.1564 -3.1564 -2.9980 -2.9980 -2.9171 -2.9171 -2.8357 -2.8357 -2.7797 -2.7797 -2.7704 -2.7704 -2.7500 -2.7500 -2.7373 -2.7373 -2.6836 -2.6836 -2.6664 -2.6664 k = 0.3710 0.2142 0.1514 ( 7138 PWs) bands (ev): -23.9641 -23.9641 -23.1806 -23.1806 -23.1658 -23.1658 -23.1647 -23.1647 -22.8593 -22.8593 -22.8593 -22.8593 -14.8026 -14.8026 -14.5911 -14.5911 -14.5851 -14.5851 -7.1784 -7.1784 -5.8337 -5.8337 -5.8291 -5.8291 -5.8123 -5.8123 -5.2249 -5.2249 -5.2033 -5.2033 -5.1260 -5.1260 -4.7760 -4.7760 -4.7678 -4.7678 -4.0297 -4.0297 -4.0092 -4.0092 -3.9311 -3.9311 -3.7916 -3.7916 -3.7855 -3.7855 -3.7558 -3.7558 -3.2770 -3.2770 -3.2536 -3.2536 -3.1576 -3.1576 -3.0134 -3.0134 -2.9164 -2.9164 -2.8407 -2.8407 -2.7765 -2.7765 -2.7667 -2.7667 -2.7451 -2.7451 -2.7325 -2.7325 -2.6865 -2.6865 -2.6696 -2.6696 k = 0.3871 0.2235 0.1580 ( 7129 PWs) bands (ev): -23.9637 -23.9637 -23.1811 -23.1811 -23.1657 -23.1657 -23.1646 -23.1646 -22.8595 -22.8595 -22.8595 -22.8595 -14.8018 -14.8018 -14.5916 -14.5916 -14.5856 -14.5856 -7.1816 -7.1816 -5.8265 -5.8265 -5.8200 -5.8200 -5.8035 -5.8035 -5.2220 -5.2220 -5.1997 -5.1997 -5.1173 -5.1173 -4.7874 -4.7874 -4.7787 -4.7787 -4.0358 -4.0358 -4.0162 -4.0162 -3.9319 -3.9319 -3.7898 -3.7898 -3.7830 -3.7830 -3.7548 -3.7548 -3.2805 -3.2805 -3.2573 -3.2573 -3.1588 -3.1588 -3.0281 -3.0281 -2.9146 -2.9146 -2.8456 -2.8456 -2.7739 -2.7739 -2.7636 -2.7636 -2.7401 -2.7401 -2.7277 -2.7277 -2.6894 -2.6894 -2.6728 -2.6728 k = 0.4032 0.2328 0.1646 ( 7123 PWs) bands (ev): -23.9633 -23.9633 -23.1816 -23.1816 -23.1655 -23.1655 -23.1645 -23.1645 -22.8596 -22.8596 -22.8596 -22.8596 -14.8011 -14.8011 -14.5920 -14.5920 -14.5860 -14.5860 -7.1843 -7.1843 -5.8201 -5.8201 -5.8117 -5.8117 -5.7955 -5.7955 -5.2195 -5.2195 -5.1966 -5.1966 -5.1094 -5.1094 -4.7974 -4.7974 -4.7882 -4.7882 -4.0414 -4.0414 -4.0226 -4.0226 -3.9325 -3.9325 -3.7881 -3.7881 -3.7807 -3.7807 -3.7539 -3.7539 -3.2836 -3.2836 -3.2605 -3.2605 -3.1598 -3.1598 -3.0416 -3.0416 -2.9121 -2.9121 -2.8506 -2.8506 -2.7719 -2.7719 -2.7611 -2.7611 -2.7352 -2.7352 -2.7228 -2.7228 -2.6923 -2.6923 -2.6761 -2.6761 k = 0.4194 0.2421 0.1712 ( 7117 PWs) bands (ev): -23.9630 -23.9630 -23.1820 -23.1820 -23.1654 -23.1654 -23.1644 -23.1644 -22.8597 -22.8597 -22.8597 -22.8597 -14.8004 -14.8004 -14.5924 -14.5924 -14.5864 -14.5864 -7.1867 -7.1867 -5.8147 -5.8147 -5.8044 -5.8044 -5.7883 -5.7883 -5.2175 -5.2175 -5.1941 -5.1941 -5.1025 -5.1025 -4.8061 -4.8061 -4.7965 -4.7965 -4.0464 -4.0464 -4.0281 -4.0281 -3.9331 -3.9331 -3.7866 -3.7866 -3.7786 -3.7786 -3.7531 -3.7531 -3.2863 -3.2863 -3.2632 -3.2632 -3.1607 -3.1607 -3.0536 -3.0536 -2.9092 -2.9092 -2.8556 -2.8556 -2.7703 -2.7703 -2.7591 -2.7591 -2.7306 -2.7306 -2.7179 -2.7179 -2.6951 -2.6951 -2.6794 -2.6794 k = 0.4355 0.2514 0.1778 ( 7117 PWs) bands (ev): -23.9627 -23.9627 -23.1823 -23.1823 -23.1654 -23.1654 -23.1643 -23.1643 -22.8598 -22.8598 -22.8598 -22.8598 -14.7999 -14.7999 -14.5926 -14.5926 -14.5868 -14.5868 -7.1887 -7.1887 -5.8102 -5.8102 -5.7982 -5.7982 -5.7822 -5.7822 -5.2160 -5.2160 -5.1921 -5.1921 -5.0966 -5.0966 -4.8133 -4.8133 -4.8033 -4.8033 -4.0506 -4.0506 -4.0328 -4.0328 -3.9335 -3.9335 -3.7853 -3.7853 -3.7769 -3.7769 -3.7524 -3.7524 -3.2885 -3.2885 -3.2655 -3.2655 -3.1614 -3.1614 -3.0637 -3.0637 -2.9060 -2.9060 -2.8604 -2.8604 -2.7690 -2.7690 -2.7576 -2.7576 -2.7261 -2.7261 -2.7133 -2.7133 -2.6980 -2.6980 -2.6827 -2.6827 k = 0.4516 0.2607 0.1844 ( 7129 PWs) bands (ev): -23.9625 -23.9625 -23.1826 -23.1826 -23.1653 -23.1653 -23.1642 -23.1642 -22.8599 -22.8599 -22.8599 -22.8599 -14.7995 -14.7995 -14.5929 -14.5929 -14.5870 -14.5870 -7.1903 -7.1903 -5.8066 -5.8066 -5.7932 -5.7932 -5.7774 -5.7774 -5.2149 -5.2149 -5.1907 -5.1907 -5.0920 -5.0920 -4.8189 -4.8189 -4.8086 -4.8086 -4.0539 -4.0539 -4.0365 -4.0365 -3.9339 -3.9339 -3.7843 -3.7843 -3.7756 -3.7756 -3.7519 -3.7519 -3.2902 -3.2902 -3.2672 -3.2672 -3.1620 -3.1620 -3.0717 -3.0717 -2.9027 -2.9027 -2.8648 -2.8648 -2.7680 -2.7680 -2.7564 -2.7564 -2.7221 -2.7221 -2.7089 -2.7089 -2.7008 -2.7008 -2.6861 -2.6861 k = 0.4677 0.2701 0.1910 ( 7129 PWs) bands (ev): -23.9623 -23.9623 -23.1827 -23.1827 -23.1653 -23.1653 -23.1642 -23.1642 -22.8599 -22.8599 -22.8599 -22.8599 -14.7992 -14.7992 -14.5930 -14.5930 -14.5872 -14.5872 -7.1914 -7.1914 -5.8041 -5.8041 -5.7896 -5.7896 -5.7738 -5.7738 -5.2141 -5.2141 -5.1896 -5.1896 -5.0886 -5.0886 -4.8229 -4.8229 -4.8124 -4.8124 -4.0564 -4.0564 -4.0392 -4.0392 -3.9341 -3.9341 -3.7836 -3.7836 -3.7746 -3.7746 -3.7515 -3.7515 -3.2915 -3.2915 -3.2685 -3.2685 -3.1624 -3.1624 -3.0775 -3.0775 -2.8996 -2.8996 -2.8687 -2.8687 -2.7673 -2.7673 -2.7555 -2.7555 -2.7183 -2.7183 -2.7047 -2.7047 -2.7036 -2.7036 -2.6895 -2.6895 k = 0.4839 0.2794 0.1975 ( 7120 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1642 -23.1642 -22.8600 -22.8600 -22.8600 -22.8600 -14.7990 -14.7990 -14.5931 -14.5931 -14.5873 -14.5873 -7.1921 -7.1921 -5.8025 -5.8025 -5.7874 -5.7874 -5.7716 -5.7716 -5.2137 -5.2137 -5.1890 -5.1890 -5.0866 -5.0866 -4.8254 -4.8254 -4.8148 -4.8148 -4.0579 -4.0579 -4.0408 -4.0408 -3.9343 -3.9343 -3.7831 -3.7831 -3.7740 -3.7740 -3.7512 -3.7512 -3.2922 -3.2922 -3.2693 -3.2693 -3.1627 -3.1627 -3.0811 -3.0811 -2.8973 -2.8973 -2.8716 -2.8716 -2.7669 -2.7669 -2.7550 -2.7550 -2.7152 -2.7152 -2.7062 -2.7062 -2.7007 -2.7007 -2.6930 -2.6930 k = 0.5000 0.2887 0.2041 ( 7120 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1641 -23.1641 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5873 -14.5873 -7.1923 -7.1923 -5.8020 -5.8020 -5.7866 -5.7866 -5.7709 -5.7709 -5.2135 -5.2135 -5.1888 -5.1888 -5.0859 -5.0859 -4.8262 -4.8262 -4.8155 -4.8155 -4.0584 -4.0584 -4.0414 -4.0414 -3.9344 -3.9344 -3.7829 -3.7829 -3.7738 -3.7738 -3.7511 -3.7511 -3.2925 -3.2925 -3.2696 -3.2696 -3.1627 -3.1627 -3.0823 -3.0823 -2.8964 -2.8964 -2.8726 -2.8726 -2.7668 -2.7668 -2.7549 -2.7549 -2.7136 -2.7136 -2.7076 -2.7076 -2.6975 -2.6975 -2.6960 -2.6960 k = 0.5000 0.2887 0.2041 ( 7120 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1641 -23.1641 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5873 -14.5873 -7.1923 -7.1923 -5.8020 -5.8020 -5.7866 -5.7866 -5.7709 -5.7709 -5.2135 -5.2135 -5.1888 -5.1888 -5.0859 -5.0859 -4.8262 -4.8262 -4.8155 -4.8155 -4.0584 -4.0584 -4.0414 -4.0414 -3.9344 -3.9344 -3.7829 -3.7829 -3.7738 -3.7738 -3.7511 -3.7511 -3.2925 -3.2925 -3.2696 -3.2696 -3.1627 -3.1627 -3.0823 -3.0823 -2.8964 -2.8964 -2.8726 -2.8726 -2.7668 -2.7668 -2.7549 -2.7549 -2.7136 -2.7136 -2.7076 -2.7076 -2.6975 -2.6975 -2.6960 -2.6960 k = 0.5057 0.2723 0.2134 ( 7132 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1642 -23.1642 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5874 -14.5874 -7.1921 -7.1921 -5.8022 -5.8022 -5.7868 -5.7868 -5.7711 -5.7711 -5.2131 -5.2131 -5.1884 -5.1884 -5.0858 -5.0858 -4.8258 -4.8258 -4.8151 -4.8151 -4.0583 -4.0583 -4.0413 -4.0413 -3.9349 -3.9349 -3.7837 -3.7837 -3.7746 -3.7746 -3.7516 -3.7516 -3.2924 -3.2924 -3.2695 -3.2695 -3.1629 -3.1629 -3.0814 -3.0814 -2.8962 -2.8962 -2.8725 -2.8725 -2.7669 -2.7669 -2.7550 -2.7550 -2.7138 -2.7138 -2.7078 -2.7078 -2.6975 -2.6975 -2.6961 -2.6961 k = 0.5114 0.2559 0.2227 ( 7124 PWs) bands (ev): -23.9622 -23.9622 -23.1828 -23.1828 -23.1653 -23.1653 -23.1642 -23.1642 -22.8601 -22.8601 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5874 -14.5874 -7.1913 -7.1913 -5.8028 -5.8028 -5.7874 -5.7874 -5.7717 -5.7717 -5.2118 -5.2118 -5.1872 -5.1872 -5.0856 -5.0856 -4.8247 -4.8247 -4.8138 -4.8138 -4.0581 -4.0581 -4.0409 -4.0409 -3.9363 -3.9363 -3.7864 -3.7864 -3.7766 -3.7766 -3.7527 -3.7527 -3.2922 -3.2922 -3.2693 -3.2693 -3.1634 -3.1634 -3.0789 -3.0789 -2.8954 -2.8954 -2.8720 -2.8720 -2.7672 -2.7672 -2.7554 -2.7554 -2.7142 -2.7142 -2.7084 -2.7084 -2.6976 -2.6976 -2.6963 -2.6963 k = 0.5170 0.2395 0.2320 ( 7120 PWs) bands (ev): -23.9621 -23.9621 -23.1826 -23.1826 -23.1654 -23.1654 -23.1643 -23.1643 -22.8602 -22.8602 -22.8599 -22.8599 -14.7987 -14.7987 -14.5932 -14.5932 -14.5876 -14.5876 -7.1901 -7.1901 -5.8039 -5.8039 -5.7884 -5.7884 -5.7726 -5.7726 -5.2097 -5.2097 -5.1852 -5.1852 -5.0852 -5.0852 -4.8232 -4.8232 -4.8114 -4.8114 -4.0578 -4.0578 -4.0403 -4.0403 -3.9388 -3.9388 -3.7918 -3.7918 -3.7791 -3.7791 -3.7544 -3.7544 -3.2919 -3.2919 -3.2688 -3.2688 -3.1643 -3.1643 -3.0748 -3.0748 -2.8942 -2.8942 -2.8713 -2.8713 -2.7678 -2.7678 -2.7561 -2.7561 -2.7149 -2.7149 -2.7093 -2.7093 -2.6976 -2.6976 -2.6965 -2.6965 k = 0.5227 0.2231 0.2412 ( 7107 PWs) bands (ev): -23.9620 -23.9620 -23.1824 -23.1824 -23.1655 -23.1655 -23.1644 -23.1644 -22.8604 -22.8604 -22.8599 -22.8599 -14.7986 -14.7986 -14.5933 -14.5933 -14.5878 -14.5878 -7.1883 -7.1883 -5.8055 -5.8055 -5.7898 -5.7898 -5.7739 -5.7739 -5.2068 -5.2068 -5.1824 -5.1824 -5.0846 -5.0846 -4.8215 -4.8215 -4.8075 -4.8075 -4.0575 -4.0575 -4.0395 -4.0395 -3.9421 -3.9421 -3.8002 -3.8002 -3.7817 -3.7817 -3.7563 -3.7563 -3.2916 -3.2916 -3.2681 -3.2681 -3.1655 -3.1655 -3.0693 -3.0693 -2.8925 -2.8925 -2.8703 -2.8703 -2.7687 -2.7687 -2.7569 -2.7569 -2.7160 -2.7160 -2.7106 -2.7106 -2.6977 -2.6977 -2.6969 -2.6969 k = 0.5284 0.2067 0.2505 ( 7105 PWs) bands (ev): -23.9619 -23.9619 -23.1822 -23.1822 -23.1656 -23.1656 -23.1645 -23.1645 -22.8606 -22.8606 -22.8598 -22.8598 -14.7984 -14.7984 -14.5933 -14.5933 -14.5880 -14.5880 -7.1861 -7.1861 -5.8077 -5.8077 -5.7914 -5.7914 -5.7753 -5.7753 -5.2031 -5.2031 -5.1789 -5.1789 -5.0838 -5.0838 -4.8199 -4.8199 -4.8020 -4.8020 -4.0573 -4.0573 -4.0386 -4.0386 -3.9462 -3.9462 -3.8111 -3.8111 -3.7849 -3.7849 -3.7581 -3.7581 -3.2915 -3.2915 -3.2670 -3.2670 -3.1670 -3.1670 -3.0626 -3.0626 -2.8904 -2.8904 -2.8689 -2.8689 -2.7699 -2.7699 -2.7578 -2.7578 -2.7176 -2.7176 -2.7120 -2.7120 -2.6977 -2.6977 -2.6972 -2.6972 k = 0.5341 0.1903 0.2598 ( 7109 PWs) bands (ev): -23.9618 -23.9618 -23.1819 -23.1819 -23.1658 -23.1658 -23.1646 -23.1646 -22.8608 -22.8608 -22.8597 -22.8597 -14.7981 -14.7981 -14.5933 -14.5933 -14.5882 -14.5882 -7.1835 -7.1835 -5.8105 -5.8105 -5.7932 -5.7932 -5.7770 -5.7770 -5.1988 -5.1988 -5.1748 -5.1748 -5.0829 -5.0829 -4.8182 -4.8182 -4.7950 -4.7950 -4.0573 -4.0573 -4.0377 -4.0377 -3.9510 -3.9510 -3.8240 -3.8240 -3.7889 -3.7889 -3.7598 -3.7598 -3.2917 -3.2917 -3.2655 -3.2655 -3.1687 -3.1687 -3.0551 -3.0551 -2.8879 -2.8879 -2.8673 -2.8673 -2.7716 -2.7716 -2.7588 -2.7588 -2.7197 -2.7197 -2.7136 -2.7136 -2.6980 -2.6980 -2.6973 -2.6973 k = 0.5398 0.1739 0.2691 ( 7111 PWs) bands (ev): -23.9616 -23.9616 -23.1815 -23.1815 -23.1661 -23.1661 -23.1648 -23.1648 -22.8611 -22.8611 -22.8596 -22.8596 -14.7979 -14.7979 -14.5934 -14.5934 -14.5885 -14.5885 -7.1805 -7.1805 -5.8140 -5.8140 -5.7951 -5.7951 -5.7788 -5.7788 -5.1938 -5.1938 -5.1701 -5.1701 -5.0819 -5.0819 -4.8164 -4.8164 -4.7866 -4.7866 -4.0577 -4.0577 -4.0371 -4.0371 -3.9562 -3.9562 -3.8385 -3.8385 -3.7937 -3.7937 -3.7611 -3.7611 -3.2922 -3.2922 -3.2636 -3.2636 -3.1708 -3.1708 -3.0469 -3.0469 -2.8849 -2.8849 -2.8655 -2.8655 -2.7738 -2.7738 -2.7597 -2.7597 -2.7223 -2.7223 -2.7153 -2.7153 -2.6984 -2.6984 -2.6972 -2.6972 k = 0.5455 0.1575 0.2784 ( 7109 PWs) bands (ev): -23.9614 -23.9614 -23.1811 -23.1811 -23.1664 -23.1664 -23.1649 -23.1649 -22.8614 -22.8614 -22.8595 -22.8595 -14.7976 -14.7976 -14.5935 -14.5935 -14.5889 -14.5889 -7.1771 -7.1771 -5.8179 -5.8179 -5.7972 -5.7972 -5.7807 -5.7807 -5.1883 -5.1883 -5.1649 -5.1649 -5.0807 -5.0807 -4.8143 -4.8143 -4.7769 -4.7769 -4.0587 -4.0587 -4.0370 -4.0370 -3.9617 -3.9617 -3.8540 -3.8540 -3.7991 -3.7991 -3.7620 -3.7620 -3.2929 -3.2929 -3.2613 -3.2613 -3.1730 -3.1730 -3.0383 -3.0383 -2.8816 -2.8816 -2.8634 -2.8634 -2.7765 -2.7765 -2.7605 -2.7605 -2.7253 -2.7253 -2.7170 -2.7170 -2.6987 -2.6987 -2.6971 -2.6971 k = 0.5511 0.1411 0.2876 ( 7108 PWs) bands (ev): -23.9612 -23.9612 -23.1807 -23.1807 -23.1667 -23.1667 -23.1651 -23.1651 -22.8617 -22.8617 -22.8594 -22.8594 -14.7973 -14.7973 -14.5935 -14.5935 -14.5893 -14.5893 -7.1734 -7.1734 -5.8223 -5.8223 -5.7993 -5.7993 -5.7827 -5.7827 -5.1823 -5.1823 -5.1593 -5.1593 -5.0794 -5.0794 -4.8119 -4.8119 -4.7661 -4.7661 -4.0605 -4.0605 -4.0377 -4.0377 -3.9673 -3.9673 -3.8699 -3.8699 -3.8051 -3.8051 -3.7626 -3.7626 -3.2939 -3.2939 -3.2587 -3.2587 -3.1753 -3.1753 -3.0297 -3.0297 -2.8779 -2.8779 -2.8610 -2.8610 -2.7797 -2.7797 -2.7612 -2.7612 -2.7286 -2.7286 -2.7189 -2.7189 -2.6990 -2.6990 -2.6969 -2.6969 k = 0.5568 0.1247 0.2969 ( 7105 PWs) bands (ev): -23.9610 -23.9610 -23.1802 -23.1802 -23.1670 -23.1670 -23.1652 -23.1652 -22.8621 -22.8621 -22.8592 -22.8592 -14.7969 -14.7969 -14.5936 -14.5936 -14.5896 -14.5896 -7.1695 -7.1695 -5.8270 -5.8270 -5.8015 -5.8015 -5.7849 -5.7849 -5.1760 -5.1760 -5.1534 -5.1534 -5.0779 -5.0779 -4.8091 -4.8091 -4.7543 -4.7543 -4.0633 -4.0633 -4.0395 -4.0395 -3.9729 -3.9729 -3.8854 -3.8854 -3.8114 -3.8114 -3.7630 -3.7630 -3.2950 -3.2950 -3.2560 -3.2560 -3.1778 -3.1778 -3.0213 -3.0213 -2.8739 -2.8739 -2.8584 -2.8584 -2.7833 -2.7833 -2.7618 -2.7618 -2.7320 -2.7320 -2.7210 -2.7210 -2.6992 -2.6992 -2.6967 -2.6967 k = 0.5625 0.1083 0.3062 ( 7099 PWs) bands (ev): -23.9608 -23.9608 -23.1797 -23.1797 -23.1674 -23.1674 -23.1654 -23.1654 -22.8625 -22.8625 -22.8591 -22.8591 -14.7965 -14.7965 -14.5937 -14.5937 -14.5901 -14.5901 -7.1653 -7.1653 -5.8319 -5.8319 -5.8038 -5.8038 -5.7873 -5.7873 -5.1695 -5.1695 -5.1474 -5.1474 -5.0763 -5.0763 -4.8059 -4.8059 -4.7415 -4.7415 -4.0676 -4.0676 -4.0425 -4.0425 -3.9789 -3.9789 -3.8995 -3.8995 -3.8176 -3.8176 -3.7632 -3.7632 -3.2963 -3.2963 -3.2534 -3.2534 -3.1801 -3.1801 -3.0132 -3.0132 -2.8698 -2.8698 -2.8555 -2.8555 -2.7873 -2.7873 -2.7623 -2.7623 -2.7356 -2.7356 -2.7232 -2.7232 -2.6993 -2.6993 -2.6965 -2.6965 k = 0.5682 0.0919 0.3155 ( 7097 PWs) bands (ev): -23.9606 -23.9606 -23.1791 -23.1791 -23.1678 -23.1678 -23.1656 -23.1656 -22.8629 -22.8629 -22.8590 -22.8590 -14.7962 -14.7962 -14.5938 -14.5938 -14.5905 -14.5905 -7.1610 -7.1610 -5.8366 -5.8366 -5.8062 -5.8062 -5.7898 -5.7898 -5.1629 -5.1629 -5.1412 -5.1412 -5.0746 -5.0746 -4.8020 -4.8020 -4.7281 -4.7281 -4.0737 -4.0737 -4.0467 -4.0467 -3.9861 -3.9861 -3.9109 -3.9109 -3.8237 -3.8237 -3.7634 -3.7634 -3.2976 -3.2976 -3.2509 -3.2509 -3.1824 -3.1824 -3.0058 -3.0058 -2.8656 -2.8656 -2.8523 -2.8523 -2.7915 -2.7915 -2.7628 -2.7628 -2.7392 -2.7392 -2.7255 -2.7255 -2.6992 -2.6992 -2.6963 -2.6963 k = 0.5739 0.0754 0.3247 ( 7096 PWs) bands (ev): -23.9604 -23.9604 -23.1786 -23.1786 -23.1682 -23.1682 -23.1657 -23.1657 -22.8634 -22.8634 -22.8588 -22.8588 -14.7958 -14.7958 -14.5939 -14.5939 -14.5909 -14.5909 -7.1566 -7.1566 -5.8413 -5.8413 -5.8088 -5.8088 -5.7926 -5.7926 -5.1563 -5.1563 -5.1351 -5.1351 -5.0727 -5.0727 -4.7976 -4.7976 -4.7142 -4.7142 -4.0816 -4.0816 -4.0517 -4.0517 -3.9954 -3.9954 -3.9186 -3.9186 -3.8293 -3.8293 -3.7634 -3.7634 -3.2989 -3.2989 -3.2488 -3.2488 -3.1843 -3.1843 -2.9992 -2.9992 -2.8615 -2.8615 -2.8487 -2.8487 -2.7959 -2.7959 -2.7631 -2.7631 -2.7426 -2.7426 -2.7279 -2.7279 -2.6991 -2.6991 -2.6960 -2.6960 k = 0.5795 0.0590 0.3340 ( 7098 PWs) bands (ev): -23.9602 -23.9602 -23.1780 -23.1780 -23.1687 -23.1687 -23.1659 -23.1659 -22.8638 -22.8638 -22.8586 -22.8586 -14.7954 -14.7954 -14.5940 -14.5940 -14.5913 -14.5913 -7.1522 -7.1522 -5.8456 -5.8456 -5.8116 -5.8116 -5.7955 -5.7955 -5.1499 -5.1499 -5.1290 -5.1290 -5.0707 -5.0707 -4.7925 -4.7925 -4.6999 -4.6999 -4.0913 -4.0913 -4.0574 -4.0574 -4.0071 -4.0071 -3.9222 -3.9222 -3.8343 -3.8343 -3.7634 -3.7634 -3.3003 -3.3003 -3.2472 -3.2472 -3.1858 -3.1858 -2.9936 -2.9936 -2.8578 -2.8578 -2.8446 -2.8446 -2.8002 -2.8002 -2.7634 -2.7634 -2.7459 -2.7459 -2.7305 -2.7305 -2.6989 -2.6989 -2.6957 -2.6957 k = 0.5852 0.0426 0.3433 ( 7092 PWs) bands (ev): -23.9599 -23.9599 -23.1774 -23.1774 -23.1691 -23.1691 -23.1661 -23.1661 -22.8642 -22.8642 -22.8584 -22.8584 -14.7950 -14.7950 -14.5941 -14.5941 -14.5916 -14.5916 -7.1477 -7.1477 -5.8495 -5.8495 -5.8146 -5.8146 -5.7986 -5.7986 -5.1438 -5.1438 -5.1231 -5.1231 -5.0686 -5.0686 -4.7866 -4.7866 -4.6857 -4.6857 -4.1022 -4.1022 -4.0638 -4.0638 -4.0206 -4.0206 -3.9224 -3.9224 -3.8387 -3.8387 -3.7634 -3.7634 -3.3015 -3.3015 -3.2463 -3.2463 -3.1867 -3.1867 -2.9890 -2.9890 -2.8547 -2.8547 -2.8401 -2.8401 -2.8043 -2.8043 -2.7637 -2.7637 -2.7489 -2.7489 -2.7332 -2.7332 -2.6988 -2.6988 -2.6952 -2.6952 k = 0.5909 0.0262 0.3526 ( 7099 PWs) bands (ev): -23.9598 -23.9598 -23.1768 -23.1768 -23.1695 -23.1695 -23.1663 -23.1663 -22.8647 -22.8647 -22.8583 -22.8583 -14.7947 -14.7947 -14.5943 -14.5943 -14.5919 -14.5919 -7.1434 -7.1434 -5.8529 -5.8529 -5.8178 -5.8178 -5.8020 -5.8020 -5.1382 -5.1382 -5.1175 -5.1175 -5.0664 -5.0664 -4.7800 -4.7800 -4.6716 -4.6716 -4.1140 -4.1140 -4.0710 -4.0710 -4.0349 -4.0349 -3.9201 -3.9201 -3.8422 -3.8422 -3.7634 -3.7634 -3.3026 -3.3026 -3.2462 -3.2462 -3.1869 -3.1869 -2.9854 -2.9854 -2.8525 -2.8525 -2.8351 -2.8351 -2.8077 -2.8077 -2.7639 -2.7639 -2.7516 -2.7516 -2.7359 -2.7359 -2.6988 -2.6988 -2.6945 -2.6945 k = 0.5966 0.0098 0.3619 ( 7104 PWs) bands (ev): -23.9596 -23.9596 -23.1762 -23.1762 -23.1700 -23.1700 -23.1665 -23.1665 -22.8651 -22.8651 -22.8581 -22.8581 -14.7944 -14.7944 -14.5945 -14.5945 -14.5921 -14.5921 -7.1392 -7.1392 -5.8556 -5.8556 -5.8212 -5.8212 -5.8055 -5.8055 -5.1334 -5.1334 -5.1121 -5.1121 -5.0641 -5.0641 -4.7725 -4.7725 -4.6583 -4.6583 -4.1258 -4.1258 -4.0790 -4.0790 -4.0493 -4.0493 -3.9161 -3.9161 -3.8448 -3.8448 -3.7634 -3.7634 -3.3036 -3.3036 -3.2469 -3.2469 -3.1864 -3.1864 -2.9829 -2.9829 -2.8514 -2.8514 -2.8300 -2.8300 -2.8102 -2.8102 -2.7642 -2.7642 -2.7538 -2.7538 -2.7386 -2.7386 -2.6990 -2.6990 -2.6936 -2.6936 k = 0.6023-0.0066 0.3711 ( 7101 PWs) bands (ev): -23.9594 -23.9594 -23.1757 -23.1757 -23.1704 -23.1704 -23.1667 -23.1667 -22.8655 -22.8655 -22.8579 -22.8579 -14.7941 -14.7941 -14.5947 -14.5947 -14.5923 -14.5923 -7.1352 -7.1352 -5.8576 -5.8576 -5.8248 -5.8248 -5.8093 -5.8093 -5.1292 -5.1292 -5.1071 -5.1071 -5.0619 -5.0619 -4.7641 -4.7641 -4.6459 -4.6459 -4.1371 -4.1371 -4.0880 -4.0880 -4.0632 -4.0632 -3.9109 -3.9109 -3.8466 -3.8466 -3.7635 -3.7635 -3.3045 -3.3045 -3.2484 -3.2484 -3.1852 -3.1852 -2.9815 -2.9815 -2.8514 -2.8514 -2.8252 -2.8252 -2.8112 -2.8112 -2.7645 -2.7645 -2.7555 -2.7555 -2.7413 -2.7413 -2.6993 -2.6993 -2.6927 -2.6927 k = 0.6080-0.0230 0.3804 ( 7091 PWs) bands (ev): -23.9593 -23.9593 -23.1751 -23.1751 -23.1707 -23.1707 -23.1668 -23.1668 -22.8659 -22.8659 -22.8577 -22.8577 -14.7938 -14.7938 -14.5950 -14.5950 -14.5924 -14.5924 -7.1314 -7.1314 -5.8589 -5.8589 -5.8286 -5.8286 -5.8132 -5.8132 -5.1260 -5.1260 -5.1025 -5.1025 -5.0597 -5.0597 -4.7548 -4.7548 -4.6351 -4.6351 -4.1472 -4.1472 -4.0978 -4.0978 -4.0762 -4.0762 -3.9050 -3.9050 -3.8476 -3.8476 -3.7636 -3.7636 -3.3052 -3.3052 -3.2505 -3.2505 -3.1834 -3.1834 -2.9810 -2.9810 -2.8526 -2.8526 -2.8210 -2.8210 -2.8106 -2.8106 -2.7648 -2.7648 -2.7566 -2.7566 -2.7440 -2.7440 -2.6997 -2.6997 -2.6917 -2.6917 k = 0.6136-0.0394 0.3897 ( 7093 PWs) bands (ev): -23.9591 -23.9591 -23.1746 -23.1746 -23.1710 -23.1710 -23.1670 -23.1670 -22.8662 -22.8662 -22.8575 -22.8575 -14.7936 -14.7936 -14.5952 -14.5952 -14.5924 -14.5924 -7.1279 -7.1279 -5.8594 -5.8594 -5.8327 -5.8327 -5.8173 -5.8173 -5.1236 -5.1236 -5.0984 -5.0984 -5.0578 -5.0578 -4.7446 -4.7446 -4.6261 -4.6261 -4.1556 -4.1556 -4.1082 -4.1082 -4.0880 -4.0880 -3.8985 -3.8985 -3.8479 -3.8479 -3.7638 -3.7638 -3.3058 -3.3058 -3.2531 -3.2531 -3.1812 -3.1812 -2.9813 -2.9813 -2.8547 -2.8547 -2.8175 -2.8175 -2.8085 -2.8085 -2.7650 -2.7650 -2.7573 -2.7573 -2.7466 -2.7466 -2.7002 -2.7002 -2.6906 -2.6906 k = 0.6193-0.0558 0.3990 ( 7097 PWs) bands (ev): -23.9590 -23.9590 -23.1742 -23.1742 -23.1712 -23.1712 -23.1672 -23.1672 -22.8666 -22.8666 -22.8573 -22.8573 -14.7934 -14.7934 -14.5955 -14.5955 -14.5924 -14.5924 -7.1247 -7.1247 -5.8590 -5.8590 -5.8370 -5.8370 -5.8215 -5.8215 -5.1220 -5.1220 -5.0949 -5.0949 -5.0562 -5.0562 -4.7335 -4.7335 -4.6196 -4.6196 -4.1619 -4.1619 -4.1187 -4.1187 -4.0988 -4.0988 -3.8917 -3.8917 -3.8475 -3.8475 -3.7640 -3.7640 -3.3062 -3.3062 -3.2560 -3.2560 -3.1786 -3.1786 -2.9823 -2.9823 -2.8574 -2.8574 -2.8145 -2.8145 -2.8058 -2.8058 -2.7649 -2.7649 -2.7575 -2.7575 -2.7490 -2.7490 -2.7008 -2.7008 -2.6897 -2.6897 k = 0.6250-0.0722 0.4082 ( 7094 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8580 -5.8580 -5.8415 -5.8415 -5.8258 -5.8258 -5.1213 -5.1213 -5.0921 -5.0921 -5.0550 -5.0550 -4.7216 -4.7216 -4.6158 -4.6158 -4.1659 -4.1659 -4.1285 -4.1285 -4.1087 -4.1087 -3.8847 -3.8847 -3.8466 -3.8466 -3.7643 -3.7643 -3.3064 -3.3064 -3.2592 -3.2592 -3.1758 -3.1758 -2.9838 -2.9838 -2.8604 -2.8604 -2.8116 -2.8116 -2.8034 -2.8034 -2.7644 -2.7644 -2.7574 -2.7574 -2.7509 -2.7509 -2.7014 -2.7014 -2.6890 -2.6890 k = 0.6250-0.0722 0.4082 ( 7094 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8580 -5.8580 -5.8415 -5.8415 -5.8258 -5.8258 -5.1213 -5.1213 -5.0921 -5.0921 -5.0550 -5.0550 -4.7216 -4.7216 -4.6158 -4.6158 -4.1659 -4.1659 -4.1285 -4.1285 -4.1087 -4.1087 -3.8847 -3.8847 -3.8466 -3.8466 -3.7643 -3.7643 -3.3064 -3.3064 -3.2592 -3.2592 -3.1758 -3.1758 -2.9838 -2.9838 -2.8604 -2.8604 -2.8116 -2.8116 -2.8034 -2.8034 -2.7644 -2.7644 -2.7574 -2.7574 -2.7509 -2.7509 -2.7014 -2.7014 -2.6890 -2.6890 k = 0.6154-0.0666 0.4240 ( 7095 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8582 -5.8582 -5.8431 -5.8431 -5.8239 -5.8239 -5.1211 -5.1211 -5.0920 -5.0920 -5.0550 -5.0550 -4.7222 -4.7222 -4.6149 -4.6149 -4.1667 -4.1667 -4.1327 -4.1327 -4.1039 -4.1039 -3.8849 -3.8849 -3.8464 -3.8464 -3.7650 -3.7650 -3.3067 -3.3067 -3.2587 -3.2587 -3.1760 -3.1760 -2.9833 -2.9833 -2.8603 -2.8603 -2.8115 -2.8115 -2.8034 -2.8034 -2.7647 -2.7647 -2.7577 -2.7577 -2.7511 -2.7511 -2.7013 -2.7013 -2.6889 -2.6889 k = 0.6058-0.0611 0.4397 ( 7095 PWs) bands (ev): -23.9590 -23.9590 -23.1738 -23.1738 -23.1713 -23.1713 -23.1675 -23.1675 -22.8668 -22.8668 -22.8572 -22.8572 -14.7933 -14.7933 -14.5957 -14.5957 -14.5924 -14.5924 -7.1219 -7.1219 -5.8588 -5.8588 -5.8464 -5.8464 -5.8195 -5.8195 -5.1206 -5.1206 -5.0919 -5.0919 -5.0550 -5.0550 -4.7239 -4.7239 -4.6125 -4.6125 -4.1691 -4.1691 -4.1403 -4.1403 -4.0943 -4.0943 -3.8855 -3.8855 -3.8459 -3.8459 -3.7671 -3.7671 -3.3074 -3.3074 -3.2573 -3.2573 -3.1768 -3.1768 -2.9821 -2.9821 -2.8598 -2.8598 -2.8111 -2.8111 -2.8035 -2.8035 -2.7653 -2.7653 -2.7585 -2.7585 -2.7516 -2.7516 -2.7011 -2.7011 -2.6887 -2.6887 k = 0.5962-0.0555 0.4554 ( 7097 PWs) bands (ev): -23.9589 -23.9589 -23.1737 -23.1737 -23.1713 -23.1713 -23.1676 -23.1676 -22.8668 -22.8668 -22.8572 -22.8572 -14.7933 -14.7933 -14.5956 -14.5956 -14.5925 -14.5925 -7.1219 -7.1219 -5.8601 -5.8601 -5.8498 -5.8498 -5.8142 -5.8142 -5.1198 -5.1198 -5.0917 -5.0917 -5.0550 -5.0550 -4.7266 -4.7266 -4.6086 -4.6086 -4.1732 -4.1732 -4.1477 -4.1477 -4.0834 -4.0834 -3.8865 -3.8865 -3.8450 -3.8450 -3.7704 -3.7704 -3.3084 -3.3084 -3.2552 -3.2552 -3.1780 -3.1780 -2.9801 -2.9801 -2.8590 -2.8590 -2.8104 -2.8104 -2.8036 -2.8036 -2.7665 -2.7665 -2.7597 -2.7597 -2.7524 -2.7524 -2.7007 -2.7007 -2.6884 -2.6884 k = 0.5865-0.0500 0.4711 ( 7094 PWs) bands (ev): -23.9589 -23.9589 -23.1736 -23.1736 -23.1713 -23.1713 -23.1678 -23.1678 -22.8668 -22.8668 -22.8573 -22.8573 -14.7932 -14.7932 -14.5956 -14.5956 -14.5926 -14.5926 -7.1218 -7.1218 -5.8621 -5.8621 -5.8526 -5.8526 -5.8087 -5.8087 -5.1186 -5.1186 -5.0914 -5.0914 -5.0550 -5.0550 -4.7299 -4.7299 -4.6037 -4.6037 -4.1787 -4.1787 -4.1543 -4.1543 -4.0719 -4.0719 -3.8880 -3.8880 -3.8439 -3.8439 -3.7748 -3.7748 -3.3097 -3.3097 -3.2524 -3.2524 -3.1796 -3.1796 -2.9774 -2.9774 -2.8579 -2.8579 -2.8095 -2.8095 -2.8037 -2.8037 -2.7681 -2.7681 -2.7612 -2.7612 -2.7537 -2.7537 -2.7002 -2.7002 -2.6880 -2.6880 k = 0.5769-0.0444 0.4868 ( 7084 PWs) bands (ev): -23.9589 -23.9589 -23.1734 -23.1734 -23.1712 -23.1712 -23.1680 -23.1680 -22.8667 -22.8667 -22.8574 -22.8574 -14.7931 -14.7931 -14.5955 -14.5955 -14.5927 -14.5927 -7.1218 -7.1218 -5.8646 -5.8646 -5.8546 -5.8546 -5.8032 -5.8032 -5.1172 -5.1172 -5.0911 -5.0911 -5.0550 -5.0550 -4.7336 -4.7336 -4.5980 -4.5980 -4.1852 -4.1852 -4.1601 -4.1601 -4.0603 -4.0603 -3.8902 -3.8902 -3.8426 -3.8426 -3.7800 -3.7800 -3.3111 -3.3111 -3.2491 -3.2491 -3.1818 -3.1818 -2.9742 -2.9742 -2.8565 -2.8565 -2.8083 -2.8083 -2.8039 -2.8039 -2.7702 -2.7702 -2.7629 -2.7629 -2.7552 -2.7552 -2.6995 -2.6995 -2.6877 -2.6877 k = 0.5673-0.0389 0.5025 ( 7094 PWs) bands (ev): -23.9589 -23.9589 -23.1733 -23.1733 -23.1712 -23.1712 -23.1682 -23.1682 -22.8666 -22.8666 -22.8575 -22.8575 -14.7931 -14.7931 -14.5954 -14.5954 -14.5929 -14.5929 -7.1217 -7.1217 -5.8672 -5.8672 -5.8561 -5.8561 -5.7980 -5.7980 -5.1155 -5.1155 -5.0909 -5.0909 -5.0549 -5.0549 -4.7375 -4.7375 -4.5918 -4.5918 -4.1919 -4.1919 -4.1655 -4.1655 -4.0485 -4.0485 -3.8930 -3.8930 -3.8411 -3.8411 -3.7857 -3.7857 -3.3125 -3.3125 -3.2455 -3.2455 -3.1843 -3.1843 -2.9707 -2.9707 -2.8549 -2.8549 -2.8070 -2.8070 -2.8041 -2.8041 -2.7726 -2.7726 -2.7649 -2.7649 -2.7569 -2.7569 -2.6986 -2.6986 -2.6873 -2.6873 k = 0.5577-0.0333 0.5182 ( 7096 PWs) bands (ev): -23.9588 -23.9588 -23.1731 -23.1731 -23.1712 -23.1712 -23.1685 -23.1685 -22.8665 -22.8665 -22.8576 -22.8576 -14.7930 -14.7930 -14.5954 -14.5954 -14.5930 -14.5930 -7.1217 -7.1217 -5.8696 -5.8696 -5.8574 -5.8574 -5.7931 -5.7931 -5.1137 -5.1137 -5.0907 -5.0907 -5.0548 -5.0548 -4.7414 -4.7414 -4.5855 -4.5855 -4.1984 -4.1984 -4.1707 -4.1707 -4.0367 -4.0367 -3.8968 -3.8968 -3.8395 -3.8395 -3.7915 -3.7915 -3.3137 -3.3137 -3.2416 -3.2416 -3.1872 -3.1872 -2.9670 -2.9670 -2.8531 -2.8531 -2.8059 -2.8059 -2.8040 -2.8040 -2.7751 -2.7751 -2.7670 -2.7670 -2.7588 -2.7588 -2.6976 -2.6976 -2.6871 -2.6871 k = 0.5481-0.0278 0.5339 ( 7110 PWs) bands (ev): -23.9588 -23.9588 -23.1729 -23.1729 -23.1711 -23.1711 -23.1688 -23.1688 -22.8665 -22.8665 -22.8577 -22.8577 -14.7930 -14.7930 -14.5952 -14.5952 -14.5932 -14.5932 -7.1216 -7.1216 -5.8716 -5.8716 -5.8586 -5.8586 -5.7887 -5.7887 -5.1117 -5.1117 -5.0907 -5.0907 -5.0546 -5.0546 -4.7450 -4.7450 -4.5795 -4.5795 -4.2042 -4.2042 -4.1757 -4.1757 -4.0251 -4.0251 -3.9015 -3.9015 -3.8381 -3.8381 -3.7971 -3.7971 -3.3149 -3.3149 -3.2375 -3.2375 -3.1903 -3.1903 -2.9634 -2.9634 -2.8512 -2.8512 -2.8060 -2.8060 -2.8024 -2.8024 -2.7777 -2.7777 -2.7694 -2.7694 -2.7607 -2.7607 -2.6964 -2.6964 -2.6870 -2.6870 k = 0.5385-0.0222 0.5496 ( 7114 PWs) bands (ev): -23.9588 -23.9588 -23.1726 -23.1726 -23.1710 -23.1710 -23.1691 -23.1691 -22.8664 -22.8664 -22.8578 -22.8578 -14.7929 -14.7929 -14.5951 -14.5951 -14.5935 -14.5935 -7.1215 -7.1215 -5.8730 -5.8730 -5.8599 -5.8599 -5.7849 -5.7849 -5.1097 -5.1097 -5.0908 -5.0908 -5.0544 -5.0544 -4.7482 -4.7482 -4.5739 -4.5739 -4.2089 -4.2089 -4.1805 -4.1805 -4.0138 -4.0138 -3.9072 -3.9072 -3.8367 -3.8367 -3.8019 -3.8019 -3.3158 -3.3158 -3.2334 -3.2334 -3.1937 -3.1937 -2.9601 -2.9601 -2.8492 -2.8492 -2.8069 -2.8069 -2.8001 -2.8001 -2.7801 -2.7801 -2.7720 -2.7720 -2.7623 -2.7623 -2.6953 -2.6953 -2.6870 -2.6870 k = 0.5288-0.0167 0.5653 ( 7117 PWs) bands (ev): -23.9587 -23.9587 -23.1724 -23.1724 -23.1709 -23.1709 -23.1695 -23.1695 -22.8663 -22.8663 -22.8579 -22.8579 -14.7928 -14.7928 -14.5950 -14.5950 -14.5937 -14.5937 -7.1215 -7.1215 -5.8738 -5.8738 -5.8611 -5.8611 -5.7819 -5.7819 -5.1079 -5.1079 -5.0910 -5.0910 -5.0541 -5.0541 -4.7509 -4.7509 -4.5692 -4.5692 -4.2124 -4.2124 -4.1850 -4.1850 -4.0032 -4.0032 -3.9136 -3.9136 -3.8357 -3.8357 -3.8057 -3.8057 -3.3166 -3.3166 -3.2294 -3.2294 -3.1972 -3.1972 -2.9572 -2.9572 -2.8473 -2.8473 -2.8079 -2.8079 -2.7975 -2.7975 -2.7823 -2.7823 -2.7746 -2.7746 -2.7638 -2.7638 -2.6941 -2.6941 -2.6872 -2.6872 k = 0.5192-0.0111 0.5810 ( 7114 PWs) bands (ev): -23.9587 -23.9587 -23.1722 -23.1722 -23.1708 -23.1708 -23.1698 -23.1698 -22.8663 -22.8663 -22.8579 -22.8579 -14.7928 -14.7928 -14.5948 -14.5948 -14.5939 -14.5939 -7.1215 -7.1215 -5.8741 -5.8741 -5.8623 -5.8623 -5.7796 -5.7796 -5.1063 -5.1063 -5.0913 -5.0913 -5.0538 -5.0538 -4.7529 -4.7529 -4.5656 -4.5656 -4.2145 -4.2145 -4.1889 -4.1889 -3.9938 -3.9938 -3.9202 -3.9202 -3.8350 -3.8350 -3.8084 -3.8084 -3.3171 -3.3171 -3.2257 -3.2257 -3.2005 -3.2005 -2.9551 -2.9551 -2.8457 -2.8457 -2.8090 -2.8090 -2.7947 -2.7947 -2.7843 -2.7843 -2.7770 -2.7770 -2.7650 -2.7650 -2.6930 -2.6930 -2.6876 -2.6876 k = 0.5096-0.0056 0.5967 ( 7114 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1706 -23.1706 -23.1701 -23.1701 -22.8663 -22.8663 -22.8580 -22.8580 -14.7927 -14.7927 -14.5946 -14.5946 -14.5941 -14.5941 -7.1215 -7.1215 -5.8740 -5.8740 -5.8633 -5.8633 -5.7782 -5.7782 -5.1051 -5.1051 -5.0916 -5.0916 -5.0536 -5.0536 -4.7542 -4.7542 -4.5634 -4.5634 -4.2154 -4.2154 -4.1918 -4.1918 -3.9868 -3.9868 -3.9257 -3.9257 -3.8346 -3.8346 -3.8099 -3.8099 -3.3174 -3.3174 -3.2228 -3.2228 -3.2033 -3.2033 -2.9537 -2.9537 -2.8446 -2.8446 -2.8099 -2.8099 -2.7920 -2.7920 -2.7860 -2.7860 -2.7787 -2.7787 -2.7658 -2.7658 -2.6921 -2.6921 -2.6880 -2.6880 k = 0.5000 0.0000 0.6124 ( 7104 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1704 -23.1704 -23.1704 -23.1704 -22.8662 -22.8662 -22.8580 -22.8580 -14.7927 -14.7927 -14.5944 -14.5944 -14.5944 -14.5944 -7.1214 -7.1214 -5.8739 -5.8739 -5.8637 -5.8637 -5.7777 -5.7777 -5.1047 -5.1047 -5.0917 -5.0917 -5.0536 -5.0536 -4.7546 -4.7546 -4.5626 -4.5626 -4.2155 -4.2155 -4.1930 -4.1930 -3.9841 -3.9841 -3.9279 -3.9279 -3.8346 -3.8346 -3.8103 -3.8103 -3.3175 -3.3175 -3.2216 -3.2216 -3.2044 -3.2044 -2.9533 -2.9533 -2.8442 -2.8442 -2.8102 -2.8102 -2.7906 -2.7906 -2.7870 -2.7870 -2.7793 -2.7793 -2.7661 -2.7661 -2.6917 -2.6917 -2.6882 -2.6882 k = 0.5000 0.0000 0.6124 ( 7104 PWs) bands (ev): -23.9587 -23.9587 -23.1721 -23.1721 -23.1704 -23.1704 -23.1704 -23.1704 -22.8662 -22.8662 -22.8580 -22.8580 -14.7927 -14.7927 -14.5944 -14.5944 -14.5944 -14.5944 -7.1214 -7.1214 -5.8739 -5.8739 -5.8637 -5.8637 -5.7777 -5.7777 -5.1047 -5.1047 -5.0917 -5.0917 -5.0536 -5.0536 -4.7546 -4.7546 -4.5626 -4.5626 -4.2155 -4.2155 -4.1930 -4.1930 -3.9841 -3.9841 -3.9279 -3.9279 -3.8346 -3.8346 -3.8103 -3.8103 -3.3175 -3.3175 -3.2216 -3.2216 -3.2044 -3.2044 -2.9533 -2.9533 -2.8442 -2.8442 -2.8102 -2.8102 -2.7906 -2.7906 -2.7870 -2.7870 -2.7793 -2.7793 -2.7661 -2.7661 -2.6917 -2.6917 -2.6882 -2.6882 k = 0.5000 0.0115 0.5960 ( 7112 PWs) bands (ev): -23.9587 -23.9587 -23.1722 -23.1722 -23.1707 -23.1707 -23.1700 -23.1700 -22.8662 -22.8662 -22.8580 -22.8580 -14.7928 -14.7928 -14.5944 -14.5944 -14.5943 -14.5943 -7.1217 -7.1217 -5.8736 -5.8736 -5.8634 -5.8634 -5.7777 -5.7777 -5.1051 -5.1051 -5.0920 -5.0920 -5.0538 -5.0538 -4.7552 -4.7552 -4.5643 -4.5643 -4.2140 -4.2140 -4.1914 -4.1914 -3.9842 -3.9842 -3.9281 -3.9281 -3.8343 -3.8343 -3.8101 -3.8101 -3.3174 -3.3174 -3.2216 -3.2216 -3.2044 -3.2044 -2.9535 -2.9535 -2.8441 -2.8441 -2.8104 -2.8104 -2.7932 -2.7932 -2.7861 -2.7861 -2.7781 -2.7781 -2.7653 -2.7653 -2.6918 -2.6918 -2.6883 -2.6883 k = 0.5000 0.0231 0.5797 ( 7112 PWs) bands (ev): -23.9587 -23.9587 -23.1725 -23.1725 -23.1708 -23.1708 -23.1696 -23.1696 -22.8661 -22.8661 -22.8580 -22.8580 -14.7928 -14.7928 -14.5944 -14.5944 -14.5943 -14.5943 -7.1226 -7.1226 -5.8727 -5.8727 -5.8625 -5.8625 -5.7778 -5.7778 -5.1063 -5.1063 -5.0930 -5.0930 -5.0545 -5.0545 -4.7568 -4.7568 -4.5693 -4.5693 -4.2095 -4.2095 -4.1868 -4.1868 -3.9844 -3.9844 -3.9287 -3.9287 -3.8337 -3.8337 -3.8096 -3.8096 -3.3170 -3.3170 -3.2217 -3.2217 -3.2044 -3.2044 -2.9541 -2.9541 -2.8438 -2.8438 -2.8109 -2.8109 -2.7971 -2.7971 -2.7865 -2.7865 -2.7746 -2.7746 -2.7633 -2.7633 -2.6921 -2.6921 -2.6885 -2.6885 k = 0.5000 0.0346 0.5634 ( 7110 PWs) bands (ev): -23.9588 -23.9588 -23.1730 -23.1730 -23.1707 -23.1707 -23.1692 -23.1692 -22.8660 -22.8660 -22.8581 -22.8581 -14.7930 -14.7930 -14.5943 -14.5943 -14.5941 -14.5941 -7.1241 -7.1241 -5.8712 -5.8712 -5.8609 -5.8609 -5.7779 -5.7779 -5.1083 -5.1083 -5.0945 -5.0945 -5.0555 -5.0555 -4.7594 -4.7594 -4.5773 -4.5773 -4.2024 -4.2024 -4.1793 -4.1793 -3.9847 -3.9847 -3.9296 -3.9296 -3.8325 -3.8325 -3.8088 -3.8088 -3.3163 -3.3163 -3.2220 -3.2220 -3.2043 -3.2043 -2.9553 -2.9553 -2.8434 -2.8434 -2.8125 -2.8125 -2.8002 -2.8002 -2.7880 -2.7880 -2.7702 -2.7702 -2.7605 -2.7605 -2.6927 -2.6927 -2.6889 -2.6889 k = 0.5000 0.0462 0.5471 ( 7112 PWs) bands (ev): -23.9589 -23.9589 -23.1735 -23.1735 -23.1706 -23.1706 -23.1687 -23.1687 -22.8659 -22.8659 -22.8581 -22.8581 -14.7931 -14.7931 -14.5943 -14.5943 -14.5939 -14.5939 -7.1261 -7.1261 -5.8691 -5.8691 -5.8588 -5.8588 -5.7781 -5.7781 -5.1110 -5.1110 -5.0966 -5.0966 -5.0570 -5.0570 -4.7628 -4.7628 -4.5878 -4.5878 -4.1929 -4.1929 -4.1693 -4.1693 -3.9851 -3.9851 -3.9308 -3.9308 -3.8310 -3.8310 -3.8077 -3.8077 -3.3154 -3.3154 -3.2225 -3.2225 -3.2040 -3.2040 -2.9569 -2.9569 -2.8431 -2.8431 -2.8155 -2.8155 -2.8017 -2.8017 -2.7894 -2.7894 -2.7656 -2.7656 -2.7572 -2.7572 -2.6935 -2.6935 -2.6893 -2.6893 k = 0.5000 0.0577 0.5307 ( 7100 PWs) bands (ev): -23.9590 -23.9590 -23.1741 -23.1741 -23.1704 -23.1704 -23.1683 -23.1683 -22.8656 -22.8656 -22.8582 -22.8582 -14.7933 -14.7933 -14.5943 -14.5943 -14.5937 -14.5937 -7.1286 -7.1286 -5.8665 -5.8665 -5.8560 -5.8560 -5.7782 -5.7782 -5.1145 -5.1145 -5.0993 -5.0993 -5.0587 -5.0587 -4.7669 -4.7669 -4.6003 -4.6003 -4.1815 -4.1815 -4.1573 -4.1573 -3.9855 -3.9855 -3.9322 -3.9322 -3.8290 -3.8290 -3.8062 -3.8062 -3.3142 -3.3142 -3.2236 -3.2236 -3.2033 -3.2033 -2.9591 -2.9591 -2.8430 -2.8430 -2.8198 -2.8198 -2.8018 -2.8018 -2.7905 -2.7905 -2.7610 -2.7610 -2.7538 -2.7538 -2.6947 -2.6947 -2.6897 -2.6897 k = 0.5000 0.0693 0.5144 ( 7114 PWs) bands (ev): -23.9591 -23.9591 -23.1747 -23.1747 -23.1702 -23.1702 -23.1679 -23.1679 -22.8654 -22.8654 -22.8583 -22.8583 -14.7936 -14.7936 -14.5942 -14.5942 -14.5934 -14.5934 -7.1316 -7.1316 -5.8636 -5.8636 -5.8527 -5.8527 -5.7784 -5.7784 -5.1187 -5.1187 -5.1027 -5.1027 -5.0606 -5.0606 -4.7714 -4.7714 -4.6143 -4.6143 -4.1686 -4.1686 -4.1436 -4.1436 -3.9860 -3.9860 -3.9337 -3.9337 -3.8267 -3.8267 -3.8044 -3.8044 -3.3128 -3.3128 -3.2252 -3.2252 -3.2020 -3.2020 -2.9619 -2.9619 -2.8432 -2.8432 -2.8247 -2.8247 -2.8011 -2.8011 -2.7909 -2.7909 -2.7566 -2.7566 -2.7504 -2.7504 -2.6960 -2.6960 -2.6901 -2.6901 k = 0.5000 0.0808 0.4981 ( 7112 PWs) bands (ev): -23.9593 -23.9593 -23.1753 -23.1753 -23.1699 -23.1699 -23.1675 -23.1675 -22.8651 -22.8651 -22.8583 -22.8583 -14.7939 -14.7939 -14.5942 -14.5942 -14.5931 -14.5931 -7.1350 -7.1350 -5.8602 -5.8602 -5.8489 -5.8489 -5.7787 -5.7787 -5.1235 -5.1235 -5.1067 -5.1067 -5.0626 -5.0626 -4.7762 -4.7762 -4.6294 -4.6294 -4.1548 -4.1548 -4.1288 -4.1288 -3.9864 -3.9864 -3.9349 -3.9349 -3.8241 -3.8241 -3.8022 -3.8022 -3.3113 -3.3113 -3.2273 -3.2273 -3.2004 -3.2004 -2.9654 -2.9654 -2.8440 -2.8440 -2.8297 -2.8297 -2.7997 -2.7997 -2.7905 -2.7905 -2.7523 -2.7523 -2.7469 -2.7469 -2.6975 -2.6975 -2.6905 -2.6905 k = 0.5000 0.0924 0.4817 ( 7110 PWs) bands (ev): -23.9595 -23.9595 -23.1760 -23.1760 -23.1696 -23.1696 -23.1672 -23.1672 -22.8648 -22.8648 -22.8585 -22.8585 -14.7942 -14.7942 -14.5941 -14.5941 -14.5927 -14.5927 -7.1388 -7.1388 -5.8565 -5.8565 -5.8446 -5.8446 -5.7789 -5.7789 -5.1289 -5.1289 -5.1112 -5.1112 -5.0647 -5.0647 -4.7811 -4.7811 -4.6452 -4.6452 -4.1406 -4.1406 -4.1133 -4.1133 -3.9867 -3.9867 -3.9357 -3.9357 -3.8212 -3.8212 -3.7998 -3.7998 -3.3095 -3.3095 -3.2299 -3.2299 -3.1983 -3.1983 -2.9696 -2.9696 -2.8456 -2.8456 -2.8346 -2.8346 -2.7979 -2.7979 -2.7893 -2.7893 -2.7483 -2.7483 -2.7434 -2.7434 -2.6990 -2.6990 -2.6908 -2.6908 k = 0.5000 0.1039 0.4654 ( 7114 PWs) bands (ev): -23.9597 -23.9597 -23.1766 -23.1766 -23.1693 -23.1693 -23.1669 -23.1669 -22.8644 -22.8644 -22.8586 -22.8586 -14.7946 -14.7946 -14.5940 -14.5940 -14.5923 -14.5923 -7.1428 -7.1428 -5.8525 -5.8525 -5.8400 -5.8400 -5.7791 -5.7791 -5.1348 -5.1348 -5.1162 -5.1162 -5.0667 -5.0667 -4.7859 -4.7859 -4.6614 -4.6614 -4.1264 -4.1264 -4.0977 -4.0977 -3.9867 -3.9867 -3.9357 -3.9357 -3.8181 -3.8181 -3.7970 -3.7970 -3.3077 -3.3077 -3.2329 -3.2329 -3.1959 -3.1959 -2.9746 -2.9746 -2.8480 -2.8480 -2.8391 -2.8391 -2.7958 -2.7958 -2.7873 -2.7873 -2.7446 -2.7446 -2.7401 -2.7401 -2.7004 -2.7004 -2.6912 -2.6912 k = 0.5000 0.1155 0.4491 ( 7120 PWs) bands (ev): -23.9599 -23.9599 -23.1772 -23.1772 -23.1689 -23.1689 -23.1666 -23.1666 -22.8641 -22.8641 -22.8587 -22.8587 -14.7949 -14.7949 -14.5940 -14.5940 -14.5919 -14.5919 -7.1470 -7.1470 -5.8482 -5.8482 -5.8350 -5.8350 -5.7793 -5.7793 -5.1411 -5.1411 -5.1217 -5.1217 -5.0688 -5.0688 -4.7906 -4.7906 -4.6775 -4.6775 -4.1129 -4.1129 -4.0825 -4.0825 -3.9863 -3.9863 -3.9344 -3.9344 -3.8148 -3.8148 -3.7940 -3.7940 -3.3057 -3.3057 -3.2361 -3.2361 -3.1932 -3.1932 -2.9803 -2.9803 -2.8514 -2.8514 -2.8430 -2.8430 -2.7934 -2.7934 -2.7847 -2.7847 -2.7412 -2.7412 -2.7369 -2.7369 -2.7016 -2.7016 -2.6917 -2.6917 k = 0.5000 0.1270 0.4327 ( 7112 PWs) bands (ev): -23.9601 -23.9601 -23.1778 -23.1778 -23.1685 -23.1685 -23.1663 -23.1663 -22.8637 -22.8637 -22.8588 -22.8588 -14.7953 -14.7953 -14.5939 -14.5939 -14.5915 -14.5915 -7.1514 -7.1514 -5.8438 -5.8438 -5.8299 -5.8299 -5.7795 -5.7795 -5.1477 -5.1477 -5.1276 -5.1276 -5.0708 -5.0708 -4.7950 -4.7950 -4.6935 -4.6935 -4.1003 -4.1003 -4.0687 -4.0687 -3.9854 -3.9854 -3.9311 -3.9311 -3.8114 -3.8114 -3.7907 -3.7907 -3.3037 -3.3037 -3.2396 -3.2396 -3.1904 -3.1904 -2.9868 -2.9868 -2.8555 -2.8555 -2.8465 -2.8465 -2.7908 -2.7908 -2.7815 -2.7815 -2.7381 -2.7381 -2.7337 -2.7337 -2.7026 -2.7026 -2.6921 -2.6921 k = 0.5000 0.1386 0.4164 ( 7120 PWs) bands (ev): -23.9603 -23.9603 -23.1784 -23.1784 -23.1681 -23.1681 -23.1660 -23.1660 -22.8633 -22.8633 -22.8589 -22.8589 -14.7957 -14.7957 -14.5938 -14.5938 -14.5910 -14.5910 -7.1558 -7.1558 -5.8393 -5.8393 -5.8247 -5.8247 -5.7796 -5.7796 -5.1545 -5.1545 -5.1337 -5.1337 -5.0727 -5.0727 -4.7991 -4.7991 -4.7091 -4.7091 -4.0891 -4.0891 -4.0570 -4.0570 -3.9836 -3.9836 -3.9252 -3.9252 -3.8079 -3.8079 -3.7873 -3.7873 -3.3017 -3.3017 -3.2433 -3.2433 -3.1875 -3.1875 -2.9940 -2.9940 -2.8600 -2.8600 -2.8496 -2.8496 -2.7882 -2.7882 -2.7781 -2.7781 -2.7353 -2.7353 -2.7307 -2.7307 -2.7032 -2.7032 -2.6926 -2.6926 k = 0.5000 0.1501 0.4001 ( 7124 PWs) bands (ev): -23.9606 -23.9606 -23.1790 -23.1790 -23.1678 -23.1678 -23.1658 -23.1658 -22.8629 -22.8629 -22.8590 -22.8590 -14.7961 -14.7961 -14.5937 -14.5937 -14.5906 -14.5906 -7.1603 -7.1603 -5.8347 -5.8347 -5.8195 -5.8195 -5.7797 -5.7797 -5.1614 -5.1614 -5.1399 -5.1399 -5.0745 -5.0745 -4.8029 -4.8029 -4.7241 -4.7241 -4.0797 -4.0797 -4.0481 -4.0481 -3.9810 -3.9810 -3.9162 -3.9162 -3.8044 -3.8044 -3.7837 -3.7837 -3.2997 -3.2997 -3.2470 -3.2470 -3.1845 -3.1845 -3.0018 -3.0018 -2.8646 -2.8646 -2.8526 -2.8526 -2.7855 -2.7855 -2.7745 -2.7745 -2.7328 -2.7328 -2.7278 -2.7278 -2.7033 -2.7033 -2.6931 -2.6931 k = 0.5000 0.1617 0.3838 ( 7120 PWs) bands (ev): -23.9608 -23.9608 -23.1796 -23.1796 -23.1674 -23.1674 -23.1655 -23.1655 -22.8625 -22.8625 -22.8592 -22.8592 -14.7965 -14.7965 -14.5937 -14.5937 -14.5902 -14.5902 -7.1646 -7.1646 -5.8301 -5.8301 -5.8144 -5.8144 -5.7796 -5.7796 -5.1683 -5.1683 -5.1462 -5.1462 -5.0762 -5.0762 -4.8063 -4.8063 -4.7384 -4.7384 -4.0720 -4.0720 -4.0420 -4.0420 -3.9775 -3.9775 -3.9043 -3.9043 -3.8009 -3.8009 -3.7800 -3.7800 -3.2978 -3.2978 -3.2506 -3.2506 -3.1816 -3.1816 -3.0101 -3.0101 -2.8691 -2.8691 -2.8555 -2.8555 -2.7829 -2.7829 -2.7711 -2.7711 -2.7305 -2.7305 -2.7251 -2.7251 -2.7032 -2.7032 -2.6937 -2.6937 k = 0.5000 0.1732 0.3674 ( 7118 PWs) bands (ev): -23.9610 -23.9610 -23.1801 -23.1801 -23.1670 -23.1670 -23.1653 -23.1653 -22.8621 -22.8621 -22.8593 -22.8593 -14.7968 -14.7968 -14.5936 -14.5936 -14.5897 -14.5897 -7.1689 -7.1689 -5.8257 -5.8257 -5.8095 -5.8095 -5.7794 -5.7794 -5.1750 -5.1750 -5.1524 -5.1524 -5.0778 -5.0778 -4.8093 -4.8093 -4.7518 -4.7518 -4.0663 -4.0663 -4.0384 -4.0384 -3.9731 -3.9731 -3.8900 -3.8900 -3.7975 -3.7975 -3.7762 -3.7762 -3.2961 -3.2961 -3.2541 -3.2541 -3.1787 -3.1787 -3.0188 -3.0188 -2.8734 -2.8734 -2.8582 -2.8582 -2.7803 -2.7803 -2.7680 -2.7680 -2.7282 -2.7282 -2.7225 -2.7225 -2.7027 -2.7027 -2.6943 -2.6943 k = 0.5000 0.1848 0.3511 ( 7114 PWs) bands (ev): -23.9612 -23.9612 -23.1806 -23.1806 -23.1667 -23.1667 -23.1651 -23.1651 -22.8618 -22.8618 -22.8594 -22.8594 -14.7972 -14.7972 -14.5935 -14.5935 -14.5893 -14.5893 -7.1729 -7.1729 -5.8214 -5.8214 -5.8050 -5.8050 -5.7791 -5.7791 -5.1814 -5.1814 -5.1584 -5.1584 -5.0792 -5.0792 -4.8119 -4.8119 -4.7641 -4.7641 -4.0622 -4.0622 -4.0367 -4.0367 -3.9680 -3.9680 -3.8743 -3.8743 -3.7943 -3.7943 -3.7725 -3.7725 -3.2946 -3.2946 -3.2575 -3.2575 -3.1760 -3.1760 -3.0278 -3.0278 -2.8774 -2.8774 -2.8608 -2.8608 -2.7778 -2.7778 -2.7652 -2.7652 -2.7260 -2.7260 -2.7201 -2.7201 -2.7019 -2.7019 -2.6948 -2.6948 k = 0.5000 0.1963 0.3348 ( 7112 PWs) bands (ev): -23.9614 -23.9614 -23.1811 -23.1811 -23.1664 -23.1664 -23.1650 -23.1650 -22.8614 -22.8614 -22.8595 -22.8595 -14.7975 -14.7975 -14.5935 -14.5935 -14.5889 -14.5889 -7.1767 -7.1767 -5.8174 -5.8174 -5.8009 -5.8009 -5.7785 -5.7785 -5.1875 -5.1875 -5.1642 -5.1642 -5.0806 -5.0806 -4.8142 -4.8142 -4.7754 -4.7754 -4.0596 -4.0596 -4.0363 -4.0363 -3.9625 -3.9625 -3.8579 -3.8579 -3.7912 -3.7912 -3.7690 -3.7690 -3.2933 -3.2933 -3.2605 -3.2605 -3.1734 -3.1734 -3.0369 -3.0369 -2.8812 -2.8812 -2.8631 -2.8631 -2.7754 -2.7754 -2.7629 -2.7629 -2.7237 -2.7237 -2.7179 -2.7179 -2.7010 -2.7010 -2.6953 -2.6953 k = 0.5000 0.2078 0.3184 ( 7108 PWs) bands (ev): -23.9616 -23.9616 -23.1815 -23.1815 -23.1661 -23.1661 -23.1648 -23.1648 -22.8611 -22.8611 -22.8596 -22.8596 -14.7978 -14.7978 -14.5934 -14.5934 -14.5886 -14.5886 -7.1801 -7.1801 -5.8137 -5.8137 -5.7973 -5.7973 -5.7776 -5.7776 -5.1932 -5.1932 -5.1695 -5.1695 -5.0818 -5.0818 -4.8163 -4.8163 -4.7854 -4.7854 -4.0581 -4.0581 -4.0367 -4.0367 -3.9569 -3.9569 -3.8418 -3.8418 -3.7884 -3.7884 -3.7655 -3.7655 -3.2924 -3.2924 -3.2631 -3.2631 -3.1711 -3.1711 -3.0458 -3.0458 -2.8846 -2.8846 -2.8653 -2.8653 -2.7733 -2.7733 -2.7610 -2.7610 -2.7215 -2.7215 -2.7158 -2.7158 -2.7001 -2.7001 -2.6958 -2.6958 k = 0.5000 0.2194 0.3021 ( 7104 PWs) bands (ev): -23.9617 -23.9617 -23.1818 -23.1818 -23.1658 -23.1658 -23.1646 -23.1646 -22.8608 -22.8608 -22.8597 -22.8597 -14.7981 -14.7981 -14.5933 -14.5933 -14.5883 -14.5883 -7.1832 -7.1832 -5.8105 -5.8105 -5.7943 -5.7943 -5.7765 -5.7765 -5.1983 -5.1983 -5.1743 -5.1743 -5.0828 -5.0828 -4.8181 -4.8181 -4.7942 -4.7942 -4.0574 -4.0574 -4.0375 -4.0375 -3.9515 -3.9515 -3.8265 -3.8265 -3.7858 -3.7858 -3.7623 -3.7623 -3.2918 -3.2918 -3.2652 -3.2652 -3.1690 -3.1690 -3.0542 -3.0542 -2.8876 -2.8876 -2.8672 -2.8672 -2.7715 -2.7715 -2.7594 -2.7594 -2.7194 -2.7194 -2.7139 -2.7139 -2.6992 -2.6992 -2.6963 -2.6963 k = 0.5000 0.2309 0.2858 ( 7106 PWs) bands (ev): -23.9619 -23.9619 -23.1822 -23.1822 -23.1656 -23.1656 -23.1645 -23.1645 -22.8606 -22.8606 -22.8598 -22.8598 -14.7984 -14.7984 -14.5933 -14.5933 -14.5880 -14.5880 -7.1859 -7.1859 -5.8078 -5.8078 -5.7919 -5.7919 -5.7752 -5.7752 -5.2028 -5.2028 -5.1786 -5.1786 -5.0838 -5.0838 -4.8198 -4.8198 -4.8014 -4.8014 -4.0573 -4.0573 -4.0385 -4.0385 -3.9466 -3.9466 -3.8128 -3.8128 -3.7834 -3.7834 -3.7594 -3.7594 -3.2916 -3.2916 -3.2669 -3.2669 -3.1671 -3.1671 -3.0620 -3.0620 -2.8902 -2.8902 -2.8688 -2.8688 -2.7699 -2.7699 -2.7581 -2.7581 -2.7176 -2.7176 -2.7122 -2.7122 -2.6985 -2.6985 -2.6966 -2.6966 k = 0.5000 0.2425 0.2694 ( 7110 PWs) bands (ev): -23.9620 -23.9620 -23.1824 -23.1824 -23.1655 -23.1655 -23.1644 -23.1644 -22.8604 -22.8604 -22.8599 -22.8599 -14.7986 -14.7986 -14.5933 -14.5933 -14.5878 -14.5878 -7.1882 -7.1882 -5.8056 -5.8056 -5.7900 -5.7900 -5.7739 -5.7739 -5.2066 -5.2066 -5.1822 -5.1822 -5.0845 -5.0845 -4.8214 -4.8214 -4.8071 -4.8071 -4.0575 -4.0575 -4.0394 -4.0394 -3.9423 -3.9423 -3.8012 -3.8012 -3.7811 -3.7811 -3.7568 -3.7568 -3.2916 -3.2916 -3.2680 -3.2680 -3.1656 -3.1656 -3.0689 -3.0689 -2.8924 -2.8924 -2.8702 -2.8702 -2.7687 -2.7687 -2.7570 -2.7570 -2.7161 -2.7161 -2.7107 -2.7107 -2.6979 -2.6979 -2.6967 -2.6967 k = 0.5000 0.2540 0.2531 ( 7116 PWs) bands (ev): -23.9621 -23.9621 -23.1826 -23.1826 -23.1654 -23.1654 -23.1643 -23.1643 -22.8602 -22.8602 -22.8599 -22.8599 -14.7987 -14.7987 -14.5932 -14.5932 -14.5876 -14.5876 -7.1900 -7.1900 -5.8040 -5.8040 -5.7885 -5.7885 -5.7727 -5.7727 -5.2096 -5.2096 -5.1850 -5.1850 -5.0851 -5.0851 -4.8231 -4.8231 -4.8112 -4.8112 -4.0578 -4.0578 -4.0402 -4.0402 -3.9389 -3.9389 -3.7923 -3.7923 -3.7790 -3.7790 -3.7545 -3.7545 -3.2919 -3.2919 -3.2688 -3.2688 -3.1643 -3.1643 -3.0745 -3.0745 -2.8942 -2.8942 -2.8713 -2.8713 -2.7678 -2.7678 -2.7561 -2.7561 -2.7150 -2.7150 -2.7094 -2.7094 -2.6977 -2.6977 -2.6965 -2.6965 k = 0.5000 0.2656 0.2368 ( 7126 PWs) bands (ev): -23.9622 -23.9622 -23.1828 -23.1828 -23.1653 -23.1653 -23.1642 -23.1642 -22.8601 -22.8601 -22.8600 -22.8600 -14.7988 -14.7988 -14.5932 -14.5932 -14.5874 -14.5874 -7.1913 -7.1913 -5.8029 -5.8029 -5.7875 -5.7875 -5.7717 -5.7717 -5.2118 -5.2118 -5.1871 -5.1871 -5.0856 -5.0856 -4.8246 -4.8246 -4.8138 -4.8138 -4.0581 -4.0581 -4.0409 -4.0409 -3.9364 -3.9364 -3.7865 -3.7865 -3.7767 -3.7767 -3.7528 -3.7528 -3.2922 -3.2922 -3.2693 -3.2693 -3.1635 -3.1635 -3.0788 -3.0788 -2.8954 -2.8954 -2.8720 -2.8720 -2.7672 -2.7672 -2.7554 -2.7554 -2.7142 -2.7142 -2.7084 -2.7084 -2.6976 -2.6976 -2.6963 -2.6963 k = 0.5000 0.2771 0.2205 ( 7130 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1642 -23.1642 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5874 -14.5874 -7.1921 -7.1921 -5.8022 -5.8022 -5.7868 -5.7868 -5.7711 -5.7711 -5.2131 -5.2131 -5.1884 -5.1884 -5.0858 -5.0858 -4.8258 -4.8258 -4.8151 -4.8151 -4.0583 -4.0583 -4.0412 -4.0412 -3.9349 -3.9349 -3.7837 -3.7837 -3.7746 -3.7746 -3.7516 -3.7516 -3.2924 -3.2924 -3.2695 -3.2695 -3.1629 -3.1629 -3.0814 -3.0814 -2.8962 -2.8962 -2.8725 -2.8725 -2.7669 -2.7669 -2.7550 -2.7550 -2.7138 -2.7138 -2.7078 -2.7078 -2.6975 -2.6975 -2.6961 -2.6961 k = 0.5000 0.2887 0.2041 ( 7120 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1641 -23.1641 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5873 -14.5873 -7.1923 -7.1923 -5.8020 -5.8020 -5.7866 -5.7866 -5.7709 -5.7709 -5.2135 -5.2135 -5.1888 -5.1888 -5.0859 -5.0859 -4.8262 -4.8262 -4.8155 -4.8155 -4.0584 -4.0584 -4.0414 -4.0414 -3.9344 -3.9344 -3.7829 -3.7829 -3.7738 -3.7738 -3.7511 -3.7511 -3.2925 -3.2925 -3.2696 -3.2696 -3.1627 -3.1627 -3.0823 -3.0823 -2.8964 -2.8964 -2.8726 -2.8726 -2.7668 -2.7668 -2.7549 -2.7549 -2.7136 -2.7136 -2.7076 -2.7076 -2.6975 -2.6975 -2.6960 -2.6960 k = 0.5000 0.2887 0.2041 ( 7120 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1641 -23.1641 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5873 -14.5873 -7.1923 -7.1923 -5.8020 -5.8020 -5.7866 -5.7866 -5.7709 -5.7709 -5.2135 -5.2135 -5.1888 -5.1888 -5.0859 -5.0859 -4.8262 -4.8262 -4.8155 -4.8155 -4.0584 -4.0584 -4.0414 -4.0414 -3.9344 -3.9344 -3.7829 -3.7829 -3.7738 -3.7738 -3.7511 -3.7511 -3.2925 -3.2925 -3.2696 -3.2696 -3.1627 -3.1627 -3.0823 -3.0823 -2.8964 -2.8964 -2.8726 -2.8726 -2.7668 -2.7668 -2.7549 -2.7549 -2.7136 -2.7136 -2.7076 -2.7076 -2.6975 -2.6975 -2.6960 -2.6960 k = 0.4943 0.2854 0.2227 ( 7132 PWs) bands (ev): -23.9622 -23.9622 -23.1829 -23.1829 -23.1652 -23.1652 -23.1642 -23.1642 -22.8600 -22.8600 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5874 -14.5874 -7.1921 -7.1921 -5.8022 -5.8022 -5.7868 -5.7868 -5.7711 -5.7711 -5.2131 -5.2131 -5.1884 -5.1884 -5.0858 -5.0858 -4.8258 -4.8258 -4.8151 -4.8151 -4.0583 -4.0583 -4.0413 -4.0413 -3.9349 -3.9349 -3.7837 -3.7837 -3.7746 -3.7746 -3.7516 -3.7516 -3.2924 -3.2924 -3.2695 -3.2695 -3.1629 -3.1629 -3.0814 -3.0814 -2.8962 -2.8962 -2.8725 -2.8725 -2.7669 -2.7669 -2.7550 -2.7550 -2.7138 -2.7138 -2.7078 -2.7078 -2.6975 -2.6975 -2.6961 -2.6961 k = 0.4886 0.2821 0.2412 ( 7124 PWs) bands (ev): -23.9622 -23.9622 -23.1828 -23.1828 -23.1653 -23.1653 -23.1642 -23.1642 -22.8601 -22.8601 -22.8600 -22.8600 -14.7989 -14.7989 -14.5932 -14.5932 -14.5874 -14.5874 -7.1913 -7.1913 -5.8028 -5.8028 -5.7874 -5.7874 -5.7717 -5.7717 -5.2118 -5.2118 -5.1872 -5.1872 -5.0856 -5.0856 -4.8247 -4.8247 -4.8138 -4.8138 -4.0581 -4.0581 -4.0409 -4.0409 -3.9363 -3.9363 -3.7864 -3.7864 -3.7766 -3.7766 -3.7527 -3.7527 -3.2922 -3.2922 -3.2693 -3.2693 -3.1634 -3.1634 -3.0789 -3.0789 -2.8954 -2.8954 -2.8720 -2.8720 -2.7672 -2.7672 -2.7554 -2.7554 -2.7142 -2.7142 -2.7084 -2.7084 -2.6976 -2.6976 -2.6963 -2.6963 k = 0.4830 0.2788 0.2598 ( 7120 PWs) bands (ev): -23.9621 -23.9621 -23.1826 -23.1826 -23.1654 -23.1654 -23.1643 -23.1643 -22.8602 -22.8602 -22.8599 -22.8599 -14.7987 -14.7987 -14.5932 -14.5932 -14.5876 -14.5876 -7.1901 -7.1901 -5.8039 -5.8039 -5.7884 -5.7884 -5.7726 -5.7726 -5.2097 -5.2097 -5.1852 -5.1852 -5.0852 -5.0852 -4.8232 -4.8232 -4.8114 -4.8114 -4.0578 -4.0578 -4.0403 -4.0403 -3.9388 -3.9388 -3.7918 -3.7918 -3.7791 -3.7791 -3.7544 -3.7544 -3.2919 -3.2919 -3.2688 -3.2688 -3.1643 -3.1643 -3.0748 -3.0748 -2.8942 -2.8942 -2.8713 -2.8713 -2.7678 -2.7678 -2.7561 -2.7561 -2.7149 -2.7149 -2.7093 -2.7093 -2.6976 -2.6976 -2.6965 -2.6965 k = 0.4773 0.2756 0.2784 ( 7107 PWs) bands (ev): -23.9620 -23.9620 -23.1824 -23.1824 -23.1655 -23.1655 -23.1644 -23.1644 -22.8604 -22.8604 -22.8599 -22.8599 -14.7986 -14.7986 -14.5933 -14.5933 -14.5878 -14.5878 -7.1883 -7.1883 -5.8055 -5.8055 -5.7898 -5.7898 -5.7739 -5.7739 -5.2068 -5.2068 -5.1824 -5.1824 -5.0846 -5.0846 -4.8215 -4.8215 -4.8075 -4.8075 -4.0575 -4.0575 -4.0395 -4.0395 -3.9421 -3.9421 -3.8002 -3.8002 -3.7817 -3.7817 -3.7563 -3.7563 -3.2916 -3.2916 -3.2681 -3.2681 -3.1655 -3.1655 -3.0693 -3.0693 -2.8925 -2.8925 -2.8703 -2.8703 -2.7687 -2.7687 -2.7569 -2.7569 -2.7160 -2.7160 -2.7106 -2.7106 -2.6977 -2.6977 -2.6969 -2.6969 k = 0.4716 0.2723 0.2969 ( 7105 PWs) bands (ev): -23.9619 -23.9619 -23.1822 -23.1822 -23.1656 -23.1656 -23.1645 -23.1645 -22.8606 -22.8606 -22.8598 -22.8598 -14.7984 -14.7984 -14.5933 -14.5933 -14.5880 -14.5880 -7.1861 -7.1861 -5.8077 -5.8077 -5.7914 -5.7914 -5.7753 -5.7753 -5.2031 -5.2031 -5.1789 -5.1789 -5.0838 -5.0838 -4.8199 -4.8199 -4.8020 -4.8020 -4.0573 -4.0573 -4.0386 -4.0386 -3.9462 -3.9462 -3.8111 -3.8111 -3.7849 -3.7849 -3.7581 -3.7581 -3.2915 -3.2915 -3.2670 -3.2670 -3.1670 -3.1670 -3.0626 -3.0626 -2.8904 -2.8904 -2.8689 -2.8689 -2.7699 -2.7699 -2.7578 -2.7578 -2.7176 -2.7176 -2.7120 -2.7120 -2.6977 -2.6977 -2.6972 -2.6972 k = 0.4659 0.2690 0.3155 ( 7109 PWs) bands (ev): -23.9618 -23.9618 -23.1819 -23.1819 -23.1658 -23.1658 -23.1646 -23.1646 -22.8608 -22.8608 -22.8597 -22.8597 -14.7981 -14.7981 -14.5933 -14.5933 -14.5882 -14.5882 -7.1835 -7.1835 -5.8105 -5.8105 -5.7932 -5.7932 -5.7770 -5.7770 -5.1988 -5.1988 -5.1748 -5.1748 -5.0829 -5.0829 -4.8182 -4.8182 -4.7950 -4.7950 -4.0573 -4.0573 -4.0377 -4.0377 -3.9510 -3.9510 -3.8240 -3.8240 -3.7889 -3.7889 -3.7598 -3.7598 -3.2917 -3.2917 -3.2655 -3.2655 -3.1687 -3.1687 -3.0551 -3.0551 -2.8879 -2.8879 -2.8673 -2.8673 -2.7716 -2.7716 -2.7588 -2.7588 -2.7197 -2.7197 -2.7136 -2.7136 -2.6980 -2.6980 -2.6973 -2.6973 k = 0.4602 0.2657 0.3340 ( 7111 PWs) bands (ev): -23.9616 -23.9616 -23.1815 -23.1815 -23.1661 -23.1661 -23.1648 -23.1648 -22.8611 -22.8611 -22.8596 -22.8596 -14.7979 -14.7979 -14.5934 -14.5934 -14.5885 -14.5885 -7.1805 -7.1805 -5.8140 -5.8140 -5.7951 -5.7951 -5.7788 -5.7788 -5.1938 -5.1938 -5.1701 -5.1701 -5.0819 -5.0819 -4.8164 -4.8164 -4.7866 -4.7866 -4.0577 -4.0577 -4.0371 -4.0371 -3.9562 -3.9562 -3.8385 -3.8385 -3.7937 -3.7937 -3.7611 -3.7611 -3.2922 -3.2922 -3.2636 -3.2636 -3.1708 -3.1708 -3.0469 -3.0469 -2.8849 -2.8849 -2.8655 -2.8655 -2.7738 -2.7738 -2.7597 -2.7597 -2.7223 -2.7223 -2.7153 -2.7153 -2.6984 -2.6984 -2.6972 -2.6972 k = 0.4545 0.2624 0.3526 ( 7109 PWs) bands (ev): -23.9614 -23.9614 -23.1811 -23.1811 -23.1664 -23.1664 -23.1649 -23.1649 -22.8614 -22.8614 -22.8595 -22.8595 -14.7976 -14.7976 -14.5935 -14.5935 -14.5889 -14.5889 -7.1771 -7.1771 -5.8179 -5.8179 -5.7972 -5.7972 -5.7807 -5.7807 -5.1883 -5.1883 -5.1649 -5.1649 -5.0807 -5.0807 -4.8143 -4.8143 -4.7769 -4.7769 -4.0587 -4.0587 -4.0370 -4.0370 -3.9617 -3.9617 -3.8540 -3.8540 -3.7991 -3.7991 -3.7620 -3.7620 -3.2929 -3.2929 -3.2613 -3.2613 -3.1730 -3.1730 -3.0383 -3.0383 -2.8816 -2.8816 -2.8634 -2.8634 -2.7765 -2.7765 -2.7605 -2.7605 -2.7253 -2.7253 -2.7170 -2.7170 -2.6987 -2.6987 -2.6971 -2.6971 k = 0.4489 0.2592 0.3711 ( 7108 PWs) bands (ev): -23.9612 -23.9612 -23.1807 -23.1807 -23.1667 -23.1667 -23.1651 -23.1651 -22.8617 -22.8617 -22.8594 -22.8594 -14.7973 -14.7973 -14.5935 -14.5935 -14.5893 -14.5893 -7.1734 -7.1734 -5.8223 -5.8223 -5.7993 -5.7993 -5.7827 -5.7827 -5.1823 -5.1823 -5.1593 -5.1593 -5.0794 -5.0794 -4.8119 -4.8119 -4.7661 -4.7661 -4.0605 -4.0605 -4.0377 -4.0377 -3.9673 -3.9673 -3.8699 -3.8699 -3.8051 -3.8051 -3.7626 -3.7626 -3.2939 -3.2939 -3.2587 -3.2587 -3.1753 -3.1753 -3.0297 -3.0297 -2.8779 -2.8779 -2.8610 -2.8610 -2.7797 -2.7797 -2.7612 -2.7612 -2.7286 -2.7286 -2.7189 -2.7189 -2.6990 -2.6990 -2.6969 -2.6969 k = 0.4432 0.2559 0.3897 ( 7105 PWs) bands (ev): -23.9610 -23.9610 -23.1802 -23.1802 -23.1670 -23.1670 -23.1652 -23.1652 -22.8621 -22.8621 -22.8592 -22.8592 -14.7969 -14.7969 -14.5936 -14.5936 -14.5896 -14.5896 -7.1695 -7.1695 -5.8270 -5.8270 -5.8015 -5.8015 -5.7849 -5.7849 -5.1760 -5.1760 -5.1534 -5.1534 -5.0779 -5.0779 -4.8091 -4.8091 -4.7543 -4.7543 -4.0633 -4.0633 -4.0395 -4.0395 -3.9729 -3.9729 -3.8854 -3.8854 -3.8114 -3.8114 -3.7630 -3.7630 -3.2950 -3.2950 -3.2560 -3.2560 -3.1778 -3.1778 -3.0213 -3.0213 -2.8739 -2.8739 -2.8584 -2.8584 -2.7833 -2.7833 -2.7618 -2.7618 -2.7320 -2.7320 -2.7210 -2.7210 -2.6992 -2.6992 -2.6967 -2.6967 k = 0.4375 0.2526 0.4082 ( 7099 PWs) bands (ev): -23.9608 -23.9608 -23.1797 -23.1797 -23.1674 -23.1674 -23.1654 -23.1654 -22.8625 -22.8625 -22.8591 -22.8591 -14.7965 -14.7965 -14.5937 -14.5937 -14.5901 -14.5901 -7.1653 -7.1653 -5.8319 -5.8319 -5.8038 -5.8038 -5.7873 -5.7873 -5.1695 -5.1695 -5.1474 -5.1474 -5.0763 -5.0763 -4.8059 -4.8059 -4.7415 -4.7415 -4.0676 -4.0676 -4.0425 -4.0425 -3.9789 -3.9789 -3.8995 -3.8995 -3.8176 -3.8176 -3.7632 -3.7632 -3.2963 -3.2963 -3.2534 -3.2534 -3.1801 -3.1801 -3.0132 -3.0132 -2.8698 -2.8698 -2.8555 -2.8555 -2.7873 -2.7873 -2.7623 -2.7623 -2.7356 -2.7356 -2.7232 -2.7232 -2.6993 -2.6993 -2.6965 -2.6965 k = 0.4318 0.2493 0.4268 ( 7097 PWs) bands (ev): -23.9606 -23.9606 -23.1791 -23.1791 -23.1678 -23.1678 -23.1656 -23.1656 -22.8629 -22.8629 -22.8590 -22.8590 -14.7962 -14.7962 -14.5938 -14.5938 -14.5905 -14.5905 -7.1610 -7.1610 -5.8366 -5.8366 -5.8062 -5.8062 -5.7898 -5.7898 -5.1629 -5.1629 -5.1412 -5.1412 -5.0746 -5.0746 -4.8020 -4.8020 -4.7281 -4.7281 -4.0737 -4.0737 -4.0467 -4.0467 -3.9861 -3.9861 -3.9109 -3.9109 -3.8237 -3.8237 -3.7634 -3.7634 -3.2976 -3.2976 -3.2509 -3.2509 -3.1824 -3.1824 -3.0058 -3.0058 -2.8656 -2.8656 -2.8523 -2.8523 -2.7915 -2.7915 -2.7627 -2.7627 -2.7392 -2.7392 -2.7255 -2.7255 -2.6992 -2.6992 -2.6963 -2.6963 k = 0.4261 0.2460 0.4454 ( 7096 PWs) bands (ev): -23.9604 -23.9604 -23.1786 -23.1786 -23.1682 -23.1682 -23.1657 -23.1657 -22.8634 -22.8634 -22.8588 -22.8588 -14.7958 -14.7958 -14.5939 -14.5939 -14.5909 -14.5909 -7.1566 -7.1566 -5.8413 -5.8413 -5.8088 -5.8088 -5.7926 -5.7926 -5.1563 -5.1563 -5.1351 -5.1351 -5.0727 -5.0727 -4.7976 -4.7976 -4.7142 -4.7142 -4.0816 -4.0816 -4.0517 -4.0517 -3.9954 -3.9954 -3.9186 -3.9186 -3.8293 -3.8293 -3.7634 -3.7634 -3.2989 -3.2989 -3.2488 -3.2488 -3.1843 -3.1843 -2.9992 -2.9992 -2.8615 -2.8615 -2.8487 -2.8487 -2.7959 -2.7959 -2.7631 -2.7631 -2.7426 -2.7426 -2.7279 -2.7279 -2.6991 -2.6991 -2.6960 -2.6960 k = 0.4205 0.2427 0.4639 ( 7098 PWs) bands (ev): -23.9602 -23.9602 -23.1780 -23.1780 -23.1687 -23.1687 -23.1659 -23.1659 -22.8638 -22.8638 -22.8586 -22.8586 -14.7954 -14.7954 -14.5940 -14.5940 -14.5913 -14.5913 -7.1522 -7.1522 -5.8456 -5.8456 -5.8116 -5.8116 -5.7955 -5.7955 -5.1499 -5.1499 -5.1290 -5.1290 -5.0707 -5.0707 -4.7925 -4.7925 -4.6999 -4.6999 -4.0913 -4.0913 -4.0574 -4.0574 -4.0071 -4.0071 -3.9222 -3.9222 -3.8343 -3.8343 -3.7634 -3.7634 -3.3003 -3.3003 -3.2472 -3.2472 -3.1858 -3.1858 -2.9936 -2.9936 -2.8578 -2.8578 -2.8446 -2.8446 -2.8002 -2.8002 -2.7634 -2.7634 -2.7459 -2.7459 -2.7305 -2.7305 -2.6989 -2.6989 -2.6957 -2.6957 k = 0.4148 0.2395 0.4825 ( 7092 PWs) bands (ev): -23.9599 -23.9599 -23.1774 -23.1774 -23.1691 -23.1691 -23.1661 -23.1661 -22.8642 -22.8642 -22.8584 -22.8584 -14.7950 -14.7950 -14.5941 -14.5941 -14.5916 -14.5916 -7.1477 -7.1477 -5.8495 -5.8495 -5.8146 -5.8146 -5.7986 -5.7986 -5.1438 -5.1438 -5.1231 -5.1231 -5.0686 -5.0686 -4.7866 -4.7866 -4.6857 -4.6857 -4.1022 -4.1022 -4.0638 -4.0638 -4.0206 -4.0206 -3.9224 -3.9224 -3.8387 -3.8387 -3.7634 -3.7634 -3.3015 -3.3015 -3.2463 -3.2463 -3.1867 -3.1867 -2.9890 -2.9890 -2.8547 -2.8547 -2.8401 -2.8401 -2.8043 -2.8043 -2.7637 -2.7637 -2.7489 -2.7489 -2.7332 -2.7332 -2.6988 -2.6988 -2.6952 -2.6952 k = 0.4091 0.2362 0.5010 ( 7099 PWs) bands (ev): -23.9598 -23.9598 -23.1768 -23.1768 -23.1695 -23.1695 -23.1663 -23.1663 -22.8647 -22.8647 -22.8583 -22.8583 -14.7947 -14.7947 -14.5943 -14.5943 -14.5919 -14.5919 -7.1434 -7.1434 -5.8529 -5.8529 -5.8178 -5.8178 -5.8020 -5.8020 -5.1382 -5.1382 -5.1175 -5.1175 -5.0664 -5.0664 -4.7800 -4.7800 -4.6716 -4.6716 -4.1140 -4.1140 -4.0710 -4.0710 -4.0349 -4.0349 -3.9201 -3.9201 -3.8422 -3.8422 -3.7634 -3.7634 -3.3026 -3.3026 -3.2462 -3.2462 -3.1869 -3.1869 -2.9854 -2.9854 -2.8525 -2.8525 -2.8351 -2.8351 -2.8077 -2.8077 -2.7639 -2.7639 -2.7516 -2.7516 -2.7359 -2.7359 -2.6988 -2.6988 -2.6945 -2.6945 k = 0.4034 0.2329 0.5196 ( 7104 PWs) bands (ev): -23.9596 -23.9596 -23.1762 -23.1762 -23.1700 -23.1700 -23.1665 -23.1665 -22.8651 -22.8651 -22.8581 -22.8581 -14.7944 -14.7944 -14.5945 -14.5945 -14.5921 -14.5921 -7.1392 -7.1392 -5.8556 -5.8556 -5.8212 -5.8212 -5.8055 -5.8055 -5.1334 -5.1334 -5.1121 -5.1121 -5.0641 -5.0641 -4.7725 -4.7725 -4.6583 -4.6583 -4.1258 -4.1258 -4.0790 -4.0790 -4.0493 -4.0493 -3.9161 -3.9161 -3.8448 -3.8448 -3.7634 -3.7634 -3.3036 -3.3036 -3.2469 -3.2469 -3.1864 -3.1864 -2.9829 -2.9829 -2.8514 -2.8514 -2.8300 -2.8300 -2.8102 -2.8102 -2.7642 -2.7642 -2.7538 -2.7538 -2.7386 -2.7386 -2.6990 -2.6990 -2.6936 -2.6936 k = 0.3977 0.2296 0.5381 ( 7101 PWs) bands (ev): -23.9594 -23.9594 -23.1757 -23.1757 -23.1704 -23.1704 -23.1667 -23.1667 -22.8655 -22.8655 -22.8579 -22.8579 -14.7941 -14.7941 -14.5947 -14.5947 -14.5923 -14.5923 -7.1352 -7.1352 -5.8576 -5.8576 -5.8248 -5.8248 -5.8093 -5.8093 -5.1292 -5.1292 -5.1071 -5.1071 -5.0619 -5.0619 -4.7641 -4.7641 -4.6459 -4.6459 -4.1371 -4.1371 -4.0880 -4.0880 -4.0632 -4.0632 -3.9109 -3.9109 -3.8466 -3.8466 -3.7635 -3.7635 -3.3045 -3.3045 -3.2484 -3.2484 -3.1852 -3.1852 -2.9815 -2.9815 -2.8514 -2.8514 -2.8252 -2.8252 -2.8112 -2.8112 -2.7645 -2.7645 -2.7555 -2.7555 -2.7413 -2.7413 -2.6993 -2.6993 -2.6927 -2.6927 k = 0.3920 0.2263 0.5567 ( 7091 PWs) bands (ev): -23.9593 -23.9593 -23.1751 -23.1751 -23.1707 -23.1707 -23.1668 -23.1668 -22.8659 -22.8659 -22.8577 -22.8577 -14.7938 -14.7938 -14.5950 -14.5950 -14.5924 -14.5924 -7.1314 -7.1314 -5.8589 -5.8589 -5.8286 -5.8286 -5.8132 -5.8132 -5.1260 -5.1260 -5.1025 -5.1025 -5.0597 -5.0597 -4.7548 -4.7548 -4.6351 -4.6351 -4.1472 -4.1472 -4.0978 -4.0978 -4.0762 -4.0762 -3.9050 -3.9050 -3.8476 -3.8476 -3.7636 -3.7636 -3.3052 -3.3052 -3.2505 -3.2505 -3.1834 -3.1834 -2.9810 -2.9810 -2.8526 -2.8526 -2.8210 -2.8210 -2.8106 -2.8106 -2.7648 -2.7648 -2.7566 -2.7566 -2.7440 -2.7440 -2.6997 -2.6997 -2.6917 -2.6917 k = 0.3864 0.2231 0.5753 ( 7093 PWs) bands (ev): -23.9591 -23.9591 -23.1746 -23.1746 -23.1710 -23.1710 -23.1670 -23.1670 -22.8662 -22.8662 -22.8575 -22.8575 -14.7936 -14.7936 -14.5952 -14.5952 -14.5924 -14.5924 -7.1279 -7.1279 -5.8594 -5.8594 -5.8327 -5.8327 -5.8173 -5.8173 -5.1236 -5.1236 -5.0984 -5.0984 -5.0578 -5.0578 -4.7446 -4.7446 -4.6261 -4.6261 -4.1556 -4.1556 -4.1082 -4.1082 -4.0880 -4.0880 -3.8985 -3.8985 -3.8479 -3.8479 -3.7638 -3.7638 -3.3058 -3.3058 -3.2531 -3.2531 -3.1812 -3.1812 -2.9813 -2.9813 -2.8547 -2.8547 -2.8175 -2.8175 -2.8085 -2.8085 -2.7650 -2.7650 -2.7573 -2.7573 -2.7466 -2.7466 -2.7002 -2.7002 -2.6906 -2.6906 k = 0.3807 0.2198 0.5938 ( 7097 PWs) bands (ev): -23.9590 -23.9590 -23.1742 -23.1742 -23.1712 -23.1712 -23.1672 -23.1672 -22.8666 -22.8666 -22.8573 -22.8573 -14.7934 -14.7934 -14.5955 -14.5955 -14.5924 -14.5924 -7.1247 -7.1247 -5.8590 -5.8590 -5.8370 -5.8370 -5.8215 -5.8215 -5.1220 -5.1220 -5.0949 -5.0949 -5.0562 -5.0562 -4.7335 -4.7335 -4.6196 -4.6196 -4.1619 -4.1619 -4.1187 -4.1187 -4.0988 -4.0988 -3.8917 -3.8917 -3.8475 -3.8475 -3.7640 -3.7640 -3.3062 -3.3062 -3.2560 -3.2560 -3.1786 -3.1786 -2.9823 -2.9823 -2.8574 -2.8574 -2.8145 -2.8145 -2.8058 -2.8058 -2.7649 -2.7649 -2.7575 -2.7575 -2.7490 -2.7490 -2.7008 -2.7008 -2.6897 -2.6897 k = 0.3750 0.2165 0.6124 ( 7094 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8580 -5.8580 -5.8415 -5.8415 -5.8258 -5.8258 -5.1213 -5.1213 -5.0921 -5.0921 -5.0550 -5.0550 -4.7216 -4.7216 -4.6158 -4.6158 -4.1659 -4.1659 -4.1285 -4.1285 -4.1087 -4.1087 -3.8847 -3.8847 -3.8466 -3.8466 -3.7643 -3.7643 -3.3064 -3.3064 -3.2592 -3.2592 -3.1758 -3.1758 -2.9838 -2.9838 -2.8604 -2.8604 -2.8116 -2.8116 -2.8034 -2.8034 -2.7644 -2.7644 -2.7574 -2.7574 -2.7509 -2.7509 -2.7014 -2.7014 -2.6890 -2.6890 k = 0.6250-0.0722 0.4082 ( 7094 PWs) bands (ev): -23.9590 -23.9590 -23.1739 -23.1739 -23.1713 -23.1713 -23.1674 -23.1674 -22.8669 -22.8669 -22.8571 -22.8571 -14.7933 -14.7933 -14.5957 -14.5957 -14.5923 -14.5923 -7.1219 -7.1219 -5.8580 -5.8580 -5.8415 -5.8415 -5.8258 -5.8258 -5.1213 -5.1213 -5.0921 -5.0921 -5.0550 -5.0550 -4.7216 -4.7216 -4.6158 -4.6158 -4.1659 -4.1659 -4.1285 -4.1285 -4.1087 -4.1087 -3.8847 -3.8847 -3.8466 -3.8466 -3.7643 -3.7643 -3.3064 -3.3064 -3.2592 -3.2592 -3.1758 -3.1758 -2.9838 -2.9838 -2.8604 -2.8604 -2.8116 -2.8116 -2.8034 -2.8034 -2.7644 -2.7644 -2.7574 -2.7574 -2.7509 -2.7509 -2.7014 -2.7014 -2.6890 -2.6890 k = 0.6154-0.0888 0.4082 ( 7084 PWs) bands (ev): -23.9589 -23.9589 -23.1735 -23.1735 -23.1714 -23.1714 -23.1677 -23.1677 -22.8673 -22.8673 -22.8568 -22.8568 -14.7932 -14.7932 -14.5961 -14.5961 -14.5921 -14.5921 -7.1175 -7.1175 -5.8560 -5.8560 -5.8492 -5.8492 -5.8327 -5.8327 -5.1210 -5.1210 -5.0881 -5.0881 -5.0537 -5.0537 -4.7005 -4.7005 -4.6116 -4.6116 -4.1720 -4.1720 -4.1426 -4.1426 -4.1245 -4.1245 -3.8729 -3.8729 -3.8444 -3.8444 -3.7649 -3.7649 -3.3067 -3.3067 -3.2644 -3.2644 -3.1709 -3.1709 -2.9869 -2.9869 -2.8656 -2.8656 -2.8069 -2.8069 -2.7997 -2.7997 -2.7638 -2.7638 -2.7580 -2.7580 -2.7520 -2.7520 -2.7025 -2.7025 -2.6880 -2.6880 k = 0.6058-0.1055 0.4082 ( 7088 PWs) bands (ev): -23.9589 -23.9589 -23.1731 -23.1731 -23.1714 -23.1714 -23.1680 -23.1680 -22.8678 -22.8678 -22.8565 -22.8565 -14.7931 -14.7931 -14.5964 -14.5964 -14.5920 -14.5920 -7.1130 -7.1130 -5.8571 -5.8571 -5.8554 -5.8554 -5.8383 -5.8383 -5.1211 -5.1211 -5.0844 -5.0844 -5.0526 -5.0526 -4.6789 -4.6789 -4.6073 -4.6073 -4.1816 -4.1816 -4.1530 -4.1530 -4.1394 -4.1394 -3.8615 -3.8615 -3.8416 -3.8416 -3.7654 -3.7654 -3.3071 -3.3071 -3.2694 -3.2694 -3.1660 -3.1660 -2.9904 -2.9904 -2.8707 -2.8707 -2.8029 -2.8029 -2.7959 -2.7959 -2.7650 -2.7650 -2.7588 -2.7588 -2.7502 -2.7502 -2.7038 -2.7038 -2.6873 -2.6873 k = 0.5962-0.1221 0.4082 ( 7088 PWs) bands (ev): -23.9588 -23.9588 -23.1728 -23.1728 -23.1714 -23.1714 -23.1682 -23.1682 -22.8682 -22.8682 -22.8562 -22.8562 -14.7930 -14.7930 -14.5967 -14.5967 -14.5918 -14.5918 -7.1087 -7.1087 -5.8645 -5.8645 -5.8577 -5.8577 -5.8412 -5.8412 -5.1215 -5.1215 -5.0811 -5.0811 -5.0518 -5.0518 -4.6570 -4.6570 -4.6029 -4.6029 -4.1948 -4.1948 -4.1610 -4.1610 -4.1521 -4.1521 -3.8517 -3.8517 -3.8377 -3.8377 -3.7659 -3.7659 -3.3075 -3.3075 -3.2741 -3.2741 -3.1613 -3.1613 -2.9941 -2.9941 -2.8756 -2.8756 -2.7997 -2.7997 -2.7919 -2.7919 -2.7679 -2.7679 -2.7587 -2.7587 -2.7469 -2.7469 -2.7052 -2.7052 -2.6868 -2.6868 k = 0.5865-0.1388 0.4082 ( 7088 PWs) bands (ev): -23.9588 -23.9588 -23.1726 -23.1726 -23.1713 -23.1713 -23.1685 -23.1685 -22.8686 -22.8686 -22.8559 -22.8559 -14.7930 -14.7930 -14.5970 -14.5970 -14.5916 -14.5916 -7.1045 -7.1045 -5.8717 -5.8717 -5.8624 -5.8624 -5.8414 -5.8414 -5.1220 -5.1220 -5.0782 -5.0782 -5.0511 -5.0511 -4.6352 -4.6352 -4.5986 -4.5986 -4.2092 -4.2092 -4.1731 -4.1731 -4.1581 -4.1581 -3.8449 -3.8449 -3.8312 -3.8312 -3.7663 -3.7663 -3.3080 -3.3080 -3.2785 -3.2785 -3.1568 -3.1568 -2.9980 -2.9980 -2.8802 -2.8802 -2.7971 -2.7971 -2.7881 -2.7881 -2.7711 -2.7711 -2.7582 -2.7582 -2.7428 -2.7428 -2.7066 -2.7066 -2.6866 -2.6866 k = 0.5769-0.1554 0.4082 ( 7100 PWs) bands (ev): -23.9588 -23.9588 -23.1724 -23.1724 -23.1711 -23.1711 -23.1687 -23.1687 -22.8690 -22.8690 -22.8556 -22.8556 -14.7930 -14.7930 -14.5972 -14.5972 -14.5914 -14.5914 -7.1006 -7.1006 -5.8785 -5.8785 -5.8680 -5.8680 -5.8405 -5.8405 -5.1228 -5.1228 -5.0757 -5.0757 -5.0505 -5.0505 -4.6136 -4.6136 -4.5943 -4.5943 -4.2235 -4.2235 -4.1874 -4.1874 -4.1605 -4.1605 -3.8410 -3.8410 -3.8227 -3.8227 -3.7665 -3.7665 -3.3087 -3.3087 -3.2824 -3.2824 -3.1525 -3.1525 -3.0019 -3.0019 -2.8845 -2.8845 -2.7951 -2.7951 -2.7844 -2.7844 -2.7743 -2.7743 -2.7576 -2.7576 -2.7384 -2.7384 -2.7080 -2.7080 -2.6866 -2.6866 k = 0.5673-0.1721 0.4082 ( 7108 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1709 -23.1709 -23.1689 -23.1689 -22.8693 -22.8693 -22.8554 -22.8554 -14.7930 -14.7930 -14.5974 -14.5974 -14.5912 -14.5912 -7.0969 -7.0969 -5.8847 -5.8847 -5.8736 -5.8736 -5.8393 -5.8393 -5.1236 -5.1236 -5.0736 -5.0736 -5.0500 -5.0500 -4.5927 -4.5927 -4.5900 -4.5900 -4.2370 -4.2370 -4.2019 -4.2019 -4.1618 -4.1618 -3.8384 -3.8384 -3.8140 -3.8140 -3.7665 -3.7665 -3.3094 -3.3094 -3.2858 -3.2858 -3.1486 -3.1486 -3.0056 -3.0056 -2.8884 -2.8884 -2.7937 -2.7937 -2.7813 -2.7813 -2.7769 -2.7769 -2.7569 -2.7569 -2.7340 -2.7340 -2.7092 -2.7092 -2.6867 -2.6867 k = 0.5577-0.1887 0.4082 ( 7108 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1707 -23.1707 -23.1691 -23.1691 -22.8696 -22.8696 -22.8552 -22.8552 -14.7930 -14.7930 -14.5976 -14.5976 -14.5911 -14.5911 -7.0936 -7.0936 -5.8903 -5.8903 -5.8788 -5.8788 -5.8380 -5.8380 -5.1244 -5.1244 -5.0719 -5.0719 -5.0495 -5.0495 -4.5864 -4.5864 -4.5722 -4.5722 -4.2494 -4.2494 -4.2161 -4.2161 -4.1625 -4.1625 -3.8363 -3.8363 -3.8061 -3.8061 -3.7661 -3.7661 -3.3103 -3.3103 -3.2886 -3.2886 -3.1450 -3.1450 -3.0092 -3.0092 -2.8919 -2.8919 -2.7927 -2.7927 -2.7810 -2.7810 -2.7768 -2.7768 -2.7560 -2.7560 -2.7299 -2.7299 -2.7104 -2.7104 -2.6871 -2.6871 k = 0.5481-0.2054 0.4082 ( 7102 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1705 -23.1705 -23.1692 -23.1692 -22.8699 -22.8699 -22.8550 -22.8550 -14.7930 -14.7930 -14.5978 -14.5978 -14.5910 -14.5910 -7.0907 -7.0907 -5.8951 -5.8951 -5.8835 -5.8835 -5.8369 -5.8369 -5.1252 -5.1252 -5.0707 -5.0707 -5.0490 -5.0490 -4.5830 -4.5830 -4.5532 -4.5532 -4.2606 -4.2606 -4.2293 -4.2293 -4.1630 -4.1630 -3.8346 -3.8346 -3.7996 -3.7996 -3.7653 -3.7653 -3.3112 -3.3112 -3.2909 -3.2909 -3.1419 -3.1419 -3.0125 -3.0125 -2.8949 -2.8949 -2.7920 -2.7920 -2.7828 -2.7828 -2.7746 -2.7746 -2.7550 -2.7550 -2.7263 -2.7263 -2.7113 -2.7113 -2.6875 -2.6875 k = 0.5385-0.2221 0.4082 ( 7104 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1703 -23.1703 -23.1693 -23.1693 -22.8701 -22.8701 -22.8548 -22.8548 -14.7930 -14.7930 -14.5979 -14.5979 -14.5908 -14.5908 -7.0882 -7.0882 -5.8992 -5.8992 -5.8874 -5.8874 -5.8359 -5.8359 -5.1259 -5.1259 -5.0697 -5.0697 -5.0485 -5.0485 -4.5800 -4.5800 -4.5360 -4.5360 -4.2705 -4.2705 -4.2412 -4.2412 -4.1632 -4.1632 -3.8331 -3.8331 -3.7945 -3.7945 -3.7641 -3.7641 -3.3122 -3.3122 -3.2927 -3.2927 -3.1392 -3.1392 -3.0153 -3.0153 -2.8974 -2.8974 -2.7917 -2.7917 -2.7844 -2.7844 -2.7726 -2.7726 -2.7539 -2.7539 -2.7235 -2.7235 -2.7119 -2.7119 -2.6880 -2.6880 k = 0.5288-0.2387 0.4082 ( 7096 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1702 -23.1702 -23.1694 -23.1694 -22.8702 -22.8702 -22.8547 -22.8547 -14.7930 -14.7930 -14.5980 -14.5980 -14.5908 -14.5908 -7.0862 -7.0862 -5.9024 -5.9024 -5.8905 -5.8905 -5.8352 -5.8352 -5.1265 -5.1265 -5.0691 -5.0691 -5.0481 -5.0481 -4.5776 -4.5776 -4.5212 -4.5212 -4.2789 -4.2789 -4.2512 -4.2512 -4.1633 -4.1633 -3.8320 -3.8320 -3.7909 -3.7909 -3.7626 -3.7626 -3.3130 -3.3130 -3.2940 -3.2940 -3.1371 -3.1371 -3.0176 -3.0176 -2.8994 -2.8994 -2.7918 -2.7918 -2.7855 -2.7855 -2.7711 -2.7711 -2.7528 -2.7528 -2.7214 -2.7214 -2.7120 -2.7120 -2.6885 -2.6885 k = 0.5192-0.2554 0.4082 ( 7092 PWs) bands (ev): -23.9588 -23.9588 -23.1723 -23.1723 -23.1702 -23.1702 -23.1694 -23.1694 -22.8704 -22.8704 -22.8546 -22.8546 -14.7930 -14.7930 -14.5980 -14.5980 -14.5907 -14.5907 -7.0848 -7.0848 -5.9047 -5.9047 -5.8928 -5.8928 -5.8346 -5.8346 -5.1270 -5.1270 -5.0687 -5.0687 -5.0478 -5.0478 -4.5758 -4.5758 -4.5097 -4.5097 -4.2856 -4.2856 -4.2586 -4.2586 -4.1634 -4.1634 -3.8312 -3.8312 -3.7887 -3.7887 -3.7612 -3.7612 -3.3137 -3.3137 -3.2948 -3.2948 -3.1356 -3.1356 -3.0194 -3.0194 -2.9008 -2.9008 -2.7920 -2.7920 -2.7861 -2.7861 -2.7701 -2.7701 -2.7519 -2.7519 -2.7203 -2.7203 -2.7119 -2.7119 -2.6889 -2.6889 k = 0.5096-0.2720 0.4082 ( 7100 PWs) bands (ev): -23.9588 -23.9588 -23.1724 -23.1724 -23.1702 -23.1702 -23.1694 -23.1694 -22.8704 -22.8704 -22.8546 -22.8546 -14.7930 -14.7930 -14.5981 -14.5981 -14.5906 -14.5906 -7.0839 -7.0839 -5.9061 -5.9061 -5.8942 -5.8942 -5.8343 -5.8343 -5.1273 -5.1273 -5.0684 -5.0684 -5.0476 -5.0476 -4.5748 -4.5748 -4.5023 -4.5023 -4.2901 -4.2901 -4.2631 -4.2631 -4.1634 -4.1634 -3.8307 -3.8307 -3.7875 -3.7875 -3.7602 -3.7602 -3.3142 -3.3142 -3.2953 -3.2953 -3.1346 -3.1346 -3.0204 -3.0204 -2.9017 -2.9017 -2.7923 -2.7923 -2.7864 -2.7864 -2.7695 -2.7695 -2.7513 -2.7513 -2.7198 -2.7198 -2.7116 -2.7116 -2.6891 -2.6891 k = 0.5000-0.2887 0.4082 ( 7102 PWs) bands (ev): -23.9588 -23.9588 -23.1724 -23.1724 -23.1702 -23.1702 -23.1694 -23.1694 -22.8705 -22.8705 -22.8545 -22.8545 -14.7930 -14.7930 -14.5981 -14.5981 -14.5906 -14.5906 -7.0836 -7.0836 -5.9066 -5.9066 -5.8946 -5.8946 -5.8342 -5.8342 -5.1273 -5.1273 -5.0684 -5.0684 -5.0475 -5.0475 -4.5744 -4.5744 -4.4997 -4.4997 -4.2917 -4.2917 -4.2647 -4.2647 -4.1634 -4.1634 -3.8305 -3.8305 -3.7871 -3.7871 -3.7598 -3.7598 -3.3143 -3.3143 -3.2955 -3.2955 -3.1343 -3.1343 -3.0208 -3.0208 -2.9020 -2.9020 -2.7924 -2.7924 -2.7865 -2.7865 -2.7693 -2.7693 -2.7511 -2.7511 -2.7196 -2.7196 -2.7114 -2.7114 -2.6892 -2.6892 Writing output data file AlxNF2x3.save init_run : 1.08s CPU 1.20s WALL ( 1 calls) electrons : 153.42s CPU 156.08s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 153.42s CPU 156.07s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.08s WALL ( 241 calls) cegterg : 134.40s CPU 135.74s WALL ( 241 calls) Called by sum_band: Called by *egterg: h_psi : 99.38s CPU 100.49s WALL ( 2169 calls) s_psi : 5.27s CPU 5.32s WALL ( 2169 calls) g_psi : 0.25s CPU 0.27s WALL ( 1687 calls) cdiaghg : 28.01s CPU 28.35s WALL ( 1928 calls) cegterg:over : 6.95s CPU 6.98s WALL ( 1687 calls) cegterg:upda : 5.16s CPU 5.08s WALL ( 1687 calls) cegterg:last : 2.78s CPU 2.84s WALL ( 508 calls) cdiaghg:chol : 1.68s CPU 1.68s WALL ( 1928 calls) cdiaghg:inve : 1.21s CPU 1.19s WALL ( 1928 calls) cdiaghg:para : 2.16s CPU 2.19s WALL ( 3856 calls) Called by h_psi: h_psi:vloc : 89.70s CPU 90.74s WALL ( 2169 calls) h_psi:vnl : 9.44s CPU 9.48s WALL ( 2169 calls) add_vuspsi : 4.54s CPU 4.55s WALL ( 2169 calls) General routines calbec : 4.90s CPU 4.93s WALL ( 2169 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 84.36s CPU 85.42s WALL ( 557928 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.24s CPU 1.02s WALL ( 482 calls) Parallel routines fft_scatter : 27.29s CPU 27.59s WALL ( 557951 calls) PWSCF : 2m55.94s CPU 3m 7.97s WALL This run was terminated on: 19:30: 4 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=