Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:56:20 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: ./TiNi2Sn.save/ file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 40 40 11 1017 1017 154 Max 41 41 12 1020 1020 157 Sum 1459 1459 421 36685 36685 5601 bravais-lattice index = 14 lattice parameter (alat) = 8.1364 a.u. unit-cell volume = 380.8680 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.136354 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 Sn read from file: /users/gautes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 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. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 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 Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential Sn 14.00 118.71000 Sn( 1.00) Ni 10.00 58.69340 Ni( 1.00) Ti 12.00 47.86700 Ti( 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= 346 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028902 k( 2) = ( 0.0096154 -0.0055514 0.0078509), wk = 0.0028902 k( 3) = ( 0.0192308 -0.0111029 0.0157019), wk = 0.0028902 k( 4) = ( 0.0288462 -0.0166543 0.0235528), wk = 0.0028902 k( 5) = ( 0.0384615 -0.0222058 0.0314037), wk = 0.0028902 k( 6) = ( 0.0480769 -0.0277572 0.0392546), wk = 0.0028902 k( 7) = ( 0.0576923 -0.0333087 0.0471056), wk = 0.0028902 k( 8) = ( 0.0673077 -0.0388601 0.0549565), wk = 0.0028902 k( 9) = ( 0.0769231 -0.0444116 0.0628074), wk = 0.0028902 k( 10) = ( 0.0865385 -0.0499630 0.0706584), wk = 0.0028902 k( 11) = ( 0.0961538 -0.0555145 0.0785093), wk = 0.0028902 k( 12) = ( 0.1057692 -0.0610659 0.0863602), wk = 0.0028902 k( 13) = ( 0.1153846 -0.0666173 0.0942111), wk = 0.0028902 k( 14) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0028902 k( 15) = ( 0.1346154 -0.0777202 0.1099130), wk = 0.0028902 k( 16) = ( 0.1442308 -0.0832717 0.1177639), wk = 0.0028902 k( 17) = ( 0.1538461 -0.0888231 0.1256149), wk = 0.0028902 k( 18) = ( 0.1634615 -0.0943746 0.1334658), wk = 0.0028902 k( 19) = ( 0.1730769 -0.0999260 0.1413167), wk = 0.0028902 k( 20) = ( 0.1826923 -0.1054775 0.1491676), wk = 0.0028902 k( 21) = ( 0.1923077 -0.1110289 0.1570186), wk = 0.0028902 k( 22) = ( 0.2019231 -0.1165803 0.1648695), wk = 0.0028902 k( 23) = ( 0.2115385 -0.1221318 0.1727204), wk = 0.0028902 k( 24) = ( 0.2211539 -0.1276832 0.1805714), wk = 0.0028902 k( 25) = ( 0.2307692 -0.1332347 0.1884223), wk = 0.0028902 k( 26) = ( 0.2403846 -0.1387861 0.1962732), wk = 0.0028902 k( 27) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0028902 k( 28) = ( 0.2596154 -0.1498890 0.2119751), wk = 0.0028902 k( 29) = ( 0.2692308 -0.1554405 0.2198260), wk = 0.0028902 k( 30) = ( 0.2788462 -0.1609919 0.2276769), wk = 0.0028902 k( 31) = ( 0.2884615 -0.1665433 0.2355279), wk = 0.0028902 k( 32) = ( 0.2980769 -0.1720948 0.2433788), wk = 0.0028902 k( 33) = ( 0.3076923 -0.1776462 0.2512297), wk = 0.0028902 k( 34) = ( 0.3173077 -0.1831977 0.2590806), wk = 0.0028902 k( 35) = ( 0.3269231 -0.1887491 0.2669316), wk = 0.0028902 k( 36) = ( 0.3365385 -0.1943006 0.2747825), wk = 0.0028902 k( 37) = ( 0.3461538 -0.1998520 0.2826334), wk = 0.0028902 k( 38) = ( 0.3557692 -0.2054035 0.2904844), wk = 0.0028902 k( 39) = ( 0.3653846 -0.2109549 0.2983353), wk = 0.0028902 k( 40) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0028902 k( 41) = ( 0.3846154 -0.2220578 0.3140371), wk = 0.0028902 k( 42) = ( 0.3942308 -0.2276092 0.3218881), wk = 0.0028902 k( 43) = ( 0.4038462 -0.2331607 0.3297390), wk = 0.0028902 k( 44) = ( 0.4134615 -0.2387121 0.3375899), wk = 0.0028902 k( 45) = ( 0.4230769 -0.2442636 0.3454409), wk = 0.0028902 k( 46) = ( 0.4326923 -0.2498150 0.3532918), wk = 0.0028902 k( 47) = ( 0.4423077 -0.2553665 0.3611427), wk = 0.0028902 k( 48) = ( 0.4519231 -0.2609179 0.3689936), wk = 0.0028902 k( 49) = ( 0.4615385 -0.2664694 0.3768446), wk = 0.0028902 k( 50) = ( 0.4711538 -0.2720208 0.3846955), wk = 0.0028902 k( 51) = ( 0.4807692 -0.2775722 0.3925464), wk = 0.0028902 k( 52) = ( 0.4903846 -0.2831237 0.4003974), wk = 0.0028902 k( 53) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0028902 k( 54) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0028902 k( 55) = ( 0.5000000 -0.2775723 0.4160992), wk = 0.0028902 k( 56) = ( 0.5000000 -0.2664694 0.4239501), wk = 0.0028902 k( 57) = ( 0.5000000 -0.2553665 0.4318011), wk = 0.0028902 k( 58) = ( 0.5000000 -0.2442636 0.4396520), wk = 0.0028902 k( 59) = ( 0.5000000 -0.2331607 0.4475029), wk = 0.0028902 k( 60) = ( 0.5000000 -0.2220578 0.4553539), wk = 0.0028902 k( 61) = ( 0.5000000 -0.2109549 0.4632048), wk = 0.0028902 k( 62) = ( 0.5000000 -0.1998520 0.4710557), wk = 0.0028902 k( 63) = ( 0.5000000 -0.1887491 0.4789066), wk = 0.0028902 k( 64) = ( 0.5000000 -0.1776462 0.4867576), wk = 0.0028902 k( 65) = ( 0.5000000 -0.1665433 0.4946085), wk = 0.0028902 k( 66) = ( 0.5000000 -0.1554405 0.5024594), wk = 0.0028902 k( 67) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0028902 k( 68) = ( 0.5000000 -0.1332347 0.5181613), wk = 0.0028902 k( 69) = ( 0.5000000 -0.1221318 0.5260122), wk = 0.0028902 k( 70) = ( 0.5000000 -0.1110289 0.5338631), wk = 0.0028902 k( 71) = ( 0.5000000 -0.0999260 0.5417141), wk = 0.0028902 k( 72) = ( 0.5000000 -0.0888231 0.5495650), wk = 0.0028902 k( 73) = ( 0.5000000 -0.0777202 0.5574159), wk = 0.0028902 k( 74) = ( 0.5000000 -0.0666173 0.5652669), wk = 0.0028902 k( 75) = ( 0.5000000 -0.0555144 0.5731178), wk = 0.0028902 k( 76) = ( 0.5000000 -0.0444116 0.5809687), wk = 0.0028902 k( 77) = ( 0.5000000 -0.0333087 0.5888197), wk = 0.0028902 k( 78) = ( 0.5000000 -0.0222058 0.5966706), wk = 0.0028902 k( 79) = ( 0.5000000 -0.0111029 0.6045215), wk = 0.0028902 k( 80) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0028902 k( 81) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0028902 k( 82) = ( 0.4934211 0.0113951 0.6123724), wk = 0.0028902 k( 83) = ( 0.4868421 0.0227901 0.6123724), wk = 0.0028902 k( 84) = ( 0.4802632 0.0341852 0.6123724), wk = 0.0028902 k( 85) = ( 0.4736842 0.0455803 0.6123724), wk = 0.0028902 k( 86) = ( 0.4671053 0.0569754 0.6123724), wk = 0.0028902 k( 87) = ( 0.4605263 0.0683704 0.6123724), wk = 0.0028902 k( 88) = ( 0.4539474 0.0797655 0.6123724), wk = 0.0028902 k( 89) = ( 0.4473684 0.0911606 0.6123724), wk = 0.0028902 k( 90) = ( 0.4407895 0.1025556 0.6123724), wk = 0.0028902 k( 91) = ( 0.4342105 0.1139507 0.6123724), wk = 0.0028902 k( 92) = ( 0.4276316 0.1253458 0.6123724), wk = 0.0028902 k( 93) = ( 0.4210526 0.1367409 0.6123724), wk = 0.0028902 k( 94) = ( 0.4144737 0.1481359 0.6123724), wk = 0.0028902 k( 95) = ( 0.4078947 0.1595310 0.6123724), wk = 0.0028902 k( 96) = ( 0.4013158 0.1709261 0.6123724), wk = 0.0028902 k( 97) = ( 0.3947368 0.1823211 0.6123724), wk = 0.0028902 k( 98) = ( 0.3881579 0.1937162 0.6123724), wk = 0.0028902 k( 99) = ( 0.3815789 0.2051113 0.6123724), wk = 0.0028902 k( 100) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0028902 k( 101) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0028902 k( 102) = ( 0.3681818 0.2125699 0.6012384), wk = 0.0028902 k( 103) = ( 0.3613636 0.2086334 0.5901043), wk = 0.0028902 k( 104) = ( 0.3545454 0.2046969 0.5789703), wk = 0.0028902 k( 105) = ( 0.3477273 0.2007604 0.5678363), wk = 0.0028902 k( 106) = ( 0.3409091 0.1968240 0.5567022), wk = 0.0028902 k( 107) = ( 0.3340909 0.1928875 0.5455682), wk = 0.0028902 k( 108) = ( 0.3272727 0.1889510 0.5344341), wk = 0.0028902 k( 109) = ( 0.3204546 0.1850145 0.5233001), wk = 0.0028902 k( 110) = ( 0.3136364 0.1810780 0.5121660), wk = 0.0028902 k( 111) = ( 0.3068182 0.1771416 0.5010320), wk = 0.0028902 k( 112) = ( 0.3000000 0.1732051 0.4898979), wk = 0.0028902 k( 113) = ( 0.2931818 0.1692686 0.4787639), wk = 0.0028902 k( 114) = ( 0.2863636 0.1653321 0.4676299), wk = 0.0028902 k( 115) = ( 0.2795454 0.1613956 0.4564958), wk = 0.0028902 k( 116) = ( 0.2727273 0.1574592 0.4453618), wk = 0.0028902 k( 117) = ( 0.2659091 0.1535227 0.4342277), wk = 0.0028902 k( 118) = ( 0.2590909 0.1495862 0.4230937), wk = 0.0028902 k( 119) = ( 0.2522727 0.1456497 0.4119596), wk = 0.0028902 k( 120) = ( 0.2454545 0.1417133 0.4008256), wk = 0.0028902 k( 121) = ( 0.2386364 0.1377768 0.3896916), wk = 0.0028902 k( 122) = ( 0.2318182 0.1338403 0.3785575), wk = 0.0028902 k( 123) = ( 0.2250000 0.1299038 0.3674235), wk = 0.0028902 k( 124) = ( 0.2181818 0.1259673 0.3562894), wk = 0.0028902 k( 125) = ( 0.2113636 0.1220309 0.3451554), wk = 0.0028902 k( 126) = ( 0.2045454 0.1180944 0.3340213), wk = 0.0028902 k( 127) = ( 0.1977273 0.1141579 0.3228873), wk = 0.0028902 k( 128) = ( 0.1909091 0.1102214 0.3117532), wk = 0.0028902 k( 129) = ( 0.1840909 0.1062849 0.3006192), wk = 0.0028902 k( 130) = ( 0.1772727 0.1023485 0.2894851), wk = 0.0028902 k( 131) = ( 0.1704546 0.0984120 0.2783511), wk = 0.0028902 k( 132) = ( 0.1636364 0.0944755 0.2672171), wk = 0.0028902 k( 133) = ( 0.1568182 0.0905390 0.2560830), wk = 0.0028902 k( 134) = ( 0.1500000 0.0866025 0.2449490), wk = 0.0028902 k( 135) = ( 0.1431818 0.0826661 0.2338149), wk = 0.0028902 k( 136) = ( 0.1363636 0.0787296 0.2226809), wk = 0.0028902 k( 137) = ( 0.1295455 0.0747931 0.2115468), wk = 0.0028902 k( 138) = ( 0.1227273 0.0708566 0.2004128), wk = 0.0028902 k( 139) = ( 0.1159091 0.0669201 0.1892788), wk = 0.0028902 k( 140) = ( 0.1090909 0.0629837 0.1781447), wk = 0.0028902 k( 141) = ( 0.1022727 0.0590472 0.1670107), wk = 0.0028902 k( 142) = ( 0.0954545 0.0551107 0.1558766), wk = 0.0028902 k( 143) = ( 0.0886364 0.0511742 0.1447426), wk = 0.0028902 k( 144) = ( 0.0818182 0.0472377 0.1336085), wk = 0.0028902 k( 145) = ( 0.0750000 0.0433013 0.1224745), wk = 0.0028902 k( 146) = ( 0.0681818 0.0393648 0.1113404), wk = 0.0028902 k( 147) = ( 0.0613636 0.0354283 0.1002064), wk = 0.0028902 k( 148) = ( 0.0545455 0.0314918 0.0890724), wk = 0.0028902 k( 149) = ( 0.0477273 0.0275554 0.0779383), wk = 0.0028902 k( 150) = ( 0.0409091 0.0236189 0.0668043), wk = 0.0028902 k( 151) = ( 0.0340909 0.0196824 0.0556702), wk = 0.0028902 k( 152) = ( 0.0272727 0.0157459 0.0445362), wk = 0.0028902 k( 153) = ( 0.0204545 0.0118094 0.0334021), wk = 0.0028902 k( 154) = ( 0.0136364 0.0078730 0.0222681), wk = 0.0028902 k( 155) = ( 0.0068182 0.0039365 0.0111340), wk = 0.0028902 k( 156) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028902 k( 157) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028902 k( 158) = ( 0.0111111 0.0064150 0.0045361), wk = 0.0028902 k( 159) = ( 0.0222222 0.0128300 0.0090722), wk = 0.0028902 k( 160) = ( 0.0333333 0.0192450 0.0136083), wk = 0.0028902 k( 161) = ( 0.0444444 0.0256600 0.0181444), wk = 0.0028902 k( 162) = ( 0.0555556 0.0320750 0.0226805), wk = 0.0028902 k( 163) = ( 0.0666667 0.0384900 0.0272166), wk = 0.0028902 k( 164) = ( 0.0777778 0.0449050 0.0317526), wk = 0.0028902 k( 165) = ( 0.0888889 0.0513200 0.0362887), wk = 0.0028902 k( 166) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0028902 k( 167) = ( 0.1111111 0.0641500 0.0453609), wk = 0.0028902 k( 168) = ( 0.1222222 0.0705650 0.0498970), wk = 0.0028902 k( 169) = ( 0.1333333 0.0769800 0.0544331), wk = 0.0028902 k( 170) = ( 0.1444444 0.0833950 0.0589692), wk = 0.0028902 k( 171) = ( 0.1555556 0.0898100 0.0635053), wk = 0.0028902 k( 172) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0028902 k( 173) = ( 0.1777778 0.1026400 0.0725775), wk = 0.0028902 k( 174) = ( 0.1888889 0.1090551 0.0771136), wk = 0.0028902 k( 175) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0028902 k( 176) = ( 0.2111111 0.1218851 0.0861857), wk = 0.0028902 k( 177) = ( 0.2222222 0.1283001 0.0907218), wk = 0.0028902 k( 178) = ( 0.2333333 0.1347151 0.0952579), wk = 0.0028902 k( 179) = ( 0.2444444 0.1411301 0.0997940), wk = 0.0028902 k( 180) = ( 0.2555556 0.1475451 0.1043301), wk = 0.0028902 k( 181) = ( 0.2666667 0.1539601 0.1088662), wk = 0.0028902 k( 182) = ( 0.2777778 0.1603751 0.1134023), wk = 0.0028902 k( 183) = ( 0.2888889 0.1667901 0.1179384), wk = 0.0028902 k( 184) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0028902 k( 185) = ( 0.3111111 0.1796201 0.1270106), wk = 0.0028902 k( 186) = ( 0.3222222 0.1860351 0.1315467), wk = 0.0028902 k( 187) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0028902 k( 188) = ( 0.3444444 0.1988651 0.1406189), wk = 0.0028902 k( 189) = ( 0.3555556 0.2052801 0.1451549), wk = 0.0028902 k( 190) = ( 0.3666667 0.2116951 0.1496910), wk = 0.0028902 k( 191) = ( 0.3777778 0.2181101 0.1542271), wk = 0.0028902 k( 192) = ( 0.3888889 0.2245251 0.1587632), wk = 0.0028902 k( 193) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0028902 k( 194) = ( 0.4111111 0.2373551 0.1678354), wk = 0.0028902 k( 195) = ( 0.4222222 0.2437701 0.1723715), wk = 0.0028902 k( 196) = ( 0.4333333 0.2501851 0.1769076), wk = 0.0028902 k( 197) = ( 0.4444444 0.2566001 0.1814437), wk = 0.0028902 k( 198) = ( 0.4555556 0.2630151 0.1859798), wk = 0.0028902 k( 199) = ( 0.4666667 0.2694301 0.1905159), wk = 0.0028902 k( 200) = ( 0.4777778 0.2758451 0.1950520), wk = 0.0028902 k( 201) = ( 0.4888889 0.2822601 0.1995881), wk = 0.0028902 k( 202) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028902 k( 203) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028902 k( 204) = ( 0.5039062 0.2773988 0.2105030), wk = 0.0028902 k( 205) = ( 0.5078125 0.2661224 0.2168819), wk = 0.0028902 k( 206) = ( 0.5117188 0.2548460 0.2232608), wk = 0.0028902 k( 207) = ( 0.5156250 0.2435696 0.2296397), wk = 0.0028902 k( 208) = ( 0.5195312 0.2322933 0.2360185), wk = 0.0028902 k( 209) = ( 0.5234375 0.2210169 0.2423974), wk = 0.0028902 k( 210) = ( 0.5273438 0.2097405 0.2487763), wk = 0.0028902 k( 211) = ( 0.5312500 0.1984642 0.2551552), wk = 0.0028902 k( 212) = ( 0.5351562 0.1871878 0.2615341), wk = 0.0028902 k( 213) = ( 0.5390625 0.1759114 0.2679129), wk = 0.0028902 k( 214) = ( 0.5429688 0.1646350 0.2742918), wk = 0.0028902 k( 215) = ( 0.5468750 0.1533587 0.2806707), wk = 0.0028902 k( 216) = ( 0.5507812 0.1420823 0.2870496), wk = 0.0028902 k( 217) = ( 0.5546875 0.1308059 0.2934285), wk = 0.0028902 k( 218) = ( 0.5585938 0.1195295 0.2998073), wk = 0.0028902 k( 219) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0028902 k( 220) = ( 0.5664062 0.0969768 0.3125651), wk = 0.0028902 k( 221) = ( 0.5703125 0.0857004 0.3189440), wk = 0.0028902 k( 222) = ( 0.5742188 0.0744241 0.3253229), wk = 0.0028902 k( 223) = ( 0.5781250 0.0631477 0.3317017), wk = 0.0028902 k( 224) = ( 0.5820312 0.0518713 0.3380806), wk = 0.0028902 k( 225) = ( 0.5859375 0.0405949 0.3444595), wk = 0.0028902 k( 226) = ( 0.5898438 0.0293186 0.3508384), wk = 0.0028902 k( 227) = ( 0.5937500 0.0180422 0.3572173), wk = 0.0028902 k( 228) = ( 0.5976562 0.0067658 0.3635961), wk = 0.0028902 k( 229) = ( 0.6015625 -0.0045105 0.3699750), wk = 0.0028902 k( 230) = ( 0.6054688 -0.0157869 0.3763539), wk = 0.0028902 k( 231) = ( 0.6093750 -0.0270633 0.3827328), wk = 0.0028902 k( 232) = ( 0.6132812 -0.0383397 0.3891117), wk = 0.0028902 k( 233) = ( 0.6171875 -0.0496160 0.3954905), wk = 0.0028902 k( 234) = ( 0.6210938 -0.0608924 0.4018694), wk = 0.0028902 k( 235) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0028902 k( 236) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0028902 k( 237) = ( 0.6184211 -0.0683704 0.4189917), wk = 0.0028902 k( 238) = ( 0.6118421 -0.0645721 0.4297350), wk = 0.0028902 k( 239) = ( 0.6052632 -0.0607737 0.4404784), wk = 0.0028902 k( 240) = ( 0.5986842 -0.0569754 0.4512218), wk = 0.0028902 k( 241) = ( 0.5921053 -0.0531770 0.4619652), wk = 0.0028902 k( 242) = ( 0.5855263 -0.0493786 0.4727085), wk = 0.0028902 k( 243) = ( 0.5789474 -0.0455803 0.4834519), wk = 0.0028902 k( 244) = ( 0.5723684 -0.0417819 0.4941953), wk = 0.0028902 k( 245) = ( 0.5657895 -0.0379836 0.5049387), wk = 0.0028902 k( 246) = ( 0.5592105 -0.0341852 0.5156820), wk = 0.0028902 k( 247) = ( 0.5526316 -0.0303869 0.5264254), wk = 0.0028902 k( 248) = ( 0.5460526 -0.0265885 0.5371688), wk = 0.0028902 k( 249) = ( 0.5394737 -0.0227901 0.5479122), wk = 0.0028902 k( 250) = ( 0.5328947 -0.0189918 0.5586556), wk = 0.0028902 k( 251) = ( 0.5263158 -0.0151934 0.5693989), wk = 0.0028902 k( 252) = ( 0.5197368 -0.0113951 0.5801423), wk = 0.0028902 k( 253) = ( 0.5131579 -0.0075967 0.5908857), wk = 0.0028902 k( 254) = ( 0.5065789 -0.0037984 0.6016291), wk = 0.0028902 k( 255) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0028902 k( 256) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0028902 k( 257) = ( 0.5000000 0.0078020 0.6013387), wk = 0.0028902 k( 258) = ( 0.5000000 0.0156041 0.5903050), wk = 0.0028902 k( 259) = ( 0.5000000 0.0234061 0.5792712), wk = 0.0028902 k( 260) = ( 0.5000000 0.0312081 0.5682375), wk = 0.0028902 k( 261) = ( 0.5000000 0.0390101 0.5572038), wk = 0.0028902 k( 262) = ( 0.5000000 0.0468122 0.5461700), wk = 0.0028902 k( 263) = ( 0.5000000 0.0546142 0.5351363), wk = 0.0028902 k( 264) = ( 0.5000000 0.0624162 0.5241025), wk = 0.0028902 k( 265) = ( 0.5000000 0.0702183 0.5130688), wk = 0.0028902 k( 266) = ( 0.5000000 0.0780203 0.5020351), wk = 0.0028902 k( 267) = ( 0.5000000 0.0858223 0.4910013), wk = 0.0028902 k( 268) = ( 0.5000000 0.0936244 0.4799676), wk = 0.0028902 k( 269) = ( 0.5000000 0.1014264 0.4689338), wk = 0.0028902 k( 270) = ( 0.5000000 0.1092284 0.4579001), wk = 0.0028902 k( 271) = ( 0.5000000 0.1170305 0.4468664), wk = 0.0028902 k( 272) = ( 0.5000000 0.1248325 0.4358326), wk = 0.0028902 k( 273) = ( 0.5000000 0.1326345 0.4247989), wk = 0.0028902 k( 274) = ( 0.5000000 0.1404366 0.4137652), wk = 0.0028902 k( 275) = ( 0.5000000 0.1482386 0.4027314), wk = 0.0028902 k( 276) = ( 0.5000000 0.1560406 0.3916977), wk = 0.0028902 k( 277) = ( 0.5000000 0.1638426 0.3806639), wk = 0.0028902 k( 278) = ( 0.5000000 0.1716447 0.3696302), wk = 0.0028902 k( 279) = ( 0.5000000 0.1794467 0.3585965), wk = 0.0028902 k( 280) = ( 0.5000000 0.1872487 0.3475627), wk = 0.0028902 k( 281) = ( 0.5000000 0.1950508 0.3365290), wk = 0.0028902 k( 282) = ( 0.5000000 0.2028528 0.3254953), wk = 0.0028902 k( 283) = ( 0.5000000 0.2106548 0.3144615), wk = 0.0028902 k( 284) = ( 0.5000000 0.2184569 0.3034278), wk = 0.0028902 k( 285) = ( 0.5000000 0.2262589 0.2923940), wk = 0.0028902 k( 286) = ( 0.5000000 0.2340609 0.2813603), wk = 0.0028902 k( 287) = ( 0.5000000 0.2418630 0.2703266), wk = 0.0028902 k( 288) = ( 0.5000000 0.2496650 0.2592928), wk = 0.0028902 k( 289) = ( 0.5000000 0.2574670 0.2482591), wk = 0.0028902 k( 290) = ( 0.5000000 0.2652690 0.2372254), wk = 0.0028902 k( 291) = ( 0.5000000 0.2730711 0.2261916), wk = 0.0028902 k( 292) = ( 0.5000000 0.2808731 0.2151579), wk = 0.0028902 k( 293) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028902 k( 294) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0028902 k( 295) = ( 0.4960938 0.2864199 0.2168819), wk = 0.0028902 k( 296) = ( 0.4921875 0.2841646 0.2296397), wk = 0.0028902 k( 297) = ( 0.4882812 0.2819093 0.2423974), wk = 0.0028902 k( 298) = ( 0.4843750 0.2796540 0.2551552), wk = 0.0028902 k( 299) = ( 0.4804688 0.2773988 0.2679129), wk = 0.0028902 k( 300) = ( 0.4765625 0.2751435 0.2806707), wk = 0.0028902 k( 301) = ( 0.4726562 0.2728882 0.2934285), wk = 0.0028902 k( 302) = ( 0.4687500 0.2706329 0.3061862), wk = 0.0028902 k( 303) = ( 0.4648438 0.2683777 0.3189440), wk = 0.0028902 k( 304) = ( 0.4609375 0.2661224 0.3317017), wk = 0.0028902 k( 305) = ( 0.4570312 0.2638671 0.3444595), wk = 0.0028902 k( 306) = ( 0.4531250 0.2616118 0.3572173), wk = 0.0028902 k( 307) = ( 0.4492188 0.2593566 0.3699750), wk = 0.0028902 k( 308) = ( 0.4453125 0.2571013 0.3827328), wk = 0.0028902 k( 309) = ( 0.4414062 0.2548460 0.3954905), wk = 0.0028902 k( 310) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0028902 k( 311) = ( 0.4335938 0.2503355 0.4210060), wk = 0.0028902 k( 312) = ( 0.4296875 0.2480802 0.4337638), wk = 0.0028902 k( 313) = ( 0.4257812 0.2458249 0.4465216), wk = 0.0028902 k( 314) = ( 0.4218750 0.2435696 0.4592793), wk = 0.0028902 k( 315) = ( 0.4179688 0.2413144 0.4720371), wk = 0.0028902 k( 316) = ( 0.4140625 0.2390591 0.4847948), wk = 0.0028902 k( 317) = ( 0.4101562 0.2368038 0.4975526), wk = 0.0028902 k( 318) = ( 0.4062500 0.2345485 0.5103104), wk = 0.0028902 k( 319) = ( 0.4023438 0.2322933 0.5230681), wk = 0.0028902 k( 320) = ( 0.3984375 0.2300380 0.5358259), wk = 0.0028902 k( 321) = ( 0.3945312 0.2277827 0.5485836), wk = 0.0028902 k( 322) = ( 0.3906250 0.2255274 0.5613414), wk = 0.0028902 k( 323) = ( 0.3867188 0.2232722 0.5740992), wk = 0.0028902 k( 324) = ( 0.3828125 0.2210169 0.5868569), wk = 0.0028902 k( 325) = ( 0.3789062 0.2187616 0.5996147), wk = 0.0028902 k( 326) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0028902 k( 327) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0028902 k( 328) = ( 0.6184211 -0.0835638 0.4082483), wk = 0.0028902 k( 329) = ( 0.6118421 -0.0949589 0.4082483), wk = 0.0028902 k( 330) = ( 0.6052632 -0.1063540 0.4082483), wk = 0.0028902 k( 331) = ( 0.5986842 -0.1177491 0.4082483), wk = 0.0028902 k( 332) = ( 0.5921053 -0.1291441 0.4082483), wk = 0.0028902 k( 333) = ( 0.5855263 -0.1405392 0.4082483), wk = 0.0028902 k( 334) = ( 0.5789474 -0.1519343 0.4082483), wk = 0.0028902 k( 335) = ( 0.5723684 -0.1633294 0.4082483), wk = 0.0028902 k( 336) = ( 0.5657895 -0.1747244 0.4082483), wk = 0.0028902 k( 337) = ( 0.5592105 -0.1861195 0.4082483), wk = 0.0028902 k( 338) = ( 0.5526316 -0.1975146 0.4082483), wk = 0.0028902 k( 339) = ( 0.5460526 -0.2089096 0.4082483), wk = 0.0028902 k( 340) = ( 0.5394737 -0.2203047 0.4082483), wk = 0.0028902 k( 341) = ( 0.5328947 -0.2316998 0.4082483), wk = 0.0028902 k( 342) = ( 0.5263158 -0.2430948 0.4082483), wk = 0.0028902 k( 343) = ( 0.5197368 -0.2544899 0.4082483), wk = 0.0028902 k( 344) = ( 0.5131579 -0.2658850 0.4082483), wk = 0.0028902 k( 345) = ( 0.5065789 -0.2772801 0.4082483), wk = 0.0028902 k( 346) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0028902 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028902 k( 2) = ( 0.0096154 -0.0000000 0.0096154), wk = 0.0028902 k( 3) = ( 0.0192308 -0.0000000 0.0192308), wk = 0.0028902 k( 4) = ( 0.0288462 0.0000000 0.0288461), wk = 0.0028902 k( 5) = ( 0.0384615 -0.0000000 0.0384615), wk = 0.0028902 k( 6) = ( 0.0480769 -0.0000000 0.0480769), wk = 0.0028902 k( 7) = ( 0.0576923 -0.0000000 0.0576923), wk = 0.0028902 k( 8) = ( 0.0673077 -0.0000000 0.0673077), wk = 0.0028902 k( 9) = ( 0.0769231 -0.0000000 0.0769231), wk = 0.0028902 k( 10) = ( 0.0865385 -0.0000000 0.0865385), wk = 0.0028902 k( 11) = ( 0.0961538 -0.0000000 0.0961538), wk = 0.0028902 k( 12) = ( 0.1057692 -0.0000000 0.1057692), wk = 0.0028902 k( 13) = ( 0.1153846 -0.0000000 0.1153846), wk = 0.0028902 k( 14) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0028902 k( 15) = ( 0.1346154 -0.0000000 0.1346154), wk = 0.0028902 k( 16) = ( 0.1442308 -0.0000000 0.1442308), wk = 0.0028902 k( 17) = ( 0.1538461 -0.0000000 0.1538461), wk = 0.0028902 k( 18) = ( 0.1634615 -0.0000000 0.1634615), wk = 0.0028902 k( 19) = ( 0.1730769 -0.0000000 0.1730769), wk = 0.0028902 k( 20) = ( 0.1826923 -0.0000000 0.1826923), wk = 0.0028902 k( 21) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0028902 k( 22) = ( 0.2019231 -0.0000000 0.2019231), wk = 0.0028902 k( 23) = ( 0.2115385 -0.0000000 0.2115385), wk = 0.0028902 k( 24) = ( 0.2211539 -0.0000000 0.2211538), wk = 0.0028902 k( 25) = ( 0.2307692 0.0000000 0.2307692), wk = 0.0028902 k( 26) = ( 0.2403846 0.0000000 0.2403846), wk = 0.0028902 k( 27) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0028902 k( 28) = ( 0.2596154 -0.0000000 0.2596154), wk = 0.0028902 k( 29) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0028902 k( 30) = ( 0.2788462 -0.0000000 0.2788462), wk = 0.0028902 k( 31) = ( 0.2884615 -0.0000000 0.2884615), wk = 0.0028902 k( 32) = ( 0.2980769 -0.0000000 0.2980769), wk = 0.0028902 k( 33) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0028902 k( 34) = ( 0.3173077 -0.0000000 0.3173077), wk = 0.0028902 k( 35) = ( 0.3269231 -0.0000000 0.3269231), wk = 0.0028902 k( 36) = ( 0.3365385 -0.0000000 0.3365385), wk = 0.0028902 k( 37) = ( 0.3461538 0.0000000 0.3461538), wk = 0.0028902 k( 38) = ( 0.3557692 -0.0000000 0.3557692), wk = 0.0028902 k( 39) = ( 0.3653846 -0.0000000 0.3653846), wk = 0.0028902 k( 40) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0028902 k( 41) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0028902 k( 42) = ( 0.3942308 -0.0000000 0.3942308), wk = 0.0028902 k( 43) = ( 0.4038462 -0.0000000 0.4038461), wk = 0.0028902 k( 44) = ( 0.4134615 -0.0000000 0.4134615), wk = 0.0028902 k( 45) = ( 0.4230769 -0.0000000 0.4230769), wk = 0.0028902 k( 46) = ( 0.4326923 -0.0000000 0.4326923), wk = 0.0028902 k( 47) = ( 0.4423077 -0.0000000 0.4423077), wk = 0.0028902 k( 48) = ( 0.4519231 -0.0000000 0.4519231), wk = 0.0028902 k( 49) = ( 0.4615385 0.0000000 0.4615385), wk = 0.0028902 k( 50) = ( 0.4711538 0.0000000 0.4711538), wk = 0.0028902 k( 51) = ( 0.4807692 0.0000000 0.4807692), wk = 0.0028902 k( 52) = ( 0.4903846 0.0000000 0.4903846), wk = 0.0028902 k( 53) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028902 k( 54) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028902 k( 55) = ( 0.5000000 0.0096154 0.5096154), wk = 0.0028902 k( 56) = ( 0.5000000 0.0192308 0.5192308), wk = 0.0028902 k( 57) = ( 0.5000000 0.0288461 0.5288462), wk = 0.0028902 k( 58) = ( 0.5000000 0.0384615 0.5384615), wk = 0.0028902 k( 59) = ( 0.5000000 0.0480769 0.5480769), wk = 0.0028902 k( 60) = ( 0.5000000 0.0576923 0.5576923), wk = 0.0028902 k( 61) = ( 0.5000000 0.0673077 0.5673077), wk = 0.0028902 k( 62) = ( 0.5000000 0.0769231 0.5769231), wk = 0.0028902 k( 63) = ( 0.5000000 0.0865385 0.5865385), wk = 0.0028902 k( 64) = ( 0.5000000 0.0961538 0.5961538), wk = 0.0028902 k( 65) = ( 0.5000000 0.1057692 0.6057692), wk = 0.0028902 k( 66) = ( 0.5000000 0.1153846 0.6153846), wk = 0.0028902 k( 67) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0028902 k( 68) = ( 0.5000000 0.1346154 0.6346154), wk = 0.0028902 k( 69) = ( 0.5000000 0.1442308 0.6442308), wk = 0.0028902 k( 70) = ( 0.5000000 0.1538461 0.6538462), wk = 0.0028902 k( 71) = ( 0.5000000 0.1634615 0.6634615), wk = 0.0028902 k( 72) = ( 0.5000000 0.1730769 0.6730769), wk = 0.0028902 k( 73) = ( 0.5000000 0.1826923 0.6826923), wk = 0.0028902 k( 74) = ( 0.5000000 0.1923077 0.6923077), wk = 0.0028902 k( 75) = ( 0.5000000 0.2019231 0.7019231), wk = 0.0028902 k( 76) = ( 0.5000000 0.2115385 0.7115385), wk = 0.0028902 k( 77) = ( 0.5000000 0.2211538 0.7211538), wk = 0.0028902 k( 78) = ( 0.5000000 0.2307692 0.7307692), wk = 0.0028902 k( 79) = ( 0.5000000 0.2403846 0.7403846), wk = 0.0028902 k( 80) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028902 k( 81) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028902 k( 82) = ( 0.4934211 0.2565789 0.7500000), wk = 0.0028902 k( 83) = ( 0.4868421 0.2631579 0.7500000), wk = 0.0028902 k( 84) = ( 0.4802632 0.2697368 0.7500000), wk = 0.0028902 k( 85) = ( 0.4736842 0.2763158 0.7500000), wk = 0.0028902 k( 86) = ( 0.4671053 0.2828947 0.7500000), wk = 0.0028902 k( 87) = ( 0.4605263 0.2894737 0.7500000), wk = 0.0028902 k( 88) = ( 0.4539474 0.2960526 0.7500000), wk = 0.0028902 k( 89) = ( 0.4473684 0.3026316 0.7500000), wk = 0.0028902 k( 90) = ( 0.4407895 0.3092105 0.7500000), wk = 0.0028902 k( 91) = ( 0.4342105 0.3157895 0.7500000), wk = 0.0028902 k( 92) = ( 0.4276316 0.3223684 0.7500000), wk = 0.0028902 k( 93) = ( 0.4210526 0.3289474 0.7500000), wk = 0.0028902 k( 94) = ( 0.4144737 0.3355263 0.7500000), wk = 0.0028902 k( 95) = ( 0.4078947 0.3421053 0.7500000), wk = 0.0028902 k( 96) = ( 0.4013158 0.3486842 0.7500000), wk = 0.0028902 k( 97) = ( 0.3947368 0.3552632 0.7500000), wk = 0.0028902 k( 98) = ( 0.3881579 0.3618421 0.7500000), wk = 0.0028902 k( 99) = ( 0.3815789 0.3684211 0.7500000), wk = 0.0028902 k( 100) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0028902 k( 101) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0028902 k( 102) = ( 0.3681818 0.3681818 0.7363636), wk = 0.0028902 k( 103) = ( 0.3613636 0.3613636 0.7227273), wk = 0.0028902 k( 104) = ( 0.3545454 0.3545454 0.7090909), wk = 0.0028902 k( 105) = ( 0.3477273 0.3477273 0.6954545), wk = 0.0028902 k( 106) = ( 0.3409091 0.3409091 0.6818182), wk = 0.0028902 k( 107) = ( 0.3340909 0.3340909 0.6681818), wk = 0.0028902 k( 108) = ( 0.3272727 0.3272727 0.6545454), wk = 0.0028902 k( 109) = ( 0.3204546 0.3204546 0.6409091), wk = 0.0028902 k( 110) = ( 0.3136364 0.3136364 0.6272727), wk = 0.0028902 k( 111) = ( 0.3068182 0.3068182 0.6136364), wk = 0.0028902 k( 112) = ( 0.3000000 0.3000000 0.6000000), wk = 0.0028902 k( 113) = ( 0.2931818 0.2931818 0.5863636), wk = 0.0028902 k( 114) = ( 0.2863636 0.2863636 0.5727273), wk = 0.0028902 k( 115) = ( 0.2795454 0.2795454 0.5590909), wk = 0.0028902 k( 116) = ( 0.2727273 0.2727273 0.5454545), wk = 0.0028902 k( 117) = ( 0.2659091 0.2659091 0.5318182), wk = 0.0028902 k( 118) = ( 0.2590909 0.2590909 0.5181818), wk = 0.0028902 k( 119) = ( 0.2522727 0.2522727 0.5045454), wk = 0.0028902 k( 120) = ( 0.2454545 0.2454545 0.4909091), wk = 0.0028902 k( 121) = ( 0.2386364 0.2386364 0.4772727), wk = 0.0028902 k( 122) = ( 0.2318182 0.2318182 0.4636364), wk = 0.0028902 k( 123) = ( 0.2250000 0.2250000 0.4500000), wk = 0.0028902 k( 124) = ( 0.2181818 0.2181818 0.4363636), wk = 0.0028902 k( 125) = ( 0.2113636 0.2113636 0.4227273), wk = 0.0028902 k( 126) = ( 0.2045454 0.2045454 0.4090909), wk = 0.0028902 k( 127) = ( 0.1977273 0.1977273 0.3954546), wk = 0.0028902 k( 128) = ( 0.1909091 0.1909091 0.3818182), wk = 0.0028902 k( 129) = ( 0.1840909 0.1840909 0.3681818), wk = 0.0028902 k( 130) = ( 0.1772727 0.1772727 0.3545454), wk = 0.0028902 k( 131) = ( 0.1704546 0.1704546 0.3409091), wk = 0.0028902 k( 132) = ( 0.1636364 0.1636364 0.3272727), wk = 0.0028902 k( 133) = ( 0.1568182 0.1568182 0.3136364), wk = 0.0028902 k( 134) = ( 0.1500000 0.1500000 0.3000000), wk = 0.0028902 k( 135) = ( 0.1431818 0.1431818 0.2863636), wk = 0.0028902 k( 136) = ( 0.1363636 0.1363636 0.2727273), wk = 0.0028902 k( 137) = ( 0.1295455 0.1295455 0.2590909), wk = 0.0028902 k( 138) = ( 0.1227273 0.1227273 0.2454545), wk = 0.0028902 k( 139) = ( 0.1159091 0.1159091 0.2318182), wk = 0.0028902 k( 140) = ( 0.1090909 0.1090909 0.2181818), wk = 0.0028902 k( 141) = ( 0.1022727 0.1022727 0.2045454), wk = 0.0028902 k( 142) = ( 0.0954545 0.0954545 0.1909091), wk = 0.0028902 k( 143) = ( 0.0886364 0.0886364 0.1772727), wk = 0.0028902 k( 144) = ( 0.0818182 0.0818182 0.1636364), wk = 0.0028902 k( 145) = ( 0.0750000 0.0750000 0.1500000), wk = 0.0028902 k( 146) = ( 0.0681818 0.0681818 0.1363636), wk = 0.0028902 k( 147) = ( 0.0613636 0.0613636 0.1227273), wk = 0.0028902 k( 148) = ( 0.0545455 0.0545455 0.1090909), wk = 0.0028902 k( 149) = ( 0.0477273 0.0477273 0.0954545), wk = 0.0028902 k( 150) = ( 0.0409091 0.0409091 0.0818182), wk = 0.0028902 k( 151) = ( 0.0340909 0.0340909 0.0681818), wk = 0.0028902 k( 152) = ( 0.0272727 0.0272727 0.0545455), wk = 0.0028902 k( 153) = ( 0.0204545 0.0204545 0.0409091), wk = 0.0028902 k( 154) = ( 0.0136364 0.0136364 0.0272727), wk = 0.0028902 k( 155) = ( 0.0068182 0.0068182 0.0136364), wk = 0.0028902 k( 156) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028902 k( 157) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028902 k( 158) = ( 0.0111111 0.0111111 0.0111111), wk = 0.0028902 k( 159) = ( 0.0222222 0.0222222 0.0222222), wk = 0.0028902 k( 160) = ( 0.0333333 0.0333333 0.0333333), wk = 0.0028902 k( 161) = ( 0.0444444 0.0444444 0.0444444), wk = 0.0028902 k( 162) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0028902 k( 163) = ( 0.0666667 0.0666667 0.0666667), wk = 0.0028902 k( 164) = ( 0.0777778 0.0777778 0.0777778), wk = 0.0028902 k( 165) = ( 0.0888889 0.0888889 0.0888889), wk = 0.0028902 k( 166) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0028902 k( 167) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0028902 k( 168) = ( 0.1222222 0.1222222 0.1222222), wk = 0.0028902 k( 169) = ( 0.1333333 0.1333333 0.1333333), wk = 0.0028902 k( 170) = ( 0.1444444 0.1444444 0.1444444), wk = 0.0028902 k( 171) = ( 0.1555556 0.1555556 0.1555556), wk = 0.0028902 k( 172) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0028902 k( 173) = ( 0.1777778 0.1777778 0.1777778), wk = 0.0028902 k( 174) = ( 0.1888889 0.1888889 0.1888889), wk = 0.0028902 k( 175) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0028902 k( 176) = ( 0.2111111 0.2111111 0.2111111), wk = 0.0028902 k( 177) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0028902 k( 178) = ( 0.2333333 0.2333333 0.2333333), wk = 0.0028902 k( 179) = ( 0.2444444 0.2444444 0.2444444), wk = 0.0028902 k( 180) = ( 0.2555556 0.2555556 0.2555556), wk = 0.0028902 k( 181) = ( 0.2666667 0.2666667 0.2666667), wk = 0.0028902 k( 182) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0028902 k( 183) = ( 0.2888889 0.2888889 0.2888889), wk = 0.0028902 k( 184) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0028902 k( 185) = ( 0.3111111 0.3111111 0.3111111), wk = 0.0028902 k( 186) = ( 0.3222222 0.3222222 0.3222222), wk = 0.0028902 k( 187) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0028902 k( 188) = ( 0.3444444 0.3444444 0.3444444), wk = 0.0028902 k( 189) = ( 0.3555556 0.3555556 0.3555556), wk = 0.0028902 k( 190) = ( 0.3666667 0.3666667 0.3666667), wk = 0.0028902 k( 191) = ( 0.3777778 0.3777778 0.3777778), wk = 0.0028902 k( 192) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0028902 k( 193) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0028902 k( 194) = ( 0.4111111 0.4111111 0.4111111), wk = 0.0028902 k( 195) = ( 0.4222222 0.4222222 0.4222222), wk = 0.0028902 k( 196) = ( 0.4333333 0.4333333 0.4333333), wk = 0.0028902 k( 197) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0028902 k( 198) = ( 0.4555556 0.4555556 0.4555556), wk = 0.0028902 k( 199) = ( 0.4666667 0.4666667 0.4666667), wk = 0.0028902 k( 200) = ( 0.4777778 0.4777778 0.4777778), wk = 0.0028902 k( 201) = ( 0.4888889 0.4888889 0.4888889), wk = 0.0028902 k( 202) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028902 k( 203) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028902 k( 204) = ( 0.5039062 0.4921875 0.5039062), wk = 0.0028902 k( 205) = ( 0.5078125 0.4843750 0.5078125), wk = 0.0028902 k( 206) = ( 0.5117188 0.4765625 0.5117187), wk = 0.0028902 k( 207) = ( 0.5156250 0.4687500 0.5156250), wk = 0.0028902 k( 208) = ( 0.5195312 0.4609375 0.5195312), wk = 0.0028902 k( 209) = ( 0.5234375 0.4531250 0.5234375), wk = 0.0028902 k( 210) = ( 0.5273438 0.4453125 0.5273438), wk = 0.0028902 k( 211) = ( 0.5312500 0.4375000 0.5312500), wk = 0.0028902 k( 212) = ( 0.5351562 0.4296875 0.5351562), wk = 0.0028902 k( 213) = ( 0.5390625 0.4218750 0.5390625), wk = 0.0028902 k( 214) = ( 0.5429688 0.4140625 0.5429687), wk = 0.0028902 k( 215) = ( 0.5468750 0.4062500 0.5468750), wk = 0.0028902 k( 216) = ( 0.5507812 0.3984375 0.5507812), wk = 0.0028902 k( 217) = ( 0.5546875 0.3906250 0.5546875), wk = 0.0028902 k( 218) = ( 0.5585938 0.3828125 0.5585938), wk = 0.0028902 k( 219) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0028902 k( 220) = ( 0.5664062 0.3671875 0.5664062), wk = 0.0028902 k( 221) = ( 0.5703125 0.3593750 0.5703125), wk = 0.0028902 k( 222) = ( 0.5742188 0.3515625 0.5742188), wk = 0.0028902 k( 223) = ( 0.5781250 0.3437500 0.5781250), wk = 0.0028902 k( 224) = ( 0.5820312 0.3359375 0.5820312), wk = 0.0028902 k( 225) = ( 0.5859375 0.3281250 0.5859375), wk = 0.0028902 k( 226) = ( 0.5898438 0.3203125 0.5898438), wk = 0.0028902 k( 227) = ( 0.5937500 0.3125000 0.5937500), wk = 0.0028902 k( 228) = ( 0.5976562 0.3046875 0.5976562), wk = 0.0028902 k( 229) = ( 0.6015625 0.2968750 0.6015625), wk = 0.0028902 k( 230) = ( 0.6054688 0.2890625 0.6054688), wk = 0.0028902 k( 231) = ( 0.6093750 0.2812500 0.6093750), wk = 0.0028902 k( 232) = ( 0.6132812 0.2734375 0.6132812), wk = 0.0028902 k( 233) = ( 0.6171875 0.2656250 0.6171875), wk = 0.0028902 k( 234) = ( 0.6210938 0.2578125 0.6210938), wk = 0.0028902 k( 235) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0028902 k( 236) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0028902 k( 237) = ( 0.6184211 0.2500000 0.6315789), wk = 0.0028902 k( 238) = ( 0.6118421 0.2500000 0.6381579), wk = 0.0028902 k( 239) = ( 0.6052632 0.2500000 0.6447368), wk = 0.0028902 k( 240) = ( 0.5986842 0.2500000 0.6513158), wk = 0.0028902 k( 241) = ( 0.5921053 0.2500000 0.6578947), wk = 0.0028902 k( 242) = ( 0.5855263 0.2500000 0.6644737), wk = 0.0028902 k( 243) = ( 0.5789474 0.2500000 0.6710526), wk = 0.0028902 k( 244) = ( 0.5723684 0.2500000 0.6776316), wk = 0.0028902 k( 245) = ( 0.5657895 0.2500000 0.6842105), wk = 0.0028902 k( 246) = ( 0.5592105 0.2500000 0.6907895), wk = 0.0028902 k( 247) = ( 0.5526316 0.2500000 0.6973684), wk = 0.0028902 k( 248) = ( 0.5460526 0.2500000 0.7039474), wk = 0.0028902 k( 249) = ( 0.5394737 0.2500000 0.7105263), wk = 0.0028902 k( 250) = ( 0.5328947 0.2500000 0.7171053), wk = 0.0028902 k( 251) = ( 0.5263158 0.2500000 0.7236842), wk = 0.0028902 k( 252) = ( 0.5197368 0.2500000 0.7302632), wk = 0.0028902 k( 253) = ( 0.5131579 0.2500000 0.7368421), wk = 0.0028902 k( 254) = ( 0.5065789 0.2500000 0.7434210), wk = 0.0028902 k( 255) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028902 k( 256) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0028902 k( 257) = ( 0.5000000 0.2567568 0.7432432), wk = 0.0028902 k( 258) = ( 0.5000000 0.2635135 0.7364865), wk = 0.0028902 k( 259) = ( 0.5000000 0.2702703 0.7297297), wk = 0.0028902 k( 260) = ( 0.5000000 0.2770270 0.7229730), wk = 0.0028902 k( 261) = ( 0.5000000 0.2837838 0.7162162), wk = 0.0028902 k( 262) = ( 0.5000000 0.2905405 0.7094595), wk = 0.0028902 k( 263) = ( 0.5000000 0.2972973 0.7027027), wk = 0.0028902 k( 264) = ( 0.5000000 0.3040541 0.6959459), wk = 0.0028902 k( 265) = ( 0.5000000 0.3108108 0.6891892), wk = 0.0028902 k( 266) = ( 0.5000000 0.3175676 0.6824324), wk = 0.0028902 k( 267) = ( 0.5000000 0.3243243 0.6756757), wk = 0.0028902 k( 268) = ( 0.5000000 0.3310811 0.6689189), wk = 0.0028902 k( 269) = ( 0.5000000 0.3378378 0.6621622), wk = 0.0028902 k( 270) = ( 0.5000000 0.3445946 0.6554054), wk = 0.0028902 k( 271) = ( 0.5000000 0.3513514 0.6486487), wk = 0.0028902 k( 272) = ( 0.5000000 0.3581081 0.6418919), wk = 0.0028902 k( 273) = ( 0.5000000 0.3648649 0.6351351), wk = 0.0028902 k( 274) = ( 0.5000000 0.3716216 0.6283784), wk = 0.0028902 k( 275) = ( 0.5000000 0.3783784 0.6216216), wk = 0.0028902 k( 276) = ( 0.5000000 0.3851351 0.6148649), wk = 0.0028902 k( 277) = ( 0.5000000 0.3918919 0.6081081), wk = 0.0028902 k( 278) = ( 0.5000000 0.3986486 0.6013513), wk = 0.0028902 k( 279) = ( 0.5000000 0.4054054 0.5945946), wk = 0.0028902 k( 280) = ( 0.5000000 0.4121622 0.5878378), wk = 0.0028902 k( 281) = ( 0.5000000 0.4189189 0.5810811), wk = 0.0028902 k( 282) = ( 0.5000000 0.4256757 0.5743243), wk = 0.0028902 k( 283) = ( 0.5000000 0.4324324 0.5675676), wk = 0.0028902 k( 284) = ( 0.5000000 0.4391892 0.5608108), wk = 0.0028902 k( 285) = ( 0.5000000 0.4459459 0.5540540), wk = 0.0028902 k( 286) = ( 0.5000000 0.4527027 0.5472973), wk = 0.0028902 k( 287) = ( 0.5000000 0.4594595 0.5405405), wk = 0.0028902 k( 288) = ( 0.5000000 0.4662162 0.5337838), wk = 0.0028902 k( 289) = ( 0.5000000 0.4729730 0.5270270), wk = 0.0028902 k( 290) = ( 0.5000000 0.4797297 0.5202703), wk = 0.0028902 k( 291) = ( 0.5000000 0.4864865 0.5135135), wk = 0.0028902 k( 292) = ( 0.5000000 0.4932432 0.5067568), wk = 0.0028902 k( 293) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028902 k( 294) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0028902 k( 295) = ( 0.4960938 0.4960938 0.5078125), wk = 0.0028902 k( 296) = ( 0.4921875 0.4921875 0.5156250), wk = 0.0028902 k( 297) = ( 0.4882812 0.4882812 0.5234375), wk = 0.0028902 k( 298) = ( 0.4843750 0.4843750 0.5312500), wk = 0.0028902 k( 299) = ( 0.4804688 0.4804688 0.5390625), wk = 0.0028902 k( 300) = ( 0.4765625 0.4765625 0.5468750), wk = 0.0028902 k( 301) = ( 0.4726562 0.4726562 0.5546875), wk = 0.0028902 k( 302) = ( 0.4687500 0.4687500 0.5625000), wk = 0.0028902 k( 303) = ( 0.4648438 0.4648438 0.5703125), wk = 0.0028902 k( 304) = ( 0.4609375 0.4609375 0.5781250), wk = 0.0028902 k( 305) = ( 0.4570312 0.4570313 0.5859375), wk = 0.0028902 k( 306) = ( 0.4531250 0.4531250 0.5937500), wk = 0.0028902 k( 307) = ( 0.4492188 0.4492188 0.6015625), wk = 0.0028902 k( 308) = ( 0.4453125 0.4453125 0.6093750), wk = 0.0028902 k( 309) = ( 0.4414062 0.4414062 0.6171875), wk = 0.0028902 k( 310) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0028902 k( 311) = ( 0.4335938 0.4335938 0.6328125), wk = 0.0028902 k( 312) = ( 0.4296875 0.4296875 0.6406250), wk = 0.0028902 k( 313) = ( 0.4257812 0.4257812 0.6484375), wk = 0.0028902 k( 314) = ( 0.4218750 0.4218750 0.6562500), wk = 0.0028902 k( 315) = ( 0.4179688 0.4179688 0.6640625), wk = 0.0028902 k( 316) = ( 0.4140625 0.4140625 0.6718750), wk = 0.0028902 k( 317) = ( 0.4101562 0.4101562 0.6796875), wk = 0.0028902 k( 318) = ( 0.4062500 0.4062500 0.6875000), wk = 0.0028902 k( 319) = ( 0.4023438 0.4023438 0.6953125), wk = 0.0028902 k( 320) = ( 0.3984375 0.3984375 0.7031250), wk = 0.0028902 k( 321) = ( 0.3945312 0.3945312 0.7109375), wk = 0.0028902 k( 322) = ( 0.3906250 0.3906250 0.7187500), wk = 0.0028902 k( 323) = ( 0.3867188 0.3867188 0.7265625), wk = 0.0028902 k( 324) = ( 0.3828125 0.3828125 0.7343750), wk = 0.0028902 k( 325) = ( 0.3789062 0.3789062 0.7421875), wk = 0.0028902 k( 326) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0028902 k( 327) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0028902 k( 328) = ( 0.6184211 0.2368421 0.6184210), wk = 0.0028902 k( 329) = ( 0.6118421 0.2236842 0.6118421), wk = 0.0028902 k( 330) = ( 0.6052632 0.2105263 0.6052632), wk = 0.0028902 k( 331) = ( 0.5986842 0.1973684 0.5986842), wk = 0.0028902 k( 332) = ( 0.5921053 0.1842105 0.5921053), wk = 0.0028902 k( 333) = ( 0.5855263 0.1710526 0.5855263), wk = 0.0028902 k( 334) = ( 0.5789474 0.1578947 0.5789474), wk = 0.0028902 k( 335) = ( 0.5723684 0.1447368 0.5723684), wk = 0.0028902 k( 336) = ( 0.5657895 0.1315790 0.5657895), wk = 0.0028902 k( 337) = ( 0.5592105 0.1184210 0.5592105), wk = 0.0028902 k( 338) = ( 0.5526316 0.1052632 0.5526316), wk = 0.0028902 k( 339) = ( 0.5460526 0.0921053 0.5460526), wk = 0.0028902 k( 340) = ( 0.5394737 0.0789474 0.5394737), wk = 0.0028902 k( 341) = ( 0.5328947 0.0657895 0.5328947), wk = 0.0028902 k( 342) = ( 0.5263158 0.0526316 0.5263158), wk = 0.0028902 k( 343) = ( 0.5197368 0.0394737 0.5197368), wk = 0.0028902 k( 344) = ( 0.5131579 0.0263158 0.5131579), wk = 0.0028902 k( 345) = ( 0.5065789 0.0131579 0.5065789), wk = 0.0028902 k( 346) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028902 Dense grid: 36685 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 278, 56) NL pseudopotentials 0.29 Mb ( 139, 136) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.01 Mb ( 1019) G-vector shells 0.00 Mb ( 287) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.95 Mb ( 278, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.23 Mb ( 136, 2, 56) The potential is recalculated from file : ./TiNi2Sn.save/charge-density.dat Starting wfc are 54 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.6 secs Computing kpt #: 2 total cpu time spent up to now is 3.2 secs Computing kpt #: 3 total cpu time spent up to now is 3.7 secs Computing kpt #: 4 total cpu time spent up to now is 4.3 secs Computing kpt #: 5 total cpu time spent up to now is 4.9 secs Computing kpt #: 6 total cpu time spent up to now is 5.4 secs Computing kpt #: 7 total cpu time spent up to now is 6.0 secs Computing kpt #: 8 total cpu time spent up to now is 6.6 secs Computing kpt #: 9 total cpu time spent up to now is 7.2 secs Computing kpt #: 10 total cpu time spent up to now is 7.8 secs Computing kpt #: 11 total cpu time spent up to now is 8.4 secs Computing kpt #: 12 total cpu time spent up to now is 9.1 secs Computing kpt #: 13 total cpu time spent up to now is 9.7 secs Computing kpt #: 14 total cpu time spent up to now is 10.3 secs Computing kpt #: 15 total cpu time spent up to now is 10.9 secs Computing kpt #: 16 total cpu time spent up to now is 11.5 secs Computing kpt #: 17 total cpu time spent up to now is 12.1 secs Computing kpt #: 18 total cpu time spent up to now is 12.7 secs Computing kpt #: 19 total cpu time spent up to now is 13.3 secs Computing kpt #: 20 total cpu time spent up to now is 13.9 secs Computing kpt #: 21 total cpu time spent up to now is 14.5 secs Computing kpt #: 22 total cpu time spent up to now is 15.1 secs Computing kpt #: 23 total cpu time spent up to now is 15.7 secs Computing kpt #: 24 total cpu time spent up to now is 16.2 secs Computing kpt #: 25 total cpu time spent up to now is 16.8 secs Computing kpt #: 26 total cpu time spent up to now is 17.4 secs Computing kpt #: 27 total cpu time spent up to now is 18.0 secs Computing kpt #: 28 total cpu time spent up to now is 18.6 secs Computing kpt #: 29 total cpu time spent up to now is 19.2 secs Computing kpt #: 30 total cpu time spent up to now is 19.7 secs Computing kpt #: 31 total cpu time spent up to now is 20.3 secs Computing kpt #: 32 total cpu time spent up to now is 20.8 secs Computing kpt #: 33 total cpu time spent up to now is 21.4 secs Computing kpt #: 34 total cpu time spent up to now is 22.0 secs Computing kpt #: 35 total cpu time spent up to now is 22.5 secs Computing kpt #: 36 total cpu time spent up to now is 23.1 secs Computing kpt #: 37 total cpu time spent up to now is 23.7 secs Computing kpt #: 38 total cpu time spent up to now is 24.3 secs Computing kpt #: 39 total cpu time spent up to now is 24.9 secs Computing kpt #: 40 total cpu time spent up to now is 25.5 secs Computing kpt #: 41 total cpu time spent up to now is 26.2 secs Computing kpt #: 42 total cpu time spent up to now is 26.8 secs Computing kpt #: 43 total cpu time spent up to now is 27.4 secs Computing kpt #: 44 total cpu time spent up to now is 28.0 secs Computing kpt #: 45 total cpu time spent up to now is 28.7 secs Computing kpt #: 46 total cpu time spent up to now is 29.3 secs Computing kpt #: 47 total cpu time spent up to now is 29.9 secs Computing kpt #: 48 total cpu time spent up to now is 30.5 secs Computing kpt #: 49 total cpu time spent up to now is 31.0 secs Computing kpt #: 50 total cpu time spent up to now is 31.6 secs Computing kpt #: 51 total cpu time spent up to now is 32.2 secs Computing kpt #: 52 total cpu time spent up to now is 32.7 secs Computing kpt #: 53 total cpu time spent up to now is 33.7 secs Computing kpt #: 54 total cpu time spent up to now is 34.2 secs Computing kpt #: 55 total cpu time spent up to now is 34.8 secs Computing kpt #: 56 total cpu time spent up to now is 35.4 secs Computing kpt #: 57 total cpu time spent up to now is 36.0 secs Computing kpt #: 58 total cpu time spent up to now is 36.5 secs Computing kpt #: 59 total cpu time spent up to now is 37.1 secs Computing kpt #: 60 total cpu time spent up to now is 37.7 secs Computing kpt #: 61 total cpu time spent up to now is 38.3 secs Computing kpt #: 62 total cpu time spent up to now is 39.0 secs Computing kpt #: 63 total cpu time spent up to now is 39.6 secs Computing kpt #: 64 total cpu time spent up to now is 40.2 secs Computing kpt #: 65 total cpu time spent up to now is 40.8 secs Computing kpt #: 66 total cpu time spent up to now is 41.4 secs Computing kpt #: 67 total cpu time spent up to now is 42.0 secs Computing kpt #: 68 total cpu time spent up to now is 42.6 secs Computing kpt #: 69 total cpu time spent up to now is 43.2 secs Computing kpt #: 70 total cpu time spent up to now is 43.8 secs Computing kpt #: 71 total cpu time spent up to now is 44.4 secs Computing kpt #: 72 total cpu time spent up to now is 45.0 secs Computing kpt #: 73 total cpu time spent up to now is 45.6 secs Computing kpt #: 74 total cpu time spent up to now is 46.1 secs Computing kpt #: 75 total cpu time spent up to now is 46.7 secs Computing kpt #: 76 total cpu time spent up to now is 47.3 secs Computing kpt #: 77 total cpu time spent up to now is 47.9 secs Computing kpt #: 78 total cpu time spent up to now is 48.4 secs Computing kpt #: 79 total cpu time spent up to now is 49.0 secs Computing kpt #: 80 total cpu time spent up to now is 49.6 secs Computing kpt #: 81 total cpu time spent up to now is 50.1 secs Computing kpt #: 82 total cpu time spent up to now is 50.7 secs Computing kpt #: 83 total cpu time spent up to now is 51.3 secs Computing kpt #: 84 total cpu time spent up to now is 51.8 secs Computing kpt #: 85 total cpu time spent up to now is 52.4 secs Computing kpt #: 86 total cpu time spent up to now is 53.0 secs Computing kpt #: 87 total cpu time spent up to now is 53.6 secs Computing kpt #: 88 total cpu time spent up to now is 54.2 secs Computing kpt #: 89 total cpu time spent up to now is 54.8 secs Computing kpt #: 90 total cpu time spent up to now is 55.4 secs Computing kpt #: 91 total cpu time spent up to now is 56.0 secs Computing kpt #: 92 total cpu time spent up to now is 56.7 secs Computing kpt #: 93 total cpu time spent up to now is 57.3 secs Computing kpt #: 94 total cpu time spent up to now is 57.9 secs Computing kpt #: 95 total cpu time spent up to now is 58.5 secs Computing kpt #: 96 total cpu time spent up to now is 59.2 secs Computing kpt #: 97 total cpu time spent up to now is 59.8 secs Computing kpt #: 98 total cpu time spent up to now is 60.4 secs Computing kpt #: 99 total cpu time spent up to now is 61.1 secs Computing kpt #: 100 total cpu time spent up to now is 61.7 secs Computing kpt #: 101 total cpu time spent up to now is 62.3 secs Computing kpt #: 102 total cpu time spent up to now is 63.0 secs Computing kpt #: 103 total cpu time spent up to now is 63.6 secs Computing kpt #: 104 total cpu time spent up to now is 64.2 secs Computing kpt #: 105 total cpu time spent up to now is 64.9 secs Computing kpt #: 106 total cpu time spent up to now is 65.5 secs Computing kpt #: 107 total cpu time spent up to now is 66.1 secs Computing kpt #: 108 total cpu time spent up to now is 66.8 secs Computing kpt #: 109 total cpu time spent up to now is 67.4 secs Computing kpt #: 110 total cpu time spent up to now is 68.1 secs Computing kpt #: 111 total cpu time spent up to now is 68.7 secs Computing kpt #: 112 total cpu time spent up to now is 69.3 secs Computing kpt #: 113 total cpu time spent up to now is 70.0 secs Computing kpt #: 114 total cpu time spent up to now is 70.6 secs Computing kpt #: 115 total cpu time spent up to now is 71.2 secs Computing kpt #: 116 total cpu time spent up to now is 71.9 secs Computing kpt #: 117 total cpu time spent up to now is 72.7 secs Computing kpt #: 118 total cpu time spent up to now is 73.4 secs Computing kpt #: 119 total cpu time spent up to now is 74.1 secs Computing kpt #: 120 total cpu time spent up to now is 74.9 secs Computing kpt #: 121 total cpu time spent up to now is 75.6 secs Computing kpt #: 122 total cpu time spent up to now is 76.4 secs Computing kpt #: 123 total cpu time spent up to now is 77.0 secs Computing kpt #: 124 total cpu time spent up to now is 77.7 secs Computing kpt #: 125 total cpu time spent up to now is 78.3 secs Computing kpt #: 126 total cpu time spent up to now is 79.0 secs Computing kpt #: 127 total cpu time spent up to now is 79.6 secs Computing kpt #: 128 total cpu time spent up to now is 80.2 secs Computing kpt #: 129 total cpu time spent up to now is 80.9 secs Computing kpt #: 130 total cpu time spent up to now is 81.5 secs Computing kpt #: 131 total cpu time spent up to now is 82.2 secs Computing kpt #: 132 total cpu time spent up to now is 82.8 secs Computing kpt #: 133 total cpu time spent up to now is 83.5 secs Computing kpt #: 134 total cpu time spent up to now is 84.2 secs Computing kpt #: 135 total cpu time spent up to now is 84.8 secs Computing kpt #: 136 total cpu time spent up to now is 85.5 secs Computing kpt #: 137 total cpu time spent up to now is 86.2 secs Computing kpt #: 138 total cpu time spent up to now is 86.9 secs Computing kpt #: 139 total cpu time spent up to now is 87.6 secs Computing kpt #: 140 total cpu time spent up to now is 88.2 secs Computing kpt #: 141 total cpu time spent up to now is 88.8 secs Computing kpt #: 142 total cpu time spent up to now is 89.5 secs Computing kpt #: 143 total cpu time spent up to now is 90.2 secs Computing kpt #: 144 total cpu time spent up to now is 90.8 secs Computing kpt #: 145 total cpu time spent up to now is 91.4 secs Computing kpt #: 146 total cpu time spent up to now is 92.1 secs Computing kpt #: 147 total cpu time spent up to now is 92.7 secs Computing kpt #: 148 total cpu time spent up to now is 93.3 secs Computing kpt #: 149 total cpu time spent up to now is 93.9 secs Computing kpt #: 150 total cpu time spent up to now is 94.5 secs Computing kpt #: 151 total cpu time spent up to now is 95.1 secs Computing kpt #: 152 total cpu time spent up to now is 95.7 secs Computing kpt #: 153 total cpu time spent up to now is 96.3 secs Computing kpt #: 154 total cpu time spent up to now is 96.8 secs Computing kpt #: 155 total cpu time spent up to now is 97.4 secs Computing kpt #: 156 total cpu time spent up to now is 97.9 secs Computing kpt #: 157 total cpu time spent up to now is 98.5 secs Computing kpt #: 158 total cpu time spent up to now is 99.0 secs Computing kpt #: 159 total cpu time spent up to now is 99.6 secs Computing kpt #: 160 total cpu time spent up to now is 100.2 secs Computing kpt #: 161 total cpu time spent up to now is 100.7 secs Computing kpt #: 162 total cpu time spent up to now is 101.3 secs Computing kpt #: 163 total cpu time spent up to now is 101.9 secs Computing kpt #: 164 total cpu time spent up to now is 102.5 secs Computing kpt #: 165 total cpu time spent up to now is 103.1 secs Computing kpt #: 166 total cpu time spent up to now is 103.7 secs Computing kpt #: 167 total cpu time spent up to now is 104.3 secs Computing kpt #: 168 total cpu time spent up to now is 104.9 secs Computing kpt #: 169 total cpu time spent up to now is 105.6 secs Computing kpt #: 170 total cpu time spent up to now is 106.2 secs Computing kpt #: 171 total cpu time spent up to now is 106.8 secs Computing kpt #: 172 total cpu time spent up to now is 107.5 secs Computing kpt #: 173 total cpu time spent up to now is 108.1 secs Computing kpt #: 174 total cpu time spent up to now is 108.8 secs Computing kpt #: 175 total cpu time spent up to now is 109.4 secs Computing kpt #: 176 total cpu time spent up to now is 110.1 secs Computing kpt #: 177 total cpu time spent up to now is 110.7 secs Computing kpt #: 178 total cpu time spent up to now is 111.4 secs Computing kpt #: 179 total cpu time spent up to now is 112.0 secs Computing kpt #: 180 total cpu time spent up to now is 112.6 secs Computing kpt #: 181 total cpu time spent up to now is 113.3 secs Computing kpt #: 182 total cpu time spent up to now is 113.9 secs Computing kpt #: 183 total cpu time spent up to now is 114.6 secs Computing kpt #: 184 total cpu time spent up to now is 115.2 secs Computing kpt #: 185 total cpu time spent up to now is 115.9 secs Computing kpt #: 186 total cpu time spent up to now is 116.6 secs Computing kpt #: 187 total cpu time spent up to now is 117.2 secs Computing kpt #: 188 total cpu time spent up to now is 117.9 secs Computing kpt #: 189 total cpu time spent up to now is 118.6 secs Computing kpt #: 190 total cpu time spent up to now is 119.5 secs Computing kpt #: 191 total cpu time spent up to now is 120.3 secs Computing kpt #: 192 total cpu time spent up to now is 121.0 secs Computing kpt #: 193 total cpu time spent up to now is 121.7 secs Computing kpt #: 194 total cpu time spent up to now is 122.3 secs Computing kpt #: 195 total cpu time spent up to now is 123.1 secs Computing kpt #: 196 total cpu time spent up to now is 123.8 secs Computing kpt #: 197 total cpu time spent up to now is 124.6 secs Computing kpt #: 198 total cpu time spent up to now is 125.3 secs Computing kpt #: 199 total cpu time spent up to now is 126.0 secs Computing kpt #: 200 total cpu time spent up to now is 126.7 secs Computing kpt #: 201 total cpu time spent up to now is 127.4 secs Computing kpt #: 202 total cpu time spent up to now is 127.9 secs Computing kpt #: 203 total cpu time spent up to now is 128.5 secs Computing kpt #: 204 total cpu time spent up to now is 129.2 secs Computing kpt #: 205 total cpu time spent up to now is 129.9 secs Computing kpt #: 206 total cpu time spent up to now is 130.7 secs Computing kpt #: 207 total cpu time spent up to now is 131.4 secs Computing kpt #: 208 total cpu time spent up to now is 132.2 secs Computing kpt #: 209 total cpu time spent up to now is 132.8 secs Computing kpt #: 210 total cpu time spent up to now is 133.6 secs Computing kpt #: 211 total cpu time spent up to now is 134.3 secs Computing kpt #: 212 total cpu time spent up to now is 135.0 secs Computing kpt #: 213 total cpu time spent up to now is 135.7 secs Computing kpt #: 214 total cpu time spent up to now is 136.5 secs Computing kpt #: 215 total cpu time spent up to now is 137.1 secs Computing kpt #: 216 total cpu time spent up to now is 137.7 secs Computing kpt #: 217 total cpu time spent up to now is 138.4 secs Computing kpt #: 218 total cpu time spent up to now is 139.0 secs Computing kpt #: 219 total cpu time spent up to now is 139.6 secs Computing kpt #: 220 total cpu time spent up to now is 140.3 secs Computing kpt #: 221 total cpu time spent up to now is 140.9 secs Computing kpt #: 222 total cpu time spent up to now is 141.5 secs Computing kpt #: 223 total cpu time spent up to now is 142.2 secs Computing kpt #: 224 total cpu time spent up to now is 142.8 secs Computing kpt #: 225 total cpu time spent up to now is 143.4 secs Computing kpt #: 226 total cpu time spent up to now is 144.0 secs Computing kpt #: 227 total cpu time spent up to now is 144.7 secs Computing kpt #: 228 total cpu time spent up to now is 145.3 secs Computing kpt #: 229 total cpu time spent up to now is 146.0 secs Computing kpt #: 230 total cpu time spent up to now is 146.6 secs Computing kpt #: 231 total cpu time spent up to now is 147.3 secs Computing kpt #: 232 total cpu time spent up to now is 147.9 secs Computing kpt #: 233 total cpu time spent up to now is 148.5 secs Computing kpt #: 234 total cpu time spent up to now is 149.3 secs Computing kpt #: 235 total cpu time spent up to now is 150.0 secs Computing kpt #: 236 total cpu time spent up to now is 150.7 secs Computing kpt #: 237 total cpu time spent up to now is 151.3 secs Computing kpt #: 238 total cpu time spent up to now is 152.0 secs Computing kpt #: 239 total cpu time spent up to now is 152.6 secs Computing kpt #: 240 total cpu time spent up to now is 153.3 secs Computing kpt #: 241 total cpu time spent up to now is 153.9 secs Computing kpt #: 242 total cpu time spent up to now is 154.5 secs Computing kpt #: 243 total cpu time spent up to now is 155.1 secs Computing kpt #: 244 total cpu time spent up to now is 155.7 secs Computing kpt #: 245 total cpu time spent up to now is 156.3 secs Computing kpt #: 246 total cpu time spent up to now is 156.9 secs Computing kpt #: 247 total cpu time spent up to now is 157.6 secs Computing kpt #: 248 total cpu time spent up to now is 158.2 secs Computing kpt #: 249 total cpu time spent up to now is 158.8 secs Computing kpt #: 250 total cpu time spent up to now is 159.3 secs Computing kpt #: 251 total cpu time spent up to now is 159.9 secs Computing kpt #: 252 total cpu time spent up to now is 160.5 secs Computing kpt #: 253 total cpu time spent up to now is 161.1 secs Computing kpt #: 254 total cpu time spent up to now is 161.6 secs Computing kpt #: 255 total cpu time spent up to now is 162.2 secs Computing kpt #: 256 total cpu time spent up to now is 162.8 secs Computing kpt #: 257 total cpu time spent up to now is 163.3 secs Computing kpt #: 258 total cpu time spent up to now is 163.9 secs Computing kpt #: 259 total cpu time spent up to now is 164.5 secs Computing kpt #: 260 total cpu time spent up to now is 165.0 secs Computing kpt #: 261 total cpu time spent up to now is 165.6 secs Computing kpt #: 262 total cpu time spent up to now is 166.2 secs Computing kpt #: 263 total cpu time spent up to now is 166.7 secs Computing kpt #: 264 total cpu time spent up to now is 167.3 secs Computing kpt #: 265 total cpu time spent up to now is 167.9 secs Computing kpt #: 266 total cpu time spent up to now is 168.5 secs Computing kpt #: 267 total cpu time spent up to now is 169.1 secs Computing kpt #: 268 total cpu time spent up to now is 169.7 secs Computing kpt #: 269 total cpu time spent up to now is 170.3 secs Computing kpt #: 270 total cpu time spent up to now is 170.9 secs Computing kpt #: 271 total cpu time spent up to now is 171.5 secs Computing kpt #: 272 total cpu time spent up to now is 172.1 secs Computing kpt #: 273 total cpu time spent up to now is 172.7 secs Computing kpt #: 274 total cpu time spent up to now is 173.3 secs Computing kpt #: 275 total cpu time spent up to now is 173.9 secs Computing kpt #: 276 total cpu time spent up to now is 174.5 secs Computing kpt #: 277 total cpu time spent up to now is 175.1 secs Computing kpt #: 278 total cpu time spent up to now is 175.7 secs Computing kpt #: 279 total cpu time spent up to now is 176.4 secs Computing kpt #: 280 total cpu time spent up to now is 177.0 secs Computing kpt #: 281 total cpu time spent up to now is 177.6 secs Computing kpt #: 282 total cpu time spent up to now is 178.3 secs Computing kpt #: 283 total cpu time spent up to now is 179.0 secs Computing kpt #: 284 total cpu time spent up to now is 179.6 secs Computing kpt #: 285 total cpu time spent up to now is 180.3 secs Computing kpt #: 286 total cpu time spent up to now is 180.9 secs Computing kpt #: 287 total cpu time spent up to now is 181.6 secs Computing kpt #: 288 total cpu time spent up to now is 182.3 secs Computing kpt #: 289 total cpu time spent up to now is 183.0 secs Computing kpt #: 290 total cpu time spent up to now is 183.7 secs Computing kpt #: 291 total cpu time spent up to now is 184.5 secs Computing kpt #: 292 total cpu time spent up to now is 185.2 secs Computing kpt #: 293 total cpu time spent up to now is 185.7 secs Computing kpt #: 294 total cpu time spent up to now is 186.3 secs Computing kpt #: 295 total cpu time spent up to now is 187.0 secs Computing kpt #: 296 total cpu time spent up to now is 187.7 secs Computing kpt #: 297 total cpu time spent up to now is 188.5 secs Computing kpt #: 298 total cpu time spent up to now is 189.2 secs Computing kpt #: 299 total cpu time spent up to now is 190.0 secs Computing kpt #: 300 total cpu time spent up to now is 190.7 secs Computing kpt #: 301 total cpu time spent up to now is 191.5 secs Computing kpt #: 302 total cpu time spent up to now is 192.3 secs Computing kpt #: 303 total cpu time spent up to now is 193.1 secs Computing kpt #: 304 total cpu time spent up to now is 193.9 secs Computing kpt #: 305 total cpu time spent up to now is 194.8 secs Computing kpt #: 306 total cpu time spent up to now is 195.4 secs Computing kpt #: 307 total cpu time spent up to now is 196.0 secs Computing kpt #: 308 total cpu time spent up to now is 196.7 secs Computing kpt #: 309 total cpu time spent up to now is 197.3 secs Computing kpt #: 310 total cpu time spent up to now is 197.9 secs Computing kpt #: 311 total cpu time spent up to now is 198.6 secs Computing kpt #: 312 total cpu time spent up to now is 199.2 secs Computing kpt #: 313 total cpu time spent up to now is 199.9 secs Computing kpt #: 314 total cpu time spent up to now is 200.5 secs Computing kpt #: 315 total cpu time spent up to now is 201.1 secs Computing kpt #: 316 total cpu time spent up to now is 201.8 secs Computing kpt #: 317 total cpu time spent up to now is 202.4 secs Computing kpt #: 318 total cpu time spent up to now is 203.1 secs Computing kpt #: 319 total cpu time spent up to now is 203.7 secs Computing kpt #: 320 total cpu time spent up to now is 204.4 secs Computing kpt #: 321 total cpu time spent up to now is 205.0 secs Computing kpt #: 322 total cpu time spent up to now is 205.6 secs Computing kpt #: 323 total cpu time spent up to now is 206.3 secs Computing kpt #: 324 total cpu time spent up to now is 206.9 secs Computing kpt #: 325 total cpu time spent up to now is 207.5 secs Computing kpt #: 326 total cpu time spent up to now is 208.2 secs Computing kpt #: 327 total cpu time spent up to now is 208.8 secs Computing kpt #: 328 total cpu time spent up to now is 209.4 secs Computing kpt #: 329 total cpu time spent up to now is 210.1 secs Computing kpt #: 330 total cpu time spent up to now is 210.7 secs Computing kpt #: 331 total cpu time spent up to now is 211.3 secs Computing kpt #: 332 total cpu time spent up to now is 211.9 secs Computing kpt #: 333 total cpu time spent up to now is 212.6 secs Computing kpt #: 334 total cpu time spent up to now is 213.2 secs Computing kpt #: 335 total cpu time spent up to now is 213.8 secs Computing kpt #: 336 total cpu time spent up to now is 214.4 secs Computing kpt #: 337 total cpu time spent up to now is 215.0 secs Computing kpt #: 338 total cpu time spent up to now is 215.6 secs Computing kpt #: 339 total cpu time spent up to now is 216.2 secs Computing kpt #: 340 total cpu time spent up to now is 216.8 secs Computing kpt #: 341 total cpu time spent up to now is 217.4 secs Computing kpt #: 342 total cpu time spent up to now is 218.0 secs Computing kpt #: 343 total cpu time spent up to now is 218.6 secs Computing kpt #: 344 total cpu time spent up to now is 219.2 secs Computing kpt #: 345 total cpu time spent up to now is 219.8 secs Computing kpt #: 346 total cpu time spent up to now is 220.3 secs ethr = 2.17E-08, avg # of iterations = 18.3 total cpu time spent up to now is 220.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4645 PWs) bands (ev): -41.9596 -41.9596 -18.6539 -18.6539 -17.9996 -17.9996 -17.9996 -17.9996 -6.5592 -6.5592 -6.5592 -6.5592 -5.5416 -5.5416 -5.5279 -5.5279 -5.5279 -5.5279 4.4397 4.4397 11.8336 11.8336 11.9259 11.9259 11.9259 11.9259 12.2783 12.2783 12.2783 12.2783 13.5187 13.5187 13.5187 13.5187 13.5937 13.5937 14.4081 14.4081 14.4081 14.4081 14.7325 14.7325 14.7325 14.7325 14.7669 14.7669 16.5864 16.5864 16.5864 16.5864 18.1988 18.1988 18.6799 18.6799 18.6799 18.6799 k = 0.0096-0.0056 0.0079 ( 4641 PWs) bands (ev): -41.9596 -41.9596 -18.6539 -18.6539 -17.9996 -17.9996 -17.9996 -17.9996 -6.5591 -6.5591 -6.5591 -6.5591 -5.5416 -5.5416 -5.5279 -5.5279 -5.5279 -5.5279 4.4412 4.4412 11.8323 11.8323 11.9229 11.9229 11.9263 11.9263 12.2787 12.2787 12.2811 12.2811 13.5181 13.5181 13.5188 13.5188 13.5934 13.5934 14.4022 14.4022 14.4081 14.4081 14.7303 14.7303 14.7345 14.7345 14.7674 14.7674 16.5840 16.5840 16.5859 16.5859 18.1969 18.1969 18.6591 18.6591 18.6815 18.6815 k = 0.0192-0.0111 0.0157 ( 4633 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9996 -17.9996 -17.9996 -17.9996 -6.5591 -6.5591 -6.5591 -6.5591 -5.5415 -5.5415 -5.5279 -5.5279 -5.5278 -5.5278 4.4458 4.4458 11.8275 11.8275 11.9150 11.9150 11.9275 11.9275 12.2801 12.2801 12.2891 12.2891 13.5163 13.5163 13.5191 13.5191 13.5923 13.5923 14.3855 14.3855 14.4080 14.4080 14.7236 14.7236 14.7362 14.7362 14.7726 14.7726 16.5768 16.5768 16.5845 16.5845 18.1903 18.1903 18.6116 18.6116 18.6863 18.6863 k = 0.0288-0.0167 0.0236 ( 4629 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9997 -17.9997 -17.9996 -17.9996 -6.5591 -6.5591 -6.5590 -6.5590 -5.5415 -5.5415 -5.5278 -5.5278 -5.5277 -5.5277 4.4534 4.4534 11.8173 11.8173 11.9052 11.9052 11.9295 11.9295 12.2824 12.2824 12.3015 12.3015 13.5130 13.5130 13.5196 13.5196 13.5907 13.5907 14.3604 14.3604 14.4078 14.4078 14.7126 14.7126 14.7307 14.7307 14.7868 14.7868 16.5647 16.5647 16.5821 16.5821 18.1768 18.1768 18.5602 18.5602 18.6939 18.6939 k = 0.0385-0.0222 0.0314 ( 4621 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9998 -17.9998 -17.9996 -17.9996 -6.5591 -6.5591 -6.5589 -6.5589 -5.5414 -5.5414 -5.5278 -5.5278 -5.5276 -5.5276 4.4640 4.4640 11.7993 11.7993 11.8971 11.8971 11.9324 11.9324 12.2855 12.2855 12.3169 12.3169 13.5079 13.5079 13.5202 13.5202 13.5887 13.5887 14.3295 14.3295 14.4075 14.4075 14.6974 14.6974 14.7184 14.7184 14.8075 14.8075 16.5480 16.5480 16.5788 16.5788 18.1535 18.1535 18.5187 18.5187 18.7039 18.7039 k = 0.0481-0.0278 0.0393 ( 4613 PWs) bands (ev): -41.9596 -41.9596 -18.6541 -18.6541 -17.9998 -17.9998 -17.9997 -17.9997 -6.5591 -6.5591 -6.5587 -6.5587 -5.5413 -5.5413 -5.5277 -5.5277 -5.5274 -5.5274 4.4777 4.4777 11.7726 11.7726 11.8928 11.8928 11.9361 11.9361 12.2896 12.2896 12.3345 12.3345 13.5005 13.5005 13.5211 13.5211 13.5867 13.5867 14.2950 14.2950 14.4072 14.4072 14.6783 14.6783 14.7012 14.7012 14.8313 14.8313 16.5265 16.5265 16.5745 16.5745 18.1195 18.1195 18.4927 18.4927 18.7157 18.7157 k = 0.0577-0.0333 0.0471 ( 4613 PWs) bands (ev): -41.9596 -41.9596 -18.6542 -18.6542 -18.0000 -18.0000 -17.9997 -17.9997 -6.5590 -6.5590 -6.5586 -6.5586 -5.5412 -5.5412 -5.5276 -5.5276 -5.5273 -5.5273 4.4944 4.4944 11.7382 11.7382 11.8919 11.8919 11.9406 11.9406 12.2945 12.2945 12.3534 12.3534 13.4903 13.4903 13.5221 13.5221 13.5847 13.5847 14.2588 14.2588 14.4068 14.4068 14.6554 14.6554 14.6799 14.6799 14.8562 14.8562 16.5004 16.5004 16.5693 16.5693 18.0770 18.0770 18.4817 18.4817 18.7284 18.7284 k = 0.0673-0.0389 0.0550 ( 4609 PWs) bands (ev): -41.9596 -41.9596 -18.6542 -18.6542 -18.0001 -18.0001 -17.9998 -17.9998 -6.5590 -6.5590 -6.5584 -6.5584 -5.5411 -5.5411 -5.5275 -5.5275 -5.5270 -5.5270 4.5141 4.5141 11.6979 11.6979 11.8935 11.8935 11.9458 11.9458 12.3003 12.3003 12.3730 12.3730 13.4766 13.4766 13.5234 13.5234 13.5832 13.5832 14.2220 14.2220 14.4063 14.4063 14.6292 14.6292 14.6551 14.6551 14.8810 14.8810 16.4699 16.4699 16.5632 16.5632 18.0302 18.0302 18.4818 18.4818 18.7411 18.7411 k = 0.0769-0.0444 0.0628 ( 4601 PWs) bands (ev): -41.9595 -41.9595 -18.6543 -18.6543 -18.0003 -18.0003 -17.9998 -17.9998 -6.5589 -6.5589 -6.5581 -6.5581 -5.5409 -5.5409 -5.5274 -5.5274 -5.5268 -5.5268 4.5367 4.5367 11.6528 11.6528 11.8970 11.8970 11.9519 11.9519 12.3070 12.3070 12.3928 12.3928 13.4591 13.4591 13.5248 13.5248 13.5823 13.5823 14.1857 14.1857 14.4057 14.4057 14.5998 14.5998 14.6270 14.6270 14.9052 14.9052 16.4352 16.4352 16.5562 16.5562 17.9827 17.9827 18.4889 18.4889 18.7527 18.7527 k = 0.0865-0.0500 0.0707 ( 4605 PWs) bands (ev): -41.9595 -41.9595 -18.6544 -18.6544 -18.0004 -18.0004 -17.9999 -17.9999 -6.5589 -6.5589 -6.5579 -6.5579 -5.5408 -5.5408 -5.5272 -5.5272 -5.5265 -5.5265 4.5624 4.5624 11.6038 11.6038 11.9018 11.9018 11.9588 11.9588 12.3145 12.3145 12.4128 12.4128 13.4373 13.4373 13.5265 13.5265 13.5820 13.5820 14.1510 14.1510 14.4049 14.4049 14.5677 14.5677 14.5961 14.5961 14.9284 14.9284 16.3966 16.3966 16.5483 16.5483 17.9371 17.9371 18.4993 18.4993 18.7620 18.7620 k = 0.0962-0.0555 0.0785 ( 4605 PWs) bands (ev): -41.9595 -41.9595 -18.6545 -18.6545 -18.0006 -18.0006 -17.9999 -17.9999 -6.5588 -6.5588 -6.5576 -6.5576 -5.5406 -5.5406 -5.5271 -5.5271 -5.5262 -5.5262 4.5909 4.5909 11.5516 11.5516 11.9078 11.9078 11.9665 11.9665 12.3229 12.3229 12.4325 12.4325 13.4109 13.4109 13.5283 13.5283 13.5824 13.5824 14.1184 14.1184 14.4039 14.4039 14.5334 14.5334 14.5626 14.5626 14.9503 14.9503 16.3544 16.3544 16.5394 16.5394 17.8947 17.8947 18.5103 18.5103 18.7676 18.7676 k = 0.1058-0.0611 0.0864 ( 4605 PWs) bands (ev): -41.9595 -41.9595 -18.6547 -18.6547 -18.0008 -18.0008 -18.0000 -18.0000 -6.5587 -6.5587 -6.5573 -6.5573 -5.5404 -5.5404 -5.5269 -5.5269 -5.5259 -5.5259 4.6223 4.6223 11.4964 11.4964 11.9148 11.9148 11.9750 11.9750 12.3321 12.3321 12.4520 12.4520 13.3800 13.3800 13.5304 13.5304 13.5833 13.5833 14.0885 14.0885 14.4024 14.4024 14.4972 14.4972 14.5269 14.5269 14.9707 14.9707 16.3092 16.3092 16.5298 16.5298 17.8562 17.8562 18.5195 18.5195 18.7683 18.7683 k = 0.1154-0.0666 0.0942 ( 4609 PWs) bands (ev): -41.9595 -41.9595 -18.6548 -18.6548 -18.0010 -18.0010 -18.0001 -18.0001 -6.5587 -6.5587 -6.5570 -6.5570 -5.5402 -5.5402 -5.5267 -5.5267 -5.5256 -5.5256 4.6566 4.6566 11.4388 11.4388 11.9226 11.9226 11.9842 11.9842 12.3420 12.3420 12.4710 12.4710 13.3445 13.3445 13.5326 13.5326 13.5848 13.5848 14.0617 14.0617 14.3997 14.3997 14.4605 14.4605 14.4892 14.4892 14.9897 14.9897 16.2612 16.2612 16.5193 16.5193 17.8218 17.8218 18.5253 18.5253 18.7630 18.7630 k = 0.1250-0.0722 0.1021 ( 4625 PWs) bands (ev): -41.9595 -41.9595 -18.6549 -18.6549 -18.0013 -18.0013 -18.0002 -18.0002 -6.5586 -6.5586 -6.5566 -6.5566 -5.5400 -5.5400 -5.5265 -5.5265 -5.5253 -5.5253 4.6937 4.6937 11.3789 11.3789 11.9313 11.9313 11.9942 11.9942 12.3527 12.3527 12.4896 12.4896 13.3047 13.3047 13.5351 13.5351 13.5868 13.5868 14.0381 14.0381 14.3915 14.3915 14.4275 14.4275 14.4498 14.4498 15.0071 15.0071 16.2110 16.2110 16.5080 16.5080 17.7913 17.7913 18.5259 18.5259 18.7508 18.7508 k = 0.1346-0.0777 0.1099 ( 4617 PWs) bands (ev): -41.9595 -41.9595 -18.6551 -18.6551 -18.0015 -18.0015 -18.0002 -18.0002 -6.5585 -6.5585 -6.5563 -6.5563 -5.5398 -5.5398 -5.5262 -5.5262 -5.5250 -5.5250 4.7336 4.7336 11.3170 11.3170 11.9407 11.9407 12.0050 12.0050 12.3642 12.3642 12.5077 12.5077 13.2609 13.2609 13.5378 13.5378 13.5892 13.5892 14.0177 14.0177 14.3652 14.3652 14.4090 14.4090 14.4115 14.4115 15.0230 15.0230 16.1588 16.1588 16.4958 16.4958 17.7645 17.7645 18.5201 18.5201 18.7309 18.7309 k = 0.1442-0.0833 0.1178 ( 4625 PWs) bands (ev): -41.9594 -41.9594 -18.6552 -18.6552 -18.0018 -18.0018 -18.0003 -18.0003 -6.5584 -6.5584 -6.5559 -6.5559 -5.5397 -5.5397 -5.5259 -5.5259 -5.5246 -5.5246 4.7762 4.7762 11.2534 11.2534 11.9509 11.9509 12.0165 12.0165 12.3764 12.3764 12.5251 12.5251 13.2135 13.2135 13.5407 13.5407 13.5921 13.5921 14.0003 14.0003 14.3263 14.3263 14.3670 14.3670 14.4069 14.4069 15.0375 15.0375 16.1052 16.1052 16.4830 16.4830 17.7409 17.7409 18.5071 18.5071 18.7030 18.7030 k = 0.1538-0.0888 0.1256 ( 4613 PWs) bands (ev): -41.9594 -41.9594 -18.6554 -18.6554 -18.0020 -18.0020 -18.0004 -18.0004 -6.5583 -6.5583 -6.5556 -6.5556 -5.5395 -5.5395 -5.5256 -5.5256 -5.5243 -5.5243 4.8214 4.8214 11.1884 11.1884 11.9618 11.9618 12.0287 12.0287 12.3892 12.3892 12.5419 12.5419 13.1630 13.1630 13.5438 13.5438 13.5953 13.5953 13.9856 13.9856 14.2842 14.2842 14.3241 14.3241 14.4048 14.4048 15.0504 15.0504 16.0503 16.0503 16.4693 16.4693 17.7202 17.7202 18.4862 18.4862 18.6670 18.6670 k = 0.1635-0.0944 0.1335 ( 4613 PWs) bands (ev): -41.9594 -41.9594 -18.6555 -18.6555 -18.0023 -18.0023 -18.0005 -18.0005 -6.5582 -6.5582 -6.5552 -6.5552 -5.5393 -5.5393 -5.5253 -5.5253 -5.5239 -5.5239 4.8693 4.8693 11.1221 11.1221 11.9733 11.9733 12.0417 12.0417 12.4028 12.4028 12.5580 12.5580 13.1100 13.1100 13.5471 13.5471 13.5990 13.5990 13.9735 13.9735 14.2410 14.2410 14.2805 14.2805 14.4034 14.4034 15.0620 15.0620 15.9946 15.9946 16.4550 16.4550 17.7019 17.7019 18.4575 18.4575 18.6234 18.6234 k = 0.1731-0.0999 0.1413 ( 4605 PWs) bands (ev): -41.9594 -41.9594 -18.6557 -18.6557 -18.0026 -18.0026 -18.0006 -18.0006 -6.5581 -6.5581 -6.5548 -6.5548 -5.5391 -5.5391 -5.5250 -5.5250 -5.5236 -5.5236 4.9197 4.9197 11.0547 11.0547 11.9855 11.9855 12.0554 12.0554 12.4169 12.4169 12.5732 12.5732 13.0550 13.0550 13.5506 13.5506 13.6029 13.6029 13.9636 13.9636 14.1972 14.1972 14.2364 14.2364 14.4022 14.4022 15.0722 15.0722 15.9381 15.9381 16.4400 16.4400 17.6856 17.6856 18.4209 18.4209 18.5726 18.5726 k = 0.1827-0.1055 0.1492 ( 4597 PWs) bands (ev): -41.9593 -41.9593 -18.6559 -18.6559 -18.0029 -18.0029 -18.0007 -18.0007 -6.5580 -6.5580 -6.5545 -6.5545 -5.5389 -5.5389 -5.5246 -5.5246 -5.5233 -5.5233 4.9726 4.9726 10.9865 10.9865 11.9983 11.9983 12.0697 12.0697 12.4316 12.4316 12.5876 12.5876 12.9985 12.9985 13.5543 13.5543 13.6072 13.6072 13.9556 13.9556 14.1531 14.1531 14.1920 14.1920 14.4012 14.4012 15.0812 15.0812 15.8812 15.8812 16.4244 16.4244 17.6708 17.6708 18.3771 18.3771 18.5155 18.5155 k = 0.1923-0.1110 0.1570 ( 4604 PWs) bands (ev): -41.9593 -41.9593 -18.6560 -18.6560 -18.0032 -18.0032 -18.0008 -18.0008 -6.5579 -6.5579 -6.5541 -6.5541 -5.5388 -5.5388 -5.5242 -5.5242 -5.5230 -5.5230 5.0280 5.0280 10.9177 10.9177 12.0117 12.0117 12.0848 12.0848 12.4469 12.4469 12.6009 12.6009 12.9409 12.9409 13.5581 13.5581 13.6119 13.6119 13.9492 13.9492 14.1091 14.1091 14.1475 14.1475 14.4002 14.4002 15.0890 15.0890 15.8239 15.8239 16.4082 16.4082 17.6572 17.6572 18.3267 18.3267 18.4528 18.4528 k = 0.2019-0.1166 0.1649 ( 4604 PWs) bands (ev): -41.9593 -41.9593 -18.6562 -18.6562 -18.0034 -18.0034 -18.0010 -18.0010 -6.5578 -6.5578 -6.5537 -6.5537 -5.5386 -5.5386 -5.5238 -5.5238 -5.5227 -5.5227 5.0856 5.0856 10.8485 10.8485 12.0257 12.0257 12.1004 12.1004 12.4626 12.4626 12.6132 12.6132 12.8827 12.8827 13.5621 13.5621 13.6168 13.6168 13.9442 13.9442 14.0653 14.0653 14.1030 14.1030 14.3992 14.3992 15.0956 15.0956 15.7664 15.7664 16.3914 16.3914 17.6443 17.6443 18.2704 18.2704 18.3853 18.3853 k = 0.2115-0.1221 0.1727 ( 4596 PWs) bands (ev): -41.9593 -41.9593 -18.6564 -18.6564 -18.0037 -18.0037 -18.0011 -18.0011 -6.5577 -6.5577 -6.5534 -6.5534 -5.5385 -5.5385 -5.5234 -5.5234 -5.5224 -5.5224 5.1455 5.1455 10.7791 10.7791 12.0402 12.0402 12.1167 12.1167 12.4787 12.4787 12.6242 12.6242 12.8242 12.8242 13.5662 13.5662 13.6220 13.6220 13.9403 13.9403 14.0220 14.0220 14.0589 14.0589 14.3983 14.3983 15.1012 15.1012 15.7088 15.7088 16.3741 16.3741 17.6318 17.6318 18.2092 18.2092 18.3140 18.3140 k = 0.2212-0.1277 0.1806 ( 4596 PWs) bands (ev): -41.9592 -41.9592 -18.6566 -18.6566 -18.0040 -18.0040 -18.0012 -18.0012 -6.5576 -6.5576 -6.5530 -6.5530 -5.5383 -5.5383 -5.5230 -5.5230 -5.5222 -5.5222 5.2074 5.2074 10.7096 10.7096 12.0552 12.0552 12.1336 12.1336 12.4952 12.4952 12.6338 12.6338 12.7659 12.7659 13.5704 13.5704 13.6275 13.6275 13.9373 13.9373 13.9792 13.9792 14.0152 14.0152 14.3974 14.3974 15.1059 15.1059 15.6511 15.6511 16.3564 16.3564 17.6193 17.6193 18.1440 18.1440 18.2396 18.2396 k = 0.2308-0.1332 0.1884 ( 4596 PWs) bands (ev): -41.9592 -41.9592 -18.6567 -18.6567 -18.0043 -18.0043 -18.0013 -18.0013 -6.5575 -6.5575 -6.5527 -6.5527 -5.5382 -5.5382 -5.5225 -5.5225 -5.5219 -5.5219 5.2715 5.2715 10.6403 10.6403 12.0707 12.0707 12.1510 12.1510 12.5118 12.5118 12.6419 12.6419 12.7081 12.7081 13.5746 13.5746 13.6331 13.6331 13.9342 13.9342 13.9373 13.9373 13.9730 13.9730 14.3964 14.3964 15.1096 15.1096 15.5936 15.5936 16.3382 16.3382 17.6065 17.6065 18.0754 18.0754 18.1628 18.1628 k = 0.2404-0.1388 0.1963 ( 4596 PWs) bands (ev): -41.9592 -41.9592 -18.6569 -18.6569 -18.0046 -18.0046 -18.0014 -18.0014 -6.5574 -6.5574 -6.5524 -6.5524 -5.5381 -5.5381 -5.5220 -5.5220 -5.5217 -5.5217 5.3374 5.3374 10.5712 10.5712 12.0867 12.0867 12.1689 12.1689 12.5282 12.5282 12.6483 12.6483 12.6514 12.6514 13.5786 13.5786 13.6388 13.6388 13.8964 13.8964 13.9211 13.9211 13.9423 13.9423 14.3956 14.3956 15.1125 15.1125 15.5362 15.5362 16.3197 16.3197 17.5930 17.5930 18.0044 18.0044 18.0844 18.0844 k = 0.2500-0.1443 0.2041 ( 4632 PWs) bands (ev): -41.9592 -41.9592 -18.6571 -18.6571 -18.0049 -18.0049 -18.0015 -18.0015 -6.5573 -6.5573 -6.5521 -6.5521 -5.5380 -5.5380 -5.5216 -5.5216 -5.5216 -5.5216 5.4051 5.4051 10.5026 10.5026 12.1030 12.1030 12.1872 12.1872 12.5421 12.5421 12.5984 12.5984 12.6530 12.6530 13.5823 13.5823 13.6445 13.6445 13.8568 13.8568 13.8836 13.8836 13.9375 13.9375 14.3947 14.3947 15.1146 15.1146 15.4792 15.4792 16.3010 16.3010 17.5786 17.5786 17.9315 17.9315 18.0049 18.0049 k = 0.2596-0.1499 0.2120 ( 4620 PWs) bands (ev): -41.9591 -41.9591 -18.6573 -18.6573 -18.0052 -18.0052 -18.0016 -18.0016 -6.5572 -6.5572 -6.5518 -6.5518 -5.5379 -5.5379 -5.5214 -5.5214 -5.5211 -5.5211 5.4744 5.4744 10.4346 10.4346 12.1198 12.1198 12.2058 12.2058 12.5281 12.5281 12.5747 12.5747 12.6557 12.6557 13.5854 13.5854 13.6499 13.6499 13.8188 13.8188 13.8436 13.8436 13.9370 13.9370 14.3938 14.3938 15.1160 15.1160 15.4227 15.4227 16.2819 16.2819 17.5630 17.5630 17.8575 17.8575 17.9248 17.9248 k = 0.2692-0.1554 0.2198 ( 4620 PWs) bands (ev): -41.9591 -41.9591 -18.6574 -18.6574 -18.0054 -18.0054 -18.0018 -18.0018 -6.5571 -6.5571 -6.5515 -6.5515 -5.5378 -5.5378 -5.5213 -5.5213 -5.5206 -5.5206 5.5452 5.5452 10.3674 10.3674 12.1368 12.1368 12.2245 12.2245 12.4793 12.4793 12.5874 12.5874 12.6562 12.6562 13.5875 13.5875 13.6545 13.6545 13.7830 13.7830 13.8049 13.8049 13.9376 13.9376 14.3930 14.3930 15.1168 15.1168 15.3668 15.3668 16.2628 16.2628 17.5460 17.5460 17.7828 17.7828 17.8446 17.8446 k = 0.2788-0.1610 0.2277 ( 4620 PWs) bands (ev): -41.9591 -41.9591 -18.6576 -18.6576 -18.0057 -18.0057 -18.0019 -18.0019 -6.5570 -6.5570 -6.5513 -6.5513 -5.5377 -5.5377 -5.5212 -5.5212 -5.5201 -5.5201 5.6173 5.6173 10.3010 10.3010 12.1541 12.1541 12.2430 12.2430 12.4285 12.4285 12.6044 12.6044 12.6545 12.6545 13.5875 13.5875 13.6568 13.6568 13.7504 13.7504 13.7694 13.7694 13.9386 13.9386 14.3922 14.3922 15.1170 15.1170 15.3117 15.3117 16.2435 16.2435 17.5274 17.5274 17.7080 17.7080 17.7647 17.7647 k = 0.2885-0.1665 0.2355 ( 4612 PWs) bands (ev): -41.9591 -41.9591 -18.6577 -18.6577 -18.0060 -18.0060 -18.0020 -18.0020 -6.5569 -6.5569 -6.5510 -6.5510 -5.5377 -5.5377 -5.5211 -5.5211 -5.5196 -5.5196 5.6906 5.6906 10.2355 10.2355 12.1716 12.1716 12.2597 12.2597 12.3805 12.3805 12.6220 12.6220 12.6504 12.6504 13.5842 13.5842 13.6535 13.6535 13.7223 13.7223 13.7404 13.7404 13.9401 13.9401 14.3914 14.3914 15.1168 15.1168 15.2576 15.2576 16.2242 16.2242 17.5071 17.5071 17.6336 17.6336 17.6856 17.6856 k = 0.2981-0.1721 0.2434 ( 4612 PWs) bands (ev): -41.9590 -41.9590 -18.6579 -18.6579 -18.0062 -18.0062 -18.0021 -18.0021 -6.5568 -6.5568 -6.5508 -6.5508 -5.5376 -5.5376 -5.5210 -5.5210 -5.5191 -5.5191 5.7648 5.7648 10.1712 10.1712 12.1894 12.1894 12.2690 12.2690 12.3417 12.3417 12.6398 12.6398 12.6439 12.6439 13.5756 13.5756 13.6391 13.6391 13.7008 13.7008 13.7235 13.7235 13.9420 13.9420 14.3906 14.3906 15.1160 15.1160 15.2049 15.2049 16.2049 16.2049 17.4850 17.4850 17.5602 17.5602 17.6075 17.6075 k = 0.3077-0.1776 0.2512 ( 4620 PWs) bands (ev): -41.9590 -41.9590 -18.6581 -18.6581 -18.0064 -18.0064 -18.0022 -18.0022 -6.5567 -6.5567 -6.5506 -6.5506 -5.5376 -5.5376 -5.5210 -5.5210 -5.5186 -5.5186 5.8398 5.8398 10.1080 10.1080 12.2072 12.2072 12.2527 12.2527 12.3304 12.3304 12.6347 12.6347 12.6576 12.6576 13.5602 13.5602 13.6132 13.6132 13.6873 13.6873 13.7191 13.7191 13.9441 13.9441 14.3899 14.3899 15.1149 15.1149 15.1537 15.1537 16.1857 16.1857 17.4597 17.4597 17.4896 17.4896 17.5307 17.5307 k = 0.3173-0.1832 0.2591 ( 4624 PWs) bands (ev): -41.9590 -41.9590 -18.6582 -18.6582 -18.0067 -18.0067 -18.0023 -18.0023 -6.5566 -6.5566 -6.5504 -6.5504 -5.5375 -5.5375 -5.5210 -5.5210 -5.5181 -5.5181 5.9152 5.9152 10.0462 10.0462 12.2150 12.2150 12.2250 12.2250 12.3426 12.3426 12.6230 12.6230 12.6753 12.6753 13.5390 13.5390 13.5816 13.5816 13.6810 13.6810 13.7216 13.7216 13.9464 13.9464 14.3892 14.3892 15.1043 15.1043 15.1135 15.1135 16.1668 16.1668 17.4113 17.4113 17.4423 17.4423 17.4557 17.4557 k = 0.3269-0.1887 0.2669 ( 4616 PWs) bands (ev): -41.9590 -41.9590 -18.6583 -18.6583 -18.0069 -18.0069 -18.0024 -18.0024 -6.5565 -6.5565 -6.5503 -6.5503 -5.5375 -5.5375 -5.5210 -5.5210 -5.5176 -5.5176 5.9908 5.9908 9.9857 9.9857 12.1731 12.1731 12.2429 12.2429 12.3610 12.3610 12.6086 12.6086 12.6927 12.6927 13.5141 13.5141 13.5480 13.5480 13.6797 13.6797 13.7272 13.7272 13.9489 13.9489 14.3885 14.3885 15.0569 15.0569 15.1118 15.1118 16.1481 16.1481 17.3436 17.3436 17.3826 17.3826 17.4150 17.4150 k = 0.3365-0.1943 0.2748 ( 4616 PWs) bands (ev): -41.9590 -41.9590 -18.6585 -18.6585 -18.0071 -18.0071 -18.0025 -18.0025 -6.5564 -6.5564 -6.5501 -6.5501 -5.5374 -5.5374 -5.5210 -5.5210 -5.5172 -5.5172 6.0664 6.0664 9.9267 9.9267 12.1315 12.1315 12.2606 12.2606 12.3812 12.3812 12.5918 12.5918 12.7098 12.7098 13.4874 13.4874 13.5140 13.5140 13.6815 13.6815 13.7342 13.7342 13.9516 13.9516 14.3879 14.3879 15.0119 15.0119 15.1099 15.1099 16.1297 16.1297 17.2763 17.2763 17.3117 17.3117 17.3886 17.3886 k = 0.3462-0.1999 0.2826 ( 4624 PWs) bands (ev): -41.9589 -41.9589 -18.6586 -18.6586 -18.0073 -18.0073 -18.0026 -18.0026 -6.5563 -6.5563 -6.5500 -6.5500 -5.5374 -5.5374 -5.5211 -5.5211 -5.5167 -5.5167 6.1417 6.1417 9.8693 9.8693 12.0913 12.0913 12.2782 12.2782 12.4022 12.4022 12.5726 12.5726 12.7266 12.7266 13.4602 13.4602 13.4803 13.4803 13.6852 13.6852 13.7419 13.7419 13.9543 13.9543 14.3873 14.3873 14.9694 14.9694 15.1078 15.1078 16.1118 16.1118 17.2111 17.2111 17.2433 17.2433 17.3621 17.3621 k = 0.3558-0.2054 0.2905 ( 4616 PWs) bands (ev): -41.9589 -41.9589 -18.6587 -18.6587 -18.0075 -18.0075 -18.0027 -18.0027 -6.5563 -6.5563 -6.5499 -6.5499 -5.5374 -5.5374 -5.5211 -5.5211 -5.5163 -5.5163 6.2162 6.2162 9.8136 9.8136 12.0530 12.0530 12.2954 12.2954 12.4235 12.4235 12.5512 12.5512 12.7429 12.7429 13.4333 13.4333 13.4473 13.4473 13.6899 13.6899 13.7500 13.7500 13.9571 13.9571 14.3868 14.3868 14.9296 14.9296 15.1055 15.1055 16.0945 16.0945 17.1482 17.1482 17.1776 17.1776 17.3359 17.3359 k = 0.3654-0.2110 0.2983 ( 4632 PWs) bands (ev): -41.9589 -41.9589 -18.6589 -18.6589 -18.0077 -18.0077 -18.0028 -18.0028 -6.5562 -6.5562 -6.5498 -6.5498 -5.5374 -5.5374 -5.5212 -5.5212 -5.5159 -5.5159 6.2897 6.2897 9.7597 9.7597 12.0167 12.0167 12.3124 12.3124 12.4449 12.4449 12.5280 12.5280 12.7586 12.7586 13.4071 13.4071 13.4152 13.4152 13.6952 13.6952 13.7582 13.7582 13.9600 13.9600 14.3863 14.3863 14.8926 14.8926 15.1032 15.1032 16.0777 16.0777 17.0881 17.0881 17.1147 17.1147 17.3101 17.3101 k = 0.3750-0.2165 0.3062 ( 4632 PWs) bands (ev): -41.9589 -41.9589 -18.6590 -18.6590 -18.0078 -18.0078 -18.0029 -18.0029 -6.5561 -6.5561 -6.5497 -6.5497 -5.5374 -5.5374 -5.5213 -5.5213 -5.5155 -5.5155 6.3617 6.3617 9.7077 9.7077 11.9826 11.9826 12.3288 12.3288 12.4662 12.4662 12.5033 12.5033 12.7737 12.7737 13.3819 13.3819 13.3840 13.3840 13.7010 13.7010 13.7665 13.7665 13.9628 13.9628 14.3859 14.3859 14.8586 14.8586 15.1008 15.1008 16.0616 16.0616 17.0309 17.0309 17.0551 17.0551 17.2850 17.2850 k = 0.3846-0.2221 0.3140 ( 4620 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0080 -18.0080 -18.0030 -18.0030 -6.5560 -6.5560 -6.5496 -6.5496 -5.5373 -5.5373 -5.5214 -5.5214 -5.5151 -5.5151 6.4318 6.4318 9.6579 9.6579 11.9507 11.9507 12.3446 12.3446 12.4776 12.4776 12.4873 12.4873 12.7882 12.7882 13.3540 13.3540 13.3579 13.3579 13.7068 13.7068 13.7747 13.7747 13.9656 13.9656 14.3855 14.3855 14.8275 14.8275 15.0985 15.0985 16.0463 16.0463 16.9769 16.9769 16.9988 16.9988 17.2610 17.2610 k = 0.3942-0.2276 0.3219 ( 4620 PWs) bands (ev): -41.9588 -41.9588 -18.6592 -18.6592 -18.0081 -18.0081 -18.0030 -18.0030 -6.5560 -6.5560 -6.5496 -6.5496 -5.5373 -5.5373 -5.5215 -5.5215 -5.5148 -5.5148 6.4995 6.4995 9.6103 9.6103 11.9212 11.9212 12.3594 12.3594 12.4515 12.4515 12.5080 12.5080 12.8018 12.8018 13.3251 13.3251 13.3352 13.3352 13.7127 13.7127 13.7827 13.7827 13.9684 13.9684 14.3851 14.3851 14.7995 14.7995 15.0962 15.0962 16.0319 16.0319 16.9264 16.9264 16.9460 16.9460 17.2383 17.2383 k = 0.4038-0.2332 0.3297 ( 4620 PWs) bands (ev): -41.9588 -41.9588 -18.6592 -18.6592 -18.0083 -18.0083 -18.0031 -18.0031 -6.5559 -6.5559 -6.5495 -6.5495 -5.5373 -5.5373 -5.5216 -5.5216 -5.5145 -5.5145 6.5643 6.5643 9.5653 9.5653 11.8941 11.8941 12.3725 12.3725 12.4262 12.4262 12.5283 12.5283 12.8146 12.8146 13.2975 13.2975 13.3140 13.3140 13.7185 13.7185 13.7904 13.7904 13.9710 13.9710 14.3848 14.3848 14.7744 14.7744 15.0939 15.0939 16.0184 16.0184 16.8794 16.8794 16.8970 16.8970 17.2172 17.2172 k = 0.4135-0.2387 0.3376 ( 4608 PWs) bands (ev): -41.9588 -41.9588 -18.6593 -18.6593 -18.0084 -18.0084 -18.0032 -18.0032 -6.5559 -6.5559 -6.5495 -6.5495 -5.5373 -5.5373 -5.5217 -5.5217 -5.5142 -5.5142 6.6256 6.6256 9.5230 9.5230 11.8695 11.8695 12.3793 12.3793 12.4068 12.4068 12.5478 12.5478 12.8265 12.8265 13.2714 13.2714 13.2944 13.2944 13.7241 13.7241 13.7977 13.7977 13.9736 13.9736 14.3846 14.3846 14.7522 14.7522 15.0918 15.0918 16.0059 16.0059 16.8363 16.8363 16.8520 16.8520 17.1977 17.1977 k = 0.4231-0.2443 0.3454 ( 4608 PWs) bands (ev): -41.9588 -41.9588 -18.6594 -18.6594 -18.0085 -18.0085 -18.0032 -18.0032 -6.5558 -6.5558 -6.5495 -6.5495 -5.5373 -5.5373 -5.5218 -5.5218 -5.5139 -5.5139 6.6828 6.6828 9.4838 9.4838 11.8473 11.8473 12.3657 12.3657 12.4077 12.4077 12.5665 12.5665 12.8375 12.8375 13.2469 13.2469 13.2764 13.2764 13.7294 13.7294 13.8045 13.8045 13.9759 13.9759 14.3843 14.3843 14.7327 14.7327 15.0898 15.0898 15.9945 15.9945 16.7971 16.7971 16.8112 16.8112 17.1800 17.1800 k = 0.4327-0.2498 0.3533 ( 4612 PWs) bands (ev): -41.9588 -41.9588 -18.6594 -18.6594 -18.0086 -18.0086 -18.0033 -18.0033 -6.5558 -6.5558 -6.5494 -6.5494 -5.5373 -5.5373 -5.5219 -5.5219 -5.5137 -5.5137 6.7354 6.7354 9.4480 9.4480 11.8277 11.8277 12.3439 12.3439 12.4171 12.4171 12.5841 12.5841 12.8474 12.8474 13.2242 13.2242 13.2602 13.2602 13.7342 13.7342 13.8107 13.8107 13.9781 13.9781 14.3842 14.3842 14.7160 14.7160 15.0880 15.0880 15.9843 15.9843 16.7621 16.7621 16.7747 16.7747 17.1643 17.1643 k = 0.4423-0.2554 0.3611 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0086 -18.0086 -18.0033 -18.0033 -6.5558 -6.5558 -6.5494 -6.5494 -5.5373 -5.5373 -5.5219 -5.5219 -5.5135 -5.5135 6.7827 6.7827 9.4158 9.4158 11.8106 11.8106 12.3226 12.3226 12.4269 12.4269 12.6003 12.6003 12.8562 12.8562 13.2035 13.2035 13.2460 13.2460 13.7386 13.7386 13.8162 13.8162 13.9801 13.9801 14.3840 14.3840 14.7018 14.7018 15.0863 15.0863 15.9753 15.9753 16.7314 16.7314 16.7427 16.7427 17.1505 17.1505 k = 0.4519-0.2609 0.3690 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0087 -18.0087 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5220 -5.5220 -5.5133 -5.5133 6.8241 6.8241 9.3878 9.3878 11.7962 11.7962 12.3033 12.3033 12.4357 12.4357 12.6148 12.6148 12.8638 12.8638 13.1852 13.1852 13.2337 13.2337 13.7425 13.7425 13.8211 13.8211 13.9819 13.9819 14.3839 14.3839 14.6900 14.6900 15.0849 15.0849 15.9675 15.9675 16.7052 16.7052 16.7153 16.7153 17.1388 17.1388 k = 0.4615-0.2665 0.3768 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0088 -18.0088 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5221 -5.5221 -5.5131 -5.5131 6.8589 6.8589 9.3642 9.3642 11.7843 11.7843 12.2868 12.2868 12.4432 12.4432 12.6274 12.6274 12.8703 12.8703 13.1694 13.1694 13.2235 13.2235 13.7458 13.7458 13.8251 13.8251 13.9833 13.9833 14.3838 14.3838 14.6805 14.6805 15.0837 15.0837 15.9611 15.9611 16.6836 16.6836 16.6927 16.6927 17.1292 17.1292 k = 0.4712-0.2720 0.3847 ( 4588 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0088 -18.0088 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5221 -5.5221 -5.5130 -5.5130 6.8867 6.8867 9.3454 9.3454 11.7750 11.7750 12.2735 12.2735 12.4491 12.4491 12.6376 12.6376 12.8754 12.8754 13.1566 13.1566 13.2154 13.2154 13.7483 13.7483 13.8283 13.8283 13.9845 13.9845 14.3838 14.3838 14.6733 14.6733 15.0828 15.0828 15.9561 15.9561 16.6667 16.6667 16.6751 16.6751 17.1217 17.1217 k = 0.4808-0.2776 0.3925 ( 4588 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0088 -18.0088 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9068 6.9068 9.3317 9.3317 11.7684 11.7684 12.2638 12.2638 12.4535 12.4535 12.6452 12.6452 12.8791 12.8791 13.1472 13.1472 13.2096 13.2096 13.7502 13.7502 13.8307 13.8307 13.9854 13.9854 14.3837 14.3837 14.6682 14.6682 15.0821 15.0821 15.9525 15.9525 16.6545 16.6545 16.6624 16.6624 17.1163 17.1163 k = 0.4904-0.2831 0.4004 ( 4568 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0089 -18.0089 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9191 6.9191 9.3234 9.3234 11.7644 11.7644 12.2578 12.2578 12.4561 12.4561 12.6499 12.6499 12.8814 12.8814 13.1414 13.1414 13.2061 13.2061 13.7514 13.7514 13.8321 13.8321 13.9859 13.9859 14.3837 14.3837 14.6651 14.6651 15.0817 15.0817 15.9503 15.9503 16.6472 16.6472 16.6547 16.6547 17.1131 17.1131 k = 0.5000-0.2887 0.4082 ( 4568 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9232 6.9232 9.3206 9.3206 11.7631 11.7631 12.2559 12.2559 12.4570 12.4570 12.6515 12.6515 12.8822 12.8822 13.1394 13.1394 13.2050 13.2050 13.7518 13.7518 13.8326 13.8326 13.9861 13.9861 14.3837 14.3837 14.6641 14.6641 15.0816 15.0816 15.9496 15.9496 16.6447 16.6447 16.6522 16.6522 17.1120 17.1120 k = 0.5000-0.2887 0.4082 ( 4568 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9232 6.9232 9.3206 9.3206 11.7631 11.7631 12.2559 12.2559 12.4570 12.4570 12.6515 12.6515 12.8822 12.8822 13.1394 13.1394 13.2050 13.2050 13.7518 13.7518 13.8326 13.8326 13.9861 13.9861 14.3837 14.3837 14.6641 14.6641 15.0816 15.0816 15.9496 15.9496 16.6447 16.6447 16.6522 16.6522 17.1120 17.1120 k = 0.5000-0.2776 0.4161 ( 4568 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0035 -18.0035 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9237 6.9237 9.3219 9.3219 11.7557 11.7557 12.2527 12.2527 12.4611 12.4611 12.6529 12.6529 12.8819 12.8819 13.1401 13.1401 13.2054 13.2054 13.7505 13.7505 13.8309 13.8309 13.9853 13.9853 14.3864 14.3864 14.6641 14.6641 15.0836 15.0836 15.9519 15.9519 16.6445 16.6445 16.6519 16.6519 17.1114 17.1114 k = 0.5000-0.2665 0.4240 ( 4590 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0035 -18.0035 -6.5556 -6.5556 -6.5494 -6.5494 -5.5372 -5.5372 -5.5222 -5.5222 -5.5129 -5.5129 6.9251 6.9251 9.3257 9.3257 11.7340 11.7340 12.2434 12.2434 12.4721 12.4721 12.6576 12.6576 12.8811 12.8811 13.1423 13.1423 13.2068 13.2068 13.7464 13.7464 13.8261 13.8261 13.9830 13.9830 14.3942 14.3942 14.6642 14.6642 15.0898 15.0898 15.9588 15.9588 16.6434 16.6434 16.6517 16.6517 17.1095 17.1095 k = 0.5000-0.2554 0.4318 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0035 -18.0035 -6.5556 -6.5556 -6.5494 -6.5494 -5.5371 -5.5371 -5.5221 -5.5221 -5.5129 -5.5129 6.9274 6.9274 9.3320 9.3320 11.6999 11.6999 12.2288 12.2288 12.4872 12.4872 12.6662 12.6662 12.8798 12.8798 13.1458 13.1458 13.2091 13.2091 13.7394 13.7394 13.8191 13.8191 13.9795 13.9795 14.4063 14.4063 14.6643 14.6643 15.1001 15.1001 15.9700 15.9700 16.6406 16.6406 16.6521 16.6521 17.1064 17.1064 k = 0.5000-0.2443 0.4397 ( 4606 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0035 -18.0035 -6.5555 -6.5555 -6.5494 -6.5494 -5.5370 -5.5370 -5.5221 -5.5221 -5.5130 -5.5130 6.9306 6.9306 9.3410 9.3410 11.6556 11.6556 12.2094 12.2094 12.5028 12.5028 12.6795 12.6795 12.8782 12.8782 13.1505 13.1505 13.2124 13.2124 13.7290 13.7290 13.8110 13.8110 13.9749 13.9749 14.4219 14.4219 14.6645 14.6645 15.1146 15.1146 15.9851 15.9851 16.6360 16.6360 16.6533 16.6533 17.1021 17.1021 k = 0.5000-0.2332 0.4475 ( 4606 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0036 -18.0036 -6.5554 -6.5554 -6.5494 -6.5494 -5.5369 -5.5369 -5.5221 -5.5221 -5.5131 -5.5131 6.9346 6.9346 9.3524 9.3524 11.6032 11.6032 12.1856 12.1856 12.5165 12.5165 12.6981 12.6981 12.8764 12.8764 13.1564 13.1564 13.2165 13.2165 13.7151 13.7151 13.8029 13.8029 13.9694 13.9694 14.4397 14.4397 14.6647 14.6647 15.1335 15.1335 16.0039 16.0039 16.6297 16.6297 16.6553 16.6553 17.0966 17.0966 k = 0.5000-0.2221 0.4554 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0036 -18.0036 -6.5553 -6.5553 -6.5494 -6.5494 -5.5367 -5.5367 -5.5220 -5.5220 -5.5131 -5.5131 6.9395 6.9395 9.3664 9.3664 11.5446 11.5446 12.1579 12.1579 12.5270 12.5270 12.7214 12.7214 12.8745 12.8745 13.1631 13.1631 13.2216 13.2216 13.6979 13.6979 13.7954 13.7954 13.9632 13.9632 14.4587 14.4587 14.6649 14.6649 15.1567 15.1567 16.0257 16.0257 16.6218 16.6218 16.6578 16.6578 17.0899 17.0899 k = 0.5000-0.2110 0.4632 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0087 -18.0087 -18.0037 -18.0037 -6.5552 -6.5552 -6.5495 -6.5495 -5.5365 -5.5365 -5.5219 -5.5219 -5.5132 -5.5132 6.9451 6.9451 9.3829 9.3829 11.4813 11.4813 12.1265 12.1265 12.5343 12.5343 12.7481 12.7481 12.8727 12.8727 13.1705 13.1705 13.2276 13.2276 13.6781 13.6781 13.7889 13.7889 13.9562 13.9562 14.4780 14.4780 14.6652 14.6652 15.1843 15.1843 16.0500 16.0500 16.6123 16.6123 16.6607 16.6607 17.0821 17.0821 k = 0.5000-0.1999 0.4711 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0087 -18.0087 -18.0038 -18.0038 -6.5550 -6.5550 -6.5495 -6.5495 -5.5363 -5.5363 -5.5219 -5.5219 -5.5134 -5.5134 6.9513 6.9513 9.4019 9.4019 11.4145 11.4145 12.0920 12.0920 12.5392 12.5392 12.7764 12.7764 12.8712 12.8712 13.1785 13.1785 13.2344 13.2344 13.6566 13.6566 13.7831 13.7831 13.9487 13.9487 14.4970 14.4970 14.6655 14.6655 15.2161 15.2161 16.0764 16.0764 16.6012 16.6012 16.6640 16.6640 17.0732 17.0732 k = 0.5000-0.1887 0.4789 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0086 -18.0086 -18.0039 -18.0039 -6.5548 -6.5548 -6.5495 -6.5495 -5.5361 -5.5361 -5.5218 -5.5218 -5.5135 -5.5135 6.9582 6.9582 9.4233 9.4233 11.3450 11.3450 12.0549 12.0549 12.5423 12.5423 12.8048 12.8048 12.8701 12.8701 13.1869 13.1869 13.2420 13.2420 13.6341 13.6341 13.7781 13.7781 13.9407 13.9407 14.5151 14.5151 14.6659 14.6659 15.2520 15.2520 16.1042 16.1042 16.5885 16.5885 16.6677 16.6677 17.0633 17.0633 k = 0.5000-0.1776 0.4868 ( 4612 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0086 -18.0086 -18.0040 -18.0040 -6.5547 -6.5547 -6.5496 -6.5496 -5.5359 -5.5359 -5.5217 -5.5217 -5.5136 -5.5136 6.9655 6.9655 9.4473 9.4473 11.2736 11.2736 12.0159 12.0159 12.5442 12.5442 12.8318 12.8318 12.8701 12.8701 13.1955 13.1955 13.2504 13.2504 13.6113 13.6113 13.7736 13.7736 13.9322 13.9322 14.5319 14.5319 14.6662 14.6662 15.2917 15.2917 16.1329 16.1329 16.5742 16.5742 16.6715 16.6715 17.0524 17.0524 k = 0.5000-0.1665 0.4946 ( 4608 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0085 -18.0085 -18.0041 -18.0041 -6.5545 -6.5545 -6.5496 -6.5496 -5.5356 -5.5356 -5.5216 -5.5216 -5.5138 -5.5138 6.9733 6.9733 9.4737 9.4737 11.2010 11.2010 11.9754 11.9754 12.5454 12.5454 12.8539 12.8539 12.8736 12.8736 13.2043 13.2043 13.2593 13.2593 13.5888 13.5888 13.7697 13.7697 13.9233 13.9233 14.5474 14.5474 14.6667 14.6667 15.3348 15.3348 16.1623 16.1623 16.5583 16.5583 16.6756 16.6756 17.0407 17.0407 k = 0.5000-0.1554 0.5025 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6598 -18.6598 -18.0084 -18.0084 -18.0042 -18.0042 -6.5543 -6.5543 -6.5497 -6.5497 -5.5353 -5.5353 -5.5214 -5.5214 -5.5140 -5.5140 6.9813 6.9813 9.5025 9.5025 11.1274 11.1274 11.9342 11.9342 12.5461 12.5461 12.8632 12.8632 12.8883 12.8883 13.2131 13.2131 13.2687 13.2687 13.5671 13.5671 13.7662 13.7662 13.9142 13.9142 14.5614 14.5614 14.6671 14.6671 15.3809 15.3809 16.1918 16.1918 16.5406 16.5406 16.6797 16.6797 17.0281 17.0281 k = 0.5000-0.1443 0.5103 ( 4604 PWs) bands (ev): -41.9587 -41.9587 -18.6598 -18.6598 -18.0084 -18.0084 -18.0043 -18.0043 -6.5541 -6.5541 -6.5497 -6.5497 -5.5351 -5.5351 -5.5213 -5.5213 -5.5142 -5.5142 6.9895 6.9895 9.5338 9.5338 11.0534 11.0534 11.8928 11.8928 12.5465 12.5465 12.8657 12.8657 12.9076 12.9076 13.2218 13.2218 13.2783 13.2783 13.5466 13.5466 13.7632 13.7632 13.9048 13.9048 14.5739 14.5739 14.6675 14.6675 15.4296 15.4296 16.2212 16.2212 16.5213 16.5213 16.6839 16.6839 17.0148 17.0148 k = 0.5000-0.1332 0.5182 ( 4596 PWs) bands (ev): -41.9587 -41.9587 -18.6598 -18.6598 -18.0083 -18.0083 -18.0044 -18.0044 -6.5539 -6.5539 -6.5498 -6.5498 -5.5348 -5.5348 -5.5211 -5.5211 -5.5144 -5.5144 6.9978 6.9978 9.5674 9.5674 10.9793 10.9793 11.8519 11.8519 12.5467 12.5467 12.8677 12.8677 12.9252 12.9252 13.2304 13.2304 13.2880 13.2880 13.5276 13.5276 13.7605 13.7605 13.8953 13.8953 14.5850 14.5850 14.6680 14.6680 15.4803 15.4803 16.2502 16.2502 16.5003 16.5003 16.6881 16.6881 17.0009 17.0009 k = 0.5000-0.1221 0.5260 ( 4596 PWs) bands (ev): -41.9587 -41.9587 -18.6598 -18.6598 -18.0082 -18.0082 -18.0045 -18.0045 -6.5537 -6.5537 -6.5498 -6.5498 -5.5345 -5.5345 -5.5210 -5.5210 -5.5146 -5.5146 7.0061 7.0061 9.6034 9.6034 10.9053 10.9053 11.8121 11.8121 12.5468 12.5468 12.8701 12.8701 12.9400 12.9400 13.2387 13.2387 13.2976 13.2976 13.5103 13.5103 13.7582 13.7582 13.8858 13.8858 14.5948 14.5948 14.6684 14.6684 15.5325 15.5325 16.2785 16.2785 16.4774 16.4774 16.6922 16.6922 16.9866 16.9866 k = 0.5000-0.1110 0.5339 ( 4596 PWs) bands (ev): -41.9587 -41.9587 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5534 -6.5534 -6.5499 -6.5499 -5.5343 -5.5343 -5.5208 -5.5208 -5.5148 -5.5148 7.0142 7.0142 9.6416 9.6416 10.8318 10.8318 11.7738 11.7738 12.5468 12.5468 12.8730 12.8730 12.9518 12.9518 13.2466 13.2466 13.3069 13.3069 13.4950 13.4950 13.7563 13.7563 13.8764 13.8764 14.6033 14.6033 14.6688 14.6688 15.5858 15.5858 16.3059 16.3059 16.4528 16.4528 16.6962 16.6962 16.9720 16.9720 k = 0.5000-0.0999 0.5417 ( 4606 PWs) bands (ev): -41.9587 -41.9587 -18.6598 -18.6598 -18.0081 -18.0081 -18.0047 -18.0047 -6.5532 -6.5532 -6.5500 -6.5500 -5.5341 -5.5341 -5.5206 -5.5206 -5.5150 -5.5150 7.0219 7.0219 9.6822 9.6822 10.7588 10.7588 11.7376 11.7376 12.5468 12.5468 12.8767 12.8767 12.9605 12.9605 13.2542 13.2542 13.3158 13.3158 13.4817 13.4817 13.7547 13.7547 13.8673 13.8673 14.6108 14.6108 14.6692 14.6692 15.6398 15.6398 16.3321 16.3321 16.4262 16.4262 16.6999 16.6999 16.9572 16.9572 k = 0.5000-0.0888 0.5496 ( 4602 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0080 -18.0080 -18.0049 -18.0049 -6.5530 -6.5530 -6.5501 -6.5501 -5.5338 -5.5338 -5.5204 -5.5204 -5.5153 -5.5153 7.0293 7.0293 9.7249 9.7249 10.6867 10.6867 11.7040 11.7040 12.5468 12.5468 12.8810 12.8810 12.9663 12.9663 13.2612 13.2612 13.3239 13.3239 13.4706 13.4706 13.7534 13.7534 13.8586 13.8586 14.6172 14.6172 14.6696 14.6696 15.6940 15.6940 16.3569 16.3569 16.3979 16.3979 16.7034 16.7034 16.9426 16.9426 k = 0.5000-0.0777 0.5574 ( 4596 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0079 -18.0079 -18.0050 -18.0050 -6.5528 -6.5528 -6.5502 -6.5502 -5.5336 -5.5336 -5.5202 -5.5202 -5.5155 -5.5155 7.0361 7.0361 9.7699 9.7699 10.6157 10.6157 11.6733 11.6733 12.5467 12.5467 12.8860 12.8860 12.9694 12.9694 13.2675 13.2675 13.3313 13.3313 13.4614 13.4614 13.7525 13.7525 13.8503 13.8503 14.6227 14.6227 14.6700 14.6700 15.7480 15.7480 16.3673 16.3673 16.3805 16.3805 16.7066 16.7066 16.9282 16.9282 k = 0.5000-0.0666 0.5653 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0078 -18.0078 -18.0051 -18.0051 -6.5526 -6.5526 -6.5503 -6.5503 -5.5334 -5.5334 -5.5199 -5.5199 -5.5158 -5.5158 7.0423 7.0423 9.8168 9.8168 10.5458 10.5458 11.6460 11.6460 12.5467 12.5467 12.8916 12.8916 12.9701 12.9701 13.2732 13.2732 13.3378 13.3378 13.4542 13.4542 13.7518 13.7518 13.8428 13.8428 14.6273 14.6273 14.6703 14.6703 15.8016 15.8016 16.3352 16.3352 16.4017 16.4017 16.7094 16.7094 16.9146 16.9146 k = 0.5000-0.0555 0.5731 ( 4598 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0078 -18.0078 -18.0052 -18.0052 -6.5524 -6.5524 -6.5504 -6.5504 -5.5333 -5.5333 -5.5197 -5.5197 -5.5160 -5.5160 7.0477 7.0477 9.8658 9.8658 10.4774 10.4774 11.6223 11.6223 12.5466 12.5466 12.8977 12.8977 12.9686 12.9686 13.2782 13.2782 13.3433 13.3433 13.4488 13.4488 13.7513 13.7513 13.8360 13.8360 14.6311 14.6311 14.6706 14.6706 15.8544 15.8544 16.3010 16.3010 16.4209 16.4209 16.7118 16.7118 16.9019 16.9019 k = 0.5000-0.0444 0.5810 ( 4604 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0077 -18.0077 -18.0053 -18.0053 -6.5522 -6.5522 -6.5505 -6.5505 -5.5332 -5.5332 -5.5195 -5.5195 -5.5162 -5.5162 7.0523 7.0523 9.9164 9.9164 10.4107 10.4107 11.6025 11.6025 12.5466 12.5466 12.9042 12.9042 12.9654 12.9654 13.2823 13.2823 13.3479 13.3479 13.4448 13.4448 13.7510 13.7510 13.8303 13.8303 14.6342 14.6342 14.6709 14.6709 15.9061 15.9061 16.2649 16.2649 16.4375 16.4375 16.7138 16.7138 16.8906 16.8906 k = 0.5000-0.0333 0.5888 ( 4604 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0053 -18.0053 -6.5520 -6.5520 -6.5506 -6.5506 -5.5330 -5.5330 -5.5193 -5.5193 -5.5165 -5.5165 7.0559 7.0559 9.9685 9.9685 10.3461 10.3461 11.5869 11.5869 12.5465 12.5465 12.9110 12.9110 12.9610 12.9610 13.2856 13.2856 13.3514 13.3514 13.4420 13.4420 13.7509 13.7509 13.8256 13.8256 14.6365 14.6365 14.6711 14.6711 15.9565 15.9565 16.2268 16.2268 16.4510 16.4510 16.7153 16.7153 16.8812 16.8812 k = 0.5000-0.0222 0.5967 ( 4608 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5519 -6.5519 -6.5507 -6.5507 -5.5330 -5.5330 -5.5191 -5.5191 -5.5166 -5.5166 7.0585 7.0585 10.0208 10.0208 10.2847 10.2847 11.5756 11.5756 12.5465 12.5465 12.9175 12.9175 12.9560 12.9560 13.2879 13.2879 13.3539 13.3539 13.4402 13.4402 13.7509 13.7509 13.8221 13.8221 14.6382 14.6382 14.6712 14.6712 16.0053 16.0053 16.1869 16.1869 16.4611 16.4611 16.7164 16.7164 16.8741 16.8741 k = 0.5000-0.0111 0.6045 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0601 7.0601 10.0699 10.0699 10.2302 10.2302 11.5688 11.5688 12.5465 12.5465 12.9229 12.9229 12.9514 12.9514 13.2894 13.2894 13.3553 13.3553 13.4392 13.4392 13.7509 13.7509 13.8200 13.8200 14.6392 14.6392 14.6713 14.6713 16.0518 16.0518 16.1458 16.1458 16.4674 16.4674 16.7170 16.7170 16.8697 16.8697 k = 0.5000 0.0000 0.6124 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0075 -18.0075 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0607 7.0607 10.0966 10.0966 10.2017 10.2017 11.5665 11.5665 12.5465 12.5465 12.9253 12.9253 12.9493 12.9493 13.2899 13.2899 13.3558 13.3558 13.4389 13.4389 13.7509 13.7509 13.8192 13.8192 14.6395 14.6395 14.6713 14.6713 16.0858 16.0858 16.1137 16.1137 16.4695 16.4695 16.7172 16.7172 16.8681 16.8681 k = 0.5000 0.0000 0.6124 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0075 -18.0075 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0607 7.0607 10.0966 10.0966 10.2017 10.2017 11.5665 11.5665 12.5465 12.5465 12.9253 12.9253 12.9493 12.9493 13.2899 13.2899 13.3558 13.3558 13.4389 13.4389 13.7509 13.7509 13.8192 13.8192 14.6395 14.6395 14.6713 14.6713 16.0858 16.0858 16.1137 16.1137 16.4695 16.4695 16.7172 16.7172 16.8681 16.8681 k = 0.4934 0.0114 0.6124 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0599 7.0599 10.0828 10.0828 10.2154 10.2154 11.5690 11.5690 12.5459 12.5459 12.9242 12.9242 12.9507 12.9507 13.2897 13.2897 13.3558 13.3558 13.4394 13.4394 13.7504 13.7504 13.8193 13.8193 14.6398 14.6398 14.6718 14.6718 16.0653 16.0653 16.1334 16.1334 16.4696 16.4696 16.7174 16.7174 16.8695 16.8695 k = 0.4868 0.0228 0.6124 ( 4605 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5507 -6.5507 -5.5329 -5.5329 -5.5191 -5.5191 -5.5167 -5.5167 7.0576 7.0576 10.0544 10.0544 10.2432 10.2432 11.5767 11.5767 12.5443 12.5443 12.9212 12.9212 12.9547 12.9547 13.2894 13.2894 13.3557 13.3557 13.4408 13.4408 13.7490 13.7490 13.8194 13.8194 14.6409 14.6409 14.6733 14.6733 16.0340 16.0340 16.1626 16.1626 16.4706 16.4706 16.7179 16.7179 16.8731 16.8731 k = 0.4803 0.0342 0.6124 ( 4597 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5519 -6.5519 -6.5507 -6.5507 -5.5330 -5.5330 -5.5192 -5.5192 -5.5166 -5.5166 7.0541 7.0541 10.0225 10.0225 10.2732 10.2732 11.5899 11.5899 12.5412 12.5412 12.9168 12.9168 12.9608 12.9608 13.2890 13.2890 13.3554 13.3554 13.4433 13.4433 13.7466 13.7466 13.8194 13.8194 14.6429 14.6429 14.6757 14.6757 16.0002 16.0002 16.1926 16.1926 16.4730 16.4730 16.7183 16.7183 16.8784 16.8784 k = 0.4737 0.0456 0.6124 ( 4599 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0053 -18.0053 -6.5520 -6.5520 -6.5506 -6.5506 -5.5330 -5.5330 -5.5193 -5.5193 -5.5164 -5.5164 7.0497 7.0497 9.9906 9.9906 10.3015 10.3015 11.6085 11.6085 12.5368 12.5368 12.9118 12.9118 12.9684 12.9684 13.2888 13.2888 13.3548 13.3548 13.4467 13.4467 13.7432 13.7432 13.8192 13.8192 14.6456 14.6456 14.6792 14.6792 15.9648 15.9648 16.2226 16.2226 16.4772 16.4772 16.7187 16.7187 16.8849 16.8849 k = 0.4671 0.0570 0.6124 ( 4597 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0077 -18.0077 -18.0052 -18.0052 -6.5521 -6.5521 -6.5506 -6.5506 -5.5330 -5.5330 -5.5195 -5.5195 -5.5163 -5.5163 7.0446 7.0446 9.9600 9.9600 10.3268 10.3268 11.6323 11.6323 12.5308 12.5308 12.9064 12.9064 12.9770 12.9770 13.2889 13.2889 13.3541 13.3541 13.4510 13.4510 13.7389 13.7389 13.8189 13.8189 14.6488 14.6488 14.6844 14.6844 15.9280 15.9280 16.2525 16.2525 16.4838 16.4838 16.7188 16.7188 16.8920 16.8920 k = 0.4605 0.0684 0.6124 ( 4597 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0077 -18.0077 -18.0052 -18.0052 -6.5522 -6.5522 -6.5505 -6.5505 -5.5330 -5.5330 -5.5197 -5.5197 -5.5161 -5.5161 7.0390 7.0390 9.9310 9.9310 10.3485 10.3485 11.6610 11.6610 12.5231 12.5231 12.9008 12.9008 12.9864 12.9864 13.2892 13.2892 13.3531 13.3531 13.4563 13.4563 13.7336 13.7336 13.8183 13.8183 14.6519 14.6519 14.6916 14.6916 15.8901 15.8901 16.2819 16.2819 16.4927 16.4927 16.7184 16.7184 16.8993 16.8993 k = 0.4539 0.0798 0.6124 ( 4603 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0078 -18.0078 -18.0051 -18.0051 -6.5523 -6.5523 -6.5504 -6.5504 -5.5331 -5.5331 -5.5199 -5.5199 -5.5159 -5.5159 7.0331 7.0331 9.9038 9.9038 10.3665 10.3665 11.6941 11.6941 12.5138 12.5138 12.8952 12.8952 12.9964 12.9964 13.2898 13.2898 13.3519 13.3519 13.4624 13.4624 13.7275 13.7275 13.8174 13.8174 14.6547 14.6547 14.7012 14.7012 15.8514 15.8514 16.3108 16.3108 16.5041 16.5041 16.7175 16.7175 16.9066 16.9066 k = 0.4474 0.0912 0.6124 ( 4597 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0078 -18.0078 -18.0050 -18.0050 -6.5524 -6.5524 -6.5503 -6.5503 -5.5331 -5.5331 -5.5200 -5.5200 -5.5157 -5.5157 7.0270 7.0270 9.8787 9.8787 10.3811 10.3811 11.7308 11.7308 12.5028 12.5028 12.8896 12.8896 13.0067 13.0067 13.2908 13.2908 13.3505 13.3505 13.4693 13.4693 13.7205 13.7205 13.8163 13.8163 14.6569 14.6569 14.7132 14.7132 15.8121 15.8121 16.3391 16.3391 16.5180 16.5180 16.7160 16.7160 16.9134 16.9134 k = 0.4408 0.1026 0.6124 ( 4599 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0079 -18.0079 -18.0050 -18.0050 -6.5525 -6.5525 -6.5503 -6.5503 -5.5332 -5.5332 -5.5202 -5.5202 -5.5156 -5.5156 7.0210 7.0210 9.8556 9.8556 10.3926 10.3926 11.7703 11.7703 12.4902 12.4902 12.8842 12.8842 13.0171 13.0171 13.2921 13.2921 13.3490 13.3490 13.4769 13.4769 13.7128 13.7128 13.8150 13.8150 14.6588 14.6588 14.7275 14.7275 15.7727 15.7727 16.3666 16.3666 16.5341 16.5341 16.7137 16.7137 16.9194 16.9194 k = 0.4342 0.1140 0.6124 ( 4591 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0079 -18.0079 -18.0049 -18.0049 -6.5525 -6.5525 -6.5502 -6.5502 -5.5332 -5.5332 -5.5204 -5.5204 -5.5154 -5.5154 7.0152 7.0152 9.8346 9.8346 10.4013 10.4013 11.8119 11.8119 12.4759 12.4759 12.8790 12.8790 13.0274 13.0274 13.2938 13.2938 13.3474 13.3474 13.4850 13.4850 13.7045 13.7045 13.8136 13.8136 14.6602 14.6602 14.7438 14.7438 15.7335 15.7335 16.3932 16.3932 16.5521 16.5521 16.7107 16.7107 16.9245 16.9245 k = 0.4276 0.1253 0.6124 ( 4591 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0048 -18.0048 -6.5526 -6.5526 -6.5502 -6.5502 -5.5332 -5.5332 -5.5205 -5.5205 -5.5152 -5.5152 7.0097 7.0097 9.8157 9.8157 10.4078 10.4078 11.8545 11.8545 12.4600 12.4600 12.8741 12.8741 13.0372 13.0372 13.2956 13.2956 13.3457 13.3457 13.4935 13.4935 13.6956 13.6956 13.8120 13.8120 14.6613 14.6613 14.7617 14.7617 15.6951 15.6951 16.4187 16.4187 16.5717 16.5717 16.7068 16.7068 16.9284 16.9284 k = 0.4211 0.1367 0.6124 ( 4593 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0048 -18.0048 -6.5527 -6.5527 -6.5501 -6.5501 -5.5333 -5.5333 -5.5207 -5.5207 -5.5151 -5.5151 7.0046 7.0046 9.7991 9.7991 10.4124 10.4124 11.8974 11.8974 12.4426 12.4426 12.8696 12.8696 13.0465 13.0465 13.2976 13.2976 13.3440 13.3440 13.5024 13.5024 13.6864 13.6864 13.8105 13.8105 14.6623 14.6623 14.7806 14.7806 15.6580 15.6580 16.4429 16.4429 16.5924 16.5924 16.7021 16.7021 16.9311 16.9311 k = 0.4145 0.1481 0.6124 ( 4593 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0047 -18.0047 -6.5527 -6.5527 -6.5501 -6.5501 -5.5333 -5.5333 -5.5208 -5.5208 -5.5150 -5.5150 7.0000 7.0000 9.7846 9.7846 10.4156 10.4156 11.9396 11.9396 12.4240 12.4240 12.8656 12.8656 13.0550 13.0550 13.2998 13.2998 13.3423 13.3423 13.5114 13.5114 13.6770 13.6770 13.8089 13.8089 14.6630 14.6630 14.8000 14.8000 15.6229 15.6229 16.4657 16.4657 16.6134 16.6134 16.6966 16.6966 16.9324 16.9324 k = 0.4079 0.1595 0.6124 ( 4603 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0047 -18.0047 -6.5528 -6.5528 -6.5500 -6.5500 -5.5333 -5.5333 -5.5209 -5.5209 -5.5149 -5.5149 6.9960 6.9960 9.7723 9.7723 10.4176 10.4176 11.9803 11.9803 12.4043 12.4043 12.8621 12.8621 13.0624 13.0624 13.3019 13.3019 13.3407 13.3407 13.5203 13.5203 13.6677 13.6677 13.8075 13.8075 14.6636 14.6636 14.8191 14.8191 15.5905 15.5905 16.4867 16.4867 16.6340 16.6340 16.6906 16.6906 16.9325 16.9325 k = 0.4013 0.1709 0.6124 ( 4595 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5528 -6.5528 -6.5500 -6.5500 -5.5334 -5.5334 -5.5210 -5.5210 -5.5148 -5.5148 6.9926 6.9926 9.7622 9.7622 10.4189 10.4189 12.0183 12.0183 12.3842 12.3842 12.8592 12.8592 13.0688 13.0688 13.3039 13.3039 13.3392 13.3392 13.5289 13.5289 13.6587 13.6587 13.8063 13.8063 14.6640 14.6640 14.8369 14.8369 15.5617 15.5617 16.5056 16.5056 16.6532 16.6532 16.6841 16.6841 16.9315 16.9315 k = 0.3947 0.1823 0.6124 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5147 -5.5147 6.9899 6.9899 9.7544 9.7544 10.4197 10.4197 12.0522 12.0522 12.3647 12.3647 12.8568 12.8568 13.0738 13.0738 13.3057 13.3057 13.3378 13.3378 13.5367 13.5367 13.6506 13.6506 13.8053 13.8053 14.6644 14.6644 14.8525 14.8525 15.5377 15.5377 16.5219 16.5219 16.6694 16.6694 16.6783 16.6783 16.9297 16.9297 k = 0.3882 0.1937 0.6124 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5147 -5.5147 6.9880 6.9880 9.7488 9.7488 10.4201 10.4201 12.0801 12.0801 12.3473 12.3473 12.8551 12.8551 13.0775 13.0775 13.3071 13.3071 13.3368 13.3368 13.5431 13.5431 13.6439 13.6439 13.8045 13.8045 14.6646 14.6646 14.8647 14.8647 15.5195 15.5195 16.5347 16.5347 16.6710 16.6710 16.6841 16.6841 16.9278 16.9278 k = 0.3816 0.2051 0.6124 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9868 6.9868 9.7455 9.7455 10.4202 10.4202 12.0990 12.0990 12.3347 12.3347 12.8541 12.8541 13.0798 13.0798 13.3080 13.3080 13.3361 13.3361 13.5475 13.5475 13.6393 13.6393 13.8040 13.8040 14.6648 14.6648 14.8725 14.8725 15.5080 15.5080 16.5431 16.5431 16.6672 16.6672 16.6924 16.6924 16.9263 16.9263 k = 0.3750 0.2165 0.6124 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9864 6.9864 9.7443 9.7443 10.4203 10.4203 12.1059 12.1059 12.3300 12.3300 12.8538 12.8538 13.0805 13.0805 13.3084 13.3084 13.3358 13.3358 13.5491 13.5491 13.6377 13.6377 13.8039 13.8039 14.6648 14.6648 14.8752 14.8752 15.5041 15.5041 16.5460 16.5460 16.6657 16.6657 16.6953 16.6953 16.9257 16.9257 k = 0.3750 0.2165 0.6124 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9864 6.9864 9.7443 9.7443 10.4203 10.4203 12.1059 12.1059 12.3300 12.3300 12.8538 12.8538 13.0805 13.0805 13.3084 13.3084 13.3358 13.3358 13.5491 13.5491 13.6377 13.6377 13.8039 13.8039 14.6648 14.6648 14.8752 14.8752 15.5041 15.5041 16.5460 16.5460 16.6657 16.6657 16.6953 16.6953 16.9257 16.9257 k = 0.3682 0.2126 0.6012 ( 4600 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5527 -6.5527 -6.5500 -6.5500 -5.5331 -5.5331 -5.5211 -5.5211 -5.5147 -5.5147 6.9805 6.9805 9.7904 9.7904 10.3415 10.3415 12.0719 12.0719 12.3440 12.3440 12.8552 12.8552 13.0963 13.0963 13.3174 13.3174 13.3489 13.3489 13.5326 13.5326 13.6403 13.6403 13.7871 13.7871 14.6645 14.6645 14.9092 14.9092 15.5437 15.5437 16.5339 16.5339 16.6766 16.6766 16.7722 16.7722 16.9089 16.9089 k = 0.3614 0.2086 0.5901 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5526 -6.5526 -6.5501 -6.5501 -5.5329 -5.5329 -5.5211 -5.5211 -5.5148 -5.5148 6.9712 6.9712 9.8382 9.8382 10.2684 10.2684 12.0384 12.0384 12.3582 12.3582 12.8572 12.8572 13.1105 13.1105 13.3248 13.3248 13.3622 13.3622 13.5159 13.5159 13.6445 13.6445 13.7708 13.7708 14.6640 14.6640 14.9430 14.9430 15.5856 15.5856 16.5208 16.5208 16.6894 16.6894 16.8519 16.8519 16.8924 16.8924 k = 0.3545 0.2047 0.5790 ( 4580 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0046 -18.0046 -6.5524 -6.5524 -6.5501 -6.5501 -5.5327 -5.5327 -5.5211 -5.5211 -5.5149 -5.5149 6.9582 6.9582 9.8871 9.8871 10.2025 10.2025 12.0055 12.0055 12.3727 12.3727 12.8598 12.8598 13.1233 13.1233 13.3304 13.3304 13.3754 13.3754 13.4993 13.4993 13.6496 13.6496 13.7553 13.7553 14.6632 14.6632 14.9767 14.9767 15.6300 15.6300 16.5066 16.5066 16.7043 16.7043 16.8749 16.8749 16.9355 16.9355 k = 0.3477 0.2008 0.5678 ( 4580 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0046 -18.0046 -6.5523 -6.5523 -6.5502 -6.5502 -5.5325 -5.5325 -5.5211 -5.5211 -5.5149 -5.5149 6.9412 6.9412 9.9353 9.9353 10.1460 10.1460 11.9732 11.9732 12.3873 12.3873 12.8630 12.8630 13.1350 13.1350 13.3338 13.3338 13.3881 13.3881 13.4834 13.4834 13.6550 13.6550 13.7413 13.7413 14.6622 14.6622 15.0102 15.0102 15.6770 15.6770 16.4916 16.4916 16.7215 16.7215 16.8589 16.8589 17.0204 17.0204 k = 0.3409 0.1968 0.5567 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0080 -18.0080 -18.0046 -18.0046 -6.5522 -6.5522 -6.5502 -6.5502 -5.5323 -5.5323 -5.5212 -5.5212 -5.5149 -5.5149 6.9197 6.9197 9.9760 9.9760 10.1064 10.1064 11.9418 11.9418 12.4020 12.4020 12.8669 12.8669 13.1458 13.1458 13.3348 13.3348 13.3991 13.3991 13.4692 13.4692 13.6600 13.6600 13.7297 13.7297 14.6608 14.6608 15.0437 15.0437 15.7266 15.7266 16.4755 16.4755 16.7410 16.7410 16.8435 16.8435 17.1076 17.1076 k = 0.3341 0.1929 0.5456 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0080 -18.0080 -18.0045 -18.0045 -6.5521 -6.5521 -6.5502 -6.5502 -5.5322 -5.5322 -5.5212 -5.5212 -5.5149 -5.5149 6.8935 6.8935 9.9875 9.9875 10.1057 10.1057 11.9114 11.9114 12.4165 12.4165 12.8714 12.8714 13.1557 13.1557 13.3329 13.3329 13.4058 13.4058 13.4594 13.4594 13.6636 13.6636 13.7216 13.7216 14.6591 14.6591 15.0770 15.0770 15.7789 15.7789 16.4585 16.4585 16.7624 16.7624 16.8294 16.8294 17.1969 17.1969 k = 0.3273 0.1890 0.5344 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0079 -18.0079 -18.0045 -18.0045 -6.5520 -6.5520 -6.5502 -6.5502 -5.5321 -5.5321 -5.5213 -5.5213 -5.5149 -5.5149 6.8624 6.8624 9.9678 9.9678 10.1461 10.1461 11.8820 11.8820 12.4309 12.4309 12.8766 12.8766 13.1651 13.1651 13.3282 13.3282 13.4034 13.4034 13.4587 13.4587 13.6652 13.6652 13.7175 13.7175 14.6571 14.6571 15.1102 15.1102 15.8337 15.8337 16.4405 16.4405 16.7836 16.7836 16.8191 16.8191 17.2880 17.2880 k = 0.3205 0.1850 0.5233 ( 4578 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0079 -18.0079 -18.0044 -18.0044 -6.5520 -6.5520 -6.5502 -6.5502 -5.5320 -5.5320 -5.5214 -5.5214 -5.5149 -5.5149 6.8263 6.8263 9.9431 9.9431 10.2017 10.2017 11.8537 11.8537 12.4450 12.4450 12.8825 12.8825 13.1738 13.1738 13.3206 13.3206 13.3921 13.3921 13.4666 13.4666 13.6654 13.6654 13.7174 13.7174 14.6548 14.6548 15.1434 15.1434 15.8911 15.8911 16.4214 16.4214 16.7913 16.7913 16.8264 16.8264 17.3808 17.3808 k = 0.3136 0.1811 0.5122 ( 4578 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0079 -18.0079 -18.0043 -18.0043 -6.5521 -6.5521 -6.5502 -6.5502 -5.5319 -5.5319 -5.5215 -5.5215 -5.5149 -5.5149 6.7852 6.7852 9.9230 9.9230 10.2630 10.2630 11.8266 11.8266 12.4588 12.4588 12.8890 12.8890 13.1819 13.1819 13.3104 13.3104 13.3763 13.3763 13.4786 13.4786 13.6652 13.6652 13.7198 13.7198 14.6522 14.6522 15.1765 15.1765 15.9506 15.9506 16.4013 16.4013 16.7840 16.7840 16.8529 16.8529 17.4749 17.4749 k = 0.3068 0.1771 0.5010 ( 4584 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0079 -18.0079 -18.0042 -18.0042 -6.5521 -6.5521 -6.5501 -6.5501 -5.5319 -5.5319 -5.5217 -5.5217 -5.5148 -5.5148 6.7392 6.7392 9.9096 9.9096 10.3276 10.3276 11.8007 11.8007 12.4721 12.4721 12.8962 12.8962 13.1891 13.1891 13.2984 13.2984 13.3583 13.3583 13.4922 13.4922 13.6660 13.6660 13.7234 13.7234 14.6493 14.6493 15.2096 15.2096 16.0119 16.0119 16.3802 16.3802 16.7758 16.7758 16.8853 16.8853 17.5701 17.5701 k = 0.3000 0.1732 0.4899 ( 4584 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0078 -18.0078 -18.0041 -18.0041 -6.5522 -6.5522 -6.5501 -6.5501 -5.5319 -5.5319 -5.5218 -5.5218 -5.5148 -5.5148 6.6885 6.6885 9.9038 9.9038 10.3947 10.3947 11.7762 11.7762 12.4849 12.4849 12.9040 12.9040 13.1948 13.1948 13.2852 13.2852 13.3394 13.3394 13.5065 13.5065 13.6682 13.6682 13.7275 13.7275 14.6460 14.6460 15.2428 15.2428 16.0742 16.0742 16.3579 16.3579 16.7697 16.7697 16.9212 16.9212 17.6664 17.6664 k = 0.2932 0.1693 0.4788 ( 4598 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0078 -18.0078 -18.0040 -18.0040 -6.5524 -6.5524 -6.5501 -6.5501 -5.5320 -5.5320 -5.5219 -5.5219 -5.5148 -5.5148 6.6334 6.6334 9.9054 9.9054 10.4639 10.4639 11.7530 11.7530 12.4971 12.4971 12.9125 12.9125 13.1978 13.1978 13.2715 13.2715 13.3212 13.3212 13.5212 13.5212 13.6720 13.6720 13.7315 13.7315 14.6425 14.6425 15.2759 15.2759 16.1366 16.1366 16.3347 16.3347 16.7670 16.7670 16.9602 16.9602 17.7634 17.7634 k = 0.2864 0.1653 0.4676 ( 4598 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0077 -18.0077 -18.0039 -18.0039 -6.5525 -6.5525 -6.5501 -6.5501 -5.5321 -5.5321 -5.5221 -5.5221 -5.5148 -5.5148 6.5742 6.5742 9.9144 9.9144 10.5350 10.5350 11.7313 11.7313 12.5085 12.5085 12.9215 12.9215 13.1960 13.1960 13.2571 13.2571 13.3065 13.3065 13.5360 13.5360 13.6773 13.6773 13.7352 13.7352 14.6386 14.6386 15.3091 15.3091 16.1976 16.1976 16.3106 16.3106 16.7693 16.7693 17.0021 17.0021 17.8609 17.8609 k = 0.2795 0.1614 0.4565 ( 4600 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0077 -18.0077 -18.0038 -18.0038 -6.5526 -6.5526 -6.5501 -6.5501 -5.5322 -5.5322 -5.5222 -5.5222 -5.5148 -5.5148 6.5114 6.5114 9.9305 9.9305 10.6077 10.6077 11.7110 11.7110 12.5191 12.5191 12.9311 12.9311 13.1883 13.1883 13.2403 13.2403 13.2993 13.2993 13.5507 13.5507 13.6839 13.6839 13.7385 13.7385 14.6346 14.6346 15.3424 15.3424 16.2535 16.2535 16.2871 16.2871 16.7783 16.7783 17.0468 17.0468 17.9586 17.9586 k = 0.2727 0.1575 0.4454 ( 4602 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0076 -18.0076 -18.0036 -18.0036 -6.5528 -6.5528 -6.5501 -6.5501 -5.5323 -5.5323 -5.5224 -5.5224 -5.5149 -5.5149 6.4454 6.4454 9.9532 9.9532 10.6818 10.6818 11.6922 11.6922 12.5288 12.5288 12.9411 12.9411 13.1752 13.1752 13.2199 13.2199 13.3005 13.3005 13.5654 13.5654 13.6915 13.6915 13.7416 13.7416 14.6303 14.6303 15.3758 15.3758 16.2557 16.2557 16.3107 16.3107 16.7962 16.7962 17.0943 17.0943 18.0563 18.0563 k = 0.2659 0.1535 0.4342 ( 4600 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0075 -18.0075 -18.0035 -18.0035 -6.5530 -6.5530 -6.5501 -6.5501 -5.5325 -5.5325 -5.5225 -5.5225 -5.5149 -5.5149 6.3766 6.3766 9.9822 9.9822 10.7572 10.7572 11.6749 11.6749 12.5375 12.5375 12.9514 12.9514 13.1587 13.1587 13.1972 13.1972 13.3078 13.3078 13.5797 13.5797 13.6999 13.6999 13.7444 13.7444 14.6258 14.6258 15.4092 15.4092 16.2288 16.2288 16.3543 16.3543 16.8251 16.8251 17.1445 17.1445 18.1537 18.1537 k = 0.2591 0.1496 0.4231 ( 4606 PWs) bands (ev): -41.9589 -41.9589 -18.6589 -18.6589 -18.0074 -18.0074 -18.0033 -18.0033 -6.5531 -6.5531 -6.5502 -6.5502 -5.5327 -5.5327 -5.5227 -5.5227 -5.5150 -5.5150 6.3056 6.3056 10.0169 10.0169 10.8336 10.8336 11.6592 11.6592 12.5452 12.5452 12.9619 12.9619 13.1404 13.1404 13.1734 13.1734 13.3191 13.3191 13.5938 13.5938 13.7090 13.7090 13.7473 13.7473 14.6212 14.6212 15.4429 15.4429 16.2001 16.2001 16.3889 16.3889 16.8665 16.8665 17.1973 17.1973 18.2503 18.2504 k = 0.2523 0.1456 0.4120 ( 4602 PWs) bands (ev): -41.9589 -41.9589 -18.6588 -18.6588 -18.0073 -18.0073 -18.0032 -18.0032 -6.5533 -6.5533 -6.5503 -6.5503 -5.5329 -5.5329 -5.5229 -5.5229 -5.5151 -5.5151 6.2327 6.2327 10.0569 10.0569 10.9109 10.9109 11.6450 11.6450 12.5517 12.5517 12.9722 12.9722 13.1213 13.1213 13.1495 13.1495 13.3330 13.3330 13.6074 13.6074 13.7184 13.7184 13.7503 13.7503 14.6165 14.6165 15.4766 15.4766 16.1701 16.1701 16.4140 16.4140 16.9198 16.9198 17.2526 17.2526 18.3459 18.3459 k = 0.2455 0.1417 0.4008 ( 4604 PWs) bands (ev): -41.9590 -41.9590 -18.6587 -18.6587 -18.0071 -18.0071 -18.0030 -18.0030 -6.5535 -6.5535 -6.5504 -6.5504 -5.5331 -5.5331 -5.5230 -5.5230 -5.5153 -5.5153 6.1584 6.1584 10.1018 10.1018 10.9886 10.9886 11.6325 11.6325 12.5571 12.5571 12.9817 12.9817 13.1021 13.1021 13.1265 13.1265 13.3488 13.3488 13.6205 13.6205 13.7282 13.7282 13.7537 13.7537 14.6118 14.6118 15.5106 15.5106 16.1389 16.1389 16.4307 16.4307 16.9833 16.9833 17.3103 17.3103 18.4399 18.4399 k = 0.2386 0.1378 0.3897 ( 4610 PWs) bands (ev): -41.9590 -41.9590 -18.6586 -18.6586 -18.0070 -18.0070 -18.0029 -18.0029 -6.5537 -6.5537 -6.5505 -6.5505 -5.5334 -5.5334 -5.5232 -5.5232 -5.5155 -5.5155 6.0831 6.0831 10.1509 10.1509 11.0666 11.0666 11.6216 11.6216 12.5612 12.5612 12.9891 12.9891 13.0830 13.0830 13.1062 13.1062 13.3661 13.3661 13.6330 13.6330 13.7381 13.7381 13.7580 13.7580 14.6071 14.6071 15.5446 15.5446 16.1066 16.1066 16.4409 16.4409 17.0543 17.0543 17.3703 17.3703 18.5319 18.5319 k = 0.2318 0.1338 0.3786 ( 4614 PWs) bands (ev): -41.9590 -41.9590 -18.6584 -18.6584 -18.0068 -18.0068 -18.0027 -18.0027 -6.5539 -6.5539 -6.5507 -6.5507 -5.5336 -5.5336 -5.5234 -5.5234 -5.5157 -5.5157 6.0072 6.0072 10.2040 10.2040 11.1443 11.1443 11.6124 11.6124 12.5641 12.5641 12.9928 12.9928 13.0627 13.0627 13.0924 13.0924 13.3845 13.3845 13.6449 13.6449 13.7478 13.7478 13.7636 13.7636 14.6023 14.6023 15.5789 15.5789 16.0732 16.0732 16.4465 16.4465 17.1300 17.1300 17.4324 17.4324 18.6210 18.6210 k = 0.2250 0.1299 0.3674 ( 4618 PWs) bands (ev): -41.9590 -41.9590 -18.6583 -18.6583 -18.0066 -18.0066 -18.0026 -18.0026 -6.5541 -6.5541 -6.5508 -6.5508 -5.5339 -5.5339 -5.5235 -5.5235 -5.5159 -5.5159 5.9310 5.9310 10.2605 10.2605 11.2213 11.2213 11.6050 11.6050 12.5656 12.5656 12.9911 12.9911 13.0404 13.0404 13.0878 13.0878 13.4038 13.4038 13.6563 13.6563 13.7569 13.7569 13.7710 13.7710 14.5977 14.5977 15.6133 15.6133 16.0388 16.0388 16.4489 16.4489 17.2079 17.2079 17.4965 17.4965 18.6811 18.6811 k = 0.2182 0.1260 0.3563 ( 4614 PWs) bands (ev): -41.9590 -41.9590 -18.6581 -18.6581 -18.0064 -18.0064 -18.0024 -18.0024 -6.5543 -6.5543 -6.5510 -6.5510 -5.5342 -5.5342 -5.5237 -5.5237 -5.5162 -5.5162 5.8549 5.8549 10.3200 10.3200 11.2970 11.2970 11.5996 11.5996 12.5659 12.5659 12.9846 12.9846 13.0172 13.0172 13.0916 13.0916 13.4236 13.4236 13.6674 13.6674 13.7654 13.7654 13.7807 13.7807 14.5932 14.5932 15.6479 15.6479 16.0034 16.0034 16.4493 16.4493 17.2854 17.2854 17.5624 17.5624 18.6713 18.6713 k = 0.2114 0.1220 0.3452 ( 4622 PWs) bands (ev): -41.9591 -41.9591 -18.6580 -18.6580 -18.0062 -18.0062 -18.0023 -18.0023 -6.5545 -6.5545 -6.5512 -6.5512 -5.5345 -5.5345 -5.5239 -5.5239 -5.5165 -5.5165 5.7792 5.7792 10.3821 10.3821 11.3703 11.3703 11.5966 11.5966 12.5649 12.5649 12.9749 12.9749 12.9943 12.9943 13.1011 13.1011 13.4434 13.4434 13.6786 13.6786 13.7739 13.7739 13.7920 13.7920 14.5888 14.5888 15.6826 15.6826 15.9670 15.9670 16.4485 16.4485 17.3603 17.3603 17.6299 17.6299 18.6689 18.6689 k = 0.2045 0.1181 0.3340 ( 4615 PWs) bands (ev): -41.9591 -41.9591 -18.6578 -18.6578 -18.0060 -18.0060 -18.0021 -18.0021 -6.5548 -6.5548 -6.5515 -6.5515 -5.5348 -5.5348 -5.5241 -5.5241 -5.5168 -5.5168 5.7041 5.7041 10.4463 10.4463 11.4396 11.4396 11.5971 11.5971 12.5626 12.5626 12.9605 12.9605 12.9766 12.9766 13.1139 13.1139 13.4628 13.4628 13.6902 13.6902 13.7830 13.7830 13.8046 13.8046 14.5847 14.5847 15.7174 15.7174 15.9298 15.9298 16.4468 16.4468 17.4303 17.4303 17.6987 17.6987 18.6766 18.6766 k = 0.1977 0.1142 0.3229 ( 4611 PWs) bands (ev): -41.9591 -41.9591 -18.6577 -18.6577 -18.0058 -18.0058 -18.0020 -18.0020 -6.5550 -6.5550 -6.5517 -6.5517 -5.5351 -5.5351 -5.5242 -5.5242 -5.5172 -5.5172 5.6300 5.6300 10.5123 10.5123 11.5005 11.5005 11.6047 11.6047 12.5591 12.5591 12.9384 12.9384 12.9687 12.9687 13.1289 13.1289 13.4810 13.4810 13.7027 13.7027 13.7934 13.7934 13.8182 13.8182 14.5808 14.5808 15.7520 15.7520 15.8919 15.8919 16.4447 16.4447 17.4933 17.4933 17.7686 17.7686 18.6964 18.6964 k = 0.1909 0.1102 0.3118 ( 4621 PWs) bands (ev): -41.9591 -41.9591 -18.6575 -18.6575 -18.0055 -18.0055 -18.0018 -18.0018 -6.5552 -6.5552 -6.5520 -6.5520 -5.5354 -5.5354 -5.5244 -5.5244 -5.5175 -5.5175 5.5569 5.5569 10.5797 10.5797 11.5428 11.5428 11.6288 11.6288 12.5544 12.5544 12.9139 12.9139 12.9667 12.9667 13.1453 13.1453 13.4976 13.4976 13.7163 13.7163 13.8054 13.8054 13.8328 13.8328 14.5773 14.5773 15.7853 15.7853 15.8547 15.8547 16.4425 16.4425 17.5477 17.5477 17.8392 17.8392 18.7298 18.7298 k = 0.1841 0.1063 0.3006 ( 4623 PWs) bands (ev): -41.9592 -41.9592 -18.6573 -18.6573 -18.0053 -18.0053 -18.0017 -18.0017 -6.5554 -6.5554 -6.5523 -6.5523 -5.5357 -5.5357 -5.5246 -5.5246 -5.5179 -5.5179 5.4851 5.4851 10.6481 10.6481 11.5622 11.5622 11.6729 11.6729 12.5485 12.5485 12.8886 12.8886 12.9702 12.9702 13.1627 13.1627 13.5120 13.5120 13.7310 13.7310 13.8197 13.8197 13.8484 13.8484 14.5740 14.5740 15.7997 15.7997 15.8358 15.8358 16.4404 16.4404 17.5924 17.5924 17.9102 17.9102 18.7776 18.7776 k = 0.1773 0.1023 0.2895 ( 4623 PWs) bands (ev): -41.9592 -41.9592 -18.6571 -18.6571 -18.0050 -18.0050 -18.0015 -18.0015 -6.5556 -6.5556 -6.5526 -6.5526 -5.5361 -5.5361 -5.5248 -5.5248 -5.5184 -5.5184 5.4149 5.4149 10.7172 10.7172 11.5715 11.5715 11.7233 11.7233 12.5416 12.5416 12.8629 12.8629 12.9794 12.9794 13.1809 13.1809 13.5240 13.5240 13.7460 13.7460 13.8370 13.8370 13.8653 13.8653 14.5711 14.5711 15.7663 15.7663 15.8639 15.8639 16.4384 16.4384 17.6273 17.6273 17.9811 17.9811 18.8398 18.8398 k = 0.1705 0.0984 0.2784 ( 4617 PWs) bands (ev): -41.9592 -41.9592 -18.6570 -18.6570 -18.0047 -18.0047 -18.0014 -18.0014 -6.5559 -6.5559 -6.5529 -6.5529 -5.5364 -5.5364 -5.5250 -5.5250 -5.5188 -5.5188 5.3463 5.3463 10.7865 10.7865 11.5784 11.5784 11.7717 11.7717 12.5336 12.5336 12.8369 12.8369 12.9950 12.9950 13.1996 13.1996 13.5336 13.5336 13.7609 13.7609 13.8573 13.8573 13.8845 13.8845 14.5686 14.5686 15.7257 15.7257 15.8986 15.8986 16.4368 16.4368 17.6531 17.6531 18.0516 18.0516 18.9155 18.9155 k = 0.1636 0.0945 0.2672 ( 4609 PWs) bands (ev): -41.9592 -41.9592 -18.6568 -18.6568 -18.0045 -18.0045 -18.0013 -18.0013 -6.5561 -6.5561 -6.5532 -6.5532 -5.5367 -5.5367 -5.5251 -5.5251 -5.5193 -5.5193 5.2795 5.2795 10.8558 10.8558 11.5851 11.5851 11.8150 11.8150 12.5248 12.5248 12.8107 12.8107 13.0171 13.0171 13.2187 13.2187 13.5410 13.5410 13.7752 13.7752 13.8790 13.8790 13.9078 13.9078 14.5664 14.5664 15.6837 15.6837 15.9343 15.9343 16.4357 16.4357 17.6713 17.6713 18.1210 18.1210 19.0031 19.0031 k = 0.1568 0.0905 0.2561 ( 4609 PWs) bands (ev): -41.9593 -41.9593 -18.6566 -18.6566 -18.0042 -18.0042 -18.0011 -18.0011 -6.5563 -6.5563 -6.5536 -6.5536 -5.5370 -5.5370 -5.5253 -5.5253 -5.5198 -5.5198 5.2147 5.2147 10.9247 10.9247 11.5925 11.5925 11.8523 11.8523 12.5152 12.5152 12.7844 12.7844 13.0459 13.0459 13.2381 13.2381 13.5466 13.5466 13.7889 13.7889 13.9000 13.9000 13.9371 13.9371 14.5647 14.5647 15.6408 15.6408 15.9702 15.9702 16.4352 16.4352 17.6836 17.6836 18.1886 18.1886 19.1002 19.1002 k = 0.1500 0.0866 0.2449 ( 4609 PWs) bands (ev): -41.9593 -41.9593 -18.6564 -18.6564 -18.0039 -18.0039 -18.0010 -18.0010 -6.5565 -6.5565 -6.5539 -6.5539 -5.5373 -5.5373 -5.5255 -5.5255 -5.5203 -5.5203 5.1519 5.1519 10.9929 10.9929 11.6009 11.6009 11.8831 11.8831 12.5048 12.5048 12.7578 12.7578 13.0808 13.0808 13.2577 13.2577 13.5506 13.5506 13.8027 13.8027 13.9199 13.9199 13.9724 13.9724 14.5635 14.5635 15.5972 15.5972 16.0064 16.0064 16.4352 16.4352 17.6917 17.6917 18.2539 18.2539 19.1941 19.1941 k = 0.1432 0.0827 0.2338 ( 4619 PWs) bands (ev): -41.9593 -41.9593 -18.6562 -18.6562 -18.0036 -18.0036 -18.0009 -18.0009 -6.5567 -6.5567 -6.5543 -6.5543 -5.5376 -5.5376 -5.5257 -5.5257 -5.5208 -5.5208 5.0913 5.0913 11.0600 11.0600 11.6102 11.6102 11.9075 11.9075 12.4937 12.4937 12.7311 12.7311 13.1209 13.1209 13.2773 13.2773 13.5535 13.5535 13.8171 13.8171 13.9392 13.9392 14.0123 14.0123 14.5628 14.5628 15.5530 15.5530 16.0426 16.0426 16.4361 16.4361 17.6972 17.6972 18.3158 18.3158 19.1972 19.1972 k = 0.1364 0.0787 0.2227 ( 4619 PWs) bands (ev): -41.9593 -41.9593 -18.6561 -18.6561 -18.0033 -18.0033 -18.0008 -18.0008 -6.5569 -6.5569 -6.5546 -6.5546 -5.5380 -5.5380 -5.5259 -5.5259 -5.5213 -5.5213 5.0330 5.0330 11.1259 11.1259 11.6207 11.6207 11.9261 11.9261 12.4822 12.4822 12.7043 12.7043 13.1651 13.1651 13.2969 13.2969 13.5554 13.5554 13.8330 13.8330 13.9586 13.9586 14.0557 14.0557 14.5625 14.5625 15.5083 15.5083 16.0788 16.0788 16.4377 16.4377 17.7015 17.7015 18.3734 18.3734 19.1810 19.1810 k = 0.1295 0.0748 0.2115 ( 4615 PWs) bands (ev): -41.9593 -41.9593 -18.6559 -18.6559 -18.0030 -18.0030 -18.0007 -18.0007 -6.5571 -6.5571 -6.5550 -6.5550 -5.5383 -5.5383 -5.5260 -5.5260 -5.5218 -5.5218 4.9771 4.9771 11.1902 11.1902 11.6322 11.6322 11.9395 11.9395 12.4701 12.4701 12.6774 12.6774 13.2116 13.2116 13.3164 13.3164 13.5567 13.5567 13.8512 13.8512 13.9784 13.9784 14.1015 14.1015 14.5629 14.5629 15.4633 15.4633 16.1149 16.1149 16.4403 16.4403 17.7059 17.7059 18.4258 18.4258 19.1576 19.1576 k = 0.1227 0.0709 0.2004 ( 4627 PWs) bands (ev): -41.9594 -41.9594 -18.6557 -18.6557 -18.0027 -18.0027 -18.0006 -18.0006 -6.5573 -6.5573 -6.5553 -6.5553 -5.5385 -5.5385 -5.5262 -5.5262 -5.5223 -5.5223 4.9236 4.9236 11.2526 11.2526 11.6447 11.6447 11.9483 11.9483 12.4578 12.4578 12.6505 12.6505 13.2589 13.2589 13.3356 13.3356 13.5575 13.5575 13.8726 13.8726 13.9986 13.9986 14.1491 14.1491 14.5638 14.5638 15.4179 15.4179 16.1509 16.1509 16.4439 16.4439 17.7113 17.7113 18.4719 18.4719 19.1290 19.1290 k = 0.1159 0.0669 0.1893 ( 4619 PWs) bands (ev): -41.9594 -41.9594 -18.6555 -18.6555 -18.0024 -18.0024 -18.0005 -18.0005 -6.5575 -6.5575 -6.5557 -6.5557 -5.5388 -5.5388 -5.5264 -5.5264 -5.5229 -5.5229 4.8727 4.8727 11.3130 11.3130 11.6583 11.6583 11.9535 11.9535 12.4451 12.4451 12.6235 12.6235 13.3049 13.3049 13.3543 13.3543 13.5580 13.5580 13.8981 13.8981 14.0195 14.0195 14.1979 14.1979 14.5653 14.5653 15.3724 15.3724 16.1866 16.1866 16.4486 16.4486 17.7187 17.7187 18.5106 18.5106 19.0966 19.0966 k = 0.1091 0.0630 0.1781 ( 4625 PWs) bands (ev): -41.9594 -41.9594 -18.6554 -18.6554 -18.0021 -18.0021 -18.0004 -18.0004 -6.5576 -6.5576 -6.5560 -6.5560 -5.5391 -5.5391 -5.5265 -5.5265 -5.5234 -5.5234 4.8243 4.8243 11.3710 11.3710 11.6729 11.6729 11.9556 11.9556 12.4323 12.4323 12.5966 12.5966 13.3479 13.3479 13.3726 13.3726 13.5583 13.5583 13.9282 13.9282 14.0410 14.0410 14.2473 14.2473 14.5677 14.5677 15.3267 15.3267 16.2220 16.2220 16.4544 16.4544 17.7287 17.7287 18.5411 18.5411 19.0617 19.0617 k = 0.1023 0.0590 0.1670 ( 4621 PWs) bands (ev): -41.9594 -41.9594 -18.6552 -18.6552 -18.0019 -18.0019 -18.0003 -18.0003 -6.5578 -6.5578 -6.5563 -6.5563 -5.5394 -5.5394 -5.5267 -5.5267 -5.5238 -5.5238 4.7786 4.7786 11.4265 11.4265 11.6883 11.6883 11.9554 11.9554 12.4193 12.4193 12.5697 12.5697 13.3860 13.3860 13.3907 13.3907 13.5586 13.5586 13.9635 13.9635 14.0633 14.0633 14.2967 14.2967 14.5709 14.5709 15.2810 15.2810 16.2569 16.2569 16.4613 16.4613 17.7422 17.7422 18.5628 18.5628 19.0256 19.0256 k = 0.0955 0.0551 0.1559 ( 4617 PWs) bands (ev): -41.9595 -41.9595 -18.6551 -18.6551 -18.0016 -18.0016 -18.0002 -18.0002 -6.5580 -6.5580 -6.5567 -6.5567 -5.5396 -5.5396 -5.5268 -5.5268 -5.5243 -5.5243 4.7356 4.7356 11.4792 11.4792 11.7047 11.7047 11.9535 11.9535 12.4064 12.4064 12.5430 12.5430 13.4066 13.4066 13.4201 13.4201 13.5591 13.5591 14.0036 14.0036 14.0863 14.0863 14.3455 14.3455 14.5751 14.5751 15.2353 15.2353 16.2912 16.2912 16.4693 16.4693 17.7596 17.7596 18.5753 18.5753 18.9894 18.9894 k = 0.0886 0.0512 0.1447 ( 4619 PWs) bands (ev): -41.9595 -41.9595 -18.6549 -18.6549 -18.0014 -18.0014 -18.0001 -18.0001 -6.5581 -6.5581 -6.5570 -6.5570 -5.5399 -5.5399 -5.5270 -5.5270 -5.5248 -5.5248 4.6954 4.6954 11.5290 11.5290 11.7218 11.7218 11.9504 11.9504 12.3935 12.3935 12.5165 12.5165 13.4226 13.4226 13.4475 13.4475 13.5600 13.5600 14.0479 14.0479 14.1102 14.1102 14.3930 14.3930 14.5806 14.5806 15.1898 15.1898 16.3247 16.3247 16.4784 16.4784 17.7814 17.7814 18.5791 18.5791 18.9539 18.9539 k = 0.0818 0.0472 0.1336 ( 4615 PWs) bands (ev): -41.9595 -41.9595 -18.6548 -18.6548 -18.0011 -18.0011 -18.0000 -18.0000 -6.5583 -6.5583 -6.5573 -6.5573 -5.5401 -5.5401 -5.5271 -5.5271 -5.5252 -5.5252 4.6580 4.6580 11.5756 11.5756 11.7398 11.7398 11.9464 11.9464 12.3807 12.3807 12.4903 12.4903 13.4374 13.4374 13.4692 13.4692 13.5614 13.5614 14.0950 14.0950 14.1349 14.1349 14.4388 14.4388 14.5877 14.5877 15.1446 15.1446 16.3573 16.3573 16.4883 16.4883 17.8082 17.8082 18.5748 18.5748 18.9199 18.9199 k = 0.0750 0.0433 0.1225 ( 4609 PWs) bands (ev): -41.9595 -41.9595 -18.6547 -18.6547 -18.0009 -18.0009 -18.0000 -18.0000 -6.5584 -6.5584 -6.5575 -6.5575 -5.5403 -5.5403 -5.5272 -5.5272 -5.5256 -5.5256 4.6235 4.6235 11.6189 11.6189 11.7584 11.7584 11.9420 11.9420 12.3681 12.3681 12.4645 12.4645 13.4512 13.4512 13.4856 13.4856 13.5635 13.5635 14.1432 14.1432 14.1605 14.1605 14.4821 14.4821 14.5967 14.5967 15.0999 15.0999 16.3887 16.3887 16.4991 16.4991 17.8401 17.8401 18.5641 18.5641 18.8874 18.8874 k = 0.0682 0.0394 0.1113 ( 4609 PWs) bands (ev): -41.9595 -41.9595 -18.6545 -18.6545 -18.0007 -18.0007 -17.9999 -17.9999 -6.5585 -6.5585 -6.5578 -6.5578 -5.5405 -5.5405 -5.5273 -5.5273 -5.5260 -5.5260 4.5918 4.5918 11.6585 11.6585 11.7777 11.7777 11.9375 11.9375 12.3557 12.3557 12.4392 12.4392 13.4637 13.4637 13.4975 13.4975 13.5663 13.5663 14.1860 14.1860 14.1916 14.1916 14.5224 14.5224 14.6082 14.6082 15.0557 15.0557 16.4188 16.4188 16.5103 16.5103 17.8773 17.8773 18.5487 18.5487 18.8568 18.8568 k = 0.0614 0.0354 0.1002 ( 4613 PWs) bands (ev): -41.9595 -41.9595 -18.6544 -18.6544 -18.0005 -18.0005 -17.9998 -17.9998 -6.5587 -6.5587 -6.5580 -6.5580 -5.5407 -5.5407 -5.5274 -5.5274 -5.5263 -5.5263 4.5631 4.5631 11.6942 11.6942 11.7976 11.7976 11.9332 11.9332 12.3438 12.3438 12.4147 12.4147 13.4749 13.4749 13.5056 13.5056 13.5698 13.5698 14.2134 14.2134 14.2361 14.2361 14.5591 14.5591 14.6227 14.6227 15.0123 15.0123 16.4473 16.4473 16.5218 16.5218 17.9197 17.9197 18.5310 18.5310 18.8278 18.8278 k = 0.0545 0.0315 0.0891 ( 4615 PWs) bands (ev): -41.9595 -41.9595 -18.6543 -18.6543 -18.0003 -18.0003 -17.9998 -17.9998 -6.5588 -6.5588 -6.5583 -6.5583 -5.5409 -5.5409 -5.5275 -5.5275 -5.5266 -5.5266 4.5373 4.5373 11.7258 11.7258 11.8178 11.8178 11.9293 11.9293 12.3323 12.3323 12.3911 12.3911 13.4847 13.4847 13.5109 13.5109 13.5738 13.5738 14.2409 14.2409 14.2767 14.2767 14.5917 14.5917 14.6404 14.6404 14.9700 14.9700 16.4740 16.4740 16.5332 16.5332 17.9664 17.9664 18.5137 18.5137 18.8005 18.8005 k = 0.0477 0.0276 0.0779 ( 4629 PWs) bands (ev): -41.9596 -41.9596 -18.6542 -18.6542 -18.0001 -18.0001 -17.9997 -17.9997 -6.5588 -6.5588 -6.5585 -6.5585 -5.5410 -5.5410 -5.5276 -5.5276 -5.5269 -5.5269 4.5145 4.5145 11.7532 11.7532 11.8381 11.8381 11.9261 11.9261 12.3214 12.3214 12.3686 12.3686 13.4932 13.4932 13.5143 13.5143 13.5778 13.5778 14.2687 14.2687 14.3118 14.3118 14.6204 14.6204 14.6606 14.6606 14.9291 14.9291 16.4985 16.4985 16.5441 16.5441 18.0161 18.0161 18.4998 18.4998 18.7752 18.7752 k = 0.0409 0.0236 0.0668 ( 4623 PWs) bands (ev): -41.9596 -41.9596 -18.6542 -18.6542 -18.0000 -18.0000 -17.9997 -17.9997 -6.5589 -6.5589 -6.5586 -6.5586 -5.5412 -5.5412 -5.5277 -5.5277 -5.5272 -5.5272 4.4947 4.4947 11.7763 11.7763 11.8579 11.8579 11.9238 11.9238 12.3113 12.3113 12.3476 12.3476 13.5004 13.5004 13.5163 13.5163 13.5816 13.5816 14.2964 14.2964 14.3408 14.3408 14.6463 14.6463 14.6817 14.6817 14.8900 14.8900 16.5206 16.5206 16.5544 16.5544 18.0661 18.0661 18.4932 18.4932 18.7520 18.7520 k = 0.0341 0.0197 0.0557 ( 4623 PWs) bands (ev): -41.9596 -41.9596 -18.6541 -18.6541 -17.9999 -17.9999 -17.9997 -17.9997 -6.5590 -6.5590 -6.5588 -6.5588 -5.5413 -5.5413 -5.5277 -5.5277 -5.5274 -5.5274 4.4779 4.4779 11.7951 11.7951 11.8764 11.8764 11.9225 11.9225 12.3021 12.3021 12.3285 12.3285 13.5062 13.5062 13.5175 13.5175 13.5851 13.5851 14.3234 14.3234 14.3637 14.3637 14.6699 14.6699 14.7014 14.7014 14.8535 14.8535 16.5399 16.5399 16.5636 16.5636 18.1123 18.1123 18.4983 18.4983 18.7313 18.7313 k = 0.0273 0.0157 0.0445 ( 4623 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9998 -17.9998 -17.9996 -17.9996 -6.5591 -6.5591 -6.5589 -6.5589 -5.5414 -5.5414 -5.5278 -5.5278 -5.5276 -5.5276 4.4642 4.4642 11.8099 11.8099 11.8930 11.8930 11.9224 11.9224 12.2940 12.2940 12.3116 12.3116 13.5109 13.5109 13.5181 13.5181 13.5881 13.5881 14.3491 14.3491 14.3810 14.3810 14.6909 14.6909 14.7183 14.7183 14.8205 14.8205 16.5562 16.5562 16.5715 16.5715 18.1498 18.1498 18.5199 18.5199 18.7135 18.7135 k = 0.0205 0.0118 0.0334 ( 4625 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9997 -17.9997 -17.9996 -17.9996 -6.5591 -6.5591 -6.5590 -6.5590 -5.5415 -5.5415 -5.5278 -5.5278 -5.5277 -5.5277 4.4535 4.4535 11.8208 11.8208 11.9068 11.9068 11.9231 11.9231 12.2874 12.2874 12.2977 12.2977 13.5144 13.5144 13.5185 13.5185 13.5905 13.5905 14.3722 14.3722 14.3935 14.3935 14.7085 14.7085 14.7309 14.7309 14.7929 14.7929 16.5692 16.5692 16.5779 16.5779 18.1754 18.1754 18.5591 18.5591 18.6991 18.6991 k = 0.0136 0.0079 0.0223 ( 4635 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9996 -17.9996 -17.9996 -17.9996 -6.5591 -6.5591 -6.5591 -6.5591 -5.5415 -5.5415 -5.5279 -5.5279 -5.5278 -5.5278 4.4458 4.4458 11.8281 11.8281 11.9172 11.9172 11.9243 11.9243 12.2824 12.2824 12.2871 12.2871 13.5168 13.5168 13.5186 13.5186 13.5923 13.5923 14.3910 14.3910 14.4018 14.4018 14.7217 14.7217 14.7370 14.7370 14.7742 14.7742 16.5787 16.5787 16.5826 16.5826 18.1900 18.1900 18.6102 18.6102 18.6886 18.6886 k = 0.0068 0.0039 0.0111 ( 4639 PWs) bands (ev): -41.9596 -41.9596 -18.6539 -18.6539 -17.9996 -17.9996 -17.9996 -17.9996 -6.5591 -6.5591 -6.5591 -6.5591 -5.5416 -5.5416 -5.5279 -5.5279 -5.5279 -5.5279 4.4412 4.4412 11.8323 11.8323 11.9237 11.9237 11.9254 11.9254 12.2793 12.2793 12.2805 12.2805 13.5182 13.5182 13.5187 13.5187 13.5934 13.5934 14.4036 14.4036 14.4066 14.4066 14.7298 14.7298 14.7350 14.7350 14.7675 14.7675 16.5845 16.5845 16.5854 16.5854 18.1969 18.1969 18.6585 18.6585 18.6821 18.6821 k = 0.0000 0.0000 0.0000 ( 4645 PWs) bands (ev): -41.9596 -41.9596 -18.6539 -18.6539 -17.9996 -17.9996 -17.9996 -17.9996 -6.5592 -6.5592 -6.5592 -6.5592 -5.5416 -5.5416 -5.5279 -5.5279 -5.5279 -5.5279 4.4397 4.4397 11.8336 11.8336 11.9259 11.9259 11.9259 11.9259 12.2783 12.2783 12.2783 12.2783 13.5187 13.5187 13.5187 13.5187 13.5937 13.5937 14.4081 14.4081 14.4081 14.4081 14.7325 14.7325 14.7325 14.7325 14.7669 14.7669 16.5864 16.5864 16.5864 16.5864 18.1988 18.1988 18.6799 18.6799 18.6799 18.6799 k = 0.0000 0.0000 0.0000 ( 4645 PWs) bands (ev): -41.9596 -41.9596 -18.6539 -18.6539 -17.9996 -17.9996 -17.9996 -17.9996 -6.5592 -6.5592 -6.5592 -6.5592 -5.5416 -5.5416 -5.5279 -5.5279 -5.5279 -5.5279 4.4397 4.4397 11.8336 11.8336 11.9259 11.9259 11.9259 11.9259 12.2783 12.2783 12.2783 12.2783 13.5187 13.5187 13.5187 13.5187 13.5937 13.5937 14.4081 14.4081 14.4081 14.4081 14.7325 14.7325 14.7325 14.7325 14.7669 14.7669 16.5864 16.5864 16.5864 16.5864 18.1988 18.1988 18.6799 18.6799 18.6799 18.6799 k = 0.0111 0.0064 0.0045 ( 4636 PWs) bands (ev): -41.9596 -41.9596 -18.6539 -18.6539 -17.9996 -17.9996 -17.9996 -17.9996 -6.5591 -6.5591 -6.5591 -6.5591 -5.5416 -5.5416 -5.5279 -5.5279 -5.5279 -5.5279 4.4412 4.4412 11.8323 11.8323 11.9244 11.9244 11.9247 11.9247 12.2799 12.2799 12.2799 12.2799 13.5183 13.5183 13.5186 13.5186 13.5934 13.5934 14.4051 14.4051 14.4052 14.4052 14.7293 14.7293 14.7355 14.7355 14.7675 14.7675 16.5849 16.5849 16.5850 16.5850 18.1969 18.1969 18.6585 18.6585 18.6823 18.6823 k = 0.0222 0.0128 0.0091 ( 4636 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9996 -17.9996 -17.9996 -17.9996 -6.5591 -6.5591 -6.5591 -6.5591 -5.5415 -5.5415 -5.5279 -5.5279 -5.5278 -5.5278 4.4458 4.4458 11.8284 11.8284 11.9200 11.9200 11.9213 11.9213 12.2847 12.2847 12.2849 12.2849 13.5171 13.5171 13.5184 13.5184 13.5923 13.5923 14.3963 14.3963 14.3966 14.3966 14.7166 14.7166 14.7442 14.7442 14.7721 14.7721 16.5805 16.5805 16.5809 16.5809 18.1900 18.1900 18.6101 18.6101 18.6893 18.6893 k = 0.0333 0.0192 0.0136 ( 4630 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9997 -17.9997 -17.9996 -17.9996 -6.5591 -6.5591 -6.5590 -6.5590 -5.5415 -5.5415 -5.5278 -5.5278 -5.5277 -5.5277 4.4534 4.4534 11.8218 11.8218 11.9127 11.9127 11.9158 11.9158 12.2925 12.2925 12.2929 12.2929 13.5150 13.5150 13.5180 13.5180 13.5904 13.5904 14.3825 14.3825 14.3831 14.3831 14.6923 14.6923 14.7576 14.7576 14.7827 14.7827 16.5732 16.5732 16.5741 16.5741 18.1750 18.1750 18.5592 18.5592 18.7009 18.7009 k = 0.0444 0.0257 0.0181 ( 4627 PWs) bands (ev): -41.9596 -41.9596 -18.6540 -18.6540 -17.9998 -17.9998 -17.9996 -17.9996 -6.5590 -6.5590 -6.5590 -6.5590 -5.5414 -5.5414 -5.5278 -5.5278 -5.5276 -5.5276 4.4641 4.4641 11.8127 11.8127 11.9028 11.9028 11.9086 11.9086 12.3031 12.3031 12.3036 12.3036 13.5121 13.5121 13.5173 13.5173 13.5879 13.5879 14.3649 14.3649 14.3656 14.3656 14.6570 14.6570 14.7747 14.7747 14.7978 14.7978 16.5634 16.5634 16.5649 16.5649 18.1484 18.1484 18.5211 18.5211 18.7168 18.7168 k = 0.0556 0.0321 0.0227 ( 4621 PWs) bands (ev): -41.9596 -41.9596 -18.6541 -18.6541 -17.9999 -17.9999 -17.9997 -17.9997 -6.5590 -6.5590 -6.5588 -6.5588 -5.5413 -5.5413 -5.5278 -5.5278 -5.5274 -5.5274 4.4778 4.4778 11.8011 11.8011 11.8905 11.8905 11.9000 11.9000 12.3161 12.3161 12.3167 12.3167 13.5084 13.5084 13.5162 13.5162 13.5846 13.5846 14.3444 14.3444 14.3451 14.3451 14.6120 14.6120 14.7946 14.7946 14.8161 14.8161 16.5513 16.5513 16.5534 16.5534 18.1090 18.1090 18.5020 18.5020 18.7369 18.7369 k = 0.0667 0.0385 0.0272 ( 4624 PWs) bands (ev): -41.9596 -41.9596 -18.6542 -18.6542 -18.0000 -18.0000 -17.9997 -17.9997 -6.5589 -6.5589 -6.5587 -6.5587 -5.5412 -5.5412 -5.5277 -5.5277 -5.5272 -5.5272 4.4945 4.4945 11.7867 11.7867 11.8762 11.8762 11.8902 11.8902 12.3312 12.3312 12.3319 12.3319 13.5038 13.5038 13.5146 13.5146 13.5805 13.5805 14.3217 14.3217 14.3224 14.3224 14.5586 14.5586 14.8165 14.8165 14.8366 14.8366 16.5373 16.5373 16.5399 16.5399 18.0598 18.0598 18.5010 18.5010 18.7607 18.7607 k = 0.0778 0.0449 0.0318 ( 4618 PWs) bands (ev): -41.9596 -41.9596 -18.6542 -18.6542 -18.0001 -18.0001 -17.9997 -17.9997 -6.5588 -6.5588 -6.5585 -6.5585 -5.5410 -5.5410 -5.5276 -5.5276 -5.5269 -5.5269 4.5142 4.5142 11.7693 11.7693 11.8604 11.8604 11.8797 11.8797 12.3481 12.3481 12.3489 12.3489 13.4985 13.4985 13.5124 13.5124 13.5756 13.5756 14.2976 14.2976 14.2980 14.2980 14.4977 14.4977 14.8397 14.8397 14.8584 14.8584 16.5216 16.5216 16.5248 16.5248 18.0056 18.0056 18.5139 18.5139 18.7881 18.7881 k = 0.0889 0.0513 0.0363 ( 4618 PWs) bands (ev): -41.9595 -41.9595 -18.6543 -18.6543 -18.0003 -18.0003 -17.9998 -17.9998 -6.5587 -6.5587 -6.5584 -6.5584 -5.5409 -5.5409 -5.5276 -5.5276 -5.5266 -5.5266 4.5370 4.5370 11.7484 11.7484 11.8437 11.8437 11.8686 11.8686 12.3666 12.3666 12.3673 12.3673 13.4924 13.4924 13.5094 13.5094 13.5697 13.5697 14.2724 14.2724 14.2725 14.2725 14.4309 14.4309 14.8637 14.8637 14.8811 14.8811 16.5047 16.5047 16.5083 16.5083 17.9505 17.9505 18.5367 18.5367 18.8185 18.8185 k = 0.1000 0.0577 0.0408 ( 4618 PWs) bands (ev): -41.9595 -41.9595 -18.6544 -18.6544 -18.0005 -18.0005 -17.9998 -17.9998 -6.5585 -6.5585 -6.5582 -6.5582 -5.5407 -5.5407 -5.5275 -5.5275 -5.5263 -5.5263 4.5626 4.5626 11.7233 11.7233 11.8268 11.8268 11.8572 11.8572 12.3864 12.3864 12.3868 12.3868 13.4855 13.4855 13.5055 13.5055 13.5626 13.5626 14.2461 14.2461 14.2467 14.2467 14.3595 14.3595 14.8882 14.8882 14.9043 14.9043 16.4870 16.4870 16.4908 16.4908 17.8969 17.8969 18.5666 18.5666 18.8516 18.8516 k = 0.1111 0.0642 0.0454 ( 4609 PWs) bands (ev): -41.9595 -41.9595 -18.6545 -18.6545 -18.0007 -18.0007 -17.9999 -17.9999 -6.5584 -6.5584 -6.5579 -6.5579 -5.5405 -5.5405 -5.5274 -5.5274 -5.5259 -5.5259 4.5913 4.5913 11.6936 11.6936 11.8102 11.8102 11.8456 11.8456 12.4072 12.4072 12.4074 12.4074 13.4780 13.4780 13.5007 13.5007 13.5540 13.5540 14.2191 14.2191 14.2206 14.2206 14.2853 14.2853 14.9128 14.9128 14.9276 14.9276 16.4688 16.4688 16.4727 16.4727 17.8460 17.8460 18.6017 18.6017 18.8871 18.8871 k = 0.1222 0.0706 0.0499 ( 4609 PWs) bands (ev): -41.9595 -41.9595 -18.6547 -18.6547 -18.0009 -18.0009 -17.9999 -17.9999 -6.5583 -6.5583 -6.5577 -6.5577 -5.5403 -5.5403 -5.5273 -5.5273 -5.5255 -5.5255 4.6228 4.6228 11.6589 11.6589 11.7943 11.7943 11.8340 11.8340 12.4287 12.4287 12.4289 12.4289 13.4696 13.4696 13.4948 13.4948 13.5433 13.5433 14.1912 14.1912 14.1942 14.1942 14.2107 14.2107 14.9374 14.9374 14.9508 14.9508 16.4506 16.4506 16.4542 16.4542 17.7984 17.7984 18.6406 18.6406 18.9245 18.9245 k = 0.1333 0.0770 0.0544 ( 4603 PWs) bands (ev): -41.9595 -41.9595 -18.6548 -18.6548 -18.0011 -18.0011 -18.0000 -18.0000 -6.5581 -6.5581 -6.5574 -6.5574 -5.5401 -5.5401 -5.5272 -5.5272 -5.5251 -5.5251 4.6572 4.6572 11.6188 11.6188 11.7792 11.7792 11.8226 11.8226 12.4507 12.4507 12.4513 12.4513 13.4607 13.4607 13.4879 13.4879 13.5299 13.5299 14.1341 14.1341 14.1660 14.1660 14.1677 14.1677 14.9617 14.9617 14.9737 14.9737 16.4326 16.4326 16.4358 16.4358 17.7542 17.7542 18.6825 18.6825 18.9635 18.9635 k = 0.1444 0.0834 0.0590 ( 4606 PWs) bands (ev): -41.9595 -41.9595 -18.6549 -18.6549 -18.0014 -18.0014 -18.0000 -18.0000 -6.5579 -6.5579 -6.5571 -6.5571 -5.5399 -5.5399 -5.5270 -5.5270 -5.5247 -5.5247 4.6945 4.6945 11.5732 11.5732 11.7650 11.7650 11.8114 11.8114 12.4732 12.4732 12.4742 12.4742 13.4510 13.4510 13.4797 13.4797 13.5131 13.5131 14.0628 14.0628 14.1385 14.1385 14.1414 14.1414 14.9855 14.9855 14.9961 14.9961 16.4151 16.4151 16.4177 16.4177 17.7130 17.7130 18.7265 18.7265 19.0036 19.0036 k = 0.1556 0.0898 0.0635 ( 4618 PWs) bands (ev): -41.9595 -41.9595 -18.6551 -18.6551 -18.0017 -18.0017 -18.0001 -18.0001 -6.5577 -6.5577 -6.5568 -6.5568 -5.5396 -5.5396 -5.5269 -5.5269 -5.5242 -5.5242 4.7346 4.7346 11.5221 11.5221 11.7515 11.7515 11.8004 11.8004 12.4960 12.4960 12.4974 12.4974 13.4408 13.4408 13.4697 13.4697 13.4924 13.4924 13.9963 13.9963 14.1114 14.1114 14.1152 14.1152 15.0087 15.0087 15.0179 15.0179 16.3986 16.3986 16.4003 16.4003 17.6747 17.6747 18.7720 18.7720 19.0445 19.0445 k = 0.1667 0.0962 0.0680 ( 4630 PWs) bands (ev): -41.9594 -41.9594 -18.6552 -18.6552 -18.0019 -18.0019 -18.0002 -18.0002 -6.5576 -6.5576 -6.5565 -6.5565 -5.5393 -5.5393 -5.5268 -5.5268 -5.5237 -5.5237 4.7775 4.7775 11.4653 11.4653 11.7387 11.7387 11.7898 11.7898 12.5190 12.5190 12.5209 12.5209 13.4301 13.4301 13.4541 13.4541 13.4710 13.4710 13.9369 13.9369 14.0847 14.0847 14.0893 14.0893 15.0312 15.0312 15.0389 15.0389 16.3831 16.3831 16.3839 16.3839 17.6388 17.6388 18.8186 18.8186 19.0858 19.0858 k = 0.1778 0.1026 0.0726 ( 4630 PWs) bands (ev): -41.9594 -41.9594 -18.6554 -18.6554 -18.0022 -18.0022 -18.0003 -18.0003 -6.5574 -6.5574 -6.5562 -6.5562 -5.5391 -5.5391 -5.5266 -5.5266 -5.5232 -5.5232 4.8231 4.8231 11.4027 11.4027 11.7266 11.7266 11.7796 11.7796 12.5422 12.5422 12.5446 12.5446 13.4188 13.4188 13.4248 13.4248 13.4564 13.4564 13.8858 13.8858 14.0584 14.0584 14.0637 14.0637 15.0528 15.0528 15.0590 15.0590 16.3687 16.3687 16.3691 16.3691 17.6048 17.6048 18.8657 18.8657 19.1273 19.1273 k = 0.1889 0.1091 0.0771 ( 4618 PWs) bands (ev): -41.9594 -41.9594 -18.6555 -18.6555 -18.0025 -18.0025 -18.0003 -18.0003 -6.5572 -6.5572 -6.5559 -6.5559 -5.5388 -5.5388 -5.5265 -5.5265 -5.5226 -5.5226 4.8713 4.8713 11.3342 11.3342 11.7152 11.7152 11.7698 11.7698 12.5655 12.5655 12.5682 12.5682 13.3865 13.3865 13.4071 13.4071 13.4447 13.4447 13.8437 13.8437 14.0326 14.0326 14.0385 14.0385 15.0733 15.0733 15.0781 15.0781 16.3550 16.3550 16.3567 16.3567 17.5723 17.5723 18.9131 18.9131 19.1686 19.1686 k = 0.2000 0.1155 0.0816 ( 4612 PWs) bands (ev): -41.9594 -41.9594 -18.6557 -18.6557 -18.0028 -18.0028 -18.0004 -18.0004 -6.5570 -6.5570 -6.5555 -6.5555 -5.5385 -5.5385 -5.5263 -5.5263 -5.5221 -5.5221 4.9222 4.9222 11.2598 11.2598 11.7043 11.7043 11.7605 11.7605 12.5887 12.5887 12.5918 12.5918 13.3431 13.3431 13.3951 13.3951 13.4333 13.4333 13.8098 13.8098 14.0073 14.0073 14.0136 14.0136 15.0927 15.0927 15.0961 15.0961 16.3431 16.3431 16.3461 16.3461 17.5407 17.5407 18.9602 18.9602 19.1998 19.1998 k = 0.2111 0.1219 0.0862 ( 4618 PWs) bands (ev): -41.9593 -41.9593 -18.6559 -18.6559 -18.0032 -18.0032 -18.0005 -18.0005 -6.5567 -6.5567 -6.5552 -6.5552 -5.5382 -5.5382 -5.5262 -5.5262 -5.5215 -5.5215 4.9756 4.9756 11.1797 11.1797 11.6940 11.6940 11.7516 11.7516 12.6119 12.6119 12.6151 12.6151 13.2970 13.2970 13.3827 13.3827 13.4218 13.4218 13.7827 13.7827 13.9827 13.9827 13.9893 13.9893 15.1108 15.1108 15.1130 15.1130 16.3332 16.3332 16.3375 16.3375 17.5096 17.5096 19.0069 19.0069 19.0865 19.0865 k = 0.2222 0.1283 0.0907 ( 4636 PWs) bands (ev): -41.9593 -41.9593 -18.6561 -18.6561 -18.0035 -18.0035 -18.0006 -18.0006 -6.5565 -6.5565 -6.5548 -6.5548 -5.5379 -5.5379 -5.5260 -5.5260 -5.5210 -5.5210 5.0314 5.0314 11.0938 11.0938 11.6843 11.6843 11.7432 11.7432 12.6348 12.6348 12.6382 12.6382 13.2504 13.2504 13.3701 13.3701 13.4101 13.4101 13.7608 13.7608 13.9587 13.9587 13.9653 13.9653 15.1275 15.1275 15.1285 15.1285 16.3254 16.3254 16.3310 16.3310 17.4784 17.4784 18.9756 18.9756 19.0529 19.0529 k = 0.2333 0.1347 0.0953 ( 4630 PWs) bands (ev): -41.9593 -41.9593 -18.6562 -18.6562 -18.0038 -18.0038 -18.0007 -18.0007 -6.5563 -6.5563 -6.5545 -6.5545 -5.5376 -5.5376 -5.5258 -5.5258 -5.5204 -5.5204 5.0897 5.0897 11.0026 11.0026 11.6751 11.6751 11.7352 11.7352 12.6575 12.6575 12.6609 12.6609 13.2051 13.2051 13.3573 13.3573 13.3985 13.3985 13.7427 13.7427 13.9354 13.9354 13.9419 13.9419 15.1428 15.1428 15.1429 15.1429 16.3199 16.3199 16.3267 16.3267 17.4466 17.4466 18.8683 18.8683 19.0978 19.0978 k = 0.2444 0.1411 0.0998 ( 4624 PWs) bands (ev): -41.9593 -41.9593 -18.6564 -18.6564 -18.0041 -18.0041 -18.0008 -18.0008 -6.5561 -6.5561 -6.5541 -6.5541 -5.5373 -5.5373 -5.5257 -5.5257 -5.5198 -5.5198 5.1502 5.1502 10.9064 10.9064 11.6665 11.6665 11.7277 11.7277 12.6800 12.6800 12.6830 12.6830 13.1623 13.1623 13.3444 13.3444 13.3868 13.3868 13.7272 13.7272 13.9130 13.9130 13.9190 13.9190 15.1558 15.1558 15.1567 15.1567 16.3168 16.3168 16.3247 16.3247 17.4139 17.4139 18.7653 18.7653 19.1414 19.1414 k = 0.2556 0.1475 0.1043 ( 4624 PWs) bands (ev): -41.9593 -41.9593 -18.6566 -18.6566 -18.0045 -18.0045 -18.0008 -18.0008 -6.5559 -6.5559 -6.5537 -6.5537 -5.5370 -5.5370 -5.5255 -5.5255 -5.5192 -5.5192 5.2129 5.2129 10.8056 10.8056 11.6584 11.6584 11.7207 11.7207 12.7020 12.7020 12.7045 12.7045 13.1230 13.1230 13.3315 13.3315 13.3753 13.3753 13.7132 13.7132 13.8915 13.8915 13.8966 13.8966 15.1673 15.1673 15.1690 15.1690 16.3161 16.3161 16.3250 16.3250 17.3797 17.3797 18.6673 18.6673 19.1836 19.1836 k = 0.2667 0.1540 0.1089 ( 4615 PWs) bands (ev): -41.9592 -41.9592 -18.6568 -18.6568 -18.0048 -18.0048 -18.0009 -18.0009 -6.5556 -6.5556 -6.5534 -6.5534 -5.5367 -5.5367 -5.5253 -5.5253 -5.5186 -5.5186 5.2777 5.2777 10.7008 10.7008 11.6507 11.6507 11.7142 11.7142 12.7237 12.7237 12.7253 12.7253 13.0876 13.0876 13.3187 13.3187 13.3641 13.3641 13.7002 13.7002 13.8709 13.8709 13.8748 13.8748 15.1776 15.1776 15.1797 15.1797 16.3179 16.3179 16.3275 16.3275 17.3437 17.3437 18.5748 18.5748 19.2239 19.2239 k = 0.2778 0.1604 0.1134 ( 4609 PWs) bands (ev): -41.9592 -41.9592 -18.6570 -18.6570 -18.0051 -18.0051 -18.0010 -18.0010 -6.5554 -6.5554 -6.5530 -6.5530 -5.5364 -5.5364 -5.5251 -5.5251 -5.5180 -5.5180 5.3445 5.3445 10.5926 10.5926 11.6436 11.6436 11.7081 11.7081 12.7449 12.7449 12.7453 12.7453 13.0566 13.0566 13.3059 13.3059 13.3531 13.3531 13.6876 13.6876 13.8513 13.8513 13.8535 13.8535 15.1866 15.1866 15.1889 15.1889 16.3222 16.3222 16.3323 16.3323 17.3055 17.3055 18.4886 18.4886 19.2624 19.2624 k = 0.2889 0.1668 0.1179 ( 4609 PWs) bands (ev): -41.9592 -41.9592 -18.6571 -18.6571 -18.0054 -18.0054 -18.0011 -18.0011 -6.5552 -6.5552 -6.5527 -6.5527 -5.5362 -5.5362 -5.5250 -5.5250 -5.5175 -5.5175 5.4130 5.4130 10.4816 10.4816 11.6370 11.6370 11.7025 11.7025 12.7642 12.7642 12.7656 12.7656 13.0299 13.0299 13.2932 13.2932 13.3426 13.3426 13.6750 13.6750 13.8328 13.8328 13.8328 13.8328 15.1942 15.1942 15.1967 15.1967 16.3288 16.3288 16.3392 16.3392 17.2650 17.2650 18.4089 18.4089 19.2987 19.2987 k = 0.3000 0.1732 0.1225 ( 4615 PWs) bands (ev): -41.9592 -41.9592 -18.6573 -18.6573 -18.0058 -18.0058 -18.0012 -18.0012 -6.5550 -6.5550 -6.5523 -6.5523 -5.5359 -5.5359 -5.5248 -5.5248 -5.5169 -5.5169 5.4832 5.4832 10.3684 10.3684 11.6308 11.6308 11.6972 11.6972 12.7819 12.7819 12.7857 12.7857 13.0078 13.0078 13.2808 13.2808 13.3325 13.3325 13.6623 13.6623 13.8128 13.8128 13.8154 13.8154 15.2007 15.2007 15.2031 15.2031 16.3376 16.3376 16.3481 16.3481 17.2221 17.2221 18.3361 18.3361 19.3326 19.3326 k = 0.3111 0.1796 0.1270 ( 4615 PWs) bands (ev): -41.9591 -41.9591 -18.6575 -18.6575 -18.0061 -18.0061 -18.0012 -18.0012 -6.5548 -6.5548 -6.5520 -6.5520 -5.5356 -5.5356 -5.5246 -5.5246 -5.5163 -5.5163 5.5548 5.5548 10.2538 10.2538 11.6250 11.6250 11.6924 11.6924 12.7983 12.7983 12.8053 12.8053 12.9901 12.9901 13.2686 13.2686 13.3229 13.3229 13.6493 13.6493 13.7934 13.7934 13.7991 13.7991 15.2061 15.2061 15.2081 15.2081 16.3485 16.3485 16.3589 16.3589 17.1769 17.1769 18.2702 18.2702 19.3638 19.3638 k = 0.3222 0.1860 0.1315 ( 4609 PWs) bands (ev): -41.9591 -41.9591 -18.6576 -18.6576 -18.0064 -18.0064 -18.0013 -18.0013 -6.5546 -6.5546 -6.5516 -6.5516 -5.5353 -5.5353 -5.5244 -5.5244 -5.5158 -5.5158 5.6276 5.6276 10.1384 10.1384 11.6197 11.6197 11.6880 11.6880 12.8130 12.8130 12.8243 12.8243 12.9769 12.9769 13.2567 13.2567 13.3138 13.3138 13.6359 13.6359 13.7748 13.7748 13.7838 13.7838 15.2104 15.2104 15.2120 15.2120 16.3612 16.3612 16.3713 16.3713 17.1296 17.1296 18.2112 18.2112 19.3920 19.3920 k = 0.3333 0.1925 0.1361 ( 4609 PWs) bands (ev): -41.9591 -41.9591 -18.6578 -18.6578 -18.0067 -18.0067 -18.0014 -18.0014 -6.5544 -6.5544 -6.5513 -6.5513 -5.5351 -5.5351 -5.5243 -5.5243 -5.5153 -5.5153 5.7013 5.7013 10.0229 10.0229 11.6148 11.6148 11.6840 11.6840 12.8258 12.8258 12.8426 12.8426 12.9680 12.9680 13.2451 13.2451 13.3054 13.3054 13.6223 13.6223 13.7568 13.7568 13.7695 13.7695 15.2139 15.2139 15.2148 15.2148 16.3755 16.3755 16.3851 16.3851 17.0808 17.0808 18.1589 18.1589 19.4167 19.4167 k = 0.3444 0.1989 0.1406 ( 4600 PWs) bands (ev): -41.9591 -41.9591 -18.6580 -18.6580 -18.0069 -18.0069 -18.0015 -18.0015 -6.5542 -6.5542 -6.5510 -6.5510 -5.5348 -5.5348 -5.5241 -5.5241 -5.5148 -5.5148 5.7757 5.7757 9.9079 9.9079 11.6103 11.6103 11.6803 11.6803 12.8365 12.8365 12.8603 12.8603 12.9634 12.9634 13.2339 13.2339 13.2976 13.2976 13.6085 13.6085 13.7397 13.7397 13.7561 13.7561 15.2165 15.2165 15.2167 15.2167 16.3911 16.3911 16.4000 16.4000 17.0309 17.0309 18.1129 18.1129 19.4372 19.4372 k = 0.3556 0.2053 0.1452 ( 4600 PWs) bands (ev): -41.9591 -41.9591 -18.6581 -18.6581 -18.0072 -18.0072 -18.0015 -18.0015 -6.5540 -6.5540 -6.5507 -6.5507 -5.5346 -5.5346 -5.5240 -5.5240 -5.5143 -5.5143 5.8504 5.8504 9.7942 9.7942 11.6062 11.6062 11.6769 11.6769 12.8452 12.8452 12.8773 12.8773 12.9626 12.9626 13.2230 13.2230 13.2904 13.2904 13.5947 13.5947 13.7234 13.7234 13.7434 13.7434 15.2178 15.2178 15.2184 15.2184 16.4078 16.4078 16.4159 16.4159 16.9808 16.9808 18.0727 18.0727 19.4527 19.4527 k = 0.3667 0.2117 0.1497 ( 4600 PWs) bands (ev): -41.9590 -41.9590 -18.6582 -18.6582 -18.0074 -18.0074 -18.0016 -18.0016 -6.5539 -6.5539 -6.5504 -6.5504 -5.5344 -5.5344 -5.5238 -5.5238 -5.5139 -5.5139 5.9250 5.9250 9.6824 9.6824 11.6025 11.6025 11.6739 11.6739 12.8519 12.8519 12.8936 12.8936 12.9653 12.9653 13.2125 13.2125 13.2839 13.2839 13.5809 13.5809 13.7079 13.7079 13.7316 13.7316 15.2182 15.2182 15.2197 15.2197 16.4252 16.4252 16.4323 16.4323 16.9311 16.9311 18.0377 18.0377 19.4620 19.4620 k = 0.3778 0.2181 0.1542 ( 4591 PWs) bands (ev): -41.9590 -41.9590 -18.6584 -18.6584 -18.0077 -18.0077 -18.0017 -18.0017 -6.5537 -6.5537 -6.5502 -6.5502 -5.5342 -5.5342 -5.5237 -5.5237 -5.5134 -5.5134 5.9989 5.9989 9.5734 9.5734 11.5991 11.5991 11.6712 11.6712 12.8573 12.8573 12.9092 12.9092 12.9705 12.9705 13.2023 13.2023 13.2779 13.2779 13.5674 13.5674 13.6935 13.6935 13.7204 13.7204 15.2181 15.2181 15.2206 15.2206 16.4429 16.4429 16.4490 16.4490 16.8825 16.8825 18.0076 18.0076 19.4639 19.4639 k = 0.3889 0.2245 0.1588 ( 4597 PWs) bands (ev): -41.9590 -41.9590 -18.6585 -18.6585 -18.0079 -18.0079 -18.0017 -18.0017 -6.5536 -6.5536 -6.5499 -6.5499 -5.5340 -5.5340 -5.5235 -5.5235 -5.5130 -5.5130 6.0717 6.0717 9.4680 9.4680 11.5960 11.5960 11.6688 11.6688 12.8617 12.8617 12.9240 12.9240 12.9775 12.9775 13.1925 13.1925 13.2726 13.2726 13.5544 13.5544 13.6800 13.6800 13.7098 13.7098 15.2177 15.2177 15.2210 15.2210 16.4607 16.4607 16.4657 16.4657 16.8358 16.8358 17.9816 17.9816 19.4574 19.4574 k = 0.4000 0.2309 0.1633 ( 4618 PWs) bands (ev): -41.9590 -41.9590 -18.6586 -18.6586 -18.0081 -18.0081 -18.0018 -18.0018 -6.5534 -6.5534 -6.5497 -6.5497 -5.5338 -5.5338 -5.5234 -5.5234 -5.5127 -5.5127 6.1425 6.1425 9.3670 9.3670 11.5933 11.5933 11.6666 11.6666 12.8655 12.8655 12.9381 12.9381 12.9855 12.9855 13.1831 13.1831 13.2677 13.2677 13.5420 13.5420 13.6675 13.6675 13.7000 13.7000 15.2169 15.2169 15.2211 15.2211 16.4782 16.4782 16.4821 16.4821 16.7917 16.7917 17.9594 17.9594 19.4431 19.4431 k = 0.4111 0.2374 0.1678 ( 4615 PWs) bands (ev): -41.9590 -41.9590 -18.6587 -18.6587 -18.0083 -18.0083 -18.0018 -18.0018 -6.5533 -6.5533 -6.5495 -6.5495 -5.5337 -5.5337 -5.5233 -5.5233 -5.5123 -5.5123 6.2106 6.2106 9.2714 9.2714 11.5909 11.5909 11.6648 11.6648 12.8690 12.8690 12.9513 12.9513 12.9940 12.9940 13.1742 13.1742 13.2634 13.2634 13.5304 13.5304 13.6562 13.6562 13.6908 13.6908 15.2159 15.2159 15.2210 15.2210 16.4950 16.4950 16.4978 16.4978 16.7507 16.7507 17.9406 17.9406 19.4228 19.4228 k = 0.4222 0.2438 0.1724 ( 4609 PWs) bands (ev): -41.9590 -41.9590 -18.6588 -18.6588 -18.0084 -18.0084 -18.0019 -18.0019 -6.5532 -6.5532 -6.5493 -6.5493 -5.5335 -5.5335 -5.5232 -5.5232 -5.5121 -5.5121 6.2751 6.2751 9.1825 9.1825 11.5888 11.5888 11.6631 11.6631 12.8722 12.8722 12.9637 12.9637 13.0024 13.0024 13.1657 13.1657 13.2596 13.2596 13.5197 13.5197 13.6461 13.6461 13.6824 13.6824 15.2149 15.2149 15.2208 15.2208 16.5108 16.5108 16.5126 16.5126 16.7133 16.7133 17.9247 17.9247 19.3994 19.3994 k = 0.4333 0.2502 0.1769 ( 4609 PWs) bands (ev): -41.9590 -41.9590 -18.6589 -18.6589 -18.0086 -18.0086 -18.0019 -18.0019 -6.5531 -6.5531 -6.5491 -6.5491 -5.5334 -5.5334 -5.5231 -5.5231 -5.5118 -5.5118 6.3349 6.3349 9.1012 9.1012 11.5869 11.5869 11.6618 11.6618 12.8753 12.8753 12.9751 12.9751 13.0105 13.0105 13.1576 13.1576 13.2562 13.2562 13.5101 13.5101 13.6372 13.6372 13.6748 13.6748 15.2138 15.2138 15.2204 15.2204 16.5252 16.5252 16.5260 16.5260 16.6802 16.6802 17.9115 17.9115 19.3753 19.3753 k = 0.4444 0.2566 0.1814 ( 4600 PWs) bands (ev): -41.9590 -41.9590 -18.6589 -18.6589 -18.0087 -18.0087 -18.0019 -18.0019 -6.5530 -6.5530 -6.5490 -6.5490 -5.5333 -5.5333 -5.5230 -5.5230 -5.5116 -5.5116 6.3887 6.3887 9.0290 9.0290 11.5854 11.5854 11.6606 11.6606 12.8781 12.8781 12.9854 12.9854 13.0180 13.0180 13.1502 13.1502 13.2533 13.2533 13.5017 13.5017 13.6296 13.6296 13.6681 13.6681 15.2128 15.2128 15.2200 15.2200 16.5378 16.5378 16.5381 16.5381 16.6515 16.6515 17.9007 17.9007 19.3525 19.3525 k = 0.4556 0.2630 0.1860 ( 4594 PWs) bands (ev): -41.9590 -41.9590 -18.6590 -18.6590 -18.0088 -18.0088 -18.0020 -18.0020 -6.5529 -6.5529 -6.5489 -6.5489 -5.5332 -5.5332 -5.5230 -5.5230 -5.5114 -5.5114 6.4353 6.4353 8.9673 8.9673 11.5842 11.5842 11.6597 11.6597 12.8806 12.8806 12.9944 12.9944 13.0245 13.0245 13.1436 13.1436 13.2508 13.2508 13.4946 13.4946 13.6232 13.6232 13.6625 13.6625 15.2119 15.2119 15.2196 15.2196 16.5477 16.5477 16.5490 16.5490 16.6279 16.6279 17.8922 17.8922 19.3324 19.3324 k = 0.4667 0.2694 0.1905 ( 4587 PWs) bands (ev): -41.9589 -41.9589 -18.6590 -18.6590 -18.0089 -18.0089 -18.0020 -18.0020 -6.5529 -6.5529 -6.5488 -6.5488 -5.5332 -5.5332 -5.5229 -5.5229 -5.5112 -5.5112 6.4734 6.4734 8.9173 8.9173 11.5833 11.5833 11.6590 11.6590 12.8826 12.8826 13.0020 13.0020 13.0298 13.0298 13.1379 13.1379 13.2488 13.2488 13.4890 13.4890 13.6183 13.6183 13.6579 13.6579 15.2112 15.2112 15.2193 15.2193 16.5554 16.5554 16.5578 16.5578 16.6095 16.6095 17.8857 17.8857 19.3159 19.3159 k = 0.4778 0.2758 0.1951 ( 4596 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5017 6.5017 8.8806 8.8806 11.5826 11.5826 11.6585 11.6585 12.8841 12.8841 13.0077 13.0077 13.0338 13.0338 13.1335 13.1335 13.2474 13.2474 13.4849 13.4849 13.6147 13.6147 13.6546 13.6546 15.2106 15.2106 15.2190 15.2190 16.5605 16.5605 16.5642 16.5642 16.5967 16.5967 17.8811 17.8811 19.3038 19.3038 k = 0.4889 0.2823 0.1996 ( 4596 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5191 6.5191 8.8580 8.8580 11.5822 11.5822 11.6582 11.6582 12.8851 12.8851 13.0113 13.0113 13.0362 13.0362 13.1307 13.1307 13.2465 13.2465 13.4825 13.4825 13.6126 13.6126 13.6526 13.6526 15.2103 15.2103 15.2189 15.2189 16.5630 16.5630 16.5681 16.5681 16.5896 16.5896 17.8784 17.8784 19.2963 19.2963 k = 0.5000 0.2887 0.2041 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5250 6.5250 8.8504 8.8504 11.5820 11.5820 11.6581 11.6581 12.8854 12.8854 13.0126 13.0126 13.0371 13.0371 13.1298 13.1298 13.2462 13.2462 13.4816 13.4816 13.6119 13.6119 13.6520 13.6520 15.2102 15.2102 15.2188 15.2188 16.5636 16.5636 16.5694 16.5694 16.5875 16.5875 17.8775 17.8775 19.2938 19.2938 k = 0.5000 0.2887 0.2041 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5250 6.5250 8.8504 8.8504 11.5820 11.5820 11.6581 11.6581 12.8854 12.8854 13.0126 13.0126 13.0371 13.0371 13.1298 13.1298 13.2462 13.2462 13.4816 13.4816 13.6119 13.6119 13.6520 13.6520 15.2102 15.2102 15.2188 15.2188 16.5636 16.5636 16.5694 16.5694 16.5875 16.5875 17.8775 17.8775 19.2938 19.2938 k = 0.5039 0.2774 0.2105 ( 4587 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5258 6.5258 8.8520 8.8520 11.5809 11.5809 11.6571 11.6571 12.8844 12.8844 13.0121 13.0121 13.0344 13.0344 13.1325 13.1325 13.2477 13.2477 13.4817 13.4817 13.6116 13.6116 13.6523 13.6523 15.2090 15.2090 15.2179 15.2179 16.5624 16.5624 16.5684 16.5684 16.5866 16.5866 17.8818 17.8818 19.2674 19.2674 k = 0.5078 0.2661 0.2169 ( 4595 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5280 6.5280 8.8566 8.8566 11.5772 11.5772 11.6547 11.6547 12.8815 12.8815 13.0105 13.0105 13.0277 13.0277 13.1398 13.1398 13.2522 13.2522 13.4820 13.4820 13.6108 13.6108 13.6532 13.6532 15.2048 15.2048 15.2157 15.2157 16.5582 16.5582 16.5660 16.5660 16.5841 16.5841 17.8942 17.8942 19.1909 19.1909 k = 0.5117 0.2548 0.2233 ( 4594 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0021 -18.0021 -6.5528 -6.5528 -6.5487 -6.5487 -5.5330 -5.5330 -5.5228 -5.5228 -5.5112 -5.5112 6.5317 6.5317 8.8643 8.8643 11.5696 11.5696 11.6520 11.6520 12.8765 12.8765 13.0065 13.0065 13.0205 13.0205 13.1498 13.1498 13.2595 13.2595 13.4823 13.4823 13.6095 13.6095 13.6548 13.6548 15.1968 15.1968 15.2133 15.2133 16.5497 16.5497 16.5632 16.5632 16.5807 16.5807 17.9137 17.9137 19.0858 19.0858 k = 0.5156 0.2436 0.2296 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0021 -18.0021 -6.5528 -6.5528 -6.5487 -6.5487 -5.5330 -5.5330 -5.5228 -5.5228 -5.5112 -5.5112 6.5370 6.5370 8.8751 8.8751 11.5569 11.5569 11.6506 11.6506 12.8691 12.8691 12.9985 12.9985 13.0163 13.0163 13.1611 13.1611 13.2691 13.2691 13.4825 13.4825 13.6077 13.6077 13.6572 13.6572 15.1851 15.1851 15.2106 15.2106 16.5369 16.5369 16.5600 16.5600 16.5767 16.5767 17.9386 17.9386 18.9741 18.9741 k = 0.5195 0.2323 0.2360 ( 4582 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0022 -18.0022 -6.5528 -6.5528 -6.5488 -6.5488 -5.5330 -5.5330 -5.5228 -5.5228 -5.5113 -5.5113 6.5436 6.5436 8.8889 8.8889 11.5380 11.5380 11.6515 11.6515 12.8592 12.8592 12.9883 12.9883 13.0147 13.0147 13.1729 13.1729 13.2805 13.2805 13.4826 13.4826 13.6056 13.6056 13.6603 13.6603 15.1701 15.1701 15.2076 15.2076 16.5203 16.5203 16.5562 16.5562 16.5725 16.5725 17.9659 17.9659 18.8637 18.8637 k = 0.5234 0.2210 0.2424 ( 4583 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0022 -18.0022 -6.5528 -6.5528 -6.5488 -6.5488 -5.5329 -5.5329 -5.5228 -5.5228 -5.5115 -5.5115 6.5518 6.5518 8.9058 8.9058 11.5130 11.5130 11.6548 11.6548 12.8467 12.8467 12.9779 12.9779 13.0146 13.0146 13.1850 13.1850 13.2933 13.2933 13.4823 13.4823 13.6030 13.6030 13.6642 13.6642 15.1522 15.1522 15.2040 15.2040 16.5002 16.5002 16.5519 16.5519 16.5682 16.5682 17.9916 17.9916 18.7604 18.7604 k = 0.5273 0.2097 0.2488 ( 4581 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0089 -18.0089 -18.0023 -18.0023 -6.5527 -6.5527 -6.5488 -6.5488 -5.5329 -5.5329 -5.5227 -5.5227 -5.5116 -5.5116 6.5613 6.5613 8.9256 8.9256 11.4822 11.4822 11.6604 11.6604 12.8319 12.8319 12.9680 12.9680 13.0158 13.0158 13.1971 13.1971 13.3069 13.3069 13.4814 13.4814 13.6002 13.6002 13.6690 13.6690 15.1318 15.1318 15.1998 15.1998 16.4769 16.4769 16.5470 16.5470 16.5642 16.5642 18.0092 18.0092 18.6687 18.6687 k = 0.5312 0.1985 0.2552 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0024 -18.0024 -6.5527 -6.5527 -6.5489 -6.5489 -5.5328 -5.5328 -5.5227 -5.5227 -5.5118 -5.5118 6.5722 6.5722 8.9484 8.9484 11.4462 11.4462 11.6679 11.6679 12.8148 12.8148 12.9588 12.9588 13.0181 13.0181 13.2092 13.2092 13.3207 13.3207 13.4801 13.4801 13.5972 13.5972 13.6745 13.6745 15.1093 15.1093 15.1950 15.1950 16.4507 16.4507 16.5415 16.5415 16.5606 16.5606 18.0104 18.0104 18.5839 18.5839 k = 0.5352 0.1872 0.2615 ( 4592 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0025 -18.0025 -6.5527 -6.5527 -6.5489 -6.5489 -5.5327 -5.5327 -5.5226 -5.5226 -5.5119 -5.5119 6.5845 6.5845 8.9740 8.9740 11.4054 11.4054 11.6770 11.6770 12.7960 12.7960 12.9502 12.9502 13.0216 13.0216 13.2213 13.2213 13.3344 13.3344 13.4782 13.4782 13.5942 13.5942 13.6807 13.6807 15.0850 15.0850 15.1895 15.1895 16.4216 16.4216 16.5356 16.5356 16.5577 16.5577 17.9876 17.9876 18.4891 18.4891 k = 0.5391 0.1759 0.2679 ( 4586 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0026 -18.0026 -6.5526 -6.5526 -6.5490 -6.5490 -5.5327 -5.5327 -5.5226 -5.5226 -5.5121 -5.5121 6.5980 6.5980 9.0025 9.0025 11.3604 11.3604 11.6876 11.6876 12.7757 12.7757 12.9421 12.9421 13.0263 13.0263 13.2333 13.2333 13.3476 13.3476 13.4758 13.4758 13.5913 13.5913 13.6875 13.6875 15.0594 15.0594 15.1833 15.1833 16.3896 16.3896 16.5294 16.5294 16.5558 16.5558 17.9396 17.9396 18.3904 18.3904 k = 0.5430 0.1646 0.2743 ( 4590 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0087 -18.0087 -18.0027 -18.0027 -6.5526 -6.5526 -6.5491 -6.5491 -5.5326 -5.5326 -5.5225 -5.5225 -5.5123 -5.5123 6.6128 6.6128 9.0338 9.0338 11.3114 11.3114 11.6996 11.6996 12.7543 12.7543 12.9345 12.9345 13.0320 13.0320 13.2453 13.2453 13.3597 13.3597 13.4731 13.4731 13.5886 13.5886 13.6947 13.6947 15.0328 15.0328 15.1764 15.1764 16.3548 16.3548 16.5229 16.5229 16.5550 16.5550 17.8727 17.8727 18.2921 18.2921 k = 0.5469 0.1534 0.2807 ( 4588 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0087 -18.0087 -18.0028 -18.0028 -6.5526 -6.5526 -6.5491 -6.5491 -5.5325 -5.5325 -5.5224 -5.5224 -5.5125 -5.5125 6.6288 6.6288 9.0677 9.0677 11.2589 11.2589 11.7127 11.7127 12.7320 12.7320 12.9271 12.9271 13.0387 13.0387 13.2570 13.2570 13.3704 13.3704 13.4704 13.4704 13.5862 13.5862 13.7022 13.7022 15.0056 15.0056 15.1688 15.1688 16.3173 16.3173 16.5163 16.5163 16.5554 16.5554 17.7953 17.7953 18.1952 18.1952 k = 0.5508 0.1421 0.2870 ( 4590 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0086 -18.0086 -18.0029 -18.0029 -6.5525 -6.5525 -6.5492 -6.5492 -5.5325 -5.5325 -5.5223 -5.5223 -5.5127 -5.5127 6.6459 6.6459 9.1042 9.1042 11.2032 11.2032 11.7270 11.7270 12.7090 12.7090 12.9201 12.9201 13.0461 13.0461 13.2686 13.2686 13.3794 13.3794 13.4678 13.4678 13.5845 13.5845 13.7097 13.7097 14.9780 14.9780 15.1604 15.1604 16.2772 16.2772 16.5098 16.5098 16.5570 16.5570 17.7137 17.7137 18.1001 18.1001 k = 0.5547 0.1308 0.2934 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0086 -18.0086 -18.0030 -18.0030 -6.5525 -6.5525 -6.5493 -6.5493 -5.5324 -5.5324 -5.5223 -5.5223 -5.5129 -5.5129 6.6641 6.6641 9.1432 9.1432 11.1447 11.1447 11.7423 11.7423 12.6855 12.6855 12.9134 12.9134 13.0542 13.0542 13.2798 13.2798 13.3864 13.3864 13.4657 13.4657 13.5835 13.5835 13.7171 13.7171 14.9505 14.9505 15.1513 15.1513 16.2347 16.2347 16.5035 16.5035 16.5598 16.5598 17.6319 17.6319 18.0069 18.0069 k = 0.5586 0.1195 0.2998 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0085 -18.0085 -18.0032 -18.0032 -6.5525 -6.5525 -6.5494 -6.5494 -5.5324 -5.5324 -5.5222 -5.5222 -5.5131 -5.5131 6.6832 6.6832 9.1846 9.1846 11.0838 11.0838 11.7585 11.7585 12.6617 12.6617 12.9070 12.9070 13.0626 13.0626 13.2904 13.2904 13.3914 13.3914 13.4640 13.4640 13.5834 13.5834 13.7242 13.7242 14.9232 14.9232 15.1414 15.1414 16.1900 16.1900 16.4975 16.4975 16.5639 16.5639 17.5523 17.5523 17.9156 17.9156 k = 0.5625 0.1083 0.3062 ( 4579 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0085 -18.0085 -18.0033 -18.0033 -6.5524 -6.5524 -6.5494 -6.5494 -5.5323 -5.5323 -5.5220 -5.5220 -5.5134 -5.5134 6.7032 6.7032 9.2283 9.2283 11.0208 11.0208 11.7757 11.7757 12.6376 12.6376 12.9010 12.9010 13.0713 13.0713 13.3002 13.3002 13.3947 13.3947 13.4627 13.4627 13.5845 13.5845 13.7309 13.7309 14.8965 14.8965 15.1308 15.1308 16.1435 16.1435 16.4920 16.4920 16.5691 16.5691 17.4762 17.4762 17.8264 17.8264 k = 0.5664 0.0970 0.3126 ( 4593 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0084 -18.0084 -18.0034 -18.0034 -6.5524 -6.5524 -6.5495 -6.5495 -5.5323 -5.5323 -5.5219 -5.5219 -5.5136 -5.5136 6.7239 6.7239 9.2740 9.2740 10.9561 10.9561 11.7937 11.7937 12.6134 12.6134 12.8953 12.8953 13.0799 13.0799 13.3089 13.3089 13.3969 13.3969 13.4614 13.4614 13.5867 13.5867 13.7370 13.7370 14.8705 14.8705 15.1194 15.1194 16.0956 16.0956 16.4872 16.4872 16.5754 16.5754 17.4043 17.4043 17.7391 17.7391 k = 0.5703 0.0857 0.3189 ( 4591 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0084 -18.0084 -18.0036 -18.0036 -6.5524 -6.5524 -6.5496 -6.5496 -5.5323 -5.5323 -5.5218 -5.5218 -5.5138 -5.5138 6.7452 6.7452 9.3216 9.3216 10.8903 10.8903 11.8124 11.8124 12.5893 12.5893 12.8899 12.8899 13.0882 13.0882 13.3161 13.3161 13.3988 13.3988 13.4601 13.4601 13.5900 13.5900 13.7425 13.7425 14.8455 14.8455 15.1073 15.1073 16.0468 16.0468 16.4831 16.4831 16.5828 16.5828 17.3372 17.3372 17.6538 17.6538 k = 0.5742 0.0744 0.3253 ( 4589 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0083 -18.0083 -18.0037 -18.0037 -6.5524 -6.5524 -6.5497 -6.5497 -5.5323 -5.5323 -5.5217 -5.5217 -5.5140 -5.5140 6.7669 6.7669 9.3708 9.3708 10.8236 10.8236 11.8319 11.8319 12.5653 12.5653 12.8850 12.8850 13.0959 13.0959 13.3218 13.3218 13.4007 13.4007 13.4587 13.4587 13.5942 13.5942 13.7474 13.7474 14.8216 14.8216 15.0945 15.0945 15.9975 15.9975 16.4799 16.4799 16.5911 16.5911 17.2748 17.2748 17.5706 17.5706 k = 0.5781 0.0631 0.3317 ( 4585 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0083 -18.0083 -18.0038 -18.0038 -6.5523 -6.5523 -6.5498 -6.5498 -5.5323 -5.5323 -5.5216 -5.5216 -5.5142 -5.5142 6.7890 6.7890 9.4213 9.4213 10.7568 10.7568 11.8519 11.8519 12.5415 12.5415 12.8804 12.8804 13.1028 13.1028 13.3257 13.3257 13.4028 13.4028 13.4576 13.4576 13.5991 13.5991 13.7516 13.7516 14.7991 14.7991 15.0810 15.0810 15.9484 15.9484 16.4778 16.4778 16.6003 16.6003 17.2172 17.2172 17.4894 17.4894 k = 0.5820 0.0519 0.3381 ( 4584 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0082 -18.0082 -18.0040 -18.0040 -6.5523 -6.5523 -6.5498 -6.5498 -5.5323 -5.5323 -5.5215 -5.5215 -5.5143 -5.5143 6.8112 6.8112 9.4728 9.4728 10.6904 10.6904 11.8724 11.8724 12.5181 12.5181 12.8762 12.8762 13.1086 13.1086 13.3281 13.3281 13.4043 13.4043 13.4577 13.4577 13.6045 13.6045 13.7551 13.7551 14.7780 14.7780 15.0667 15.0667 15.8999 15.8999 16.4767 16.4767 16.6101 16.6101 17.1645 17.1645 17.4102 17.4102 k = 0.5859 0.0406 0.3445 ( 4588 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0082 -18.0082 -18.0041 -18.0041 -6.5523 -6.5523 -6.5499 -6.5499 -5.5324 -5.5324 -5.5214 -5.5214 -5.5145 -5.5145 6.8333 6.8333 9.5247 9.5247 10.6251 10.6251 11.8934 11.8934 12.4953 12.4953 12.8724 12.8724 13.1131 13.1131 13.3293 13.3293 13.4044 13.4044 13.4597 13.4597 13.6100 13.6100 13.7581 13.7581 14.7585 14.7585 15.0519 15.0519 15.8526 15.8526 16.4769 16.4769 16.6204 16.6204 17.1163 17.1163 17.3330 17.3330 k = 0.5898 0.0293 0.3508 ( 4590 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0081 -18.0081 -18.0042 -18.0042 -6.5523 -6.5523 -6.5499 -6.5499 -5.5324 -5.5324 -5.5213 -5.5213 -5.5146 -5.5146 6.8551 6.8551 9.5763 9.5763 10.5620 10.5620 11.9147 11.9147 12.4731 12.4731 12.8690 12.8690 13.1161 13.1161 13.3298 13.3298 13.4022 13.4022 13.4642 13.4642 13.6154 13.6154 13.7607 13.7607 14.7407 14.7407 15.0364 15.0364 15.8068 15.8068 16.4783 16.4783 16.6309 16.6309 17.0729 17.0729 17.2579 17.2579 k = 0.5938 0.0180 0.3572 ( 4588 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0043 -18.0043 -6.5524 -6.5524 -6.5500 -6.5500 -5.5325 -5.5325 -5.5212 -5.5212 -5.5147 -5.5147 6.8763 6.8763 9.6266 9.6266 10.5023 10.5023 11.9363 11.9363 12.4517 12.4517 12.8660 12.8660 13.1177 13.1177 13.3298 13.3298 13.3980 13.3980 13.4710 13.4710 13.6206 13.6206 13.7630 13.7630 14.7247 14.7247 15.0203 15.0203 15.7630 15.7630 16.4811 16.4811 16.6413 16.6413 17.0341 17.0341 17.1850 17.1850 k = 0.5977 0.0068 0.3636 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0044 -18.0044 -6.5524 -6.5524 -6.5500 -6.5500 -5.5326 -5.5326 -5.5212 -5.5212 -5.5147 -5.5147 6.8967 6.8967 9.6741 9.6741 10.4477 10.4477 11.9581 11.9581 12.4313 12.4313 12.8633 12.8633 13.1176 13.1176 13.3294 13.3294 13.3920 13.3920 13.4794 13.4794 13.6254 13.6254 13.7654 13.7654 14.7105 14.7105 15.0037 15.0037 15.7214 15.7214 16.4853 16.4853 16.6513 16.6513 17.0001 17.0001 17.1142 17.1142 k = 0.6016-0.0045 0.3700 ( 4590 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0044 -18.0044 -6.5524 -6.5524 -6.5500 -6.5500 -5.5326 -5.5326 -5.5211 -5.5211 -5.5148 -5.5148 6.9159 6.9159 9.7168 9.7168 10.4005 10.4005 11.9799 11.9799 12.4121 12.4121 12.8611 12.8611 13.1161 13.1161 13.3285 13.3285 13.3849 13.3849 13.4888 13.4888 13.6296 13.6296 13.7680 13.7680 14.6982 14.6982 14.9865 14.9865 15.6824 15.6824 16.4909 16.4909 16.6602 16.6602 16.9711 16.9711 17.0458 17.0458 k = 0.6055-0.0158 0.3764 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0045 -18.0045 -6.5525 -6.5525 -6.5500 -6.5500 -5.5327 -5.5327 -5.5211 -5.5211 -5.5148 -5.5148 6.9336 6.9336 9.7519 9.7519 10.3640 10.3640 12.0016 12.0016 12.3942 12.3942 12.8592 12.8592 13.1132 13.1132 13.3270 13.3270 13.3770 13.3770 13.4988 13.4988 13.6331 13.6331 13.7712 13.7712 14.6878 14.6878 14.9689 14.9689 15.6460 15.6460 16.4979 16.4979 16.6676 16.6676 16.9474 16.9474 16.9800 16.9800 k = 0.6094-0.0271 0.3827 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5525 -6.5525 -6.5500 -6.5500 -5.5329 -5.5329 -5.5211 -5.5211 -5.5148 -5.5148 6.9495 6.9495 9.7761 9.7761 10.3417 10.3417 12.0232 12.0232 12.3778 12.3778 12.8576 12.8576 13.1090 13.1090 13.3249 13.3249 13.3687 13.3687 13.5091 13.5091 13.6358 13.6358 13.7754 13.7754 14.6794 14.6794 14.9509 14.9509 15.6123 15.6123 16.5063 16.5063 16.6727 16.6727 16.9140 16.9140 16.9325 16.9325 k = 0.6133-0.0383 0.3891 ( 4586 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5526 -6.5526 -6.5500 -6.5500 -5.5330 -5.5330 -5.5211 -5.5211 -5.5148 -5.5148 6.9631 6.9631 9.7866 9.7866 10.3366 10.3366 12.0446 12.0446 12.3630 12.3630 12.8563 12.8563 13.1036 13.1036 13.3220 13.3220 13.3602 13.3602 13.5194 13.5194 13.6375 13.6375 13.7806 13.7806 14.6729 14.6729 14.9324 14.9324 15.5813 15.5813 16.5159 16.5159 16.6749 16.6749 16.8542 16.8542 16.9207 16.9207 k = 0.6172-0.0496 0.3955 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5527 -6.5527 -6.5500 -6.5500 -5.5331 -5.5331 -5.5211 -5.5211 -5.5147 -5.5147 6.9741 6.9741 9.7830 9.7830 10.3496 10.3496 12.0655 12.0655 12.3500 12.3500 12.8553 12.8553 13.0971 13.0971 13.3183 13.3183 13.3517 13.3517 13.5296 13.5296 13.6383 13.6383 13.7871 13.7871 14.6683 14.6683 14.9137 14.9137 15.5530 15.5530 16.5265 16.5265 16.6742 16.6742 16.7965 16.7965 16.9164 16.9164 k = 0.6211-0.0609 0.4019 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5528 -6.5528 -6.5500 -6.5500 -5.5333 -5.5333 -5.5211 -5.5211 -5.5147 -5.5147 6.9820 6.9820 9.7676 9.7676 10.3787 10.3787 12.0860 12.0860 12.3390 12.3390 12.8545 12.8545 13.0894 13.0894 13.3137 13.3137 13.3435 13.3435 13.5395 13.5395 13.6384 13.6384 13.7948 13.7948 14.6656 14.6656 14.8946 14.8946 15.5273 15.5273 16.5372 16.5372 16.6709 16.6709 16.7428 16.7428 16.9184 16.9184 k = 0.6250-0.0722 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9864 6.9864 9.7443 9.7443 10.4203 10.4203 12.1059 12.1059 12.3300 12.3300 12.8538 12.8538 13.0805 13.0805 13.3084 13.3084 13.3358 13.3358 13.5491 13.5491 13.6377 13.6377 13.8039 13.8039 14.6648 14.6648 14.8752 14.8752 15.5041 15.5041 16.5460 16.5460 16.6657 16.6657 16.6953 16.6953 16.9257 16.9257 k = 0.6250-0.0722 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9864 6.9864 9.7443 9.7443 10.4203 10.4203 12.1059 12.1059 12.3300 12.3300 12.8538 12.8538 13.0805 13.0805 13.3084 13.3084 13.3358 13.3358 13.5491 13.5491 13.6377 13.6377 13.8039 13.8039 14.6648 14.6648 14.8752 14.8752 15.5041 15.5041 16.5460 16.5460 16.6657 16.6657 16.6953 16.6953 16.9257 16.9257 k = 0.6184-0.0684 0.4190 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9868 6.9868 9.7455 9.7455 10.4202 10.4202 12.0990 12.0990 12.3347 12.3347 12.8541 12.8541 13.0798 13.0798 13.3080 13.3080 13.3361 13.3361 13.5475 13.5475 13.6393 13.6393 13.8040 13.8040 14.6648 14.6648 14.8725 14.8725 15.5080 15.5080 16.5431 16.5431 16.6672 16.6672 16.6924 16.6924 16.9263 16.9263 k = 0.6118-0.0646 0.4297 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5147 -5.5147 6.9880 6.9880 9.7488 9.7488 10.4201 10.4201 12.0801 12.0801 12.3473 12.3473 12.8551 12.8551 13.0775 13.0775 13.3071 13.3071 13.3368 13.3368 13.5431 13.5431 13.6439 13.6439 13.8045 13.8045 14.6646 14.6646 14.8647 14.8647 15.5195 15.5195 16.5347 16.5347 16.6710 16.6710 16.6841 16.6841 16.9278 16.9278 k = 0.6053-0.0608 0.4405 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5147 -5.5147 6.9899 6.9899 9.7544 9.7544 10.4197 10.4197 12.0522 12.0522 12.3647 12.3647 12.8568 12.8568 13.0738 13.0738 13.3057 13.3057 13.3378 13.3378 13.5367 13.5367 13.6506 13.6506 13.8053 13.8053 14.6644 14.6644 14.8525 14.8525 15.5377 15.5377 16.5219 16.5219 16.6694 16.6694 16.6783 16.6783 16.9297 16.9297 k = 0.5987-0.0570 0.4512 ( 4595 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5528 -6.5528 -6.5500 -6.5500 -5.5334 -5.5334 -5.5210 -5.5210 -5.5148 -5.5148 6.9926 6.9926 9.7622 9.7622 10.4189 10.4189 12.0183 12.0183 12.3842 12.3842 12.8592 12.8592 13.0688 13.0688 13.3039 13.3039 13.3392 13.3392 13.5289 13.5289 13.6587 13.6587 13.8063 13.8063 14.6640 14.6640 14.8369 14.8369 15.5617 15.5617 16.5056 16.5056 16.6532 16.6532 16.6841 16.6841 16.9315 16.9315 k = 0.5921-0.0532 0.4620 ( 4603 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0047 -18.0047 -6.5528 -6.5528 -6.5500 -6.5500 -5.5333 -5.5333 -5.5209 -5.5209 -5.5149 -5.5149 6.9960 6.9960 9.7723 9.7723 10.4176 10.4176 11.9803 11.9803 12.4043 12.4043 12.8621 12.8621 13.0624 13.0624 13.3019 13.3019 13.3407 13.3407 13.5203 13.5203 13.6677 13.6677 13.8075 13.8075 14.6636 14.6636 14.8191 14.8191 15.5905 15.5905 16.4867 16.4867 16.6340 16.6340 16.6906 16.6906 16.9325 16.9325 k = 0.5855-0.0494 0.4727 ( 4593 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0047 -18.0047 -6.5527 -6.5527 -6.5501 -6.5501 -5.5333 -5.5333 -5.5208 -5.5208 -5.5150 -5.5150 7.0000 7.0000 9.7846 9.7846 10.4156 10.4156 11.9396 11.9396 12.4240 12.4240 12.8656 12.8656 13.0550 13.0550 13.2998 13.2998 13.3423 13.3423 13.5114 13.5114 13.6770 13.6770 13.8089 13.8089 14.6630 14.6630 14.8000 14.8000 15.6229 15.6229 16.4657 16.4657 16.6134 16.6134 16.6966 16.6966 16.9324 16.9324 k = 0.5789-0.0456 0.4835 ( 4593 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0048 -18.0048 -6.5527 -6.5527 -6.5501 -6.5501 -5.5333 -5.5333 -5.5207 -5.5207 -5.5151 -5.5151 7.0046 7.0046 9.7991 9.7991 10.4124 10.4124 11.8974 11.8974 12.4426 12.4426 12.8696 12.8696 13.0465 13.0465 13.2976 13.2976 13.3440 13.3440 13.5024 13.5024 13.6864 13.6864 13.8105 13.8105 14.6623 14.6623 14.7806 14.7806 15.6580 15.6580 16.4429 16.4429 16.5924 16.5924 16.7021 16.7021 16.9311 16.9311 k = 0.5724-0.0418 0.4942 ( 4591 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0080 -18.0080 -18.0048 -18.0048 -6.5526 -6.5526 -6.5502 -6.5502 -5.5332 -5.5332 -5.5205 -5.5205 -5.5152 -5.5152 7.0097 7.0097 9.8157 9.8157 10.4078 10.4078 11.8545 11.8545 12.4600 12.4600 12.8741 12.8741 13.0372 13.0372 13.2956 13.2956 13.3457 13.3457 13.4935 13.4935 13.6956 13.6956 13.8120 13.8120 14.6613 14.6613 14.7617 14.7617 15.6951 15.6951 16.4187 16.4187 16.5717 16.5717 16.7068 16.7068 16.9284 16.9284 k = 0.5658-0.0380 0.5049 ( 4591 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0079 -18.0079 -18.0049 -18.0049 -6.5525 -6.5525 -6.5502 -6.5502 -5.5332 -5.5332 -5.5204 -5.5204 -5.5154 -5.5154 7.0152 7.0152 9.8346 9.8346 10.4013 10.4013 11.8119 11.8119 12.4759 12.4759 12.8790 12.8790 13.0274 13.0274 13.2938 13.2938 13.3474 13.3474 13.4850 13.4850 13.7045 13.7045 13.8136 13.8136 14.6602 14.6602 14.7438 14.7438 15.7335 15.7335 16.3932 16.3932 16.5521 16.5521 16.7107 16.7107 16.9245 16.9245 k = 0.5592-0.0342 0.5157 ( 4599 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0079 -18.0079 -18.0050 -18.0050 -6.5525 -6.5525 -6.5503 -6.5503 -5.5332 -5.5332 -5.5202 -5.5202 -5.5156 -5.5156 7.0210 7.0210 9.8556 9.8556 10.3926 10.3926 11.7703 11.7703 12.4902 12.4902 12.8842 12.8842 13.0171 13.0171 13.2921 13.2921 13.3490 13.3490 13.4769 13.4769 13.7128 13.7128 13.8150 13.8150 14.6588 14.6588 14.7275 14.7275 15.7727 15.7727 16.3666 16.3666 16.5341 16.5341 16.7137 16.7137 16.9194 16.9194 k = 0.5526-0.0304 0.5264 ( 4597 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0078 -18.0078 -18.0050 -18.0050 -6.5524 -6.5524 -6.5503 -6.5503 -5.5331 -5.5331 -5.5200 -5.5200 -5.5157 -5.5157 7.0270 7.0270 9.8787 9.8787 10.3811 10.3811 11.7308 11.7308 12.5028 12.5028 12.8896 12.8896 13.0067 13.0067 13.2908 13.2908 13.3505 13.3505 13.4693 13.4693 13.7205 13.7205 13.8163 13.8163 14.6569 14.6569 14.7132 14.7132 15.8121 15.8121 16.3391 16.3391 16.5180 16.5180 16.7160 16.7160 16.9134 16.9134 k = 0.5461-0.0266 0.5372 ( 4603 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0078 -18.0078 -18.0051 -18.0051 -6.5523 -6.5523 -6.5504 -6.5504 -5.5331 -5.5331 -5.5199 -5.5199 -5.5159 -5.5159 7.0331 7.0331 9.9038 9.9038 10.3665 10.3665 11.6941 11.6941 12.5138 12.5138 12.8952 12.8952 12.9964 12.9964 13.2898 13.2898 13.3519 13.3519 13.4624 13.4624 13.7275 13.7275 13.8174 13.8174 14.6547 14.6547 14.7012 14.7012 15.8514 15.8514 16.3108 16.3108 16.5041 16.5041 16.7175 16.7175 16.9066 16.9066 k = 0.5395-0.0228 0.5479 ( 4597 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0077 -18.0077 -18.0052 -18.0052 -6.5522 -6.5522 -6.5505 -6.5505 -5.5330 -5.5330 -5.5197 -5.5197 -5.5161 -5.5161 7.0390 7.0390 9.9310 9.9310 10.3485 10.3485 11.6610 11.6610 12.5231 12.5231 12.9008 12.9008 12.9864 12.9864 13.2892 13.2892 13.3531 13.3531 13.4563 13.4563 13.7336 13.7336 13.8183 13.8183 14.6519 14.6519 14.6916 14.6916 15.8901 15.8901 16.2819 16.2819 16.4927 16.4927 16.7184 16.7184 16.8993 16.8993 k = 0.5329-0.0190 0.5587 ( 4597 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0077 -18.0077 -18.0052 -18.0052 -6.5521 -6.5521 -6.5506 -6.5506 -5.5330 -5.5330 -5.5195 -5.5195 -5.5163 -5.5163 7.0446 7.0446 9.9600 9.9600 10.3268 10.3268 11.6323 11.6323 12.5308 12.5308 12.9064 12.9064 12.9770 12.9770 13.2889 13.2889 13.3541 13.3541 13.4510 13.4510 13.7389 13.7389 13.8189 13.8189 14.6488 14.6488 14.6844 14.6844 15.9280 15.9280 16.2525 16.2525 16.4838 16.4838 16.7188 16.7188 16.8920 16.8920 k = 0.5263-0.0152 0.5694 ( 4599 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0053 -18.0053 -6.5520 -6.5520 -6.5506 -6.5506 -5.5330 -5.5330 -5.5193 -5.5193 -5.5164 -5.5164 7.0497 7.0497 9.9906 9.9906 10.3015 10.3015 11.6085 11.6085 12.5368 12.5368 12.9118 12.9118 12.9684 12.9684 13.2888 13.2888 13.3548 13.3548 13.4467 13.4467 13.7432 13.7432 13.8192 13.8192 14.6456 14.6456 14.6792 14.6792 15.9648 15.9648 16.2226 16.2226 16.4772 16.4772 16.7187 16.7187 16.8849 16.8849 k = 0.5197-0.0114 0.5801 ( 4597 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5519 -6.5519 -6.5507 -6.5507 -5.5330 -5.5330 -5.5192 -5.5192 -5.5166 -5.5166 7.0541 7.0541 10.0225 10.0225 10.2732 10.2732 11.5899 11.5899 12.5412 12.5412 12.9168 12.9168 12.9608 12.9608 13.2890 13.2890 13.3554 13.3554 13.4433 13.4433 13.7466 13.7466 13.8194 13.8194 14.6429 14.6429 14.6757 14.6757 16.0002 16.0002 16.1926 16.1926 16.4730 16.4730 16.7183 16.7183 16.8784 16.8784 k = 0.5132-0.0076 0.5909 ( 4605 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5507 -6.5507 -5.5329 -5.5329 -5.5191 -5.5191 -5.5167 -5.5167 7.0576 7.0576 10.0544 10.0544 10.2432 10.2432 11.5767 11.5767 12.5443 12.5443 12.9212 12.9212 12.9547 12.9547 13.2894 13.2894 13.3557 13.3557 13.4408 13.4408 13.7490 13.7490 13.8194 13.8194 14.6409 14.6409 14.6733 14.6733 16.0340 16.0340 16.1626 16.1626 16.4706 16.4706 16.7179 16.7179 16.8731 16.8731 k = 0.5066-0.0038 0.6016 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0599 7.0599 10.0828 10.0828 10.2154 10.2154 11.5690 11.5690 12.5459 12.5459 12.9242 12.9242 12.9507 12.9507 13.2897 13.2897 13.3558 13.3558 13.4394 13.4394 13.7504 13.7504 13.8193 13.8193 14.6398 14.6398 14.6718 14.6718 16.0653 16.0653 16.1334 16.1334 16.4696 16.4696 16.7174 16.7174 16.8695 16.8695 k = 0.5000 0.0000 0.6124 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0075 -18.0075 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0607 7.0607 10.0966 10.0966 10.2017 10.2017 11.5665 11.5665 12.5465 12.5465 12.9253 12.9253 12.9493 12.9493 13.2899 13.2899 13.3558 13.3558 13.4389 13.4389 13.7509 13.7509 13.8192 13.8192 14.6395 14.6395 14.6713 14.6713 16.0858 16.0858 16.1137 16.1137 16.4695 16.4695 16.7172 16.7172 16.8681 16.8681 k = 0.5000 0.0000 0.6124 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0075 -18.0075 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0607 7.0607 10.0966 10.0966 10.2017 10.2017 11.5665 11.5665 12.5465 12.5465 12.9253 12.9253 12.9493 12.9493 13.2899 13.2899 13.3558 13.3558 13.4389 13.4389 13.7509 13.7509 13.8192 13.8192 14.6395 14.6395 14.6713 14.6713 16.0858 16.0858 16.1137 16.1137 16.4695 16.4695 16.7172 16.7172 16.8681 16.8681 k = 0.5000 0.0078 0.6013 ( 4600 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0594 7.0594 10.0956 10.0956 10.2010 10.2010 11.5694 11.5694 12.5454 12.5454 12.9257 12.9257 12.9498 12.9498 13.2900 13.2900 13.3563 13.3563 13.4396 13.4396 13.7499 13.7499 13.8187 13.8187 14.6404 14.6404 14.6725 14.6725 16.0860 16.0860 16.1138 16.1138 16.4717 16.4717 16.7179 16.7179 16.8696 16.8696 k = 0.5000 0.0156 0.5903 ( 4596 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5190 -5.5190 -5.5168 -5.5168 7.0555 7.0555 10.0913 10.0913 10.2005 10.2005 11.5779 11.5779 12.5425 12.5425 12.9268 12.9268 12.9513 12.9513 13.2902 13.2902 13.3576 13.3576 13.4416 13.4416 13.7470 13.7470 13.8171 13.8171 14.6430 14.6430 14.6759 14.6759 16.0866 16.0866 16.1146 16.1146 16.4780 16.4780 16.7200 16.7200 16.8742 16.8742 k = 0.5000 0.0234 0.5793 ( 4598 PWs) bands (ev): -41.9587 -41.9587 -18.6599 -18.6599 -18.0076 -18.0076 -18.0054 -18.0054 -6.5518 -6.5518 -6.5508 -6.5508 -5.5329 -5.5329 -5.5191 -5.5191 -5.5167 -5.5167 7.0491 7.0491 10.0805 10.0805 10.2038 10.2038 11.5914 11.5914 12.5378 12.5378 12.9283 12.9283 12.9539 12.9539 13.2908 13.2908 13.3597 13.3597 13.4451 13.4451 13.7420 13.7420 13.8148 13.8148 14.6474 14.6474 14.6816 14.6816 16.0868 16.0868 16.1169 16.1169 16.4881 16.4881 16.7238 16.7238 16.8818 16.8818 k = 0.5000 0.0312 0.5682 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0076 -18.0076 -18.0053 -18.0053 -6.5518 -6.5518 -6.5507 -6.5507 -5.5328 -5.5328 -5.5192 -5.5192 -5.5166 -5.5166 7.0403 7.0403 10.0604 10.0604 10.2141 10.2141 11.6090 11.6090 12.5318 12.5318 12.9300 12.9300 12.9577 12.9577 13.2917 13.2917 13.3623 13.3623 13.4498 13.4498 13.7349 13.7349 13.8120 13.8120 14.6536 14.6536 14.6895 14.6895 16.0862 16.0862 16.1214 16.1214 16.5011 16.5011 16.7296 16.7296 16.8925 16.8925 k = 0.5000 0.0390 0.5572 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0076 -18.0076 -18.0053 -18.0053 -6.5518 -6.5518 -6.5507 -6.5507 -5.5328 -5.5328 -5.5193 -5.5193 -5.5165 -5.5165 7.0292 7.0292 10.0312 10.0312 10.2323 10.2323 11.6298 11.6298 12.5250 12.5250 12.9317 12.9317 12.9624 12.9624 13.2931 13.2931 13.3653 13.3653 13.4558 13.4558 13.7254 13.7254 13.8090 13.8090 14.6614 14.6614 14.6996 14.6996 16.0848 16.0848 16.1284 16.1284 16.5161 16.5161 16.7381 16.7381 16.9064 16.9064 k = 0.5000 0.0468 0.5462 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6599 -18.6599 -18.0077 -18.0077 -18.0052 -18.0052 -6.5519 -6.5519 -6.5506 -6.5506 -5.5328 -5.5328 -5.5194 -5.5194 -5.5164 -5.5164 7.0159 7.0159 9.9945 9.9945 10.2574 10.2574 11.6525 11.6525 12.5181 12.5181 12.9331 12.9331 12.9678 12.9678 13.2950 13.2950 13.3684 13.3684 13.4628 13.4628 13.7137 13.7137 13.8060 13.8060 14.6707 14.6707 14.7119 14.7119 16.0831 16.0831 16.1376 16.1376 16.5319 16.5319 16.7501 16.7501 16.9237 16.9237 k = 0.5000 0.0546 0.5351 ( 4600 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0077 -18.0077 -18.0051 -18.0051 -6.5519 -6.5519 -6.5506 -6.5506 -5.5327 -5.5327 -5.5196 -5.5196 -5.5163 -5.5163 7.0008 7.0008 9.9519 9.9519 10.2884 10.2884 11.6759 11.6759 12.5115 12.5115 12.9345 12.9345 12.9736 12.9736 13.2974 13.2974 13.3716 13.3716 13.4706 13.4706 13.7000 13.7000 13.8032 13.8032 14.6815 14.6815 14.7265 14.7265 16.0818 16.0818 16.1487 16.1487 16.5474 16.5474 16.7665 16.7665 16.9444 16.9444 k = 0.5000 0.0624 0.5241 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0077 -18.0077 -18.0050 -18.0050 -6.5519 -6.5519 -6.5505 -6.5505 -5.5327 -5.5327 -5.5197 -5.5197 -5.5161 -5.5161 6.9839 6.9839 9.9049 9.9049 10.3246 10.3246 11.6990 11.6990 12.5059 12.5059 12.9356 12.9356 12.9794 12.9794 13.3004 13.3004 13.3748 13.3748 13.4789 13.4789 13.6848 13.6848 13.8004 13.8004 14.6934 14.6934 14.7435 14.7435 16.0814 16.0814 16.1612 16.1612 16.5613 16.5613 16.7882 16.7882 16.9687 16.9687 k = 0.5000 0.0702 0.5131 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0078 -18.0078 -18.0049 -18.0049 -6.5519 -6.5519 -6.5505 -6.5505 -5.5326 -5.5326 -5.5199 -5.5199 -5.5160 -5.5160 6.9655 6.9655 9.8548 9.8548 10.3652 10.3652 11.7208 11.7208 12.5018 12.5018 12.9367 12.9367 12.9851 12.9851 13.3041 13.3041 13.3778 13.3778 13.4873 13.4873 13.6683 13.6683 13.7975 13.7975 14.7063 14.7063 14.7629 14.7629 16.0823 16.0823 16.1749 16.1749 16.5730 16.5730 16.8157 16.8157 16.9966 16.9966 k = 0.5000 0.0780 0.5020 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0078 -18.0078 -18.0048 -18.0048 -6.5520 -6.5520 -6.5504 -6.5504 -5.5326 -5.5326 -5.5201 -5.5201 -5.5158 -5.5158 6.9458 6.9458 9.8023 9.8023 10.4099 10.4099 11.7404 11.7404 12.4998 12.4998 12.9377 12.9377 12.9903 12.9903 13.3082 13.3082 13.3807 13.3807 13.4954 13.4954 13.6511 13.6511 13.7946 13.7946 14.7201 14.7201 14.7846 14.7846 16.0848 16.0848 16.1894 16.1894 16.5821 16.5821 16.8493 16.8493 17.0283 17.0283 k = 0.5000 0.0858 0.4910 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0079 -18.0079 -18.0047 -18.0047 -6.5520 -6.5520 -6.5503 -6.5503 -5.5325 -5.5325 -5.5203 -5.5203 -5.5156 -5.5156 6.9250 6.9250 9.7483 9.7483 10.4580 10.4580 11.7572 11.7572 12.5003 12.5003 12.9387 12.9387 12.9950 12.9950 13.3127 13.3127 13.3835 13.3835 13.5027 13.5027 13.6337 13.6337 13.7915 13.7915 14.7346 14.7346 14.8086 14.8086 16.0893 16.0893 16.2046 16.2046 16.5888 16.5888 16.8887 16.8887 17.0639 17.0639 k = 0.5000 0.0936 0.4800 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0079 -18.0079 -18.0046 -18.0046 -6.5521 -6.5521 -6.5502 -6.5502 -5.5324 -5.5324 -5.5205 -5.5205 -5.5154 -5.5154 6.9035 6.9035 9.6934 9.6934 10.5092 10.5092 11.7706 11.7706 12.5035 12.5035 12.9396 12.9396 12.9990 12.9990 13.3175 13.3175 13.3861 13.3861 13.5086 13.5086 13.6169 13.6169 13.7881 13.7881 14.7498 14.7498 14.8345 14.8345 16.0960 16.0960 16.2203 16.2203 16.5936 16.5936 16.9337 16.9337 17.1034 17.1034 k = 0.5000 0.1014 0.4689 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0080 -18.0080 -18.0044 -18.0044 -6.5521 -6.5521 -6.5501 -6.5501 -5.5324 -5.5324 -5.5207 -5.5207 -5.5152 -5.5152 6.8812 6.8812 9.6382 9.6382 10.5631 10.5631 11.7803 11.7803 12.5095 12.5095 12.9405 12.9405 13.0023 13.0023 13.3223 13.3223 13.3885 13.3885 13.5123 13.5123 13.6015 13.6015 13.7843 13.7843 14.7656 14.7656 14.8621 14.8621 16.1050 16.1050 16.2362 16.2362 16.5966 16.5966 16.9839 16.9839 17.1467 17.1467 k = 0.5000 0.1092 0.4579 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0080 -18.0080 -18.0043 -18.0043 -6.5521 -6.5521 -6.5501 -6.5501 -5.5324 -5.5324 -5.5208 -5.5208 -5.5150 -5.5150 6.8586 6.8586 9.5831 9.5831 10.6192 10.6192 11.7865 11.7865 12.5185 12.5185 12.9413 12.9413 13.0050 13.0050 13.3267 13.3267 13.3909 13.3909 13.5130 13.5130 13.5887 13.5887 13.7801 13.7801 14.7821 14.7821 14.8909 14.8909 16.1166 16.1166 16.2522 16.2522 16.5984 16.5984 17.0391 17.0391 17.1940 17.1940 k = 0.5000 0.1170 0.4469 ( 4600 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0081 -18.0081 -18.0042 -18.0042 -6.5522 -6.5522 -6.5500 -6.5500 -5.5323 -5.5323 -5.5210 -5.5210 -5.5148 -5.5148 6.8357 6.8357 9.5285 9.5285 10.6771 10.6771 11.7890 11.7890 12.5302 12.5302 12.9421 12.9421 13.0071 13.0071 13.3303 13.3303 13.3932 13.3932 13.5097 13.5097 13.5797 13.5797 13.7754 13.7754 14.7994 14.7994 14.9204 14.9204 16.1309 16.1309 16.2683 16.2683 16.5992 16.5992 17.0991 17.0991 17.2450 17.2450 k = 0.5000 0.1248 0.4358 ( 4596 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0082 -18.0082 -18.0040 -18.0040 -6.5522 -6.5522 -6.5499 -6.5499 -5.5323 -5.5323 -5.5212 -5.5212 -5.5146 -5.5146 6.8128 6.8128 9.4747 9.4747 10.7364 10.7364 11.7884 11.7884 12.5445 12.5445 12.9429 12.9429 13.0085 13.0085 13.3325 13.3325 13.3958 13.3958 13.5026 13.5026 13.5746 13.5746 13.7702 13.7702 14.8174 14.8174 14.9499 14.9499 16.1478 16.1478 16.2842 16.2842 16.5993 16.5993 17.1638 17.1638 17.2997 17.2997 k = 0.5000 0.1326 0.4248 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0082 -18.0082 -18.0039 -18.0039 -6.5523 -6.5523 -6.5498 -6.5498 -5.5323 -5.5323 -5.5214 -5.5214 -5.5143 -5.5143 6.7900 6.7900 9.4221 9.4221 10.7967 10.7967 11.7849 11.7849 12.5609 12.5609 12.9437 12.9437 13.0095 13.0095 13.3327 13.3327 13.3985 13.3985 13.4931 13.4931 13.5725 13.5725 13.7644 13.7644 14.8363 14.8363 14.9791 14.9791 16.1673 16.1673 16.3001 16.3001 16.5988 16.5988 17.2334 17.2334 17.3580 17.3580 k = 0.5000 0.1404 0.4138 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0083 -18.0083 -18.0038 -18.0038 -6.5523 -6.5523 -6.5497 -6.5497 -5.5323 -5.5323 -5.5215 -5.5215 -5.5141 -5.5141 6.7675 6.7675 9.3708 9.3708 10.8576 10.8576 11.7790 11.7790 12.5791 12.5791 12.9444 12.9444 13.0100 13.0100 13.3305 13.3305 13.4015 13.4015 13.4830 13.4830 13.5722 13.5722 13.7581 13.7581 14.8560 14.8560 15.0072 15.0072 16.1893 16.1893 16.3158 16.3158 16.5978 16.5978 17.3078 17.3078 17.4194 17.4194 k = 0.5000 0.1482 0.4027 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0083 -18.0083 -18.0036 -18.0036 -6.5523 -6.5523 -6.5496 -6.5496 -5.5323 -5.5323 -5.5217 -5.5217 -5.5139 -5.5139 6.7455 6.7455 9.3212 9.3212 10.9186 10.9186 11.7712 11.7712 12.5988 12.5988 12.9452 12.9452 13.0101 13.0101 13.3258 13.3258 13.4042 13.4042 13.4737 13.4737 13.5728 13.5728 13.7514 13.7514 14.8767 14.8767 15.0340 15.0340 16.2135 16.2135 16.3314 16.3314 16.5966 16.5966 17.3871 17.3871 17.4838 17.4838 k = 0.5000 0.1560 0.3917 ( 4598 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0084 -18.0084 -18.0035 -18.0035 -6.5524 -6.5524 -6.5495 -6.5495 -5.5323 -5.5323 -5.5218 -5.5218 -5.5137 -5.5137 6.7239 6.7239 9.2734 9.2734 10.9794 10.9794 11.7619 11.7619 12.6197 12.6197 12.9461 12.9461 13.0100 13.0100 13.3187 13.3187 13.4058 13.4058 13.4662 13.4662 13.5739 13.5739 13.7441 13.7441 14.8982 14.8982 15.0591 15.0591 16.2396 16.2396 16.3469 16.3469 16.5951 16.5951 17.4714 17.4714 17.5508 17.5508 k = 0.5000 0.1638 0.3807 ( 4588 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0085 -18.0085 -18.0033 -18.0033 -6.5524 -6.5524 -6.5495 -6.5495 -5.5323 -5.5323 -5.5220 -5.5220 -5.5134 -5.5134 6.7031 6.7031 9.2276 9.2276 11.0396 11.0396 11.7514 11.7514 12.6414 12.6414 12.9470 12.9470 13.0096 13.0096 13.3096 13.3096 13.4052 13.4052 13.4614 13.4614 13.5754 13.5754 13.7364 13.7364 14.9206 14.9206 15.0821 15.0821 16.2673 16.2673 16.3624 16.3624 16.5934 16.5934 17.5606 17.5606 17.6199 17.6199 k = 0.5000 0.1716 0.3696 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0085 -18.0085 -18.0032 -18.0032 -6.5525 -6.5525 -6.5494 -6.5494 -5.5324 -5.5324 -5.5221 -5.5221 -5.5132 -5.5132 6.6831 6.6831 9.1840 9.1840 11.0987 11.0987 11.7403 11.7403 12.6636 12.6636 12.9481 12.9481 13.0092 13.0092 13.2990 13.2990 13.4014 13.4014 13.4599 13.4599 13.5772 13.5772 13.7285 13.7285 14.9437 14.9437 15.1030 15.1030 16.2959 16.2959 16.3779 16.3779 16.5917 16.5917 17.6541 17.6541 17.6910 17.6910 k = 0.5000 0.1794 0.3586 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0086 -18.0086 -18.0031 -18.0031 -6.5525 -6.5525 -6.5493 -6.5493 -5.5324 -5.5324 -5.5222 -5.5222 -5.5130 -5.5130 6.6639 6.6639 9.1426 9.1426 11.1563 11.1563 11.7288 11.7288 12.6862 12.6862 12.9494 12.9494 13.0087 13.0087 13.2872 13.2872 13.3946 13.3946 13.4611 13.4611 13.5794 13.5794 13.7203 13.7203 14.9676 14.9676 15.1216 15.1216 16.3251 16.3251 16.3935 16.3935 16.5899 16.5899 17.7465 17.7465 17.7681 17.7681 k = 0.5000 0.1872 0.3476 ( 4582 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0086 -18.0086 -18.0029 -18.0029 -6.5525 -6.5525 -6.5492 -6.5492 -5.5325 -5.5325 -5.5223 -5.5223 -5.5127 -5.5127 6.6457 6.6457 9.1036 9.1036 11.2121 11.2121 11.7171 11.7171 12.7089 12.7089 12.9510 12.9510 13.0083 13.0083 13.2747 13.2747 13.3853 13.3853 13.4640 13.4640 13.5818 13.5818 13.7120 13.7120 14.9919 14.9919 15.1381 15.1381 16.3542 16.3542 16.4092 16.4092 16.5882 16.5882 17.8220 17.8220 17.8654 17.8654 k = 0.5000 0.1951 0.3365 ( 4588 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0087 -18.0087 -18.0028 -18.0028 -6.5526 -6.5526 -6.5491 -6.5491 -5.5325 -5.5325 -5.5224 -5.5224 -5.5125 -5.5125 6.6286 6.6286 9.0671 9.0671 11.2655 11.2655 11.7057 11.7057 12.7314 12.7314 12.9530 12.9530 13.0079 13.0079 13.2619 13.2619 13.3743 13.3743 13.4676 13.4676 13.5846 13.5846 13.7038 13.7038 15.0165 15.0165 15.1524 15.1524 16.3827 16.3827 16.4251 16.4251 16.5864 16.5864 17.8872 17.8872 17.9737 17.9737 k = 0.5000 0.2029 0.3255 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0087 -18.0087 -18.0027 -18.0027 -6.5526 -6.5526 -6.5491 -6.5491 -5.5326 -5.5326 -5.5225 -5.5225 -5.5123 -5.5123 6.6126 6.6126 9.0333 9.0333 11.3162 11.3162 11.6947 11.6947 12.7535 12.7535 12.9555 12.9555 13.0078 13.0078 13.2489 13.2489 13.3621 13.3621 13.4713 13.4713 13.5875 13.5875 13.6958 13.6958 15.0411 15.0411 15.1648 15.1648 16.4102 16.4102 16.4413 16.4413 16.5848 16.5848 17.9436 17.9436 18.0874 18.0874 k = 0.5000 0.2107 0.3145 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0026 -18.0026 -6.5526 -6.5526 -6.5490 -6.5490 -5.5327 -5.5327 -5.5226 -5.5226 -5.5121 -5.5121 6.5979 6.5979 9.0021 9.0021 11.3638 11.3638 11.6844 11.6844 12.7749 12.7749 12.9587 12.9587 13.0078 13.0078 13.2359 13.2359 13.3489 13.3489 13.4747 13.4747 13.5907 13.5907 13.6882 13.6882 15.0655 15.0655 15.1754 15.1754 16.4359 16.4359 16.4579 16.4579 16.5832 16.5832 17.9875 17.9875 18.2054 18.2054 k = 0.5000 0.2185 0.3034 ( 4582 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0025 -18.0025 -6.5527 -6.5527 -6.5489 -6.5489 -5.5327 -5.5327 -5.5226 -5.5226 -5.5119 -5.5119 6.5843 6.5843 8.9737 8.9737 11.4078 11.4078 11.6749 11.6749 12.7953 12.7953 12.9627 12.9627 13.0081 13.0081 13.2230 13.2230 13.3351 13.3351 13.4776 13.4776 13.5939 13.5939 13.6811 13.6811 15.0893 15.0893 15.1843 15.1843 16.4594 16.4594 16.4752 16.4752 16.5818 16.5818 18.0144 18.0144 18.3270 18.3270 k = 0.5000 0.2263 0.2924 ( 4576 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0024 -18.0024 -6.5527 -6.5527 -6.5489 -6.5489 -5.5328 -5.5328 -5.5227 -5.5227 -5.5117 -5.5117 6.5721 6.5721 8.9481 8.9481 11.4477 11.4477 11.6666 11.6666 12.8143 12.8143 12.9677 12.9677 13.0087 13.0087 13.2103 13.2103 13.3210 13.3210 13.4798 13.4798 13.5971 13.5971 13.6747 13.6747 15.1122 15.1122 15.1918 15.1918 16.4801 16.4801 16.4931 16.4931 16.5806 16.5806 18.0224 18.0224 18.4516 18.4516 k = 0.5000 0.2341 0.2814 ( 4580 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0089 -18.0089 -18.0023 -18.0023 -6.5527 -6.5527 -6.5488 -6.5488 -5.5329 -5.5329 -5.5227 -5.5227 -5.5116 -5.5116 6.5612 6.5612 8.9254 8.9254 11.4831 11.4831 11.6597 11.6597 12.8315 12.8315 12.9739 12.9739 13.0096 13.0096 13.1977 13.1977 13.3069 13.3069 13.4813 13.4813 13.6001 13.6001 13.6691 13.6691 15.1336 15.1336 15.1979 15.1979 16.4980 16.4980 16.5110 16.5110 16.5796 16.5796 18.0135 18.0135 18.5784 18.5784 k = 0.5000 0.2419 0.2703 ( 4578 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0022 -18.0022 -6.5528 -6.5528 -6.5488 -6.5488 -5.5329 -5.5329 -5.5228 -5.5228 -5.5115 -5.5115 6.5517 6.5517 8.9056 8.9056 11.5135 11.5135 11.6545 11.6545 12.8466 12.8466 12.9815 12.9815 13.0110 13.0110 13.1853 13.1853 13.2933 13.2933 13.4822 13.4822 13.6030 13.6030 13.6643 13.6643 15.1532 15.1532 15.2030 15.2030 16.5140 16.5140 16.5276 16.5276 16.5790 16.5790 17.9927 17.9927 18.7062 18.7062 k = 0.5000 0.2497 0.2593 ( 4582 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0022 -18.0022 -6.5528 -6.5528 -6.5488 -6.5488 -5.5330 -5.5330 -5.5228 -5.5228 -5.5113 -5.5113 6.5436 6.5436 8.8888 8.8888 11.5383 11.5383 11.6513 11.6513 12.8592 12.8592 12.9903 12.9903 13.0127 13.0127 13.1730 13.1730 13.2805 13.2805 13.4826 13.4826 13.6055 13.6055 13.6603 13.6603 15.1706 15.1706 15.2071 15.2071 16.5284 16.5284 16.5419 16.5419 16.5789 16.5789 17.9661 17.9661 18.8338 18.8338 k = 0.5000 0.2575 0.2483 ( 4588 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0021 -18.0021 -6.5528 -6.5528 -6.5487 -6.5487 -5.5330 -5.5330 -5.5228 -5.5228 -5.5112 -5.5112 6.5369 6.5369 8.8751 8.8751 11.5570 11.5570 11.6506 11.6506 12.8691 12.8691 12.9994 12.9994 13.0154 13.0154 13.1611 13.1611 13.2690 13.2690 13.4825 13.4825 13.6077 13.6077 13.6572 13.6572 15.1854 15.1854 15.2105 15.2105 16.5409 16.5409 16.5532 16.5532 16.5796 16.5796 17.9385 17.9385 18.9593 18.9593 k = 0.5000 0.2653 0.2372 ( 4590 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0021 -18.0021 -6.5528 -6.5528 -6.5487 -6.5487 -5.5330 -5.5330 -5.5228 -5.5228 -5.5112 -5.5112 6.5317 6.5317 8.8643 8.8643 11.5697 11.5697 11.6520 11.6520 12.8765 12.8765 13.0067 13.0067 13.0203 13.0203 13.1498 13.1498 13.2595 13.2595 13.4823 13.4823 13.6095 13.6095 13.6548 13.6548 15.1969 15.1969 15.2132 15.2132 16.5511 16.5511 16.5611 16.5611 16.5815 16.5815 17.9137 17.9137 19.0798 19.0798 k = 0.5000 0.2731 0.2262 ( 4594 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5280 6.5280 8.8566 8.8566 11.5772 11.5772 11.6547 11.6547 12.8815 12.8815 13.0105 13.0105 13.0277 13.0277 13.1398 13.1398 13.2522 13.2522 13.4820 13.4820 13.6108 13.6108 13.6532 13.6532 15.2049 15.2049 15.2157 15.2157 16.5585 16.5585 16.5657 16.5657 16.5842 16.5842 17.8942 17.8942 19.1892 19.1892 k = 0.5000 0.2809 0.2152 ( 4588 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5258 6.5258 8.8520 8.8520 11.5809 11.5809 11.6571 11.6571 12.8844 12.8844 13.0121 13.0121 13.0344 13.0344 13.1325 13.1325 13.2477 13.2477 13.4817 13.4817 13.6116 13.6116 13.6523 13.6523 15.2090 15.2090 15.2179 15.2179 16.5625 16.5625 16.5684 16.5684 16.5866 16.5866 17.8818 17.8818 19.2674 19.2674 k = 0.5000 0.2887 0.2041 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5250 6.5250 8.8504 8.8504 11.5820 11.5820 11.6581 11.6581 12.8854 12.8854 13.0126 13.0126 13.0371 13.0371 13.1298 13.1298 13.2462 13.2462 13.4816 13.4816 13.6119 13.6119 13.6520 13.6520 15.2102 15.2102 15.2188 15.2188 16.5636 16.5636 16.5694 16.5694 16.5875 16.5875 17.8775 17.8775 19.2938 19.2938 k = 0.5000 0.2887 0.2041 ( 4584 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5250 6.5250 8.8504 8.8504 11.5820 11.5820 11.6581 11.6581 12.8854 12.8854 13.0126 13.0126 13.0371 13.0371 13.1298 13.1298 13.2462 13.2462 13.4816 13.4816 13.6119 13.6119 13.6520 13.6520 15.2102 15.2102 15.2188 15.2188 16.5636 16.5636 16.5694 16.5694 16.5875 16.5875 17.8775 17.8775 19.2938 19.2938 k = 0.4961 0.2864 0.2169 ( 4587 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5258 6.5258 8.8520 8.8520 11.5809 11.5809 11.6571 11.6571 12.8844 12.8844 13.0121 13.0121 13.0344 13.0344 13.1325 13.1325 13.2477 13.2477 13.4817 13.4817 13.6116 13.6116 13.6523 13.6523 15.2090 15.2090 15.2179 15.2179 16.5624 16.5624 16.5684 16.5684 16.5866 16.5866 17.8818 17.8818 19.2674 19.2674 k = 0.4922 0.2842 0.2296 ( 4595 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0020 -18.0020 -6.5528 -6.5528 -6.5487 -6.5487 -5.5331 -5.5331 -5.5229 -5.5229 -5.5111 -5.5111 6.5280 6.5280 8.8566 8.8566 11.5772 11.5772 11.6547 11.6547 12.8815 12.8815 13.0105 13.0105 13.0277 13.0277 13.1398 13.1398 13.2522 13.2522 13.4820 13.4820 13.6108 13.6108 13.6532 13.6532 15.2048 15.2048 15.2157 15.2157 16.5582 16.5582 16.5660 16.5660 16.5841 16.5841 17.8942 17.8942 19.1909 19.1909 k = 0.4883 0.2819 0.2424 ( 4594 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0090 -18.0090 -18.0021 -18.0021 -6.5528 -6.5528 -6.5487 -6.5487 -5.5330 -5.5330 -5.5228 -5.5228 -5.5112 -5.5112 6.5317 6.5317 8.8643 8.8643 11.5696 11.5696 11.6520 11.6520 12.8765 12.8765 13.0065 13.0065 13.0205 13.0205 13.1498 13.1498 13.2595 13.2595 13.4823 13.4823 13.6095 13.6095 13.6548 13.6548 15.1968 15.1968 15.2133 15.2133 16.5497 16.5497 16.5632 16.5632 16.5807 16.5807 17.9137 17.9137 19.0858 19.0858 k = 0.4844 0.2797 0.2552 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0021 -18.0021 -6.5528 -6.5528 -6.5487 -6.5487 -5.5330 -5.5330 -5.5228 -5.5228 -5.5112 -5.5112 6.5370 6.5370 8.8751 8.8751 11.5569 11.5569 11.6506 11.6506 12.8691 12.8691 12.9985 12.9985 13.0163 13.0163 13.1611 13.1611 13.2691 13.2691 13.4825 13.4825 13.6077 13.6077 13.6572 13.6572 15.1851 15.1851 15.2106 15.2106 16.5369 16.5369 16.5600 16.5600 16.5767 16.5767 17.9386 17.9386 18.9741 18.9741 k = 0.4805 0.2774 0.2679 ( 4582 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0022 -18.0022 -6.5528 -6.5528 -6.5488 -6.5488 -5.5330 -5.5330 -5.5228 -5.5228 -5.5113 -5.5113 6.5436 6.5436 8.8889 8.8889 11.5380 11.5380 11.6515 11.6515 12.8592 12.8592 12.9883 12.9883 13.0147 13.0147 13.1729 13.1729 13.2805 13.2805 13.4826 13.4826 13.6056 13.6056 13.6603 13.6603 15.1701 15.1701 15.2076 15.2076 16.5203 16.5203 16.5562 16.5562 16.5725 16.5725 17.9659 17.9659 18.8637 18.8637 k = 0.4766 0.2751 0.2807 ( 4583 PWs) bands (ev): -41.9589 -41.9589 -18.6591 -18.6591 -18.0089 -18.0089 -18.0022 -18.0022 -6.5528 -6.5528 -6.5488 -6.5488 -5.5329 -5.5329 -5.5228 -5.5228 -5.5115 -5.5115 6.5518 6.5518 8.9058 8.9058 11.5130 11.5130 11.6548 11.6548 12.8467 12.8467 12.9779 12.9779 13.0146 13.0146 13.1850 13.1850 13.2933 13.2933 13.4823 13.4823 13.6030 13.6030 13.6642 13.6642 15.1522 15.1522 15.2040 15.2040 16.5002 16.5002 16.5519 16.5519 16.5682 16.5682 17.9916 17.9916 18.7604 18.7604 k = 0.4727 0.2729 0.2934 ( 4581 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0089 -18.0089 -18.0023 -18.0023 -6.5527 -6.5527 -6.5488 -6.5488 -5.5329 -5.5329 -5.5227 -5.5227 -5.5116 -5.5116 6.5613 6.5613 8.9256 8.9256 11.4822 11.4822 11.6604 11.6604 12.8319 12.8319 12.9680 12.9680 13.0158 13.0158 13.1971 13.1971 13.3069 13.3069 13.4814 13.4814 13.6002 13.6002 13.6690 13.6690 15.1318 15.1318 15.1998 15.1998 16.4769 16.4769 16.5470 16.5470 16.5642 16.5642 18.0092 18.0092 18.6687 18.6687 k = 0.4688 0.2706 0.3062 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0024 -18.0024 -6.5527 -6.5527 -6.5489 -6.5489 -5.5328 -5.5328 -5.5227 -5.5227 -5.5118 -5.5118 6.5722 6.5722 8.9484 8.9484 11.4462 11.4462 11.6679 11.6679 12.8148 12.8148 12.9588 12.9588 13.0181 13.0181 13.2092 13.2092 13.3207 13.3207 13.4801 13.4801 13.5972 13.5972 13.6745 13.6745 15.1093 15.1093 15.1950 15.1950 16.4507 16.4507 16.5415 16.5415 16.5606 16.5606 18.0104 18.0104 18.5839 18.5839 k = 0.4648 0.2684 0.3189 ( 4592 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0025 -18.0025 -6.5527 -6.5527 -6.5489 -6.5489 -5.5327 -5.5327 -5.5226 -5.5226 -5.5119 -5.5119 6.5845 6.5845 8.9740 8.9740 11.4054 11.4054 11.6770 11.6770 12.7960 12.7960 12.9502 12.9502 13.0216 13.0216 13.2213 13.2213 13.3344 13.3344 13.4782 13.4782 13.5942 13.5942 13.6807 13.6807 15.0850 15.0850 15.1895 15.1895 16.4216 16.4216 16.5356 16.5356 16.5577 16.5577 17.9876 17.9876 18.4891 18.4891 k = 0.4609 0.2661 0.3317 ( 4586 PWs) bands (ev): -41.9589 -41.9589 -18.6592 -18.6592 -18.0088 -18.0088 -18.0026 -18.0026 -6.5526 -6.5526 -6.5490 -6.5490 -5.5327 -5.5327 -5.5226 -5.5226 -5.5121 -5.5121 6.5980 6.5980 9.0025 9.0025 11.3604 11.3604 11.6876 11.6876 12.7757 12.7757 12.9421 12.9421 13.0263 13.0263 13.2333 13.2333 13.3476 13.3476 13.4758 13.4758 13.5913 13.5913 13.6875 13.6875 15.0594 15.0594 15.1833 15.1833 16.3896 16.3896 16.5294 16.5294 16.5558 16.5558 17.9396 17.9396 18.3904 18.3904 k = 0.4570 0.2639 0.3445 ( 4590 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0087 -18.0087 -18.0027 -18.0027 -6.5526 -6.5526 -6.5491 -6.5491 -5.5326 -5.5326 -5.5225 -5.5225 -5.5123 -5.5123 6.6128 6.6128 9.0338 9.0338 11.3114 11.3114 11.6996 11.6996 12.7543 12.7543 12.9345 12.9345 13.0320 13.0320 13.2453 13.2453 13.3597 13.3597 13.4731 13.4731 13.5886 13.5886 13.6947 13.6947 15.0328 15.0328 15.1764 15.1764 16.3548 16.3548 16.5229 16.5229 16.5550 16.5550 17.8727 17.8727 18.2921 18.2921 k = 0.4531 0.2616 0.3572 ( 4588 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0087 -18.0087 -18.0028 -18.0028 -6.5526 -6.5526 -6.5491 -6.5491 -5.5325 -5.5325 -5.5224 -5.5224 -5.5125 -5.5125 6.6288 6.6288 9.0677 9.0677 11.2589 11.2589 11.7127 11.7127 12.7320 12.7320 12.9271 12.9271 13.0387 13.0387 13.2570 13.2570 13.3704 13.3704 13.4704 13.4704 13.5862 13.5862 13.7022 13.7022 15.0056 15.0056 15.1688 15.1688 16.3173 16.3173 16.5163 16.5163 16.5554 16.5554 17.7953 17.7953 18.1952 18.1952 k = 0.4492 0.2594 0.3700 ( 4590 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0086 -18.0086 -18.0029 -18.0029 -6.5525 -6.5525 -6.5492 -6.5492 -5.5325 -5.5325 -5.5223 -5.5223 -5.5127 -5.5127 6.6459 6.6459 9.1042 9.1042 11.2032 11.2032 11.7270 11.7270 12.7090 12.7090 12.9201 12.9201 13.0461 13.0461 13.2686 13.2686 13.3794 13.3794 13.4678 13.4678 13.5845 13.5845 13.7097 13.7097 14.9780 14.9780 15.1604 15.1604 16.2772 16.2772 16.5098 16.5098 16.5570 16.5570 17.7137 17.7137 18.1001 18.1001 k = 0.4453 0.2571 0.3827 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6593 -18.6593 -18.0086 -18.0086 -18.0030 -18.0030 -6.5525 -6.5525 -6.5493 -6.5493 -5.5324 -5.5324 -5.5223 -5.5223 -5.5129 -5.5129 6.6641 6.6641 9.1432 9.1432 11.1447 11.1447 11.7423 11.7423 12.6855 12.6855 12.9134 12.9134 13.0542 13.0542 13.2798 13.2798 13.3864 13.3864 13.4657 13.4657 13.5835 13.5835 13.7171 13.7171 14.9505 14.9505 15.1513 15.1513 16.2347 16.2347 16.5035 16.5035 16.5598 16.5598 17.6319 17.6319 18.0069 18.0069 k = 0.4414 0.2548 0.3955 ( 4589 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0085 -18.0085 -18.0032 -18.0032 -6.5525 -6.5525 -6.5494 -6.5494 -5.5324 -5.5324 -5.5222 -5.5222 -5.5131 -5.5131 6.6832 6.6832 9.1846 9.1846 11.0838 11.0838 11.7585 11.7585 12.6617 12.6617 12.9070 12.9070 13.0626 13.0626 13.2904 13.2904 13.3914 13.3914 13.4640 13.4640 13.5834 13.5834 13.7242 13.7242 14.9232 14.9232 15.1414 15.1414 16.1900 16.1900 16.4975 16.4975 16.5639 16.5639 17.5523 17.5523 17.9156 17.9156 k = 0.4375 0.2526 0.4082 ( 4579 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0085 -18.0085 -18.0033 -18.0033 -6.5524 -6.5524 -6.5494 -6.5494 -5.5323 -5.5323 -5.5220 -5.5220 -5.5134 -5.5134 6.7032 6.7032 9.2283 9.2283 11.0208 11.0208 11.7757 11.7757 12.6376 12.6376 12.9010 12.9010 13.0713 13.0713 13.3002 13.3002 13.3947 13.3947 13.4627 13.4627 13.5845 13.5845 13.7309 13.7309 14.8965 14.8965 15.1308 15.1308 16.1435 16.1435 16.4920 16.4920 16.5691 16.5691 17.4762 17.4762 17.8264 17.8264 k = 0.4336 0.2503 0.4210 ( 4593 PWs) bands (ev): -41.9589 -41.9589 -18.6594 -18.6594 -18.0084 -18.0084 -18.0034 -18.0034 -6.5524 -6.5524 -6.5495 -6.5495 -5.5323 -5.5323 -5.5219 -5.5219 -5.5136 -5.5136 6.7239 6.7239 9.2740 9.2740 10.9561 10.9561 11.7937 11.7937 12.6134 12.6134 12.8953 12.8953 13.0799 13.0799 13.3089 13.3089 13.3969 13.3969 13.4614 13.4614 13.5867 13.5867 13.7370 13.7370 14.8705 14.8705 15.1194 15.1194 16.0956 16.0956 16.4872 16.4872 16.5754 16.5754 17.4043 17.4043 17.7391 17.7391 k = 0.4297 0.2481 0.4338 ( 4591 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0084 -18.0084 -18.0036 -18.0036 -6.5524 -6.5524 -6.5496 -6.5496 -5.5323 -5.5323 -5.5218 -5.5218 -5.5138 -5.5138 6.7452 6.7452 9.3216 9.3216 10.8903 10.8903 11.8124 11.8124 12.5893 12.5893 12.8899 12.8899 13.0882 13.0882 13.3161 13.3161 13.3988 13.3988 13.4601 13.4601 13.5900 13.5900 13.7425 13.7425 14.8455 14.8455 15.1073 15.1073 16.0468 16.0468 16.4831 16.4831 16.5828 16.5828 17.3372 17.3372 17.6538 17.6538 k = 0.4258 0.2458 0.4465 ( 4589 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0083 -18.0083 -18.0037 -18.0037 -6.5524 -6.5524 -6.5497 -6.5497 -5.5323 -5.5323 -5.5217 -5.5217 -5.5140 -5.5140 6.7669 6.7669 9.3708 9.3708 10.8236 10.8236 11.8319 11.8319 12.5653 12.5653 12.8850 12.8850 13.0959 13.0959 13.3218 13.3218 13.4007 13.4007 13.4587 13.4587 13.5942 13.5942 13.7474 13.7474 14.8216 14.8216 15.0945 15.0945 15.9975 15.9975 16.4799 16.4799 16.5911 16.5911 17.2748 17.2748 17.5706 17.5706 k = 0.4219 0.2436 0.4593 ( 4585 PWs) bands (ev): -41.9588 -41.9588 -18.6595 -18.6595 -18.0083 -18.0083 -18.0038 -18.0038 -6.5523 -6.5523 -6.5498 -6.5498 -5.5323 -5.5323 -5.5216 -5.5216 -5.5142 -5.5142 6.7890 6.7890 9.4213 9.4213 10.7568 10.7568 11.8519 11.8519 12.5415 12.5415 12.8804 12.8804 13.1028 13.1028 13.3257 13.3257 13.4028 13.4028 13.4576 13.4576 13.5991 13.5991 13.7516 13.7516 14.7991 14.7991 15.0810 15.0810 15.9484 15.9484 16.4778 16.4778 16.6003 16.6003 17.2172 17.2172 17.4894 17.4894 k = 0.4180 0.2413 0.4720 ( 4584 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0082 -18.0082 -18.0040 -18.0040 -6.5523 -6.5523 -6.5498 -6.5498 -5.5323 -5.5323 -5.5215 -5.5215 -5.5143 -5.5143 6.8112 6.8112 9.4728 9.4728 10.6904 10.6904 11.8724 11.8724 12.5181 12.5181 12.8762 12.8762 13.1086 13.1086 13.3281 13.3281 13.4043 13.4043 13.4577 13.4577 13.6045 13.6045 13.7551 13.7551 14.7780 14.7780 15.0667 15.0667 15.8999 15.8999 16.4767 16.4767 16.6101 16.6101 17.1645 17.1645 17.4102 17.4102 k = 0.4141 0.2391 0.4848 ( 4588 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0082 -18.0082 -18.0041 -18.0041 -6.5523 -6.5523 -6.5499 -6.5499 -5.5324 -5.5324 -5.5214 -5.5214 -5.5145 -5.5145 6.8333 6.8333 9.5247 9.5247 10.6251 10.6251 11.8934 11.8934 12.4953 12.4953 12.8724 12.8724 13.1131 13.1131 13.3293 13.3293 13.4044 13.4044 13.4597 13.4597 13.6100 13.6100 13.7581 13.7581 14.7585 14.7585 15.0519 15.0519 15.8526 15.8526 16.4769 16.4769 16.6204 16.6204 17.1163 17.1163 17.3330 17.3330 k = 0.4102 0.2368 0.4976 ( 4590 PWs) bands (ev): -41.9588 -41.9588 -18.6596 -18.6596 -18.0081 -18.0081 -18.0042 -18.0042 -6.5523 -6.5523 -6.5499 -6.5499 -5.5324 -5.5324 -5.5213 -5.5213 -5.5146 -5.5146 6.8551 6.8551 9.5763 9.5763 10.5620 10.5620 11.9147 11.9147 12.4731 12.4731 12.8690 12.8690 13.1161 13.1161 13.3298 13.3298 13.4022 13.4022 13.4642 13.4642 13.6154 13.6154 13.7607 13.7607 14.7407 14.7407 15.0364 15.0364 15.8068 15.8068 16.4783 16.4783 16.6309 16.6309 17.0729 17.0729 17.2579 17.2579 k = 0.4062 0.2345 0.5103 ( 4588 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0043 -18.0043 -6.5524 -6.5524 -6.5500 -6.5500 -5.5325 -5.5325 -5.5212 -5.5212 -5.5147 -5.5147 6.8763 6.8763 9.6266 9.6266 10.5023 10.5023 11.9363 11.9363 12.4517 12.4517 12.8660 12.8660 13.1177 13.1177 13.3298 13.3298 13.3980 13.3980 13.4710 13.4710 13.6206 13.6206 13.7630 13.7630 14.7247 14.7247 15.0203 15.0203 15.7630 15.7630 16.4811 16.4811 16.6413 16.6413 17.0341 17.0341 17.1850 17.1850 k = 0.4023 0.2323 0.5231 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0044 -18.0044 -6.5524 -6.5524 -6.5500 -6.5500 -5.5326 -5.5326 -5.5212 -5.5212 -5.5147 -5.5147 6.8967 6.8967 9.6741 9.6741 10.4477 10.4477 11.9581 11.9581 12.4313 12.4313 12.8633 12.8633 13.1176 13.1176 13.3294 13.3294 13.3920 13.3920 13.4794 13.4794 13.6254 13.6254 13.7654 13.7654 14.7105 14.7105 15.0037 15.0037 15.7214 15.7214 16.4853 16.4853 16.6513 16.6513 17.0001 17.0001 17.1142 17.1142 k = 0.3984 0.2300 0.5358 ( 4590 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0044 -18.0044 -6.5524 -6.5524 -6.5500 -6.5500 -5.5326 -5.5326 -5.5211 -5.5211 -5.5148 -5.5148 6.9159 6.9159 9.7168 9.7168 10.4005 10.4005 11.9799 11.9799 12.4121 12.4121 12.8611 12.8611 13.1161 13.1161 13.3285 13.3285 13.3849 13.3849 13.4888 13.4888 13.6296 13.6296 13.7680 13.7680 14.6982 14.6982 14.9865 14.9865 15.6824 15.6824 16.4909 16.4909 16.6602 16.6602 16.9711 16.9711 17.0458 17.0458 k = 0.3945 0.2278 0.5486 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0081 -18.0081 -18.0045 -18.0045 -6.5525 -6.5525 -6.5500 -6.5500 -5.5327 -5.5327 -5.5211 -5.5211 -5.5148 -5.5148 6.9336 6.9336 9.7519 9.7519 10.3640 10.3640 12.0016 12.0016 12.3942 12.3942 12.8592 12.8592 13.1132 13.1132 13.3270 13.3270 13.3770 13.3770 13.4988 13.4988 13.6331 13.6331 13.7712 13.7712 14.6878 14.6878 14.9689 14.9689 15.6460 15.6460 16.4979 16.4979 16.6676 16.6676 16.9474 16.9474 16.9800 16.9800 k = 0.3906 0.2255 0.5613 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5525 -6.5525 -6.5500 -6.5500 -5.5329 -5.5329 -5.5211 -5.5211 -5.5148 -5.5148 6.9495 6.9495 9.7761 9.7761 10.3417 10.3417 12.0232 12.0232 12.3778 12.3778 12.8576 12.8576 13.1090 13.1090 13.3249 13.3249 13.3687 13.3687 13.5091 13.5091 13.6358 13.6358 13.7754 13.7754 14.6794 14.6794 14.9509 14.9509 15.6123 15.6123 16.5063 16.5063 16.6727 16.6727 16.9140 16.9140 16.9325 16.9325 k = 0.3867 0.2233 0.5741 ( 4586 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5526 -6.5526 -6.5500 -6.5500 -5.5330 -5.5330 -5.5211 -5.5211 -5.5148 -5.5148 6.9631 6.9631 9.7866 9.7866 10.3366 10.3366 12.0446 12.0446 12.3630 12.3630 12.8563 12.8563 13.1036 13.1036 13.3220 13.3220 13.3602 13.3602 13.5194 13.5194 13.6375 13.6375 13.7806 13.7806 14.6729 14.6729 14.9324 14.9324 15.5813 15.5813 16.5159 16.5159 16.6749 16.6749 16.8542 16.8542 16.9207 16.9207 k = 0.3828 0.2210 0.5869 ( 4594 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5527 -6.5527 -6.5500 -6.5500 -5.5331 -5.5331 -5.5211 -5.5211 -5.5147 -5.5147 6.9741 6.9741 9.7830 9.7830 10.3496 10.3496 12.0655 12.0655 12.3500 12.3500 12.8553 12.8553 13.0971 13.0971 13.3183 13.3183 13.3517 13.3517 13.5296 13.5296 13.6383 13.6383 13.7871 13.7871 14.6683 14.6683 14.9137 14.9137 15.5530 15.5530 16.5265 16.5265 16.6742 16.6742 16.7965 16.7965 16.9164 16.9164 k = 0.3789 0.2188 0.5996 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0046 -18.0046 -6.5528 -6.5528 -6.5500 -6.5500 -5.5333 -5.5333 -5.5211 -5.5211 -5.5147 -5.5147 6.9820 6.9820 9.7676 9.7676 10.3787 10.3787 12.0860 12.0860 12.3390 12.3390 12.8545 12.8545 13.0894 13.0894 13.3137 13.3137 13.3435 13.3435 13.5395 13.5395 13.6384 13.6384 13.7948 13.7948 14.6656 14.6656 14.8946 14.8946 15.5273 15.5273 16.5372 16.5372 16.6709 16.6709 16.7428 16.7428 16.9184 16.9184 k = 0.3750 0.2165 0.6124 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9864 6.9864 9.7443 9.7443 10.4203 10.4203 12.1059 12.1059 12.3300 12.3300 12.8538 12.8538 13.0805 13.0805 13.3084 13.3084 13.3358 13.3358 13.5491 13.5491 13.6377 13.6377 13.8039 13.8039 14.6648 14.6648 14.8752 14.8752 15.5041 15.5041 16.5460 16.5460 16.6657 16.6657 16.6953 16.6953 16.9257 16.9257 k = 0.6250-0.0722 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0081 -18.0081 -18.0045 -18.0045 -6.5529 -6.5529 -6.5500 -6.5500 -5.5334 -5.5334 -5.5211 -5.5211 -5.5146 -5.5146 6.9864 6.9864 9.7443 9.7443 10.4203 10.4203 12.1059 12.1059 12.3300 12.3300 12.8538 12.8538 13.0805 13.0805 13.3084 13.3084 13.3358 13.3358 13.5491 13.5491 13.6377 13.6377 13.8039 13.8039 14.6648 14.6648 14.8752 14.8752 15.5041 15.5041 16.5460 16.5460 16.6657 16.6657 16.6953 16.6953 16.9257 16.9257 k = 0.6184-0.0836 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0082 -18.0082 -18.0045 -18.0045 -6.5531 -6.5531 -6.5499 -6.5499 -5.5337 -5.5337 -5.5212 -5.5212 -5.5145 -5.5145 6.9895 6.9895 9.7018 9.7018 10.5009 10.5009 12.1388 12.1388 12.3170 12.3170 12.8529 12.8529 13.0637 13.0637 13.2983 13.2983 13.3237 13.3237 13.5646 13.5646 13.6372 13.6372 13.8200 13.8200 14.6649 14.6649 14.8424 14.8424 15.4679 15.4679 16.5562 16.5562 16.6238 16.6238 16.6579 16.6579 16.9419 16.9419 k = 0.6118-0.0950 0.4082 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0082 -18.0082 -18.0044 -18.0044 -6.5533 -6.5533 -6.5499 -6.5499 -5.5339 -5.5339 -5.5212 -5.5212 -5.5144 -5.5144 6.9903 6.9903 9.6613 9.6613 10.5853 10.5853 12.1717 12.1717 12.3046 12.3046 12.8526 12.8526 13.0451 13.0451 13.2871 13.2871 13.3121 13.3121 13.5793 13.5793 13.6392 13.6392 13.8358 13.8358 14.6647 14.6647 14.8095 14.8095 15.4336 15.4336 16.5472 16.5472 16.5743 16.5743 16.6510 16.6510 16.9578 16.9578 k = 0.6053-0.1064 0.4082 ( 4600 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0083 -18.0083 -18.0044 -18.0044 -6.5535 -6.5535 -6.5498 -6.5498 -5.5342 -5.5342 -5.5213 -5.5213 -5.5143 -5.5143 6.9891 6.9891 9.6229 9.6229 10.6726 10.6726 12.2041 12.2041 12.2932 12.2932 12.8527 12.8527 13.0247 13.0247 13.2751 13.2751 13.3011 13.3011 13.5930 13.5930 13.6441 13.6441 13.8513 13.8513 14.6642 14.6642 14.7767 14.7767 15.4009 15.4009 16.4858 16.4858 16.5795 16.5795 16.6457 16.6457 16.9734 16.9734 k = 0.5987-0.1177 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0083 -18.0083 -18.0043 -18.0043 -6.5538 -6.5538 -6.5498 -6.5498 -5.5345 -5.5345 -5.5214 -5.5214 -5.5142 -5.5142 6.9865 6.9865 9.5867 9.5867 10.7620 10.7620 12.2347 12.2347 12.2839 12.2839 12.8532 12.8532 13.0024 13.0024 13.2625 13.2625 13.2906 13.2906 13.6054 13.6054 13.6521 13.6521 13.8661 13.8661 14.6633 14.6633 14.7443 14.7443 15.3697 15.3697 16.4237 16.4237 16.5879 16.5879 16.6419 16.6419 16.9886 16.9886 k = 0.5921-0.1291 0.4082 ( 4600 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0084 -18.0084 -18.0042 -18.0042 -6.5540 -6.5540 -6.5497 -6.5497 -5.5348 -5.5348 -5.5215 -5.5215 -5.5140 -5.5140 6.9826 6.9826 9.5527 9.5527 10.8530 10.8530 12.2551 12.2551 12.2850 12.2850 12.8541 12.8541 12.9782 12.9782 13.2497 13.2497 13.2806 13.2806 13.6169 13.6169 13.6630 13.6630 13.8802 13.8802 14.6613 14.6613 14.7129 14.7129 15.3399 15.3399 16.3646 16.3646 16.5959 16.5959 16.6392 16.6392 17.0033 17.0033 k = 0.5855-0.1405 0.4082 ( 4598 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0085 -18.0085 -18.0041 -18.0041 -6.5542 -6.5542 -6.5497 -6.5497 -5.5351 -5.5351 -5.5215 -5.5215 -5.5139 -5.5139 6.9777 6.9777 9.5210 9.5210 10.9446 10.9446 12.2535 12.2535 12.3082 12.3082 12.8551 12.8551 12.9523 12.9523 13.2369 13.2369 13.2712 13.2712 13.6280 13.6280 13.6760 13.6760 13.8935 13.8935 14.6550 14.6550 14.6860 14.6860 15.3113 15.3113 16.3089 16.3089 16.6034 16.6034 16.6377 16.6377 17.0173 17.0173 k = 0.5789-0.1519 0.4082 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6598 -18.6598 -18.0085 -18.0085 -18.0041 -18.0041 -6.5544 -6.5544 -6.5496 -6.5496 -5.5354 -5.5354 -5.5216 -5.5216 -5.5138 -5.5138 6.9723 6.9723 9.4915 9.4915 11.0361 11.0361 12.2461 12.2461 12.3371 12.3371 12.8561 12.8561 12.9250 12.9250 13.2244 13.2244 13.2622 13.2622 13.6393 13.6393 13.6903 13.6903 13.9060 13.9060 14.6354 14.6354 14.6726 14.6726 15.2838 15.2838 16.2569 16.2569 16.6102 16.6102 16.6370 16.6370 17.0306 17.0306 k = 0.5724-0.1633 0.4082 ( 4602 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0086 -18.0086 -18.0040 -18.0040 -6.5545 -6.5545 -6.5496 -6.5496 -5.5356 -5.5356 -5.5217 -5.5217 -5.5137 -5.5137 6.9664 6.9664 9.4644 9.4644 11.1267 11.1267 12.2387 12.2387 12.3656 12.3656 12.8560 12.8560 12.8975 12.8975 13.2123 13.2123 13.2537 13.2537 13.6511 13.6511 13.7055 13.7055 13.9177 13.9177 14.6067 14.6067 14.6688 14.6688 15.2574 15.2574 16.2086 16.2086 16.6164 16.6164 16.6371 16.6371 17.0431 17.0431 k = 0.5658-0.1747 0.4082 ( 4606 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0086 -18.0086 -18.0039 -18.0039 -6.5547 -6.5547 -6.5495 -6.5495 -5.5359 -5.5359 -5.5218 -5.5218 -5.5135 -5.5135 6.9604 6.9604 9.4395 9.4395 11.2156 11.2156 12.2321 12.2321 12.3928 12.3928 12.8489 12.8489 12.8757 12.8757 13.2009 13.2009 13.2457 13.2457 13.6634 13.6634 13.7212 13.7212 13.9285 13.9285 14.5765 14.5765 14.6672 14.6672 15.2321 15.2321 16.1642 16.1642 16.6219 16.6219 16.6379 16.6379 17.0547 17.0547 k = 0.5592-0.1861 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0086 -18.0086 -18.0038 -18.0038 -6.5549 -6.5549 -6.5495 -6.5495 -5.5361 -5.5361 -5.5218 -5.5218 -5.5134 -5.5134 6.9544 6.9544 9.4170 9.4170 11.3019 11.3019 12.2268 12.2268 12.4179 12.4179 12.8250 12.8250 12.8700 12.8700 13.1901 13.1901 13.2383 13.2383 13.6760 13.6760 13.7370 13.7370 13.9384 13.9384 14.5465 14.5465 14.6664 14.6664 15.2079 15.2079 16.1239 16.1239 16.6267 16.6267 16.6391 16.6391 17.0653 17.0653 k = 0.5526-0.1975 0.4082 ( 4608 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0087 -18.0087 -18.0037 -18.0037 -6.5550 -6.5550 -6.5495 -6.5495 -5.5364 -5.5364 -5.5219 -5.5219 -5.5133 -5.5133 6.9486 6.9486 9.3968 9.3968 11.3847 11.3847 12.2231 12.2231 12.4402 12.4402 12.7944 12.7944 12.8706 12.8706 13.1801 13.1801 13.2316 13.2316 13.6888 13.6888 13.7527 13.7527 13.9475 13.9475 14.5176 14.5176 14.6658 14.6658 15.1849 15.1849 16.0876 16.0876 16.6309 16.6309 16.6408 16.6408 17.0750 17.0750 k = 0.5461-0.2089 0.4082 ( 4616 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0087 -18.0087 -18.0037 -18.0037 -6.5552 -6.5552 -6.5495 -6.5495 -5.5366 -5.5366 -5.5220 -5.5220 -5.5132 -5.5132 6.9431 6.9431 9.3790 9.3790 11.4627 11.4627 12.2213 12.2213 12.4590 12.4590 12.7630 12.7630 12.8723 12.8723 13.1711 13.1711 13.2255 13.2255 13.7013 13.7013 13.7681 13.7681 13.9557 13.9557 14.4902 14.4902 14.6653 14.6653 15.1634 15.1634 16.0554 16.0554 16.6344 16.6344 16.6427 16.6427 17.0836 17.0836 k = 0.5395-0.2203 0.4082 ( 4616 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0036 -18.0036 -6.5553 -6.5553 -6.5494 -6.5494 -5.5368 -5.5368 -5.5220 -5.5220 -5.5131 -5.5131 6.9382 6.9382 9.3635 9.3635 11.5349 11.5349 12.2216 12.2216 12.4733 12.4733 12.7328 12.7328 12.8744 12.8744 13.1630 13.1630 13.2202 13.2202 13.7131 13.7131 13.7828 13.7828 13.9631 13.9631 14.4648 14.4648 14.6650 14.6650 15.1437 15.1437 16.0274 16.0274 16.6373 16.6373 16.6448 16.6448 17.0911 17.0911 k = 0.5329-0.2317 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0036 -18.0036 -6.5554 -6.5554 -6.5494 -6.5494 -5.5369 -5.5369 -5.5221 -5.5221 -5.5130 -5.5130 6.9338 6.9338 9.3504 9.3504 11.5998 11.5998 12.2244 12.2244 12.4819 12.4819 12.7055 12.7055 12.8764 12.8764 13.1560 13.1560 13.2156 13.2156 13.7240 13.7240 13.7965 13.7965 13.9696 13.9696 14.4419 14.4419 14.6647 14.6647 15.1260 15.1260 16.0037 16.0037 16.6396 16.6396 16.6468 16.6468 17.0974 17.0974 k = 0.5263-0.2431 0.4082 ( 4604 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0035 -18.0035 -6.5555 -6.5555 -6.5494 -6.5494 -5.5370 -5.5370 -5.5221 -5.5221 -5.5130 -5.5130 6.9301 6.9301 9.3397 9.3397 11.6558 11.6558 12.2298 12.2298 12.4837 12.4837 12.6833 12.6833 12.8783 12.8783 13.1501 13.1501 13.2118 13.2118 13.7334 13.7334 13.8086 13.8086 13.9752 13.9752 14.4220 14.4220 14.6645 14.6645 15.1107 15.1107 15.9842 15.9842 16.6415 16.6415 16.6486 16.6486 17.1027 17.1027 k = 0.5197-0.2545 0.4082 ( 4600 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0088 -18.0088 -18.0035 -18.0035 -6.5556 -6.5556 -6.5494 -6.5494 -5.5371 -5.5371 -5.5221 -5.5221 -5.5129 -5.5129 6.9271 6.9271 9.3313 9.3313 11.7015 11.7015 12.2373 12.2373 12.4789 12.4789 12.6673 12.6673 12.8799 12.8799 13.1455 13.1455 13.2088 13.2088 13.7412 13.7412 13.8187 13.8187 13.9798 13.9798 14.4058 14.4058 14.6643 14.6643 15.0983 15.0983 15.9691 15.9691 16.6429 16.6429 16.6501 16.6501 17.1068 17.1068 k = 0.5132-0.2659 0.4082 ( 4592 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0035 -18.0035 -6.5556 -6.5556 -6.5494 -6.5494 -5.5372 -5.5372 -5.5222 -5.5222 -5.5129 -5.5129 6.9250 6.9250 9.3254 9.3254 11.7353 11.7353 12.2458 12.2458 12.4697 12.4697 12.6577 12.6577 12.8811 12.8811 13.1421 13.1421 13.2067 13.2067 13.7470 13.7470 13.8262 13.8262 13.9832 13.9832 14.3937 14.3937 14.6642 14.6642 15.0891 15.0891 15.9583 15.9583 16.6439 16.6439 16.6512 16.6512 17.1097 17.1097 k = 0.5066-0.2773 0.4082 ( 4568 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0035 -18.0035 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9237 6.9237 9.3218 9.3218 11.7561 11.7561 12.2530 12.2530 12.4607 12.4607 12.6529 12.6529 12.8819 12.8819 13.1401 13.1401 13.2054 13.2054 13.7506 13.7506 13.8310 13.8310 13.9853 13.9853 14.3862 14.3862 14.6641 14.6641 15.0835 15.0835 15.9518 15.9518 16.6445 16.6445 16.6519 16.6519 17.1114 17.1114 k = 0.5000-0.2887 0.4082 ( 4568 PWs) bands (ev): -41.9588 -41.9588 -18.6597 -18.6597 -18.0089 -18.0089 -18.0034 -18.0034 -6.5557 -6.5557 -6.5494 -6.5494 -5.5373 -5.5373 -5.5222 -5.5222 -5.5129 -5.5129 6.9232 6.9232 9.3206 9.3206 11.7631 11.7631 12.2559 12.2559 12.4570 12.4570 12.6515 12.6515 12.8822 12.8822 13.1394 13.1394 13.2050 13.2050 13.7518 13.7518 13.8326 13.8326 13.9861 13.9861 14.3837 14.3837 14.6641 14.6641 15.0816 15.0816 15.9496 15.9496 16.6447 16.6447 16.6522 16.6522 17.1120 17.1120 Writing output data file TiNi2Sn.save init_run : 0.20s CPU 0.34s WALL ( 1 calls) electrons : 215.06s CPU 218.26s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 215.06s CPU 218.25s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.05s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.09s WALL ( 346 calls) cegterg : 201.34s CPU 203.85s WALL ( 391 calls) Called by sum_band: Called by *egterg: h_psi : 125.36s CPU 127.36s WALL ( 7063 calls) s_psi : 5.70s CPU 5.83s WALL ( 7063 calls) g_psi : 0.39s CPU 0.37s WALL ( 6326 calls) cdiaghg : 56.84s CPU 57.60s WALL ( 6672 calls) cegterg:over : 8.73s CPU 8.78s WALL ( 6326 calls) cegterg:upda : 7.28s CPU 7.15s WALL ( 6326 calls) cegterg:last : 4.78s CPU 4.77s WALL ( 1476 calls) cdiaghg:chol : 3.22s CPU 3.30s WALL ( 6672 calls) cdiaghg:inve : 2.19s CPU 2.26s WALL ( 6672 calls) cdiaghg:para : 3.84s CPU 3.73s WALL ( 13344 calls) Called by h_psi: h_psi:vloc : 110.30s CPU 112.01s WALL ( 7063 calls) h_psi:vnl : 14.74s CPU 15.01s WALL ( 7063 calls) add_vuspsi : 7.90s CPU 7.92s WALL ( 7063 calls) General routines calbec : 6.82s CPU 7.06s WALL ( 7063 calls) fft : 0.00s CPU 0.01s WALL ( 15 calls) fftw : 103.98s CPU 105.76s WALL ( 1021536 calls) davcio : 0.24s CPU 0.35s WALL ( 692 calls) Parallel routines fft_scatter : 34.81s CPU 35.73s WALL ( 1021551 calls) PWSCF : 3m53.86s CPU 4m17.96s WALL This run was terminated on: 21: 0:38 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=