Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:31:18 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: ./ScGaCu2.save/ file Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 3P 3P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 52 26 7 1485 535 84 Max 53 27 8 1488 552 89 Sum 1891 955 283 53497 19579 3119 bravais-lattice index = 14 lattice parameter (alat) = 8.2286 a.u. unit-cell volume = 393.9631 (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 = 51.0000 Ry charge density cutoff = 402.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.228554 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 Ga read from file: /users/gautes/Pseudo/Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF MD5 check sum: a45069c11dc40ba088a6a50723da268c Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1205 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 Sc read from file: /users/gautes/Pseudo/Sc.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: e27f768e72ba10e20459589e24f2b6a7 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1173 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 Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ga 13.00 69.72300 Ga( 1.00) Sc 11.00 44.95590 Sc( 1.00) Cu 11.00 63.54600 Cu( 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 0.0288462), 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 0.0961539), 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 0.2211539), 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 0.4038462), 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 0.4711539), 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 0.0288462 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 0.0961539 0.5961539), 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 0.1538462 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 0.2211539 0.7211539), 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 0.3545455 0.7090909), wk = 0.0028902 k( 105) = ( 0.3477273 0.3477273 0.6954546), 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 0.6545455), 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 0.5454546), 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 0.2454546 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 0.2045455 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 0.3545455), 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 0.2454546), 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 0.0954546 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 0.0954546), 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 0.5039063), wk = 0.0028902 k( 205) = ( 0.5078125 0.4843750 0.5078125), wk = 0.0028902 k( 206) = ( 0.5117188 0.4765625 0.5117188), wk = 0.0028902 k( 207) = ( 0.5156250 0.4687500 0.5156250), wk = 0.0028902 k( 208) = ( 0.5195312 0.4609375 0.5195313), 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 0.5351563), wk = 0.0028902 k( 213) = ( 0.5390625 0.4218750 0.5390625), wk = 0.0028902 k( 214) = ( 0.5429688 0.4140625 0.5429688), 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 0.5664063), 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 0.5976563), 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 0.6132813), 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 0.6315790), 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 0.7434211), 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 0.6959460), 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 0.3986487 0.6013514), 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 0.4459460 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 0.4882813 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 0.4414063 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 0.4257813 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 0.4101563 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 0.3945313 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 0.3789063 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 0.6184211), 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 0.1184211 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 0.5065790), wk = 0.0028902 k( 346) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0028902 Dense grid: 53497 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 19579 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.12 Mb ( 138, 56) NL pseudopotentials 0.14 Mb ( 69, 136) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1488) G-vector shells 0.00 Mb ( 416) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.47 Mb ( 138, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.23 Mb ( 136, 2, 56) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./ScGaCu2.save/charge-density.dat Starting wfc are 74 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 3.7 secs Computing kpt #: 3 total cpu time spent up to now is 4.1 secs Computing kpt #: 4 total cpu time spent up to now is 4.7 secs Computing kpt #: 5 total cpu time spent up to now is 5.0 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 5.8 secs Computing kpt #: 8 total cpu time spent up to now is 6.2 secs Computing kpt #: 9 total cpu time spent up to now is 6.5 secs Computing kpt #: 10 total cpu time spent up to now is 6.9 secs Computing kpt #: 11 total cpu time spent up to now is 7.3 secs Computing kpt #: 12 total cpu time spent up to now is 7.6 secs Computing kpt #: 13 total cpu time spent up to now is 8.0 secs Computing kpt #: 14 total cpu time spent up to now is 8.3 secs Computing kpt #: 15 total cpu time spent up to now is 8.7 secs Computing kpt #: 16 total cpu time spent up to now is 9.0 secs Computing kpt #: 17 total cpu time spent up to now is 9.4 secs Computing kpt #: 18 total cpu time spent up to now is 9.8 secs Computing kpt #: 19 total cpu time spent up to now is 10.1 secs Computing kpt #: 20 total cpu time spent up to now is 10.5 secs Computing kpt #: 21 total cpu time spent up to now is 10.9 secs Computing kpt #: 22 total cpu time spent up to now is 11.3 secs Computing kpt #: 23 total cpu time spent up to now is 11.6 secs Computing kpt #: 24 total cpu time spent up to now is 12.0 secs Computing kpt #: 25 total cpu time spent up to now is 12.4 secs Computing kpt #: 26 total cpu time spent up to now is 12.8 secs Computing kpt #: 27 total cpu time spent up to now is 13.2 secs Computing kpt #: 28 total cpu time spent up to now is 13.6 secs Computing kpt #: 29 total cpu time spent up to now is 14.0 secs Computing kpt #: 30 total cpu time spent up to now is 14.4 secs Computing kpt #: 31 total cpu time spent up to now is 14.8 secs Computing kpt #: 32 total cpu time spent up to now is 15.2 secs Computing kpt #: 33 total cpu time spent up to now is 15.6 secs Computing kpt #: 34 total cpu time spent up to now is 16.0 secs Computing kpt #: 35 total cpu time spent up to now is 16.5 secs Computing kpt #: 36 total cpu time spent up to now is 16.9 secs Computing kpt #: 37 total cpu time spent up to now is 17.3 secs Computing kpt #: 38 total cpu time spent up to now is 17.7 secs Computing kpt #: 39 total cpu time spent up to now is 18.1 secs Computing kpt #: 40 total cpu time spent up to now is 18.6 secs Computing kpt #: 41 total cpu time spent up to now is 19.0 secs Computing kpt #: 42 total cpu time spent up to now is 19.4 secs Computing kpt #: 43 total cpu time spent up to now is 19.8 secs Computing kpt #: 44 total cpu time spent up to now is 20.2 secs Computing kpt #: 45 total cpu time spent up to now is 20.6 secs Computing kpt #: 46 total cpu time spent up to now is 21.0 secs Computing kpt #: 47 total cpu time spent up to now is 21.4 secs Computing kpt #: 48 total cpu time spent up to now is 21.8 secs Computing kpt #: 49 total cpu time spent up to now is 22.1 secs Computing kpt #: 50 total cpu time spent up to now is 22.5 secs Computing kpt #: 51 total cpu time spent up to now is 22.9 secs Computing kpt #: 52 total cpu time spent up to now is 23.3 secs Computing kpt #: 53 total cpu time spent up to now is 23.7 secs Computing kpt #: 54 total cpu time spent up to now is 24.0 secs Computing kpt #: 55 total cpu time spent up to now is 24.4 secs Computing kpt #: 56 total cpu time spent up to now is 24.8 secs Computing kpt #: 57 total cpu time spent up to now is 25.2 secs Computing kpt #: 58 total cpu time spent up to now is 25.6 secs Computing kpt #: 59 total cpu time spent up to now is 26.0 secs Computing kpt #: 60 total cpu time spent up to now is 26.3 secs Computing kpt #: 61 total cpu time spent up to now is 26.7 secs Computing kpt #: 62 total cpu time spent up to now is 27.1 secs Computing kpt #: 63 total cpu time spent up to now is 27.5 secs Computing kpt #: 64 total cpu time spent up to now is 27.9 secs Computing kpt #: 65 total cpu time spent up to now is 28.3 secs Computing kpt #: 66 total cpu time spent up to now is 28.7 secs Computing kpt #: 67 total cpu time spent up to now is 29.1 secs Computing kpt #: 68 total cpu time spent up to now is 29.5 secs Computing kpt #: 69 total cpu time spent up to now is 29.8 secs Computing kpt #: 70 total cpu time spent up to now is 30.2 secs Computing kpt #: 71 total cpu time spent up to now is 30.6 secs Computing kpt #: 72 total cpu time spent up to now is 31.0 secs Computing kpt #: 73 total cpu time spent up to now is 31.3 secs Computing kpt #: 74 total cpu time spent up to now is 31.7 secs Computing kpt #: 75 total cpu time spent up to now is 32.1 secs Computing kpt #: 76 total cpu time spent up to now is 32.4 secs Computing kpt #: 77 total cpu time spent up to now is 32.8 secs Computing kpt #: 78 total cpu time spent up to now is 33.2 secs Computing kpt #: 79 total cpu time spent up to now is 33.5 secs Computing kpt #: 80 total cpu time spent up to now is 33.9 secs Computing kpt #: 81 total cpu time spent up to now is 34.2 secs Computing kpt #: 82 total cpu time spent up to now is 34.6 secs Computing kpt #: 83 total cpu time spent up to now is 34.9 secs Computing kpt #: 84 total cpu time spent up to now is 35.3 secs Computing kpt #: 85 total cpu time spent up to now is 35.7 secs Computing kpt #: 86 total cpu time spent up to now is 36.0 secs Computing kpt #: 87 total cpu time spent up to now is 36.4 secs Computing kpt #: 88 total cpu time spent up to now is 36.8 secs Computing kpt #: 89 total cpu time spent up to now is 37.2 secs Computing kpt #: 90 total cpu time spent up to now is 37.5 secs Computing kpt #: 91 total cpu time spent up to now is 37.9 secs Computing kpt #: 92 total cpu time spent up to now is 38.3 secs Computing kpt #: 93 total cpu time spent up to now is 38.7 secs Computing kpt #: 94 total cpu time spent up to now is 39.1 secs Computing kpt #: 95 total cpu time spent up to now is 39.5 secs Computing kpt #: 96 total cpu time spent up to now is 39.8 secs Computing kpt #: 97 total cpu time spent up to now is 40.2 secs Computing kpt #: 98 total cpu time spent up to now is 40.6 secs Computing kpt #: 99 total cpu time spent up to now is 41.0 secs Computing kpt #: 100 total cpu time spent up to now is 41.4 secs Computing kpt #: 101 total cpu time spent up to now is 41.8 secs Computing kpt #: 102 total cpu time spent up to now is 42.2 secs Computing kpt #: 103 total cpu time spent up to now is 42.5 secs Computing kpt #: 104 total cpu time spent up to now is 42.9 secs Computing kpt #: 105 total cpu time spent up to now is 43.3 secs Computing kpt #: 106 total cpu time spent up to now is 43.7 secs Computing kpt #: 107 total cpu time spent up to now is 44.1 secs Computing kpt #: 108 total cpu time spent up to now is 44.5 secs Computing kpt #: 109 total cpu time spent up to now is 44.9 secs Computing kpt #: 110 total cpu time spent up to now is 45.3 secs Computing kpt #: 111 total cpu time spent up to now is 45.7 secs Computing kpt #: 112 total cpu time spent up to now is 46.1 secs Computing kpt #: 113 total cpu time spent up to now is 46.5 secs Computing kpt #: 114 total cpu time spent up to now is 46.9 secs Computing kpt #: 115 total cpu time spent up to now is 47.3 secs Computing kpt #: 116 total cpu time spent up to now is 47.7 secs Computing kpt #: 117 total cpu time spent up to now is 48.1 secs Computing kpt #: 118 total cpu time spent up to now is 48.5 secs Computing kpt #: 119 total cpu time spent up to now is 48.9 secs Computing kpt #: 120 total cpu time spent up to now is 49.3 secs Computing kpt #: 121 total cpu time spent up to now is 49.6 secs Computing kpt #: 122 total cpu time spent up to now is 50.0 secs Computing kpt #: 123 total cpu time spent up to now is 50.4 secs Computing kpt #: 124 total cpu time spent up to now is 50.8 secs Computing kpt #: 125 total cpu time spent up to now is 51.1 secs Computing kpt #: 126 total cpu time spent up to now is 51.5 secs Computing kpt #: 127 total cpu time spent up to now is 51.9 secs Computing kpt #: 128 total cpu time spent up to now is 52.2 secs Computing kpt #: 129 total cpu time spent up to now is 52.6 secs Computing kpt #: 130 total cpu time spent up to now is 53.0 secs Computing kpt #: 131 total cpu time spent up to now is 53.4 secs Computing kpt #: 132 total cpu time spent up to now is 53.8 secs Computing kpt #: 133 total cpu time spent up to now is 54.2 secs Computing kpt #: 134 total cpu time spent up to now is 54.6 secs Computing kpt #: 135 total cpu time spent up to now is 55.1 secs Computing kpt #: 136 total cpu time spent up to now is 55.5 secs Computing kpt #: 137 total cpu time spent up to now is 56.0 secs Computing kpt #: 138 total cpu time spent up to now is 56.4 secs Computing kpt #: 139 total cpu time spent up to now is 56.8 secs Computing kpt #: 140 total cpu time spent up to now is 57.2 secs Computing kpt #: 141 total cpu time spent up to now is 57.6 secs Computing kpt #: 142 total cpu time spent up to now is 58.0 secs Computing kpt #: 143 total cpu time spent up to now is 58.3 secs Computing kpt #: 144 total cpu time spent up to now is 58.7 secs Computing kpt #: 145 total cpu time spent up to now is 59.1 secs Computing kpt #: 146 total cpu time spent up to now is 59.5 secs Computing kpt #: 147 total cpu time spent up to now is 59.8 secs Computing kpt #: 148 total cpu time spent up to now is 60.2 secs Computing kpt #: 149 total cpu time spent up to now is 60.6 secs Computing kpt #: 150 total cpu time spent up to now is 61.0 secs Computing kpt #: 151 total cpu time spent up to now is 61.3 secs Computing kpt #: 152 total cpu time spent up to now is 61.7 secs Computing kpt #: 153 total cpu time spent up to now is 62.1 secs Computing kpt #: 154 total cpu time spent up to now is 62.5 secs Computing kpt #: 155 total cpu time spent up to now is 62.9 secs Computing kpt #: 156 total cpu time spent up to now is 63.3 secs Computing kpt #: 157 total cpu time spent up to now is 63.8 secs Computing kpt #: 158 total cpu time spent up to now is 64.2 secs Computing kpt #: 159 total cpu time spent up to now is 64.6 secs Computing kpt #: 160 total cpu time spent up to now is 64.9 secs Computing kpt #: 161 total cpu time spent up to now is 65.3 secs Computing kpt #: 162 total cpu time spent up to now is 65.7 secs Computing kpt #: 163 total cpu time spent up to now is 66.1 secs Computing kpt #: 164 total cpu time spent up to now is 66.5 secs Computing kpt #: 165 total cpu time spent up to now is 66.8 secs Computing kpt #: 166 total cpu time spent up to now is 67.2 secs Computing kpt #: 167 total cpu time spent up to now is 67.6 secs Computing kpt #: 168 total cpu time spent up to now is 67.9 secs Computing kpt #: 169 total cpu time spent up to now is 68.3 secs Computing kpt #: 170 total cpu time spent up to now is 68.7 secs Computing kpt #: 171 total cpu time spent up to now is 69.1 secs Computing kpt #: 172 total cpu time spent up to now is 69.5 secs Computing kpt #: 173 total cpu time spent up to now is 69.9 secs Computing kpt #: 174 total cpu time spent up to now is 70.3 secs Computing kpt #: 175 total cpu time spent up to now is 70.7 secs Computing kpt #: 176 total cpu time spent up to now is 71.2 secs Computing kpt #: 177 total cpu time spent up to now is 71.6 secs Computing kpt #: 178 total cpu time spent up to now is 72.0 secs Computing kpt #: 179 total cpu time spent up to now is 72.5 secs Computing kpt #: 180 total cpu time spent up to now is 72.9 secs Computing kpt #: 181 total cpu time spent up to now is 73.4 secs Computing kpt #: 182 total cpu time spent up to now is 73.9 secs Computing kpt #: 183 total cpu time spent up to now is 74.4 secs Computing kpt #: 184 total cpu time spent up to now is 74.9 secs Computing kpt #: 185 total cpu time spent up to now is 75.4 secs Computing kpt #: 186 total cpu time spent up to now is 75.9 secs Computing kpt #: 187 total cpu time spent up to now is 76.4 secs Computing kpt #: 188 total cpu time spent up to now is 76.8 secs Computing kpt #: 189 total cpu time spent up to now is 77.3 secs Computing kpt #: 190 total cpu time spent up to now is 77.8 secs Computing kpt #: 191 total cpu time spent up to now is 78.2 secs Computing kpt #: 192 total cpu time spent up to now is 78.6 secs Computing kpt #: 193 total cpu time spent up to now is 79.1 secs Computing kpt #: 194 total cpu time spent up to now is 79.6 secs Computing kpt #: 195 total cpu time spent up to now is 80.0 secs Computing kpt #: 196 total cpu time spent up to now is 80.4 secs Computing kpt #: 197 total cpu time spent up to now is 80.9 secs Computing kpt #: 198 total cpu time spent up to now is 81.3 secs Computing kpt #: 199 total cpu time spent up to now is 81.7 secs Computing kpt #: 200 total cpu time spent up to now is 82.2 secs Computing kpt #: 201 total cpu time spent up to now is 82.7 secs Computing kpt #: 202 total cpu time spent up to now is 83.1 secs Computing kpt #: 203 total cpu time spent up to now is 83.6 secs Computing kpt #: 204 total cpu time spent up to now is 84.1 secs Computing kpt #: 205 total cpu time spent up to now is 84.5 secs Computing kpt #: 206 total cpu time spent up to now is 85.0 secs Computing kpt #: 207 total cpu time spent up to now is 85.4 secs Computing kpt #: 208 total cpu time spent up to now is 85.8 secs Computing kpt #: 209 total cpu time spent up to now is 86.2 secs Computing kpt #: 210 total cpu time spent up to now is 86.7 secs Computing kpt #: 211 total cpu time spent up to now is 87.1 secs Computing kpt #: 212 total cpu time spent up to now is 87.5 secs Computing kpt #: 213 total cpu time spent up to now is 87.9 secs Computing kpt #: 214 total cpu time spent up to now is 88.4 secs Computing kpt #: 215 total cpu time spent up to now is 88.8 secs Computing kpt #: 216 total cpu time spent up to now is 89.2 secs Computing kpt #: 217 total cpu time spent up to now is 89.7 secs Computing kpt #: 218 total cpu time spent up to now is 90.1 secs Computing kpt #: 219 total cpu time spent up to now is 90.5 secs Computing kpt #: 220 total cpu time spent up to now is 91.0 secs Computing kpt #: 221 total cpu time spent up to now is 91.4 secs Computing kpt #: 222 total cpu time spent up to now is 91.8 secs Computing kpt #: 223 total cpu time spent up to now is 92.2 secs Computing kpt #: 224 total cpu time spent up to now is 92.6 secs Computing kpt #: 225 total cpu time spent up to now is 93.0 secs Computing kpt #: 226 total cpu time spent up to now is 93.4 secs Computing kpt #: 227 total cpu time spent up to now is 93.8 secs Computing kpt #: 228 total cpu time spent up to now is 94.2 secs Computing kpt #: 229 total cpu time spent up to now is 94.6 secs Computing kpt #: 230 total cpu time spent up to now is 95.0 secs Computing kpt #: 231 total cpu time spent up to now is 95.4 secs Computing kpt #: 232 total cpu time spent up to now is 95.8 secs Computing kpt #: 233 total cpu time spent up to now is 96.2 secs Computing kpt #: 234 total cpu time spent up to now is 96.6 secs Computing kpt #: 235 total cpu time spent up to now is 97.0 secs Computing kpt #: 236 total cpu time spent up to now is 97.3 secs Computing kpt #: 237 total cpu time spent up to now is 97.7 secs Computing kpt #: 238 total cpu time spent up to now is 98.1 secs Computing kpt #: 239 total cpu time spent up to now is 98.5 secs Computing kpt #: 240 total cpu time spent up to now is 98.9 secs Computing kpt #: 241 total cpu time spent up to now is 99.3 secs Computing kpt #: 242 total cpu time spent up to now is 99.7 secs Computing kpt #: 243 total cpu time spent up to now is 100.0 secs Computing kpt #: 244 total cpu time spent up to now is 100.4 secs Computing kpt #: 245 total cpu time spent up to now is 100.8 secs Computing kpt #: 246 total cpu time spent up to now is 101.2 secs Computing kpt #: 247 total cpu time spent up to now is 101.6 secs Computing kpt #: 248 total cpu time spent up to now is 102.0 secs Computing kpt #: 249 total cpu time spent up to now is 102.3 secs Computing kpt #: 250 total cpu time spent up to now is 102.7 secs Computing kpt #: 251 total cpu time spent up to now is 103.1 secs Computing kpt #: 252 total cpu time spent up to now is 103.4 secs Computing kpt #: 253 total cpu time spent up to now is 103.8 secs Computing kpt #: 254 total cpu time spent up to now is 104.1 secs Computing kpt #: 255 total cpu time spent up to now is 104.5 secs Computing kpt #: 256 total cpu time spent up to now is 104.9 secs Computing kpt #: 257 total cpu time spent up to now is 105.2 secs Computing kpt #: 258 total cpu time spent up to now is 105.6 secs Computing kpt #: 259 total cpu time spent up to now is 106.0 secs Computing kpt #: 260 total cpu time spent up to now is 106.3 secs Computing kpt #: 261 total cpu time spent up to now is 106.7 secs Computing kpt #: 262 total cpu time spent up to now is 107.1 secs Computing kpt #: 263 total cpu time spent up to now is 107.4 secs Computing kpt #: 264 total cpu time spent up to now is 107.8 secs Computing kpt #: 265 total cpu time spent up to now is 108.2 secs Computing kpt #: 266 total cpu time spent up to now is 108.6 secs Computing kpt #: 267 total cpu time spent up to now is 109.0 secs Computing kpt #: 268 total cpu time spent up to now is 109.3 secs Computing kpt #: 269 total cpu time spent up to now is 109.7 secs Computing kpt #: 270 total cpu time spent up to now is 110.1 secs Computing kpt #: 271 total cpu time spent up to now is 110.5 secs Computing kpt #: 272 total cpu time spent up to now is 110.9 secs Computing kpt #: 273 total cpu time spent up to now is 111.3 secs Computing kpt #: 274 total cpu time spent up to now is 111.7 secs Computing kpt #: 275 total cpu time spent up to now is 112.1 secs Computing kpt #: 276 total cpu time spent up to now is 112.5 secs Computing kpt #: 277 total cpu time spent up to now is 113.0 secs Computing kpt #: 278 total cpu time spent up to now is 113.4 secs Computing kpt #: 279 total cpu time spent up to now is 113.7 secs Computing kpt #: 280 total cpu time spent up to now is 114.2 secs Computing kpt #: 281 total cpu time spent up to now is 114.6 secs Computing kpt #: 282 total cpu time spent up to now is 115.0 secs Computing kpt #: 283 total cpu time spent up to now is 115.4 secs Computing kpt #: 284 total cpu time spent up to now is 115.8 secs Computing kpt #: 285 total cpu time spent up to now is 116.2 secs Computing kpt #: 286 total cpu time spent up to now is 116.6 secs Computing kpt #: 287 total cpu time spent up to now is 117.1 secs Computing kpt #: 288 total cpu time spent up to now is 117.5 secs Computing kpt #: 289 total cpu time spent up to now is 117.9 secs Computing kpt #: 290 total cpu time spent up to now is 118.3 secs Computing kpt #: 291 total cpu time spent up to now is 118.8 secs Computing kpt #: 292 total cpu time spent up to now is 119.2 secs Computing kpt #: 293 total cpu time spent up to now is 119.7 secs Computing kpt #: 294 total cpu time spent up to now is 120.2 secs Computing kpt #: 295 total cpu time spent up to now is 120.7 secs Computing kpt #: 296 total cpu time spent up to now is 121.1 secs Computing kpt #: 297 total cpu time spent up to now is 121.6 secs Computing kpt #: 298 total cpu time spent up to now is 122.0 secs Computing kpt #: 299 total cpu time spent up to now is 122.4 secs Computing kpt #: 300 total cpu time spent up to now is 122.8 secs Computing kpt #: 301 total cpu time spent up to now is 123.2 secs Computing kpt #: 302 total cpu time spent up to now is 123.7 secs Computing kpt #: 303 total cpu time spent up to now is 124.1 secs Computing kpt #: 304 total cpu time spent up to now is 124.5 secs Computing kpt #: 305 total cpu time spent up to now is 124.9 secs Computing kpt #: 306 total cpu time spent up to now is 125.4 secs Computing kpt #: 307 total cpu time spent up to now is 125.8 secs Computing kpt #: 308 total cpu time spent up to now is 126.2 secs Computing kpt #: 309 total cpu time spent up to now is 126.7 secs Computing kpt #: 310 total cpu time spent up to now is 127.1 secs Computing kpt #: 311 total cpu time spent up to now is 127.5 secs Computing kpt #: 312 total cpu time spent up to now is 127.9 secs Computing kpt #: 313 total cpu time spent up to now is 128.4 secs Computing kpt #: 314 total cpu time spent up to now is 128.8 secs Computing kpt #: 315 total cpu time spent up to now is 129.2 secs Computing kpt #: 316 total cpu time spent up to now is 129.6 secs Computing kpt #: 317 total cpu time spent up to now is 130.0 secs Computing kpt #: 318 total cpu time spent up to now is 130.4 secs Computing kpt #: 319 total cpu time spent up to now is 130.8 secs Computing kpt #: 320 total cpu time spent up to now is 131.2 secs Computing kpt #: 321 total cpu time spent up to now is 131.6 secs Computing kpt #: 322 total cpu time spent up to now is 132.0 secs Computing kpt #: 323 total cpu time spent up to now is 132.3 secs Computing kpt #: 324 total cpu time spent up to now is 132.7 secs Computing kpt #: 325 total cpu time spent up to now is 133.1 secs Computing kpt #: 326 total cpu time spent up to now is 133.5 secs Computing kpt #: 327 total cpu time spent up to now is 133.9 secs Computing kpt #: 328 total cpu time spent up to now is 134.3 secs Computing kpt #: 329 total cpu time spent up to now is 134.6 secs Computing kpt #: 330 total cpu time spent up to now is 135.0 secs Computing kpt #: 331 total cpu time spent up to now is 135.4 secs Computing kpt #: 332 total cpu time spent up to now is 135.8 secs Computing kpt #: 333 total cpu time spent up to now is 136.2 secs Computing kpt #: 334 total cpu time spent up to now is 136.5 secs Computing kpt #: 335 total cpu time spent up to now is 136.9 secs Computing kpt #: 336 total cpu time spent up to now is 137.3 secs Computing kpt #: 337 total cpu time spent up to now is 137.7 secs Computing kpt #: 338 total cpu time spent up to now is 138.1 secs Computing kpt #: 339 total cpu time spent up to now is 138.5 secs Computing kpt #: 340 total cpu time spent up to now is 138.9 secs Computing kpt #: 341 total cpu time spent up to now is 139.3 secs Computing kpt #: 342 total cpu time spent up to now is 139.6 secs Computing kpt #: 343 total cpu time spent up to now is 140.0 secs Computing kpt #: 344 total cpu time spent up to now is 140.4 secs Computing kpt #: 345 total cpu time spent up to now is 140.8 secs Computing kpt #: 346 total cpu time spent up to now is 141.2 secs ethr = 2.17E-08, avg # of iterations = 16.6 total cpu time spent up to now is 141.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1968 -2.1968 -1.7447 -1.7447 -1.7371 -1.7371 -1.7371 -1.7371 2.9887 2.9887 8.6036 8.6036 8.6036 8.6036 8.6675 8.6675 8.6675 8.6675 8.7206 8.7206 9.5768 9.5768 9.5768 9.5768 9.7256 9.7256 10.0361 10.0361 10.0361 10.0361 12.2955 12.2955 12.3474 12.3474 12.3474 12.3474 14.7506 14.7506 14.7506 14.7506 15.5762 15.5762 15.7248 15.7248 15.7248 15.7248 k = 0.0096-0.0056 0.0079 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1968 -2.1968 -1.7446 -1.7446 -1.7371 -1.7371 -1.7371 -1.7371 2.9903 2.9903 8.6010 8.6010 8.6040 8.6040 8.6677 8.6677 8.6687 8.6687 8.7216 8.7216 9.5767 9.5767 9.5768 9.5768 9.7255 9.7255 10.0347 10.0347 10.0361 10.0361 12.2936 12.2936 12.3452 12.3452 12.3455 12.3455 14.7386 14.7386 14.7505 14.7505 15.5732 15.5732 15.7093 15.7093 15.7279 15.7279 k = 0.0192-0.0111 0.0157 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1967 -2.1967 -1.7446 -1.7446 -1.7371 -1.7371 -1.7370 -1.7370 2.9949 2.9949 8.5938 8.5938 8.6051 8.6051 8.6685 8.6685 8.6720 8.6720 8.7247 8.7247 9.5765 9.5765 9.5766 9.5766 9.7253 9.7253 10.0307 10.0307 10.0360 10.0360 12.2879 12.2879 12.3387 12.3387 12.3397 12.3397 14.7029 14.7029 14.7501 14.7501 15.5597 15.5597 15.6839 15.6839 15.7372 15.7372 k = 0.0288-0.0167 0.0236 ( 2425 PWs) bands (ev): -36.6698 -36.6698 -15.6803 -15.6803 -15.1773 -15.1773 -15.1771 -15.1771 -2.1968 -2.1968 -2.1967 -2.1967 -1.7446 -1.7446 -1.7370 -1.7370 -1.7370 -1.7370 3.0025 3.0025 8.5831 8.5831 8.6070 8.6070 8.6698 8.6698 8.6764 8.6764 8.7296 8.7296 9.5760 9.5760 9.5763 9.5763 9.7248 9.7248 10.0239 10.0239 10.0359 10.0359 12.2785 12.2785 12.3279 12.3279 12.3302 12.3302 14.6445 14.6445 14.7496 14.7496 15.5313 15.5313 15.6760 15.6760 15.7525 15.7525 k = 0.0385-0.0222 0.0314 ( 2425 PWs) bands (ev): -36.6698 -36.6698 -15.6804 -15.6804 -15.1774 -15.1774 -15.1772 -15.1772 -2.1968 -2.1968 -2.1966 -2.1966 -1.7445 -1.7445 -1.7370 -1.7370 -1.7369 -1.7369 3.0132 3.0132 8.5698 8.5698 8.6096 8.6096 8.6716 8.6716 8.6813 8.6813 8.7360 8.7360 9.5754 9.5754 9.5759 9.5759 9.7242 9.7242 10.0145 10.0145 10.0358 10.0358 12.2656 12.2656 12.3131 12.3131 12.3173 12.3173 14.5660 14.5660 14.7487 14.7487 15.4981 15.4981 15.6868 15.6868 15.7734 15.7734 k = 0.0481-0.0278 0.0393 ( 2425 PWs) bands (ev): -36.6697 -36.6697 -15.6805 -15.6805 -15.1776 -15.1776 -15.1773 -15.1773 -2.1967 -2.1967 -2.1964 -2.1964 -1.7445 -1.7445 -1.7369 -1.7369 -1.7367 -1.7367 3.0270 3.0270 8.5544 8.5544 8.6129 8.6129 8.6738 8.6738 8.6866 8.6866 8.7435 8.7435 9.5746 9.5746 9.5753 9.5753 9.7235 9.7235 10.0026 10.0026 10.0356 10.0356 12.2492 12.2492 12.2944 12.2944 12.3012 12.3012 14.4709 14.4709 14.7477 14.7477 15.4701 15.4701 15.7091 15.7091 15.7996 15.7996 k = 0.0577-0.0333 0.0471 ( 2425 PWs) bands (ev): -36.6697 -36.6697 -15.6806 -15.6806 -15.1778 -15.1778 -15.1773 -15.1773 -2.1967 -2.1967 -2.1962 -2.1962 -1.7444 -1.7444 -1.7369 -1.7369 -1.7365 -1.7365 3.0438 3.0438 8.5372 8.5372 8.6170 8.6170 8.6766 8.6766 8.6922 8.6922 8.7520 8.7520 9.5737 9.5737 9.5745 9.5745 9.7225 9.7225 9.9882 9.9882 10.0353 10.0353 12.2296 12.2296 12.2723 12.2723 12.2824 12.2824 14.3633 14.3633 14.7464 14.7464 15.4501 15.4501 15.7389 15.7389 15.8305 15.8305 k = 0.0673-0.0389 0.0550 ( 2425 PWs) bands (ev): -36.6697 -36.6697 -15.6808 -15.6808 -15.1781 -15.1781 -15.1774 -15.1774 -2.1967 -2.1967 -2.1960 -2.1960 -1.7443 -1.7443 -1.7368 -1.7368 -1.7363 -1.7363 3.0636 3.0636 8.5184 8.5184 8.6218 8.6218 8.6799 8.6799 8.6982 8.6982 8.7611 8.7611 9.5726 9.5726 9.5735 9.5735 9.7212 9.7212 9.9714 9.9714 10.0351 10.0351 12.2069 12.2069 12.2469 12.2469 12.2612 12.2612 14.2472 14.2472 14.7449 14.7449 15.4375 15.4375 15.7741 15.7741 15.8655 15.8655 k = 0.0769-0.0444 0.0628 ( 2425 PWs) bands (ev): -36.6697 -36.6697 -15.6810 -15.6810 -15.1784 -15.1784 -15.1776 -15.1776 -2.1967 -2.1967 -2.1958 -2.1958 -1.7442 -1.7442 -1.7367 -1.7367 -1.7360 -1.7360 3.0864 3.0864 8.4981 8.4981 8.6273 8.6273 8.6836 8.6836 8.7047 8.7047 8.7707 8.7707 9.5713 9.5713 9.5722 9.5722 9.7196 9.7196 9.9527 9.9527 10.0348 10.0348 12.1814 12.1814 12.2188 12.2188 12.2380 12.2380 14.1255 14.1255 14.7431 14.7431 15.4313 15.4313 15.8135 15.8135 15.9037 15.9037 k = 0.0865-0.0500 0.0707 ( 2433 PWs) bands (ev): -36.6696 -36.6696 -15.6812 -15.6812 -15.1787 -15.1787 -15.1777 -15.1777 -2.1966 -2.1966 -2.1956 -2.1956 -1.7441 -1.7441 -1.7366 -1.7366 -1.7359 -1.7359 3.1121 3.1121 8.4763 8.4763 8.6334 8.6334 8.6879 8.6879 8.7117 8.7117 8.7808 8.7808 9.5699 9.5699 9.5705 9.5705 9.7176 9.7176 9.9316 9.9316 10.0344 10.0344 12.1533 12.1533 12.1881 12.1881 12.2133 12.2133 14.0005 14.0005 14.7411 14.7411 15.4301 15.4301 15.8559 15.8559 15.9444 15.9444 k = 0.0962-0.0555 0.0785 ( 2429 PWs) bands (ev): -36.6696 -36.6696 -15.6814 -15.6814 -15.1791 -15.1791 -15.1779 -15.1779 -2.1966 -2.1966 -2.1953 -2.1953 -1.7439 -1.7439 -1.7364 -1.7364 -1.7356 -1.7356 3.1408 3.1408 8.4529 8.4529 8.6403 8.6403 8.6926 8.6926 8.7193 8.7193 8.7911 8.7911 9.5683 9.5683 9.5684 9.5684 9.7151 9.7151 9.9092 9.9092 10.0340 10.0340 12.1230 12.1230 12.1553 12.1553 12.1875 12.1875 13.8740 13.8740 14.7390 14.7390 15.4331 15.4331 15.9001 15.9001 15.9865 15.9865 k = 0.1058-0.0611 0.0864 ( 2429 PWs) bands (ev): -36.6696 -36.6696 -15.6817 -15.6817 -15.1795 -15.1795 -15.1780 -15.1780 -2.1965 -2.1965 -2.1950 -2.1950 -1.7438 -1.7438 -1.7362 -1.7362 -1.7353 -1.7353 3.1724 3.1724 8.4282 8.4282 8.6478 8.6478 8.6977 8.6977 8.7275 8.7275 8.8017 8.8017 9.5657 9.5657 9.5665 9.5665 9.7119 9.7119 9.8857 9.8857 10.0336 10.0336 12.0907 12.0907 12.1207 12.1207 12.1609 12.1609 13.7470 13.7470 14.7366 14.7366 15.4393 15.4393 15.9452 15.9452 16.0290 16.0290 k = 0.1154-0.0666 0.0942 ( 2429 PWs) bands (ev): -36.6695 -36.6695 -15.6820 -15.6820 -15.1799 -15.1799 -15.1782 -15.1782 -2.1965 -2.1965 -2.1947 -2.1947 -1.7437 -1.7437 -1.7360 -1.7360 -1.7350 -1.7350 3.2070 3.2070 8.4021 8.4021 8.6560 8.6560 8.7033 8.7033 8.7363 8.7363 8.8126 8.8126 9.5622 9.5622 9.5645 9.5645 9.7077 9.7077 9.8616 9.8616 10.0332 10.0332 12.0567 12.0567 12.0847 12.0847 12.1339 12.1339 13.6204 13.6204 14.7340 14.7340 15.4483 15.4483 15.9897 15.9897 16.0706 16.0706 k = 0.1250-0.0722 0.1021 ( 2421 PWs) bands (ev): -36.6695 -36.6695 -15.6822 -15.6822 -15.1803 -15.1803 -15.1783 -15.1783 -2.1964 -2.1964 -2.1943 -2.1943 -1.7435 -1.7435 -1.7357 -1.7357 -1.7347 -1.7347 3.2443 3.2443 8.3747 8.3747 8.6648 8.6648 8.7094 8.7094 8.7457 8.7457 8.8237 8.8237 9.5576 9.5576 9.5624 9.5624 9.7020 9.7020 9.8379 9.8379 10.0328 10.0328 12.0215 12.0215 12.0476 12.0476 12.1067 12.1067 13.4947 13.4947 14.7313 14.7313 15.4597 15.4597 16.0325 16.0325 16.1102 16.1102 k = 0.1346-0.0777 0.1099 ( 2429 PWs) bands (ev): -36.6694 -36.6694 -15.6826 -15.6826 -15.1809 -15.1809 -15.1786 -15.1786 -2.1963 -2.1963 -2.1940 -2.1940 -1.7435 -1.7435 -1.7355 -1.7355 -1.7344 -1.7344 3.2845 3.2845 8.3459 8.3459 8.6740 8.6740 8.7158 8.7158 8.7557 8.7557 8.8349 8.8349 9.5513 9.5513 9.5600 9.5600 9.6943 9.6943 9.8156 9.8156 10.0323 10.0323 11.9852 11.9852 12.0096 12.0096 12.0794 12.0794 13.3704 13.3704 14.7283 14.7283 15.4732 15.4732 16.0722 16.0722 16.1463 16.1463 k = 0.1442-0.0833 0.1178 ( 2421 PWs) bands (ev): -36.6694 -36.6694 -15.6829 -15.6829 -15.1813 -15.1813 -15.1787 -15.1787 -2.1962 -2.1962 -2.1936 -2.1936 -1.7433 -1.7433 -1.7351 -1.7351 -1.7340 -1.7340 3.3274 3.3274 8.3158 8.3158 8.6839 8.6839 8.7227 8.7227 8.7663 8.7663 8.8464 8.8464 9.5429 9.5429 9.5575 9.5575 9.6842 9.6842 9.7961 9.7961 10.0319 10.0319 11.9484 11.9484 11.9712 11.9712 12.0524 12.0524 13.2477 13.2477 14.7252 14.7252 15.4885 15.4885 16.1075 16.1075 16.1778 16.1778 k = 0.1538-0.0888 0.1256 ( 2437 PWs) bands (ev): -36.6693 -36.6693 -15.6832 -15.6832 -15.1819 -15.1819 -15.1790 -15.1790 -2.1963 -2.1963 -2.1934 -2.1934 -1.7434 -1.7434 -1.7349 -1.7349 -1.7338 -1.7338 3.3731 3.3731 8.2845 8.2845 8.6941 8.6941 8.7300 8.7300 8.7773 8.7773 8.8579 8.8579 9.5314 9.5314 9.5548 9.5548 9.6716 9.6716 9.7804 9.7804 10.0313 10.0313 11.9110 11.9110 11.9323 11.9323 12.0257 12.0257 13.1268 13.1268 14.7219 14.7219 15.5055 15.5055 16.1369 16.1369 16.2031 16.2031 k = 0.1635-0.0944 0.1335 ( 2445 PWs) bands (ev): -36.6693 -36.6693 -15.6836 -15.6836 -15.1825 -15.1825 -15.1792 -15.1792 -2.1963 -2.1963 -2.1931 -2.1931 -1.7434 -1.7434 -1.7347 -1.7347 -1.7335 -1.7335 3.4214 3.4214 8.2521 8.2521 8.7048 8.7048 8.7376 8.7376 8.7890 8.7890 8.8696 8.8696 9.5158 9.5158 9.5519 9.5519 9.6576 9.6576 9.7685 9.7685 10.0307 10.0307 11.8735 11.8735 11.8935 11.8935 11.9996 11.9996 13.0078 13.0078 14.7184 14.7184 15.5240 15.5240 16.1594 16.1594 16.2214 16.2214 k = 0.1731-0.0999 0.1413 ( 2437 PWs) bands (ev): -36.6692 -36.6692 -15.6839 -15.6839 -15.1830 -15.1830 -15.1795 -15.1795 -2.1962 -2.1962 -2.1926 -2.1926 -1.7433 -1.7433 -1.7343 -1.7343 -1.7331 -1.7331 3.4723 3.4723 8.2186 8.2186 8.7158 8.7158 8.7458 8.7458 8.8012 8.8012 8.8814 8.8814 9.4954 9.4954 9.5490 9.5490 9.6439 9.6439 9.7600 9.7600 10.0302 10.0302 11.8362 11.8362 11.8549 11.8549 11.9741 11.9741 12.8909 12.8909 14.7149 14.7149 15.5439 15.5439 16.1738 16.1738 16.2315 16.2315 k = 0.1827-0.1055 0.1492 ( 2437 PWs) bands (ev): -36.6692 -36.6692 -15.6843 -15.6843 -15.1836 -15.1836 -15.1797 -15.1797 -2.1961 -2.1961 -2.1923 -2.1923 -1.7432 -1.7432 -1.7339 -1.7339 -1.7328 -1.7328 3.5257 3.5257 8.1841 8.1841 8.7270 8.7270 8.7545 8.7545 8.8139 8.8139 8.8932 8.8932 9.4699 9.4699 9.5458 9.5458 9.6315 9.6315 9.7539 9.7539 10.0297 10.0297 11.7992 11.7992 11.8166 11.8166 11.9493 11.9493 12.7760 12.7760 14.7111 14.7111 15.5650 15.5650 16.1795 16.1795 16.2329 16.2329 k = 0.1923-0.1110 0.1570 ( 2437 PWs) bands (ev): -36.6691 -36.6691 -15.6847 -15.6847 -15.1842 -15.1842 -15.1799 -15.1799 -2.1960 -2.1960 -2.1919 -2.1919 -1.7432 -1.7432 -1.7334 -1.7334 -1.7326 -1.7326 3.5816 3.5816 8.1487 8.1487 8.7383 8.7383 8.7637 8.7637 8.8271 8.8271 8.9049 8.9049 9.4400 9.4400 9.5423 9.5423 9.6209 9.6209 9.7495 9.7495 10.0292 10.0292 11.7627 11.7627 11.7788 11.7788 11.9254 11.9254 12.6631 12.6631 14.7072 14.7072 15.5872 15.5872 16.1761 16.1761 16.2254 16.2254 k = 0.2019-0.1166 0.1649 ( 2437 PWs) bands (ev): -36.6691 -36.6691 -15.6851 -15.6851 -15.1848 -15.1848 -15.1802 -15.1802 -2.1959 -2.1959 -2.1916 -2.1916 -1.7431 -1.7431 -1.7330 -1.7330 -1.7323 -1.7323 3.6399 3.6399 8.1125 8.1125 8.7496 8.7496 8.7735 8.7735 8.8407 8.8407 8.9166 8.9166 9.4064 9.4064 9.5386 9.5386 9.6121 9.6121 9.7463 9.7463 10.0286 10.0286 11.7268 11.7268 11.7418 11.7418 11.9022 11.9022 12.5522 12.5522 14.7033 14.7033 15.6105 15.6105 16.1635 16.1635 16.2090 16.2090 k = 0.2115-0.1221 0.1727 ( 2429 PWs) bands (ev): -36.6690 -36.6690 -15.6854 -15.6854 -15.1854 -15.1854 -15.1804 -15.1804 -2.1958 -2.1958 -2.1912 -2.1912 -1.7431 -1.7431 -1.7325 -1.7325 -1.7320 -1.7320 3.7005 3.7005 8.0755 8.0755 8.7606 8.7606 8.7840 8.7840 8.8547 8.8547 8.9281 8.9281 9.3703 9.3703 9.5350 9.5350 9.6046 9.6046 9.7439 9.7439 10.0281 10.0281 11.6918 11.6918 11.7056 11.7056 11.8800 11.8800 12.4434 12.4434 14.6992 14.6992 15.6347 15.6347 16.1423 16.1423 16.1842 16.1842 k = 0.2212-0.1277 0.1806 ( 2433 PWs) bands (ev): -36.6690 -36.6690 -15.6859 -15.6859 -15.1860 -15.1860 -15.1807 -15.1807 -2.1958 -2.1958 -2.1909 -2.1909 -1.7431 -1.7431 -1.7321 -1.7321 -1.7318 -1.7318 3.7633 3.7633 8.0379 8.0379 8.7712 8.7712 8.7950 8.7950 8.8691 8.8691 8.9395 8.9395 9.3324 9.3324 9.5310 9.5310 9.5979 9.5979 9.7421 9.7421 10.0275 10.0275 11.6577 11.6577 11.6703 11.6703 11.8586 11.8586 12.3365 12.3365 14.6950 14.6950 15.6598 15.6598 16.1131 16.1131 16.1518 16.1518 k = 0.2308-0.1332 0.1884 ( 2425 PWs) bands (ev): -36.6689 -36.6689 -15.6862 -15.6862 -15.1866 -15.1866 -15.1809 -15.1809 -2.1957 -2.1957 -2.1905 -2.1905 -1.7431 -1.7431 -1.7316 -1.7316 -1.7315 -1.7315 3.8283 3.8283 7.9999 7.9999 8.7815 8.7815 8.8067 8.8067 8.8838 8.8838 8.9508 8.9508 9.2936 9.2936 9.5268 9.5268 9.5916 9.5916 9.7407 9.7407 10.0270 10.0270 11.6248 11.6248 11.6360 11.6360 11.8382 11.8382 12.2315 12.2315 14.6907 14.6907 15.6855 15.6855 16.0767 16.0767 16.1125 16.1125 k = 0.2404-0.1388 0.1963 ( 2429 PWs) bands (ev): -36.6688 -36.6688 -15.6866 -15.6866 -15.1872 -15.1872 -15.1812 -15.1812 -2.1957 -2.1957 -2.1902 -2.1902 -1.7431 -1.7431 -1.7313 -1.7313 -1.7311 -1.7311 3.8952 3.8952 7.9612 7.9612 8.7915 8.7915 8.8185 8.8185 8.8988 8.8988 8.9616 8.9616 9.2545 9.2545 9.5224 9.5224 9.5856 9.5856 9.7397 9.7397 10.0265 10.0265 11.5929 11.5929 11.6029 11.6029 11.8186 11.8186 12.1284 12.1284 14.6864 14.6864 15.7118 15.7118 16.0342 16.0342 16.0674 16.0674 k = 0.2500-0.1443 0.2041 ( 2429 PWs) bands (ev): -36.6688 -36.6688 -15.6870 -15.6870 -15.1878 -15.1878 -15.1814 -15.1814 -2.1956 -2.1956 -2.1899 -2.1899 -1.7431 -1.7431 -1.7312 -1.7312 -1.7307 -1.7307 3.9641 3.9641 7.9223 7.9223 8.8012 8.8012 8.8303 8.8303 8.9140 8.9140 8.9720 8.9720 9.2157 9.2157 9.5178 9.5178 9.5796 9.5796 9.7390 9.7390 10.0260 10.0260 11.5623 11.5623 11.5709 11.5709 11.8000 11.8000 12.0272 12.0272 14.6820 14.6820 15.7385 15.7385 15.9866 15.9866 16.0176 16.0176 k = 0.2596-0.1499 0.2120 ( 2429 PWs) bands (ev): -36.6687 -36.6687 -15.6874 -15.6874 -15.1885 -15.1885 -15.1817 -15.1817 -2.1955 -2.1955 -2.1896 -2.1896 -1.7431 -1.7431 -1.7310 -1.7310 -1.7302 -1.7302 4.0347 4.0347 7.8832 7.8832 8.8107 8.8107 8.8416 8.8416 8.9295 8.9295 8.9819 8.9819 9.1780 9.1780 9.5129 9.5129 9.5736 9.5736 9.7386 9.7386 10.0255 10.0255 11.5330 11.5330 11.5403 11.5403 11.7822 11.7822 11.9278 11.9278 14.6776 14.6776 15.7653 15.7653 15.9349 15.9349 15.9639 15.9639 k = 0.2692-0.1554 0.2198 ( 2425 PWs) bands (ev): -36.6687 -36.6687 -15.6878 -15.6878 -15.1890 -15.1890 -15.1820 -15.1820 -2.1955 -2.1955 -2.1893 -2.1893 -1.7431 -1.7431 -1.7309 -1.7309 -1.7296 -1.7296 4.1069 4.1069 7.8439 7.8439 8.8200 8.8200 8.8518 8.8518 8.9451 8.9451 8.9913 8.9913 9.1420 9.1420 9.5079 9.5079 9.5674 9.5674 9.7383 9.7383 10.0250 10.0250 11.5051 11.5051 11.5110 11.5110 11.7653 11.7653 11.8303 11.8303 14.6732 14.6732 15.7918 15.7918 15.8804 15.8804 15.9072 15.9072 k = 0.2788-0.1610 0.2277 ( 2425 PWs) bands (ev): -36.6686 -36.6686 -15.6882 -15.6882 -15.1896 -15.1896 -15.1822 -15.1822 -2.1954 -2.1954 -2.1891 -2.1891 -1.7432 -1.7432 -1.7308 -1.7308 -1.7292 -1.7292 4.1807 4.1807 7.8046 7.8046 8.8291 8.8291 8.8598 8.8598 8.9608 8.9608 9.0001 9.0001 9.1090 9.1090 9.5026 9.5026 9.5609 9.5609 9.7383 9.7383 10.0246 10.0246 11.4786 11.4786 11.4830 11.4830 11.7348 11.7348 11.7493 11.7493 14.6688 14.6688 15.8113 15.8113 15.8301 15.8301 15.8485 15.8485 k = 0.2885-0.1665 0.2355 ( 2425 PWs) bands (ev): -36.6685 -36.6685 -15.6886 -15.6886 -15.1902 -15.1902 -15.1825 -15.1825 -2.1954 -2.1954 -2.1889 -2.1889 -1.7432 -1.7432 -1.7307 -1.7307 -1.7287 -1.7287 4.2557 4.2557 7.7654 7.7654 8.8379 8.8379 8.8644 8.8644 8.9766 8.9766 9.0081 9.0081 9.0805 9.0805 9.4971 9.4971 9.5542 9.5542 9.7384 9.7384 10.0242 10.0242 11.4536 11.4536 11.4565 11.4565 11.6411 11.6411 11.7342 11.7342 14.6644 14.6644 15.7621 15.7621 15.7883 15.7883 15.8460 15.8460 k = 0.2981-0.1721 0.2434 ( 2425 PWs) bands (ev): -36.6685 -36.6685 -15.6890 -15.6890 -15.1908 -15.1908 -15.1827 -15.1827 -2.1953 -2.1953 -2.1887 -2.1887 -1.7433 -1.7433 -1.7307 -1.7307 -1.7282 -1.7282 4.3319 4.3319 7.7263 7.7263 8.8463 8.8463 8.8640 8.8640 8.9924 8.9924 9.0153 9.0153 9.0585 9.0585 9.4913 9.4913 9.5472 9.5472 9.7387 9.7387 10.0239 10.0239 11.4300 11.4300 11.4313 11.4313 11.5496 11.5496 11.7198 11.7198 14.6600 14.6600 15.7028 15.7028 15.7275 15.7275 15.8688 15.8688 k = 0.3077-0.1776 0.2512 ( 2417 PWs) bands (ev): -36.6684 -36.6684 -15.6893 -15.6893 -15.1913 -15.1913 -15.1830 -15.1830 -2.1952 -2.1952 -2.1884 -2.1884 -1.7432 -1.7432 -1.7306 -1.7306 -1.7277 -1.7277 4.4090 4.4090 7.6875 7.6875 8.8507 8.8507 8.8601 8.8601 9.0082 9.0082 9.0218 9.0218 9.0448 9.0448 9.4853 9.4853 9.5399 9.5399 9.7391 9.7391 10.0235 10.0235 11.4076 11.4076 11.4079 11.4079 11.4603 11.4603 11.7063 11.7063 14.6557 14.6557 15.6430 15.6430 15.6665 15.6665 15.8870 15.8870 k = 0.3173-0.1832 0.2591 ( 2417 PWs) bands (ev): -36.6684 -36.6684 -15.6897 -15.6897 -15.1919 -15.1919 -15.1832 -15.1832 -2.1952 -2.1952 -2.1883 -2.1883 -1.7433 -1.7433 -1.7306 -1.7306 -1.7272 -1.7272 4.4868 4.4868 7.6490 7.6490 8.8385 8.8385 8.8654 8.8654 9.0234 9.0234 9.0277 9.0277 9.0396 9.0396 9.4791 9.4791 9.5321 9.5321 9.7396 9.7396 10.0233 10.0233 11.3727 11.3727 11.3859 11.3859 11.3873 11.3873 11.6936 11.6936 14.6514 14.6514 15.5833 15.5833 15.6059 15.6059 15.8928 15.8928 k = 0.3269-0.1887 0.2669 ( 2409 PWs) bands (ev): -36.6683 -36.6683 -15.6900 -15.6900 -15.1923 -15.1923 -15.1834 -15.1834 -2.1951 -2.1951 -2.1881 -2.1881 -1.7433 -1.7433 -1.7305 -1.7305 -1.7267 -1.7267 4.5651 4.5651 7.6109 7.6109 8.8178 8.8178 8.8731 8.8731 9.0311 9.0311 9.0400 9.0400 9.0416 9.0416 9.4725 9.4725 9.5241 9.5241 9.7402 9.7402 10.0231 10.0231 11.2884 11.2884 11.3648 11.3648 11.3682 11.3682 11.6816 11.6816 14.6472 14.6472 15.5244 15.5244 15.5462 15.5462 15.8698 15.8698 k = 0.3365-0.1943 0.2748 ( 2397 PWs) bands (ev): -36.6683 -36.6683 -15.6903 -15.6903 -15.1928 -15.1928 -15.1836 -15.1836 -2.1950 -2.1950 -2.1879 -2.1879 -1.7433 -1.7433 -1.7305 -1.7305 -1.7262 -1.7262 4.6436 4.6436 7.5733 7.5733 8.7932 8.7932 8.8809 8.8809 9.0346 9.0346 9.0486 9.0486 9.0553 9.0553 9.4658 9.4658 9.5158 9.5158 9.7409 9.7409 10.0229 10.0229 11.2065 11.2065 11.3454 11.3454 11.3506 11.3506 11.6703 11.6703 14.6432 14.6432 15.4666 15.4666 15.4877 15.4877 15.8107 15.8107 k = 0.3462-0.1999 0.2826 ( 2397 PWs) bands (ev): -36.6682 -36.6682 -15.6906 -15.6906 -15.1933 -15.1933 -15.1838 -15.1838 -2.1950 -2.1950 -2.1878 -2.1878 -1.7433 -1.7433 -1.7306 -1.7306 -1.7258 -1.7258 4.7220 4.7220 7.5363 7.5363 8.7668 8.7668 8.8885 8.8885 9.0367 9.0367 9.0589 9.0589 9.0704 9.0704 9.4587 9.4587 9.5070 9.5070 9.7417 9.7417 10.0227 10.0227 11.1276 11.1276 11.3274 11.3274 11.3343 11.3343 11.6598 11.6598 14.6392 14.6392 15.4104 15.4104 15.4308 15.4308 15.7336 15.7336 k = 0.3558-0.2054 0.2905 ( 2413 PWs) bands (ev): -36.6682 -36.6682 -15.6910 -15.6910 -15.1938 -15.1938 -15.1841 -15.1841 -2.1951 -2.1951 -2.1878 -2.1878 -1.7435 -1.7435 -1.7307 -1.7307 -1.7254 -1.7254 4.8001 4.8001 7.4998 7.4998 8.7398 8.7398 8.8958 8.8958 9.0375 9.0375 9.0711 9.0711 9.0853 9.0853 9.4513 9.4513 9.4978 9.4978 9.7422 9.7422 10.0226 10.0226 11.0518 11.0518 11.3108 11.3108 11.3194 11.3194 11.6499 11.6499 14.6354 14.6354 15.3560 15.3560 15.3758 15.3758 15.6531 15.6531 k = 0.3654-0.2110 0.2983 ( 2413 PWs) bands (ev): -36.6681 -36.6681 -15.6913 -15.6913 -15.1942 -15.1942 -15.1843 -15.1843 -2.1950 -2.1950 -2.1877 -2.1877 -1.7436 -1.7436 -1.7308 -1.7308 -1.7251 -1.7251 4.8773 4.8773 7.4641 7.4641 8.7132 8.7132 8.9027 8.9027 9.0372 9.0372 9.0846 9.0846 9.0999 9.0999 9.4437 9.4437 9.4884 9.4884 9.7430 9.7430 10.0226 10.0226 10.9796 10.9796 11.2956 11.2956 11.3059 11.3059 11.6408 11.6408 14.6317 14.6317 15.3039 15.3039 15.3231 15.3231 15.5746 15.5746 k = 0.3750-0.2165 0.3062 ( 2413 PWs) bands (ev): -36.6681 -36.6681 -15.6915 -15.6915 -15.1946 -15.1946 -15.1845 -15.1845 -2.1950 -2.1950 -2.1876 -2.1876 -1.7436 -1.7436 -1.7309 -1.7309 -1.7247 -1.7247 4.9534 4.9534 7.4292 7.4292 8.6874 8.6874 8.9093 8.9093 9.0356 9.0356 9.0989 9.0989 9.1141 9.1141 9.4359 9.4359 9.4786 9.4786 9.7438 9.7438 10.0226 10.0226 10.9111 10.9111 11.2816 11.2816 11.2936 11.2936 11.6323 11.6323 14.6282 14.6282 15.2542 15.2542 15.2730 15.2730 15.5002 15.5002 k = 0.3846-0.2221 0.3140 ( 2413 PWs) bands (ev): -36.6680 -36.6680 -15.6918 -15.6918 -15.1950 -15.1950 -15.1847 -15.1847 -2.1950 -2.1950 -2.1876 -2.1876 -1.7436 -1.7436 -1.7310 -1.7310 -1.7243 -1.7243 5.0279 5.0279 7.3953 7.3953 8.6629 8.6629 8.9156 8.9156 9.0328 9.0328 9.1137 9.1137 9.1279 9.1279 9.4279 9.4279 9.4685 9.4685 9.7446 9.7446 10.0227 10.0227 10.8468 10.8468 11.2690 11.2690 11.2826 11.2826 11.6245 11.6245 14.6249 14.6249 15.2072 15.2072 15.2256 15.2256 15.4307 15.4307 k = 0.3942-0.2276 0.3219 ( 2430 PWs) bands (ev): -36.6680 -36.6680 -15.6921 -15.6921 -15.1954 -15.1954 -15.1849 -15.1849 -2.1951 -2.1951 -2.1876 -2.1876 -1.7438 -1.7438 -1.7311 -1.7311 -1.7241 -1.7241 5.1003 5.1003 7.3623 7.3623 8.6397 8.6397 8.9214 8.9214 9.0288 9.0288 9.1287 9.1287 9.1412 9.1412 9.4197 9.4197 9.4581 9.4581 9.7454 9.7454 10.0225 10.0225 10.7867 10.7867 11.2576 11.2576 11.2728 11.2728 11.6172 11.6172 14.6218 14.6218 15.1632 15.1632 15.1811 15.1811 15.3663 15.3663 k = 0.4038-0.2332 0.3297 ( 2438 PWs) bands (ev): -36.6680 -36.6680 -15.6923 -15.6923 -15.1958 -15.1958 -15.1851 -15.1851 -2.1951 -2.1951 -2.1877 -2.1877 -1.7439 -1.7439 -1.7314 -1.7314 -1.7239 -1.7239 5.1700 5.1700 7.3306 7.3306 8.6181 8.6181 8.9268 8.9268 9.0238 9.0238 9.1438 9.1438 9.1540 9.1540 9.4114 9.4114 9.4475 9.4475 9.7462 9.7462 10.0227 10.0227 10.7313 10.7313 11.2474 11.2474 11.2641 11.2641 11.6107 11.6107 14.6189 14.6189 15.1223 15.1223 15.1398 15.1398 15.3075 15.3075 k = 0.4135-0.2387 0.3376 ( 2446 PWs) bands (ev): -36.6679 -36.6679 -15.6926 -15.6926 -15.1961 -15.1961 -15.1853 -15.1853 -2.1952 -2.1952 -2.1877 -2.1877 -1.7440 -1.7440 -1.7315 -1.7315 -1.7237 -1.7237 5.2365 5.2365 7.3003 7.3003 8.5983 8.5983 8.9317 8.9317 9.0179 9.0179 9.1588 9.1588 9.1662 9.1662 9.4032 9.4032 9.4367 9.4367 9.7468 9.7468 10.0229 10.0229 10.6808 10.6808 11.2384 11.2384 11.2565 11.2565 11.6048 11.6048 14.6161 14.6161 15.0847 15.0847 15.1019 15.1019 15.2543 15.2543 k = 0.4231-0.2443 0.3454 ( 2446 PWs) bands (ev): -36.6679 -36.6679 -15.6928 -15.6928 -15.1964 -15.1964 -15.1854 -15.1854 -2.1951 -2.1951 -2.1877 -2.1877 -1.7440 -1.7440 -1.7316 -1.7316 -1.7234 -1.7234 5.2991 5.2991 7.2716 7.2716 8.5804 8.5804 8.9362 8.9362 9.0114 9.0114 9.1737 9.1737 9.1778 9.1778 9.3951 9.3951 9.4258 9.4258 9.7475 9.7475 10.0232 10.0232 10.6353 10.6353 11.2304 11.2304 11.2499 11.2499 11.5996 11.5996 14.6137 14.6137 15.0507 15.0507 15.0676 15.0676 15.2068 15.2068 k = 0.4327-0.2498 0.3533 ( 2442 PWs) bands (ev): -36.6679 -36.6679 -15.6929 -15.6929 -15.1966 -15.1966 -15.1855 -15.1855 -2.1951 -2.1951 -2.1876 -2.1876 -1.7440 -1.7440 -1.7317 -1.7317 -1.7232 -1.7232 5.3571 5.3571 7.2449 7.2449 8.5645 8.5645 8.9402 8.9402 9.0045 9.0045 9.1883 9.1883 9.1887 9.1887 9.3872 9.3872 9.4149 9.4149 9.7482 9.7482 10.0235 10.0235 10.5950 10.5950 11.2236 11.2236 11.2442 11.2442 11.5951 11.5951 14.6116 14.6116 15.0203 15.0203 15.0369 15.0369 15.1648 15.1648 k = 0.4423-0.2554 0.3611 ( 2434 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1968 -15.1968 -15.1856 -15.1856 -2.1951 -2.1951 -2.1875 -2.1875 -1.7440 -1.7440 -1.7316 -1.7316 -1.7230 -1.7230 5.4097 5.4097 7.2205 7.2205 8.5507 8.5507 8.9437 8.9437 8.9976 8.9976 9.1988 9.1988 9.2024 9.2024 9.3798 9.3798 9.4040 9.4040 9.7487 9.7487 10.0238 10.0238 10.5600 10.5600 11.2177 11.2177 11.2394 11.2394 11.5912 11.5912 14.6097 14.6097 14.9937 14.9937 15.0101 15.0101 15.1286 15.1286 k = 0.4519-0.2609 0.3690 ( 2434 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1970 -15.1970 -15.1857 -15.1857 -2.1951 -2.1951 -2.1875 -2.1875 -1.7440 -1.7440 -1.7317 -1.7317 -1.7228 -1.7228 5.4560 5.4560 7.1986 7.1986 8.5388 8.5388 8.9467 8.9467 8.9909 8.9909 9.2079 9.2079 9.2158 9.2158 9.3728 9.3728 9.3933 9.3933 9.7492 9.7492 10.0241 10.0241 10.5304 10.5304 11.2128 11.2128 11.2354 11.2354 11.5878 11.5878 14.6080 14.6080 14.9710 14.9710 14.9871 14.9871 15.0979 15.0979 k = 0.4615-0.2665 0.3768 ( 2438 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1971 -15.1971 -15.1857 -15.1857 -2.1951 -2.1951 -2.1875 -2.1875 -1.7441 -1.7441 -1.7318 -1.7318 -1.7227 -1.7227 5.4954 5.4954 7.1799 7.1799 8.5290 8.5290 8.9491 8.9491 8.9848 8.9848 9.2158 9.2158 9.2283 9.2283 9.3664 9.3664 9.3830 9.3830 9.7496 9.7496 10.0244 10.0244 10.5062 10.5062 11.2089 11.2089 11.2323 11.2323 11.5851 11.5851 14.6067 14.6067 14.9522 14.9522 14.9682 14.9682 15.0729 15.0729 k = 0.4712-0.2720 0.3847 ( 2442 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1973 -15.1973 -15.1858 -15.1858 -2.1951 -2.1951 -2.1876 -2.1876 -1.7441 -1.7441 -1.7319 -1.7319 -1.7226 -1.7226 5.5270 5.5270 7.1647 7.1647 8.5214 8.5214 8.9510 8.9510 8.9797 8.9797 9.2224 9.2224 9.2393 9.2393 9.3611 9.3611 9.3737 9.3737 9.7499 9.7499 10.0246 10.0246 10.4873 10.4873 11.2059 11.2059 11.2298 11.2298 11.5830 11.5830 14.6056 14.6056 14.9376 14.9376 14.9534 14.9534 15.0534 15.0534 k = 0.4808-0.2776 0.3925 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1974 -15.1974 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7441 -1.7441 -1.7320 -1.7320 -1.7226 -1.7226 5.5501 5.5501 7.1535 7.1535 8.5159 8.5159 8.9524 8.9524 8.9758 8.9758 9.2274 9.2274 9.2483 9.2483 9.3570 9.3570 9.3660 9.3660 9.7501 9.7501 10.0248 10.0248 10.4738 10.4738 11.2037 11.2037 11.2281 11.2281 11.5814 11.5814 14.6049 14.6049 14.9270 14.9270 14.9428 14.9428 15.0395 15.0395 k = 0.4904-0.2831 0.4004 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1974 -15.1974 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7442 -1.7442 -1.7320 -1.7320 -1.7226 -1.7226 5.5642 5.5642 7.1467 7.1467 8.5126 8.5126 8.9532 8.9532 8.9733 8.9733 9.2305 9.2305 9.2543 9.2543 9.3544 9.3544 9.3608 9.3608 9.7503 9.7503 10.0249 10.0249 10.4657 10.4657 11.2024 11.2024 11.2271 11.2271 11.5805 11.5805 14.6044 14.6044 14.9207 14.9207 14.9364 14.9364 15.0312 15.0312 k = 0.5000-0.2887 0.4082 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1975 -15.1975 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7442 -1.7442 -1.7320 -1.7320 -1.7225 -1.7225 5.5690 5.5690 7.1443 7.1443 8.5115 8.5115 8.9535 8.9535 8.9725 8.9725 9.2316 9.2316 9.2565 9.2565 9.3535 9.3535 9.3589 9.3589 9.7503 9.7503 10.0250 10.0250 10.4631 10.4631 11.2020 11.2020 11.2268 11.2268 11.5802 11.5802 14.6043 14.6043 14.9186 14.9186 14.9343 14.9343 15.0284 15.0284 k = 0.5000-0.2887 0.4082 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1975 -15.1975 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7442 -1.7442 -1.7320 -1.7320 -1.7225 -1.7225 5.5690 5.5690 7.1443 7.1443 8.5115 8.5115 8.9535 8.9535 8.9725 8.9725 9.2316 9.2316 9.2565 9.2565 9.3535 9.3535 9.3589 9.3589 9.7503 9.7503 10.0250 10.0250 10.4631 10.4631 11.2020 11.2020 11.2268 11.2268 11.5802 11.5802 14.6043 14.6043 14.9186 14.9186 14.9343 14.9343 15.0284 15.0284 k = 0.5000-0.2776 0.4161 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1974 -15.1974 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7441 -1.7441 -1.7320 -1.7320 -1.7226 -1.7226 5.5695 5.5695 7.1454 7.1454 8.5102 8.5102 8.9533 8.9533 8.9727 8.9727 9.2315 9.2315 9.2572 9.2572 9.3529 9.3529 9.3602 9.3602 9.7500 9.7500 10.0231 10.0231 10.4631 10.4631 11.1882 11.1882 11.2165 11.2165 11.6032 11.6032 14.6062 14.6062 14.9182 14.9182 14.9339 14.9339 15.0325 15.0325 k = 0.5000-0.2665 0.4240 ( 2446 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1974 -15.1974 -15.1859 -15.1859 -2.1950 -2.1950 -2.1877 -2.1877 -1.7441 -1.7441 -1.7320 -1.7320 -1.7225 -1.7225 5.5708 5.5708 7.1487 7.1487 8.5065 8.5065 8.9527 8.9527 8.9732 8.9732 9.2312 9.2312 9.2593 9.2593 9.3519 9.3519 9.3631 9.3631 9.7491 9.7491 10.0175 10.0175 10.4632 10.4632 11.1455 11.1455 11.1980 11.1980 11.6618 11.6618 14.6120 14.6120 14.9168 14.9168 14.9331 14.9331 15.0448 15.0448 k = 0.5000-0.2554 0.4318 ( 2442 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1974 -15.1974 -15.1859 -15.1859 -2.1949 -2.1949 -2.1877 -2.1877 -1.7439 -1.7439 -1.7319 -1.7319 -1.7226 -1.7226 5.5731 5.5731 7.1541 7.1541 8.5001 8.5001 8.9517 8.9517 8.9741 8.9741 9.2308 9.2308 9.2626 9.2626 9.3513 9.3513 9.3670 9.3670 9.7475 9.7475 10.0080 10.0080 10.4634 10.4634 11.0877 11.0877 11.1731 11.1731 11.7402 11.7402 14.6209 14.6209 14.9138 14.9138 14.9323 14.9323 15.0652 15.0652 k = 0.5000-0.2443 0.4397 ( 2434 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1973 -15.1973 -15.1860 -15.1860 -2.1948 -2.1948 -2.1876 -2.1876 -1.7437 -1.7437 -1.7319 -1.7319 -1.7226 -1.7226 5.5763 5.5763 7.1616 7.1616 8.4913 8.4913 8.9503 8.9503 8.9754 8.9754 9.2304 9.2304 9.2671 9.2671 9.3513 9.3513 9.3716 9.3716 9.7453 9.7453 9.9946 9.9946 10.4636 10.4636 11.0263 11.0263 11.1405 11.1405 11.8295 11.8295 14.6319 14.6319 14.9085 14.9085 14.9323 14.9323 15.0934 15.0934 k = 0.5000-0.2332 0.4475 ( 2426 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1972 -15.1972 -15.1860 -15.1860 -2.1946 -2.1946 -2.1876 -2.1876 -1.7435 -1.7435 -1.7318 -1.7318 -1.7226 -1.7226 5.5803 5.5803 7.1713 7.1713 8.4800 8.4800 8.9486 8.9486 8.9770 8.9770 9.2302 9.2302 9.2725 9.2725 9.3518 9.3518 9.3769 9.3769 9.7426 9.7426 9.9772 9.9772 10.4640 10.4640 10.9657 10.9657 11.1004 11.1004 11.9254 11.9254 14.6444 14.6444 14.9009 14.9009 14.9330 14.9330 15.1288 15.1288 k = 0.5000-0.2221 0.4554 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1971 -15.1971 -15.1861 -15.1861 -2.1944 -2.1944 -2.1876 -2.1876 -1.7433 -1.7433 -1.7317 -1.7317 -1.7227 -1.7227 5.5852 5.5852 7.1831 7.1831 8.4663 8.4663 8.9465 8.9465 8.9790 8.9790 9.2301 9.2301 9.2789 9.2789 9.3529 9.3529 9.3829 9.3829 9.7393 9.7393 9.9560 9.9560 10.4643 10.4643 10.9084 10.9084 11.0537 11.0537 12.0256 12.0256 14.6574 14.6574 14.8908 14.8908 14.9343 14.9343 15.1703 15.1703 k = 0.5000-0.2110 0.4632 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1970 -15.1970 -15.1862 -15.1862 -2.1943 -2.1943 -2.1876 -2.1876 -1.7431 -1.7431 -1.7317 -1.7317 -1.7228 -1.7228 5.5907 5.5907 7.1970 7.1970 8.4502 8.4502 8.9442 8.9442 8.9813 8.9813 9.2302 9.2302 9.2860 9.2860 9.3545 9.3545 9.3894 9.3894 9.7355 9.7355 9.9310 9.9310 10.4647 10.4647 10.8554 10.8554 11.0013 11.0013 12.1290 12.1290 14.6703 14.6703 14.8784 14.8784 14.9361 14.9361 15.2163 15.2163 k = 0.5000-0.1999 0.4711 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1969 -15.1969 -15.1864 -15.1864 -2.1941 -2.1941 -2.1876 -2.1876 -1.7429 -1.7429 -1.7316 -1.7316 -1.7229 -1.7229 5.5969 5.5969 7.2130 7.2130 8.4316 8.4316 8.9416 8.9416 8.9841 8.9841 9.2304 9.2304 9.2939 9.2939 9.3566 9.3566 9.3967 9.3967 9.7311 9.7311 9.9025 9.9025 10.4651 10.4651 10.8073 10.8073 10.9443 10.9443 12.2346 12.2346 14.6830 14.6830 14.8636 14.8636 14.9383 14.9383 15.2650 15.2650 k = 0.5000-0.1887 0.4789 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1968 -15.1968 -15.1865 -15.1865 -2.1940 -2.1940 -2.1877 -2.1877 -1.7427 -1.7427 -1.7315 -1.7315 -1.7231 -1.7231 5.6037 5.6037 7.2310 7.2310 8.4107 8.4107 8.9387 8.9387 8.9873 8.9873 9.2307 9.2307 9.3023 9.3023 9.3591 9.3591 9.4048 9.4048 9.7263 9.7263 9.8710 9.8710 10.4655 10.4655 10.7641 10.7641 10.8838 10.8838 12.3420 12.3420 14.6952 14.6952 14.8464 14.8464 14.9408 14.9408 15.3140 15.3140 k = 0.5000-0.1776 0.4868 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1967 -15.1967 -15.1867 -15.1867 -2.1937 -2.1937 -2.1877 -2.1877 -1.7424 -1.7424 -1.7314 -1.7314 -1.7232 -1.7232 5.6110 5.6110 7.2510 7.2510 8.3876 8.3876 8.9357 8.9357 8.9910 8.9910 9.2311 9.2311 9.3112 9.3112 9.3620 9.3620 9.4137 9.4137 9.7210 9.7210 9.8370 9.8370 10.4658 10.4658 10.7253 10.7253 10.8212 10.8212 12.4505 12.4505 14.7068 14.7068 14.8266 14.8266 14.9435 14.9435 15.3613 15.3613 k = 0.5000-0.1665 0.4946 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1965 -15.1965 -15.1868 -15.1868 -2.1935 -2.1935 -2.1877 -2.1877 -1.7421 -1.7421 -1.7313 -1.7313 -1.7234 -1.7234 5.6187 5.6187 7.2731 7.2731 8.3622 8.3622 8.9326 8.9326 8.9952 8.9952 9.2315 9.2315 9.3203 9.3203 9.3653 9.3653 9.4237 9.4237 9.7153 9.7153 9.8010 9.8010 10.4658 10.4658 10.6895 10.6895 10.7585 10.7585 12.5598 12.5598 14.7179 14.7179 14.8043 14.8043 14.9464 14.9464 15.4052 15.4052 k = 0.5000-0.1554 0.5025 ( 2420 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1964 -15.1964 -15.1870 -15.1870 -2.1933 -2.1933 -2.1878 -2.1878 -1.7418 -1.7418 -1.7311 -1.7311 -1.7236 -1.7236 5.6267 5.6267 7.2970 7.2970 8.3347 8.3347 8.9295 8.9295 8.9999 8.9999 9.2318 9.2318 9.3294 9.3294 9.3688 9.3688 9.4349 9.4349 9.7093 9.7093 9.7639 9.7639 10.4653 10.4653 10.6523 10.6523 10.7010 10.7010 12.6695 12.6695 14.7284 14.7284 14.7794 14.7794 14.9494 14.9494 15.4443 15.4443 k = 0.5000-0.1443 0.5103 ( 2410 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1962 -15.1962 -15.1872 -15.1872 -2.1930 -2.1930 -2.1878 -2.1878 -1.7415 -1.7415 -1.7309 -1.7309 -1.7237 -1.7237 5.6349 5.6349 7.3228 7.3228 8.3051 8.3051 8.9263 8.9263 9.0054 9.0054 9.2320 9.2320 9.3384 9.3384 9.3725 9.3725 9.4475 9.4475 9.7029 9.7029 9.7267 9.7267 10.4635 10.4635 10.6036 10.6036 10.6596 10.6596 12.7791 12.7791 14.7367 14.7367 14.7534 14.7534 14.9524 14.9524 15.4780 15.4780 k = 0.5000-0.1332 0.5182 ( 2414 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1961 -15.1961 -15.1874 -15.1874 -2.1928 -2.1928 -2.1878 -2.1878 -1.7412 -1.7412 -1.7308 -1.7308 -1.7239 -1.7239 5.6431 5.6431 7.3505 7.3505 8.2735 8.2735 8.9230 8.9230 9.0114 9.0114 9.2317 9.2317 9.3469 9.3469 9.3763 9.3763 9.4617 9.4617 9.6879 9.6879 9.6982 9.6982 10.4575 10.4575 10.5477 10.5477 10.6330 10.6330 12.8884 12.8884 14.7181 14.7181 14.7507 14.7507 14.9555 14.9555 15.5061 15.5061 k = 0.5000-0.1221 0.5260 ( 2414 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1959 -15.1959 -15.1876 -15.1876 -2.1925 -2.1925 -2.1879 -2.1879 -1.7409 -1.7409 -1.7306 -1.7306 -1.7242 -1.7242 5.6512 5.6512 7.3799 7.3799 8.2400 8.2400 8.9198 8.9198 9.0181 9.0181 9.2310 9.2310 9.3547 9.3547 9.3802 9.3802 9.4777 9.4777 9.6528 9.6528 9.6909 9.6909 10.4353 10.4353 10.5048 10.5048 10.6132 10.6132 12.9970 12.9970 14.6844 14.6844 14.7595 14.7595 14.9585 14.9585 15.5288 15.5288 k = 0.5000-0.1110 0.5339 ( 2414 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1957 -15.1957 -15.1878 -15.1878 -2.1923 -2.1923 -2.1880 -2.1880 -1.7407 -1.7407 -1.7304 -1.7304 -1.7244 -1.7244 5.6592 5.6592 7.4110 7.4110 8.2048 8.2048 8.9167 8.9167 9.0256 9.0256 9.2296 9.2296 9.3617 9.3617 9.3839 9.3839 9.4955 9.4955 9.6190 9.6190 9.6844 9.6844 10.3859 10.3859 10.4888 10.4888 10.5971 10.5971 13.1046 13.1046 14.6467 14.6467 14.7683 14.7683 14.9615 14.9615 15.5468 15.5468 k = 0.5000-0.0999 0.5417 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1956 -15.1956 -15.1880 -15.1880 -2.1921 -2.1921 -2.1882 -2.1882 -1.7405 -1.7405 -1.7303 -1.7303 -1.7247 -1.7247 5.6669 5.6669 7.4437 7.4437 8.1680 8.1680 8.9137 8.9137 9.0338 9.0338 9.2272 9.2272 9.3676 9.3676 9.3873 9.3873 9.5147 9.5147 9.5883 9.5883 9.6781 9.6781 10.3257 10.3257 10.4845 10.4845 10.5838 10.5838 13.2108 13.2108 14.6054 14.6054 14.7767 14.7767 14.9643 14.9643 15.5606 15.5606 k = 0.5000-0.0888 0.5496 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1954 -15.1954 -15.1882 -15.1882 -2.1918 -2.1918 -2.1883 -2.1883 -1.7402 -1.7402 -1.7301 -1.7301 -1.7250 -1.7250 5.6742 5.6742 7.4780 7.4780 8.1298 8.1298 8.9109 8.9109 9.0428 9.0428 9.2238 9.2238 9.3725 9.3725 9.3905 9.3905 9.5324 9.5324 9.5645 9.5645 9.6721 9.6721 10.2638 10.2638 10.4833 10.4833 10.5727 10.5727 13.3154 13.3154 14.5604 14.5604 14.7845 14.7845 14.9669 14.9669 15.5710 15.5710 k = 0.5000-0.0777 0.5574 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1953 -15.1953 -15.1884 -15.1884 -2.1915 -2.1915 -2.1884 -2.1884 -1.7400 -1.7400 -1.7298 -1.7298 -1.7253 -1.7253 5.6809 5.6809 7.5137 7.5137 8.0903 8.0903 8.9083 8.9083 9.0526 9.0526 9.2189 9.2189 9.3759 9.3759 9.3933 9.3933 9.5279 9.5279 9.5689 9.5689 9.6667 9.6667 10.2028 10.2028 10.4832 10.4832 10.5635 10.5635 13.4180 13.4180 14.5115 14.5115 14.7917 14.7917 14.9693 14.9693 15.5786 15.5786 k = 0.5000-0.0666 0.5653 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1951 -15.1951 -15.1886 -15.1886 -2.1913 -2.1913 -2.1885 -2.1885 -1.7398 -1.7398 -1.7296 -1.7296 -1.7256 -1.7256 5.6870 5.6870 7.5507 7.5507 8.0498 8.0498 8.9060 8.9060 9.0633 9.0633 9.2124 9.2124 9.3779 9.3779 9.3957 9.3957 9.5104 9.5104 9.5920 9.5920 9.6624 9.6624 10.1436 10.1436 10.4835 10.4835 10.5558 10.5558 13.5183 13.5183 14.4587 14.4587 14.7982 14.7982 14.9715 14.9715 15.5841 15.5841 k = 0.5000-0.0555 0.5731 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1950 -15.1950 -15.1887 -15.1887 -2.1910 -2.1910 -2.1886 -2.1886 -1.7396 -1.7396 -1.7293 -1.7293 -1.7259 -1.7259 5.6923 5.6923 7.5890 7.5890 8.0084 8.0084 8.9039 8.9039 9.0748 9.0748 9.2042 9.2042 9.3783 9.3783 9.3978 9.3978 9.4957 9.4957 9.6170 9.6170 9.6609 9.6609 10.0866 10.0866 10.4840 10.4840 10.5496 10.5496 13.6159 13.6159 14.4019 14.4019 14.8039 14.8039 14.9734 14.9734 15.5879 15.5879 k = 0.5000-0.0444 0.5810 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1948 -15.1948 -15.1889 -15.1889 -2.1908 -2.1908 -2.1887 -2.1887 -1.7395 -1.7395 -1.7290 -1.7290 -1.7262 -1.7262 5.6968 5.6968 7.6283 7.6283 7.9663 7.9663 8.9022 8.9022 9.0870 9.0870 9.1943 9.1943 9.3773 9.3773 9.3997 9.3997 9.4850 9.4850 9.6349 9.6349 9.6694 9.6694 10.0325 10.0325 10.4846 10.4846 10.5445 10.5445 13.7108 13.7108 14.3411 14.3411 14.8086 14.8086 14.9750 14.9750 15.5904 15.5904 k = 0.5000-0.0333 0.5888 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1947 -15.1947 -15.1890 -15.1890 -2.1907 -2.1907 -2.1888 -2.1888 -1.7394 -1.7394 -1.7287 -1.7287 -1.7266 -1.7266 5.7004 5.7004 7.6686 7.6686 7.9239 7.9239 8.9008 8.9008 9.1000 9.1000 9.1828 9.1828 9.3756 9.3756 9.4012 9.4012 9.4778 9.4778 9.6391 9.6391 9.6940 9.6940 9.9818 9.9818 10.4852 10.4852 10.5407 10.5407 13.8024 13.8024 14.2761 14.2761 14.8124 14.8124 14.9763 14.9763 15.5920 15.5920 k = 0.5000-0.0222 0.5967 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1905 -2.1905 -2.1889 -2.1889 -1.7393 -1.7393 -1.7284 -1.7284 -1.7269 -1.7269 5.7030 5.7030 7.7095 7.7095 7.8814 7.8814 8.8998 8.8998 9.1134 9.1134 9.1701 9.1701 9.3738 9.3738 9.4024 9.4024 9.4735 9.4735 9.6387 9.6387 9.7243 9.7243 9.9361 9.9361 10.4856 10.4856 10.5379 10.5379 13.8908 13.8908 14.2070 14.2070 14.8151 14.8151 14.9772 14.9772 15.5930 15.5930 k = 0.5000-0.0111 0.6045 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1892 -15.1892 -2.1904 -2.1904 -2.1889 -2.1889 -1.7392 -1.7392 -1.7280 -1.7280 -1.7271 -1.7271 5.7046 5.7046 7.7505 7.7505 7.8394 7.8394 8.8992 8.8992 9.1271 9.1271 9.1568 9.1568 9.3725 9.3725 9.4031 9.4031 9.4713 9.4713 9.6379 9.6379 9.7524 9.7524 9.8994 9.8994 10.4859 10.4859 10.5363 10.5363 13.9755 13.9755 14.1340 14.1340 14.8168 14.8168 14.9778 14.9778 15.5935 15.5935 k = 0.5000 0.0000 0.6124 ( 2400 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1945 -15.1945 -15.1891 -15.1891 -2.1902 -2.1902 -2.1889 -2.1889 -1.7390 -1.7390 -1.7278 -1.7278 -1.7272 -1.7272 5.7052 5.7052 7.7821 7.7821 7.8076 7.8076 8.8991 8.8991 9.1377 9.1377 9.1465 9.1465 9.3721 9.3721 9.4034 9.4034 9.4706 9.4706 9.6376 9.6376 9.7658 9.7658 9.8833 9.8833 10.4861 10.4861 10.5358 10.5358 14.0516 14.0516 14.0619 14.0619 14.8174 14.8174 14.9780 14.9780 15.5937 15.5937 k = 0.5000 0.0000 0.6124 ( 2400 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1945 -15.1945 -15.1891 -15.1891 -2.1902 -2.1902 -2.1889 -2.1889 -1.7390 -1.7390 -1.7278 -1.7278 -1.7272 -1.7272 5.7052 5.7052 7.7821 7.7821 7.8076 7.8076 8.8991 8.8991 9.1377 9.1377 9.1465 9.1465 9.3721 9.3721 9.4034 9.4034 9.4706 9.4706 9.6376 9.6376 9.7658 9.7658 9.8833 9.8833 10.4861 10.4861 10.5358 10.5358 14.0516 14.0516 14.0619 14.0619 14.8174 14.8174 14.9780 14.9780 15.5937 15.5937 k = 0.4934 0.0114 0.6124 ( 2414 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1903 -2.1903 -2.1890 -2.1890 -1.7392 -1.7392 -1.7280 -1.7280 -1.7272 -1.7272 5.7043 5.7043 7.7636 7.7636 7.8262 7.8262 8.8992 8.8992 9.1313 9.1313 9.1527 9.1527 9.3719 9.3719 9.4024 9.4024 9.4703 9.4703 9.6375 9.6375 9.7591 9.7591 9.8899 9.8899 10.4881 10.4881 10.5392 10.5392 14.0005 14.0005 14.1103 14.1103 14.8186 14.8186 14.9783 14.9783 15.5939 15.5939 k = 0.4868 0.0228 0.6124 ( 2421 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1904 -2.1904 -2.1890 -2.1890 -1.7392 -1.7392 -1.7282 -1.7282 -1.7271 -1.7271 5.7019 5.7019 7.7377 7.7377 7.8526 7.8526 8.8994 8.8994 9.1219 9.1219 9.1616 9.1616 9.3718 9.3718 9.3992 9.3992 9.4696 9.4696 9.6370 9.6370 9.7447 9.7447 9.9033 9.9033 10.4922 10.4922 10.5526 10.5526 13.9411 13.9411 14.1619 14.1619 14.8227 14.8227 14.9790 14.9790 15.5942 15.5942 k = 0.4803 0.0342 0.6124 ( 2423 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1947 -15.1947 -15.1890 -15.1890 -2.1905 -2.1905 -2.1889 -2.1889 -1.7393 -1.7393 -1.7285 -1.7285 -1.7269 -1.7269 5.6983 5.6983 7.7124 7.7124 7.8785 7.8785 8.8999 8.8999 9.1124 9.1124 9.1702 9.1702 9.3720 9.3720 9.3936 9.3936 9.4687 9.4687 9.6360 9.6360 9.7294 9.7294 9.9158 9.9158 10.4949 10.4949 10.5803 10.5803 13.8781 13.8781 14.2120 14.2120 14.8297 14.8297 14.9800 14.9800 15.5943 15.5943 k = 0.4737 0.0456 0.6124 ( 2423 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1947 -15.1947 -15.1890 -15.1890 -2.1906 -2.1906 -2.1889 -2.1889 -1.7393 -1.7393 -1.7287 -1.7287 -1.7266 -1.7266 5.6937 5.6937 7.6882 7.6882 7.9033 7.9033 8.9005 8.9005 9.1030 9.1030 9.1779 9.1779 9.3721 9.3721 9.3859 9.3859 9.4682 9.4682 9.6346 9.6346 9.7163 9.7163 9.9238 9.9238 10.4956 10.4956 10.6228 10.6228 13.8115 13.8115 14.2604 14.2604 14.8398 14.8398 14.9812 14.9812 15.5939 15.5939 k = 0.4671 0.0570 0.6124 ( 2426 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1948 -15.1948 -15.1888 -15.1888 -2.1907 -2.1907 -2.1888 -2.1888 -1.7393 -1.7393 -1.7290 -1.7290 -1.7263 -1.7263 5.6885 5.6885 7.6654 7.6654 7.9266 7.9266 8.9013 8.9013 9.0938 9.0938 9.1842 9.1842 9.3694 9.3694 9.3789 9.3789 9.4687 9.4687 9.6325 9.6325 9.7063 9.7063 9.9266 9.9266 10.4952 10.4952 10.6784 10.6784 13.7415 13.7415 14.3069 14.3069 14.8531 14.8531 14.9823 14.9823 15.5927 15.5927 k = 0.4605 0.0684 0.6124 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1949 -15.1949 -15.1887 -15.1887 -2.1908 -2.1908 -2.1888 -2.1888 -1.7393 -1.7393 -1.7292 -1.7292 -1.7261 -1.7261 5.6827 5.6827 7.6440 7.6440 7.9484 7.9484 8.9022 8.9022 9.0848 9.0848 9.1886 9.1886 9.3594 9.3594 9.3782 9.3782 9.4706 9.4706 9.6303 9.6303 9.6995 9.6995 9.9243 9.9243 10.4943 10.4943 10.7449 10.7449 13.6682 13.6682 14.3515 14.3515 14.8694 14.8694 14.9834 14.9834 15.5903 15.5903 k = 0.4539 0.0798 0.6124 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1950 -15.1950 -15.1886 -15.1886 -2.1909 -2.1909 -2.1887 -2.1887 -1.7394 -1.7394 -1.7295 -1.7295 -1.7259 -1.7259 5.6767 5.6767 7.6241 7.6241 7.9687 7.9687 8.9033 8.9033 9.0761 9.0761 9.1904 9.1904 9.3467 9.3467 9.3798 9.3798 9.4741 9.4741 9.6281 9.6281 9.6951 9.6951 9.9176 9.9176 10.4933 10.4933 10.8205 10.8205 13.5920 13.5920 14.3940 14.3940 14.8887 14.8887 14.9842 14.9842 15.5863 15.5863 k = 0.4474 0.0912 0.6124 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1951 -15.1951 -15.1884 -15.1884 -2.1910 -2.1910 -2.1886 -2.1886 -1.7394 -1.7394 -1.7297 -1.7297 -1.7257 -1.7257 5.6705 5.6705 7.6057 7.6057 7.9873 7.9873 8.9046 8.9046 9.0677 9.0677 9.1892 9.1892 9.3345 9.3345 9.3818 9.3818 9.4795 9.4795 9.6262 9.6262 9.6924 9.6924 9.9077 9.9077 10.4922 10.4922 10.9030 10.9030 13.5130 13.5130 14.4343 14.4343 14.9111 14.9111 14.9846 14.9846 15.5805 15.5805 k = 0.4408 0.1026 0.6124 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1951 -15.1951 -15.1882 -15.1882 -2.1910 -2.1910 -2.1885 -2.1885 -1.7393 -1.7393 -1.7299 -1.7299 -1.7254 -1.7254 5.6645 5.6645 7.5889 7.5889 8.0043 8.0043 8.9062 8.9062 9.0598 9.0598 9.1848 9.1848 9.3238 9.3238 9.3840 9.3840 9.4868 9.4868 9.6248 9.6248 9.6910 9.6910 9.8952 9.8952 10.4911 10.4911 10.9909 10.9909 13.4318 13.4318 14.4723 14.4723 14.9362 14.9362 14.9847 14.9847 15.5725 15.5725 k = 0.4342 0.1140 0.6124 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1952 -15.1952 -15.1881 -15.1881 -2.1911 -2.1911 -2.1884 -2.1884 -1.7393 -1.7393 -1.7300 -1.7300 -1.7252 -1.7252 5.6586 5.6586 7.5736 7.5736 8.0197 8.0197 8.9079 8.9079 9.0521 9.0521 9.1774 9.1774 9.3153 9.3153 9.3859 9.3859 9.4959 9.4959 9.6239 9.6239 9.6902 9.6902 9.8809 9.8809 10.4901 10.4901 11.0825 11.0825 13.3487 13.3487 14.5078 14.5078 14.9636 14.9636 14.9848 14.9848 15.5620 15.5620 k = 0.4276 0.1253 0.6124 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1953 -15.1953 -15.1880 -15.1880 -2.1912 -2.1912 -2.1884 -2.1884 -1.7394 -1.7394 -1.7302 -1.7302 -1.7251 -1.7251 5.6530 5.6530 7.5599 7.5599 8.0334 8.0334 8.9099 8.9099 9.0447 9.0447 9.1677 9.1677 9.3091 9.3091 9.3875 9.3875 9.5065 9.5065 9.6236 9.6236 9.6897 9.6897 9.8654 9.8654 10.4892 10.4892 11.1762 11.1762 13.2645 13.2645 14.5407 14.5407 14.9814 14.9814 14.9965 14.9965 15.5486 15.5486 k = 0.4211 0.1367 0.6124 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1954 -15.1954 -15.1878 -15.1878 -2.1913 -2.1913 -2.1883 -2.1883 -1.7394 -1.7394 -1.7304 -1.7304 -1.7249 -1.7249 5.6479 5.6479 7.5478 7.5478 8.0456 8.0456 8.9121 8.9121 9.0376 9.0376 9.1567 9.1567 9.3047 9.3047 9.3888 9.3888 9.5183 9.5183 9.6239 9.6239 9.6892 9.6892 9.8492 9.8492 10.4884 10.4884 11.2705 11.2705 13.1800 13.1800 14.5707 14.5707 14.9809 14.9809 15.0283 15.0283 15.5322 15.5322 k = 0.4145 0.1481 0.6124 ( 2413 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1955 -15.1955 -15.1877 -15.1877 -2.1913 -2.1913 -2.1883 -2.1883 -1.7393 -1.7393 -1.7305 -1.7305 -1.7248 -1.7248 5.6433 5.6433 7.5372 7.5372 8.0562 8.0562 8.9146 8.9146 9.0309 9.0309 9.1454 9.1454 9.3018 9.3018 9.3899 9.3899 9.5308 9.5308 9.6249 9.6249 9.6886 9.6886 9.8328 9.8328 10.4877 10.4877 11.3635 11.3635 13.0966 13.0966 14.5977 14.5977 14.9792 14.9792 15.0628 15.0628 15.5125 15.5125 k = 0.4079 0.1595 0.6124 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1955 -15.1955 -15.1876 -15.1876 -2.1914 -2.1914 -2.1883 -2.1883 -1.7394 -1.7394 -1.7307 -1.7307 -1.7247 -1.7247 5.6392 5.6392 7.5283 7.5283 8.0651 8.0651 8.9171 8.9171 9.0246 9.0246 9.1347 9.1347 9.2998 9.2998 9.3906 9.3906 9.5434 9.5434 9.6268 9.6268 9.6874 9.6874 9.8167 9.8167 10.4871 10.4871 11.4529 11.4529 13.0159 13.0159 14.6214 14.6214 14.9771 14.9771 15.0990 15.0990 15.4897 15.4897 k = 0.4013 0.1709 0.6124 ( 2419 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1956 -15.1956 -15.1875 -15.1875 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7308 -1.7308 -1.7246 -1.7246 5.6358 5.6358 7.5210 7.5210 8.0724 8.0724 8.9197 8.9197 9.0188 9.0188 9.1253 9.1253 9.2985 9.2985 9.3912 9.3912 9.5552 9.5552 9.6301 9.6301 9.6855 9.6855 9.8017 9.8017 10.4866 10.4866 11.5359 11.5359 12.9405 12.9405 14.6414 14.6414 14.9748 14.9748 15.1359 15.1359 15.4640 15.4640 k = 0.3947 0.1823 0.6124 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1956 -15.1956 -15.1875 -15.1875 -2.1915 -2.1915 -2.1882 -2.1882 -1.7395 -1.7395 -1.7309 -1.7309 -1.7245 -1.7245 5.6331 5.6331 7.5153 7.5153 8.0781 8.0781 8.9221 8.9221 9.0137 9.0137 9.1177 9.1177 9.2977 9.2977 9.3916 9.3916 9.5652 9.5652 9.6349 9.6349 9.6824 9.6824 9.7885 9.7885 10.4862 10.4862 11.6089 11.6089 12.8737 12.8737 14.6575 14.6575 14.9727 14.9727 15.1728 15.1728 15.4361 15.4361 k = 0.3882 0.1937 0.6124 ( 2420 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7309 -1.7309 -1.7245 -1.7245 5.6312 5.6312 7.5112 7.5112 8.0822 8.0822 8.9242 8.9242 9.0097 9.0097 9.1121 9.1121 9.2972 9.2972 9.3918 9.3918 9.5727 9.5727 9.6414 9.6414 9.6779 9.6779 9.7781 9.7781 10.4859 10.4859 11.6672 11.6672 12.8201 12.8201 14.6693 14.6693 14.9709 14.9709 15.2074 15.2074 15.4080 15.4080 k = 0.3816 0.2051 0.6124 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1957 -15.1957 -15.1874 -15.1874 -2.1916 -2.1916 -2.1882 -2.1882 -1.7395 -1.7395 -1.7310 -1.7310 -1.7244 -1.7244 5.6300 5.6300 7.5087 7.5087 8.0847 8.0847 8.9256 8.9256 9.0071 9.0071 9.1087 9.1087 9.2969 9.2969 9.3919 9.3919 9.5771 9.5771 9.6487 9.6487 9.6723 9.6723 9.7714 9.7714 10.4857 10.4857 11.7053 11.7053 12.7848 12.7848 14.6765 14.6765 14.9697 14.9697 15.2356 15.2356 15.3837 15.3837 k = 0.3750 0.2165 0.6124 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7310 -1.7310 -1.7244 -1.7244 5.6296 5.6296 7.5079 7.5079 8.0855 8.0855 8.9261 8.9261 9.0062 9.0062 9.1075 9.1075 9.2968 9.2968 9.3920 9.3920 9.5786 9.5786 9.6529 9.6529 9.6688 9.6688 9.7691 9.7691 10.4857 10.4857 11.7186 11.7186 12.7725 12.7725 14.6790 14.6790 14.9693 14.9693 15.2477 15.2477 15.3730 15.3730 k = 0.3750 0.2165 0.6124 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7310 -1.7310 -1.7244 -1.7244 5.6296 5.6296 7.5079 7.5079 8.0855 8.0855 8.9261 8.9261 9.0062 9.0062 9.1075 9.1075 9.2968 9.2968 9.3920 9.3920 9.5786 9.5786 9.6529 9.6529 9.6688 9.6688 9.7691 9.7691 10.4857 10.4857 11.7186 11.7186 12.7725 12.7725 14.6790 14.6790 14.9693 14.9693 15.2477 15.2477 15.3730 15.3730 k = 0.3682 0.2126 0.6012 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1956 -15.1956 -15.1874 -15.1874 -2.1913 -2.1913 -2.1882 -2.1882 -1.7391 -1.7391 -1.7310 -1.7310 -1.7245 -1.7245 5.6227 5.6227 7.5483 7.5483 8.0428 8.0428 8.9244 8.9244 9.0028 9.0028 9.0963 9.0963 9.2997 9.2997 9.3925 9.3925 9.5677 9.5677 9.6365 9.6365 9.6517 9.6517 9.7650 9.7650 10.4878 10.4878 11.7602 11.7602 12.8443 12.8443 14.6504 14.6504 14.9800 14.9800 15.3155 15.3155 15.3634 15.3634 k = 0.3614 0.2086 0.5901 ( 2412 PWs) bands (ev): -36.6679 -36.6679 -15.6931 -15.6931 -15.1955 -15.1955 -15.1874 -15.1874 -2.1910 -2.1910 -2.1883 -2.1883 -1.7387 -1.7387 -1.7309 -1.7309 -1.7246 -1.7246 5.6122 5.6122 7.5907 7.5907 8.0008 8.0008 8.9226 8.9226 8.9952 8.9952 9.0890 9.0890 9.3017 9.3017 9.3918 9.3918 9.5506 9.5506 9.6238 9.6238 9.6318 9.6318 9.7753 9.7753 10.4900 10.4900 11.8023 11.8023 12.9184 12.9184 14.6202 14.6202 14.9924 14.9924 15.3509 15.3509 15.3863 15.3863 k = 0.3545 0.2047 0.5790 ( 2412 PWs) bands (ev): -36.6679 -36.6679 -15.6931 -15.6931 -15.1954 -15.1954 -15.1873 -15.1873 -2.1907 -2.1907 -2.1884 -2.1884 -1.7384 -1.7384 -1.7309 -1.7309 -1.7248 -1.7248 5.5976 5.5976 7.6351 7.6351 7.9602 7.9602 8.9206 8.9206 8.9833 8.9833 9.0860 9.0860 9.3022 9.3022 9.3900 9.3900 9.5325 9.5325 9.6101 9.6101 9.6151 9.6151 9.7934 9.7934 10.4923 10.4923 11.8449 11.8449 12.9949 12.9949 14.5883 14.5883 15.0064 15.0064 15.3363 15.3363 15.4595 15.4595 k = 0.3477 0.2008 0.5678 ( 2412 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1953 -15.1953 -15.1872 -15.1872 -2.1905 -2.1905 -2.1885 -2.1885 -1.7381 -1.7381 -1.7309 -1.7309 -1.7249 -1.7249 5.5785 5.5785 7.6814 7.6814 7.9221 7.9221 8.9184 8.9184 8.9680 8.9680 9.0868 9.0868 9.3011 9.3011 9.3875 9.3875 9.5165 9.5165 9.5905 9.5905 9.6066 9.6066 9.8155 9.8155 10.4948 10.4948 11.8880 11.8880 13.0740 13.0740 14.5548 14.5548 15.0223 15.0223 15.3195 15.3195 15.5352 15.5352 k = 0.3409 0.1968 0.5567 ( 2416 PWs) bands (ev): -36.6679 -36.6679 -15.6929 -15.6929 -15.1952 -15.1952 -15.1871 -15.1871 -2.1904 -2.1904 -2.1886 -2.1886 -1.7379 -1.7379 -1.7310 -1.7310 -1.7250 -1.7250 5.5545 5.5545 7.7295 7.7295 7.8872 7.8872 8.9150 8.9150 8.9513 8.9513 9.0902 9.0902 9.2981 9.2981 9.3848 9.3848 9.5035 9.5035 9.5713 9.5713 9.6002 9.6002 9.8399 9.8399 10.4974 10.4974 11.9315 11.9315 13.1559 13.1559 14.5196 14.5196 15.0400 15.0400 15.3010 15.3010 15.6134 15.6134 k = 0.3341 0.1929 0.5456 ( 2424 PWs) bands (ev): -36.6679 -36.6679 -15.6929 -15.6929 -15.1952 -15.1952 -15.1870 -15.1870 -2.1902 -2.1902 -2.1887 -2.1887 -1.7377 -1.7377 -1.7311 -1.7311 -1.7251 -1.7251 5.5253 5.5253 7.7794 7.7794 7.8565 7.8565 8.9083 8.9083 8.9365 8.9365 9.0954 9.0954 9.2933 9.2933 9.3825 9.3825 9.4931 9.4931 9.5531 9.5531 9.5953 9.5953 9.8658 9.8658 10.5001 10.5001 11.9755 11.9755 13.2407 13.2407 14.4828 14.4828 15.0597 15.0597 15.2809 15.2809 15.6939 15.6939 k = 0.3273 0.1890 0.5344 ( 2424 PWs) bands (ev): -36.6679 -36.6679 -15.6927 -15.6927 -15.1951 -15.1951 -15.1869 -15.1869 -2.1901 -2.1901 -2.1887 -2.1887 -1.7375 -1.7375 -1.7312 -1.7312 -1.7251 -1.7251 5.4909 5.4909 7.8250 7.8250 7.8364 7.8364 8.8949 8.8949 8.9277 8.9277 9.1019 9.1019 9.2872 9.2872 9.3805 9.3805 9.4847 9.4847 9.5360 9.5360 9.5922 9.5922 9.8929 9.8929 10.5029 10.5029 12.0200 12.0200 13.3285 13.3285 14.4444 14.4444 15.0813 15.0813 15.2594 15.2594 15.7765 15.7765 k = 0.3205 0.1850 0.5233 ( 2415 PWs) bands (ev): -36.6679 -36.6679 -15.6926 -15.6926 -15.1950 -15.1950 -15.1866 -15.1866 -2.1900 -2.1900 -2.1887 -2.1887 -1.7373 -1.7373 -1.7312 -1.7312 -1.7251 -1.7251 5.4510 5.4510 7.8079 7.8079 7.8858 7.8858 8.8762 8.8762 8.9238 8.9238 9.1093 9.1093 9.2805 9.2805 9.3786 9.3786 9.4775 9.4775 9.5205 9.5205 9.5907 9.5907 9.9208 9.9208 10.5060 10.5060 12.0650 12.0650 13.4195 13.4195 14.4044 14.4044 15.1049 15.1049 15.2369 15.2369 15.8612 15.8612 k = 0.3136 0.1811 0.5122 ( 2423 PWs) bands (ev): -36.6680 -36.6680 -15.6925 -15.6925 -15.1949 -15.1949 -15.1865 -15.1865 -2.1900 -2.1900 -2.1888 -2.1888 -1.7372 -1.7372 -1.7313 -1.7313 -1.7252 -1.7252 5.4057 5.4057 7.7920 7.7920 7.9408 7.9408 8.8554 8.8554 8.9218 8.9218 9.1172 9.1172 9.2736 9.2736 9.3764 9.3764 9.4705 9.4705 9.5072 9.5072 9.5908 9.5908 9.9494 9.9494 10.5092 10.5092 12.1104 12.1104 13.5135 13.5135 14.3628 14.3628 15.1301 15.1301 15.2138 15.2138 15.9477 15.9477 k = 0.3068 0.1771 0.5010 ( 2423 PWs) bands (ev): -36.6680 -36.6680 -15.6923 -15.6923 -15.1948 -15.1948 -15.1862 -15.1862 -2.1900 -2.1900 -2.1887 -2.1887 -1.7371 -1.7371 -1.7315 -1.7315 -1.7252 -1.7252 5.3553 5.3553 7.7814 7.7814 7.9975 7.9975 8.8340 8.8340 8.9205 8.9205 9.1256 9.1256 9.2668 9.2668 9.3737 9.3737 9.4626 9.4626 9.4975 9.4975 9.5922 9.5922 9.9788 9.9788 10.5126 10.5126 12.1563 12.1563 13.6107 13.6107 14.3198 14.3198 15.1550 15.1550 15.1921 15.1921 16.0360 16.0360 k = 0.3000 0.1732 0.4899 ( 2423 PWs) bands (ev): -36.6680 -36.6680 -15.6922 -15.6922 -15.1947 -15.1947 -15.1860 -15.1860 -2.1901 -2.1901 -2.1887 -2.1887 -1.7371 -1.7371 -1.7315 -1.7315 -1.7252 -1.7252 5.3000 5.3000 7.7760 7.7760 8.0556 8.0556 8.8127 8.8127 8.9195 8.9195 9.1341 9.1341 9.2605 9.2605 9.3704 9.3704 9.4526 9.4526 9.4925 9.4925 9.5949 9.5949 10.0090 10.0090 10.5162 10.5162 12.2027 12.2027 13.7111 13.7111 14.2752 14.2752 15.1561 15.1561 15.1954 15.1954 16.1258 16.1258 k = 0.2932 0.1693 0.4788 ( 2415 PWs) bands (ev): -36.6681 -36.6681 -15.6920 -15.6920 -15.1946 -15.1946 -15.1857 -15.1857 -2.1901 -2.1901 -2.1886 -2.1886 -1.7370 -1.7370 -1.7316 -1.7316 -1.7253 -1.7253 5.2402 5.2402 7.7759 7.7759 8.1150 8.1150 8.7916 8.7916 8.9186 8.9186 9.1428 9.1428 9.2544 9.2544 9.3666 9.3666 9.4415 9.4415 9.4914 9.4914 9.5985 9.5985 10.0401 10.0401 10.5204 10.5204 12.2496 12.2496 13.8147 13.8147 14.2293 14.2293 15.1325 15.1325 15.2247 15.2247 16.2170 16.2170 k = 0.2864 0.1653 0.4676 ( 2407 PWs) bands (ev): -36.6681 -36.6681 -15.6917 -15.6917 -15.1944 -15.1944 -15.1854 -15.1854 -2.1902 -2.1902 -2.1885 -2.1885 -1.7369 -1.7369 -1.7317 -1.7317 -1.7252 -1.7252 5.1763 5.1763 7.7806 7.7806 8.1754 8.1754 8.7710 8.7710 8.9177 8.9177 9.1513 9.1513 9.2485 9.2485 9.3629 9.3629 9.4302 9.4302 9.4932 9.4932 9.6028 9.6028 10.0722 10.0722 10.5247 10.5247 12.2971 12.2971 13.9214 13.9214 14.1820 14.1820 15.1060 15.1060 15.2583 15.2583 16.3093 16.3093 k = 0.2795 0.1614 0.4565 ( 2411 PWs) bands (ev): -36.6681 -36.6681 -15.6916 -15.6916 -15.1942 -15.1942 -15.1851 -15.1851 -2.1904 -2.1904 -2.1885 -2.1885 -1.7370 -1.7370 -1.7319 -1.7319 -1.7252 -1.7252 5.1089 5.1089 7.7897 7.7897 8.2364 8.2364 8.7510 8.7510 8.9165 8.9165 9.1592 9.1592 9.2427 9.2427 9.3595 9.3595 9.4197 9.4197 9.4970 9.4970 9.6077 9.6077 10.1054 10.1054 10.5294 10.5294 12.3452 12.3452 14.0311 14.0311 14.1334 14.1334 15.0782 15.0782 15.2944 15.2944 16.2984 16.2984 k = 0.2727 0.1575 0.4454 ( 2409 PWs) bands (ev): -36.6681 -36.6681 -15.6913 -15.6913 -15.1940 -15.1940 -15.1848 -15.1848 -2.1905 -2.1905 -2.1885 -2.1885 -1.7370 -1.7370 -1.7320 -1.7320 -1.7253 -1.7253 5.0384 5.0384 7.8028 7.8028 8.2978 8.2978 8.7318 8.7318 8.9151 8.9151 9.1664 9.1664 9.2369 9.2369 9.3569 9.3569 9.4108 9.4108 9.5023 9.5023 9.6130 9.6130 10.1400 10.1400 10.5347 10.5347 12.3939 12.3939 14.0834 14.0834 14.1440 14.1440 15.0497 15.0497 15.3325 15.3325 16.2352 16.2352 k = 0.2659 0.1535 0.4342 ( 2409 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1938 -15.1938 -15.1845 -15.1845 -2.1907 -2.1907 -2.1885 -2.1885 -1.7371 -1.7371 -1.7321 -1.7321 -1.7253 -1.7253 4.9655 4.9655 7.8196 7.8196 8.3591 8.3591 8.7135 8.7135 8.9133 8.9133 9.1724 9.1724 9.2311 9.2311 9.3553 9.3553 9.4042 9.4042 9.5086 9.5086 9.6185 9.6185 10.1760 10.1760 10.5406 10.5406 12.4432 12.4432 14.0324 14.0324 14.2594 14.2594 15.0203 15.0203 15.3725 15.3725 16.1719 16.1719 k = 0.2591 0.1496 0.4231 ( 2421 PWs) bands (ev): -36.6682 -36.6682 -15.6909 -15.6909 -15.1935 -15.1935 -15.1842 -15.1842 -2.1910 -2.1910 -2.1886 -2.1886 -1.7374 -1.7374 -1.7323 -1.7323 -1.7255 -1.7255 4.8904 4.8904 7.8394 7.8394 8.4195 8.4195 8.6965 8.6965 8.9111 8.9111 9.1764 9.1764 9.2258 9.2258 9.3549 9.3549 9.4002 9.4002 9.5157 9.5157 9.6242 9.6242 10.2137 10.2137 10.5472 10.5472 12.4931 12.4931 13.9803 13.9803 14.3775 14.3775 14.9903 14.9903 15.4142 15.4142 16.1093 16.1093 k = 0.2523 0.1456 0.4120 ( 2421 PWs) bands (ev): -36.6683 -36.6683 -15.6906 -15.6906 -15.1933 -15.1933 -15.1839 -15.1839 -2.1911 -2.1911 -2.1886 -2.1886 -1.7375 -1.7375 -1.7325 -1.7325 -1.7256 -1.7256 4.8138 4.8138 7.8620 7.8620 8.4779 8.4779 8.6814 8.6814 8.9086 8.9086 9.1777 9.1777 9.2220 9.2220 9.3560 9.3560 9.3993 9.3993 9.5235 9.5235 9.6301 9.6301 10.2532 10.2532 10.5547 10.5547 12.5437 12.5437 13.9271 13.9271 14.4979 14.4979 14.9595 14.9595 15.4575 15.4575 16.0481 16.0481 k = 0.2455 0.1417 0.4008 ( 2421 PWs) bands (ev): -36.6683 -36.6683 -15.6903 -15.6903 -15.1930 -15.1930 -15.1836 -15.1836 -2.1913 -2.1913 -2.1887 -2.1887 -1.7377 -1.7377 -1.7326 -1.7326 -1.7257 -1.7257 4.7362 4.7362 7.8867 7.8867 8.5319 8.5319 8.6698 8.6698 8.9055 8.9055 9.1754 9.1754 9.2211 9.2211 9.3589 9.3589 9.4013 9.4013 9.5320 9.5320 9.6360 9.6360 10.2948 10.2948 10.5632 10.5632 12.5950 12.5950 13.8731 13.8731 14.6201 14.6201 14.9279 14.9279 15.5021 15.5021 15.9891 15.9891 k = 0.2386 0.1378 0.3897 ( 2421 PWs) bands (ev): -36.6684 -36.6684 -15.6900 -15.6900 -15.1926 -15.1926 -15.1833 -15.1833 -2.1915 -2.1915 -2.1888 -2.1888 -1.7379 -1.7379 -1.7328 -1.7328 -1.7259 -1.7259 4.6578 4.6578 7.9132 7.9132 8.5754 8.5754 8.6669 8.6669 8.9019 8.9019 9.1693 9.1693 9.2239 9.2239 9.3636 9.3636 9.4059 9.4059 9.5409 9.5409 9.6420 9.6420 10.3387 10.3387 10.5731 10.5731 12.6471 12.6471 13.8182 13.8182 14.7434 14.7434 14.8957 14.8957 15.5479 15.5479 15.9333 15.9333 k = 0.2318 0.1338 0.3786 ( 2417 PWs) bands (ev): -36.6684 -36.6684 -15.6897 -15.6897 -15.1922 -15.1922 -15.1829 -15.1829 -2.1917 -2.1917 -2.1889 -2.1889 -1.7381 -1.7381 -1.7329 -1.7329 -1.7260 -1.7260 4.5790 4.5790 7.9411 7.9411 8.5958 8.5958 8.6839 8.6839 8.8979 8.8979 9.1604 9.1604 9.2310 9.2310 9.3705 9.3705 9.4125 9.4125 9.5504 9.5504 9.6480 9.6480 10.3849 10.3849 10.5845 10.5845 12.6999 12.6999 13.7626 13.7626 14.8599 14.8599 14.8696 14.8696 15.5945 15.5945 15.8821 15.8821 k = 0.2250 0.1299 0.3674 ( 2409 PWs) bands (ev): -36.6684 -36.6684 -15.6894 -15.6894 -15.1918 -15.1918 -15.1826 -15.1826 -2.1918 -2.1918 -2.1890 -2.1890 -1.7383 -1.7383 -1.7330 -1.7330 -1.7262 -1.7262 4.5004 4.5004 7.9701 7.9701 8.5953 8.5953 8.7174 8.7174 8.8934 8.8934 9.1494 9.1494 9.2430 9.2430 9.3793 9.3793 9.4208 9.4208 9.5603 9.5603 9.6539 9.6539 10.4334 10.4334 10.5979 10.5979 12.7535 12.7535 13.7064 13.7064 14.8285 14.8285 14.9890 14.9890 15.6416 15.6416 15.8376 15.8376 k = 0.2182 0.1260 0.3563 ( 2409 PWs) bands (ev): -36.6685 -36.6685 -15.6890 -15.6890 -15.1914 -15.1914 -15.1823 -15.1823 -2.1920 -2.1920 -2.1892 -2.1892 -1.7385 -1.7385 -1.7331 -1.7331 -1.7264 -1.7264 4.4220 4.4220 7.9998 7.9998 8.5876 8.5876 8.7520 8.7520 8.8884 8.8884 9.1370 9.1370 9.2606 9.2606 9.3901 9.3901 9.4302 9.4302 9.5705 9.5705 9.6598 9.6598 10.4841 10.4841 10.6138 10.6138 12.8078 12.8078 13.6497 13.6497 14.7939 14.7939 15.1056 15.1056 15.6888 15.6888 15.8035 15.8035 k = 0.2114 0.1220 0.3452 ( 2409 PWs) bands (ev): -36.6685 -36.6685 -15.6887 -15.6887 -15.1909 -15.1909 -15.1820 -15.1820 -2.1923 -2.1923 -2.1894 -2.1894 -1.7387 -1.7387 -1.7333 -1.7333 -1.7267 -1.7267 4.3442 4.3442 8.0300 8.0300 8.5782 8.5782 8.7813 8.7813 8.8829 8.8829 9.1236 9.1236 9.2842 9.2842 9.4028 9.4028 9.4404 9.4404 9.5811 9.5811 9.6657 9.6657 10.5362 10.5362 10.6336 10.6336 12.8630 12.8630 13.5925 13.5925 14.7586 14.7586 15.2107 15.2107 15.7355 15.7355 15.7865 15.7865 k = 0.2045 0.1181 0.3340 ( 2413 PWs) bands (ev): -36.6686 -36.6686 -15.6884 -15.6884 -15.1905 -15.1905 -15.1817 -15.1817 -2.1925 -2.1925 -2.1896 -2.1896 -1.7390 -1.7390 -1.7334 -1.7334 -1.7270 -1.7270 4.2673 4.2673 8.0603 8.0603 8.5688 8.5688 8.8034 8.8034 8.8769 8.8769 9.1096 9.1096 9.3133 9.3133 9.4179 9.4179 9.4510 9.4510 9.5920 9.5920 9.6716 9.6716 10.5876 10.5876 10.6597 10.6597 12.9190 12.9190 13.5350 13.5350 14.7227 14.7227 15.2938 15.2938 15.7800 15.7800 15.7983 15.7983 k = 0.1977 0.1142 0.3229 ( 2413 PWs) bands (ev): -36.6687 -36.6687 -15.6880 -15.6880 -15.1900 -15.1900 -15.1814 -15.1814 -2.1927 -2.1927 -2.1898 -2.1898 -1.7393 -1.7393 -1.7336 -1.7336 -1.7273 -1.7273 4.1915 4.1915 8.0905 8.0905 8.5599 8.5599 8.8182 8.8182 8.8705 8.8705 9.0950 9.0950 9.3458 9.3458 9.4365 9.4365 9.4620 9.4620 9.6034 9.6034 9.6776 9.6776 10.6332 10.6332 10.6977 10.6977 12.9759 12.9759 13.4773 13.4773 14.6864 14.6864 15.3442 15.3442 15.8250 15.8250 15.8465 15.8465 k = 0.1909 0.1102 0.3118 ( 2409 PWs) bands (ev): -36.6687 -36.6687 -15.6876 -15.6876 -15.1894 -15.1894 -15.1811 -15.1811 -2.1929 -2.1929 -2.1900 -2.1900 -1.7395 -1.7395 -1.7337 -1.7337 -1.7276 -1.7276 4.1170 4.1170 8.1206 8.1206 8.5517 8.5517 8.8266 8.8266 8.8637 8.8637 9.0800 9.0800 9.3777 9.3777 9.4608 9.4608 9.4730 9.4730 9.6152 9.6152 9.6837 9.6837 10.6705 10.6705 10.7505 10.7505 13.0336 13.0336 13.4196 13.4196 14.6499 14.6499 15.3619 15.3619 15.8698 15.8698 15.9310 15.9310 k = 0.1841 0.1063 0.3006 ( 2417 PWs) bands (ev): -36.6688 -36.6688 -15.6873 -15.6873 -15.1889 -15.1889 -15.1808 -15.1808 -2.1932 -2.1932 -2.1903 -2.1903 -1.7399 -1.7399 -1.7340 -1.7340 -1.7280 -1.7280 4.0440 4.0440 8.1502 8.1502 8.5443 8.5443 8.8296 8.8296 8.8565 8.8565 9.0647 9.0647 9.4048 9.4048 9.4835 9.4835 9.4933 9.4933 9.6273 9.6273 9.6902 9.6902 10.7047 10.7047 10.8131 10.8131 13.0922 13.0922 13.3619 13.3619 14.6134 14.6134 15.3577 15.3577 15.9109 15.9109 16.0437 16.0437 k = 0.1773 0.1023 0.2895 ( 2417 PWs) bands (ev): -36.6688 -36.6688 -15.6869 -15.6869 -15.1884 -15.1884 -15.1806 -15.1806 -2.1934 -2.1934 -2.1906 -2.1906 -1.7401 -1.7401 -1.7341 -1.7341 -1.7284 -1.7284 3.9726 3.9726 8.1794 8.1794 8.5378 8.5378 8.8285 8.8285 8.8490 8.8490 9.0493 9.0493 9.4261 9.4261 9.4941 9.4941 9.5322 9.5322 9.6399 9.6399 9.6973 9.6973 10.7404 10.7404 10.8815 10.8815 13.1516 13.1516 13.3045 13.3045 14.5774 14.5774 15.3424 15.3424 15.9484 15.9484 16.1726 16.1726 k = 0.1705 0.0984 0.2784 ( 2415 PWs) bands (ev): -36.6689 -36.6689 -15.6865 -15.6865 -15.1878 -15.1878 -15.1803 -15.1803 -2.1936 -2.1936 -2.1909 -2.1909 -1.7404 -1.7404 -1.7343 -1.7343 -1.7288 -1.7288 3.9030 3.9030 8.2079 8.2079 8.5322 8.5322 8.8243 8.8243 8.8414 8.8414 9.0337 9.0337 9.4431 9.4431 9.5042 9.5042 9.5742 9.5742 9.6531 9.6531 9.7055 9.7055 10.7794 10.7794 10.9540 10.9540 13.2105 13.2105 13.2488 13.2488 14.5422 14.5422 15.3222 15.3222 15.9820 15.9820 16.3111 16.3111 k = 0.1636 0.0945 0.2672 ( 2425 PWs) bands (ev): -36.6689 -36.6689 -15.6861 -15.6861 -15.1872 -15.1872 -15.1801 -15.1801 -2.1938 -2.1938 -2.1913 -2.1913 -1.7407 -1.7407 -1.7345 -1.7345 -1.7293 -1.7293 3.8353 3.8353 8.2357 8.2357 8.5276 8.5276 8.8177 8.8177 8.8337 8.8337 9.0179 9.0179 9.4574 9.4574 9.5136 9.5136 9.6145 9.6145 9.6679 9.6679 9.7152 9.7152 10.8227 10.8227 11.0295 11.0295 13.1888 13.1888 13.2751 13.2751 14.5082 14.5082 15.3005 15.3005 16.0110 16.0110 16.4553 16.4553 k = 0.1568 0.0905 0.2561 ( 2427 PWs) bands (ev): -36.6690 -36.6690 -15.6858 -15.6858 -15.1866 -15.1866 -15.1798 -15.1798 -2.1940 -2.1940 -2.1916 -2.1916 -1.7410 -1.7410 -1.7347 -1.7347 -1.7298 -1.7298 3.7697 3.7697 8.2627 8.2627 8.5239 8.5239 8.8094 8.8094 8.8260 8.8260 9.0022 9.0022 9.4701 9.4701 9.5224 9.5224 9.6462 9.6462 9.6883 9.6883 9.7277 9.7277 10.8710 10.8710 11.1076 11.1076 13.1329 13.1329 13.3370 13.3370 14.4760 14.4760 15.2789 15.2789 16.0349 16.0349 16.6030 16.6030 k = 0.1500 0.0866 0.2449 ( 2439 PWs) bands (ev): -36.6690 -36.6690 -15.6854 -15.6854 -15.1861 -15.1861 -15.1797 -15.1797 -2.1944 -2.1944 -2.1920 -2.1920 -1.7413 -1.7413 -1.7349 -1.7349 -1.7303 -1.7303 3.7062 3.7062 8.2888 8.2888 8.5212 8.5212 8.7999 8.7999 8.8182 8.8182 8.9863 8.9863 9.4816 9.4816 9.5306 9.5306 9.6648 9.6648 9.7151 9.7151 9.7452 9.7452 10.9244 10.9244 11.1877 11.1877 13.0772 13.0772 13.4002 13.4002 14.4461 14.4461 15.2583 15.2583 16.0531 16.0531 16.7525 16.7525 k = 0.1432 0.0827 0.2338 ( 2441 PWs) bands (ev): -36.6691 -36.6691 -15.6851 -15.6851 -15.1855 -15.1855 -15.1794 -15.1794 -2.1946 -2.1946 -2.1923 -2.1923 -1.7416 -1.7416 -1.7351 -1.7351 -1.7308 -1.7308 3.6450 3.6450 8.3140 8.3140 8.5194 8.5194 8.7898 8.7898 8.8103 8.8103 8.9705 8.9705 9.4920 9.4920 9.5379 9.5379 9.6758 9.6758 9.7389 9.7389 9.7711 9.7711 10.9831 10.9831 11.2694 11.2694 13.0223 13.0223 13.4645 13.4645 14.4190 14.4190 15.2392 15.2392 16.0656 16.0656 16.9027 16.9027 k = 0.1364 0.0787 0.2227 ( 2445 PWs) bands (ev): -36.6691 -36.6691 -15.6847 -15.6847 -15.1849 -15.1849 -15.1792 -15.1792 -2.1948 -2.1948 -2.1927 -2.1927 -1.7419 -1.7419 -1.7353 -1.7353 -1.7313 -1.7313 3.5861 3.5861 8.3383 8.3383 8.5186 8.5186 8.7793 8.7793 8.8025 8.8025 8.9547 8.9547 9.5015 9.5015 9.5445 9.5445 9.6834 9.6834 9.7582 9.7582 9.8019 9.8019 11.0468 11.0468 11.3521 11.3521 12.9684 12.9684 13.5297 13.5297 14.3953 14.3953 15.2219 15.2219 16.0721 16.0721 17.0520 17.0520 k = 0.1295 0.0748 0.2115 ( 2441 PWs) bands (ev): -36.6692 -36.6692 -15.6843 -15.6843 -15.1842 -15.1842 -15.1790 -15.1790 -2.1949 -2.1949 -2.1930 -2.1930 -1.7421 -1.7421 -1.7354 -1.7354 -1.7317 -1.7317 3.5297 3.5297 8.3615 8.3615 8.5189 8.5189 8.7686 8.7686 8.7946 8.7946 8.9390 8.9390 9.5102 9.5102 9.5504 9.5504 9.6894 9.6894 9.7766 9.7766 9.8323 9.8323 11.1154 11.1154 11.4352 11.4352 12.9155 12.9155 13.5959 13.5959 14.3758 14.3758 15.2065 15.2065 16.0730 16.0730 17.1857 17.1857 k = 0.1227 0.0709 0.2004 ( 2437 PWs) bands (ev): -36.6693 -36.6693 -15.6839 -15.6839 -15.1836 -15.1836 -15.1788 -15.1788 -2.1951 -2.1951 -2.1933 -2.1933 -1.7423 -1.7423 -1.7356 -1.7356 -1.7321 -1.7321 3.4757 3.4757 8.3837 8.3837 8.5199 8.5199 8.7579 8.7579 8.7867 8.7867 8.9234 8.9234 9.5182 9.5182 9.5555 9.5555 9.6944 9.6944 9.7952 9.7952 9.8604 9.8604 11.1883 11.1883 11.5180 11.5180 12.8639 12.8639 13.6631 13.6631 14.3608 14.3608 15.1930 15.1930 16.0684 16.0684 17.0982 17.0982 k = 0.1159 0.0669 0.1893 ( 2441 PWs) bands (ev): -36.6693 -36.6693 -15.6836 -15.6836 -15.1830 -15.1830 -15.1786 -15.1786 -2.1953 -2.1953 -2.1936 -2.1936 -1.7426 -1.7426 -1.7358 -1.7358 -1.7326 -1.7326 3.4244 3.4244 8.4048 8.4048 8.5219 8.5219 8.7474 8.7474 8.7789 8.7789 8.9078 8.9078 9.5255 9.5255 9.5599 9.5599 9.6986 9.6986 9.8140 9.8140 9.8857 9.8857 11.2649 11.2649 11.5999 11.5999 12.8136 12.8136 13.7311 13.7311 14.3511 14.3511 15.1817 15.1817 16.0588 16.0588 17.0042 17.0042 k = 0.1091 0.0630 0.1781 ( 2441 PWs) bands (ev): -36.6694 -36.6694 -15.6832 -15.6832 -15.1824 -15.1824 -15.1785 -15.1785 -2.1955 -2.1955 -2.1939 -2.1939 -1.7428 -1.7428 -1.7359 -1.7359 -1.7330 -1.7330 3.3757 3.3757 8.4247 8.4247 8.5248 8.5248 8.7372 8.7372 8.7711 8.7711 8.8924 8.8924 9.5322 9.5322 9.5636 9.5636 9.7023 9.7023 9.8331 9.8331 9.9082 9.9082 11.3448 11.3448 11.6801 11.6801 12.7648 12.7648 13.7999 13.7999 14.3473 14.3473 15.1726 15.1726 16.0447 16.0447 16.9078 16.9078 k = 0.1023 0.0590 0.1670 ( 2425 PWs) bands (ev): -36.6694 -36.6694 -15.6829 -15.6829 -15.1818 -15.1818 -15.1782 -15.1782 -2.1955 -2.1955 -2.1941 -2.1941 -1.7429 -1.7429 -1.7360 -1.7360 -1.7334 -1.7334 3.3297 3.3297 8.4435 8.4435 8.5288 8.5288 8.7275 8.7275 8.7636 8.7636 8.8772 8.8772 9.5383 9.5383 9.5668 9.5668 9.7056 9.7056 9.8524 9.8524 9.9281 9.9281 11.4272 11.4272 11.7580 11.7580 12.7179 12.7179 13.8696 13.8696 14.3498 14.3498 15.1658 15.1658 16.0266 16.0266 16.8100 16.8100 k = 0.0955 0.0551 0.1559 ( 2431 PWs) bands (ev): -36.6694 -36.6694 -15.6826 -15.6826 -15.1813 -15.1813 -15.1781 -15.1781 -2.1957 -2.1957 -2.1945 -2.1945 -1.7431 -1.7431 -1.7361 -1.7361 -1.7339 -1.7339 3.2864 3.2864 8.4610 8.4610 8.5334 8.5334 8.7181 8.7181 8.7561 8.7561 8.8621 8.8621 9.5438 9.5438 9.5694 9.5694 9.7085 9.7085 9.8714 9.8714 9.9455 9.9455 11.5110 11.5110 11.8326 11.8326 12.6727 12.6727 13.9399 13.9399 14.3590 14.3590 15.1615 15.1615 16.0050 16.0050 16.7115 16.7115 k = 0.0886 0.0512 0.1447 ( 2431 PWs) bands (ev): -36.6695 -36.6695 -15.6823 -15.6823 -15.1808 -15.1808 -15.1780 -15.1780 -2.1959 -2.1959 -2.1948 -2.1948 -1.7433 -1.7433 -1.7363 -1.7363 -1.7343 -1.7343 3.2460 3.2460 8.4772 8.4772 8.5390 8.5390 8.7094 8.7094 8.7487 8.7487 8.8472 8.8472 9.5487 9.5487 9.5714 9.5714 9.7110 9.7110 9.8903 9.8903 9.9608 9.9608 11.5957 11.5957 11.9032 11.9032 12.6296 12.6296 14.0109 14.0109 14.3752 14.3752 15.1602 15.1602 15.9805 15.9805 16.6131 16.6131 k = 0.0818 0.0472 0.1336 ( 2427 PWs) bands (ev): -36.6695 -36.6695 -15.6820 -15.6820 -15.1803 -15.1803 -15.1778 -15.1778 -2.1960 -2.1960 -2.1950 -2.1950 -1.7435 -1.7435 -1.7364 -1.7364 -1.7347 -1.7347 3.2083 3.2083 8.4922 8.4922 8.5454 8.5454 8.7012 8.7012 8.7416 8.7416 8.8326 8.8326 9.5532 9.5532 9.5730 9.5730 9.7133 9.7133 9.9088 9.9088 9.9741 9.9741 11.6804 11.6804 11.9693 11.9693 12.5888 12.5888 14.0823 14.0823 14.3985 14.3985 15.1621 15.1621 15.9535 15.9535 16.5153 16.5153 k = 0.0750 0.0433 0.1225 ( 2439 PWs) bands (ev): -36.6696 -36.6696 -15.6817 -15.6817 -15.1798 -15.1798 -15.1777 -15.1777 -2.1962 -2.1962 -2.1954 -2.1954 -1.7438 -1.7438 -1.7366 -1.7366 -1.7351 -1.7351 3.1736 3.1736 8.5059 8.5059 8.5524 8.5524 8.6938 8.6938 8.7345 8.7345 8.8183 8.8183 9.5572 9.5572 9.5742 9.5742 9.7154 9.7154 9.9264 9.9264 9.9855 9.9855 11.7639 11.7639 12.0302 12.0302 12.5502 12.5502 14.1539 14.1539 14.4284 14.4284 15.1680 15.1680 15.9245 15.9245 16.4187 16.4187 k = 0.0682 0.0394 0.1113 ( 2427 PWs) bands (ev): -36.6696 -36.6696 -15.6814 -15.6814 -15.1793 -15.1793 -15.1776 -15.1776 -2.1962 -2.1962 -2.1955 -2.1955 -1.7438 -1.7438 -1.7366 -1.7366 -1.7354 -1.7354 3.1417 3.1417 8.5187 8.5187 8.5599 8.5599 8.6872 8.6872 8.7277 8.7277 8.8045 8.8045 9.5609 9.5609 9.5752 9.5752 9.7172 9.7172 9.9435 9.9435 9.9955 9.9955 11.8457 11.8457 12.0856 12.0856 12.5144 12.5144 14.2256 14.2256 14.4642 14.4642 15.1787 15.1787 15.8939 15.8939 16.3237 16.3237 k = 0.0614 0.0354 0.1002 ( 2419 PWs) bands (ev): -36.6696 -36.6696 -15.6812 -15.6812 -15.1789 -15.1789 -15.1775 -15.1775 -2.1963 -2.1963 -2.1957 -2.1957 -1.7439 -1.7439 -1.7367 -1.7367 -1.7356 -1.7356 3.1129 3.1129 8.5304 8.5304 8.5675 8.5675 8.6814 8.6814 8.7209 8.7209 8.7911 8.7911 9.5640 9.5640 9.5759 9.5759 9.7189 9.7189 9.9596 9.9596 10.0040 10.0040 11.9246 11.9246 12.1351 12.1351 12.4814 12.4814 14.2970 14.2970 14.5046 14.5046 15.1955 15.1955 15.8622 15.8622 16.2311 16.2311 k = 0.0545 0.0315 0.0891 ( 2421 PWs) bands (ev): -36.6697 -36.6697 -15.6810 -15.6810 -15.1785 -15.1785 -15.1774 -15.1774 -2.1964 -2.1964 -2.1959 -2.1959 -1.7441 -1.7441 -1.7368 -1.7368 -1.7359 -1.7359 3.0869 3.0869 8.5415 8.5415 8.5750 8.5750 8.6765 8.6765 8.7141 8.7141 8.7783 8.7783 9.5668 9.5668 9.5763 9.5763 9.7203 9.7203 9.9746 9.9746 10.0114 10.0114 11.9993 11.9993 12.1786 12.1786 12.4513 12.4513 14.3676 14.3676 14.5476 14.5476 15.2198 15.2198 15.8301 15.8301 16.1416 16.1416 k = 0.0477 0.0276 0.0779 ( 2427 PWs) bands (ev): -36.6697 -36.6697 -15.6808 -15.6808 -15.1782 -15.1782 -15.1773 -15.1773 -2.1965 -2.1965 -2.1962 -2.1962 -1.7442 -1.7442 -1.7369 -1.7369 -1.7363 -1.7363 3.0640 3.0640 8.5519 8.5519 8.5819 8.5819 8.6725 8.6725 8.7074 8.7074 8.7662 8.7662 9.5692 9.5692 9.5766 9.5766 9.7215 9.7215 9.9882 9.9882 10.0175 10.0175 12.0688 12.0688 12.2161 12.2161 12.4245 12.4245 14.4368 14.4368 14.5910 14.5910 15.2532 15.2532 15.7980 15.7980 16.0560 16.0560 k = 0.0409 0.0236 0.0668 ( 2431 PWs) bands (ev): -36.6697 -36.6697 -15.6807 -15.6807 -15.1779 -15.1779 -15.1773 -15.1773 -2.1966 -2.1966 -2.1964 -2.1964 -1.7444 -1.7444 -1.7370 -1.7370 -1.7365 -1.7365 3.0441 3.0441 8.5620 8.5620 8.5880 8.5880 8.6696 8.6696 8.7005 8.7005 8.7551 8.7551 9.5712 9.5712 9.5767 9.5767 9.7226 9.7226 10.0004 10.0004 10.0227 10.0227 12.1318 12.1318 12.2480 12.2480 12.4012 12.4012 14.5038 14.5038 14.6321 14.6321 15.2972 15.2972 15.7667 15.7667 15.9758 15.9758 k = 0.0341 0.0197 0.0557 ( 2431 PWs) bands (ev): -36.6697 -36.6697 -15.6805 -15.6805 -15.1777 -15.1777 -15.1772 -15.1772 -2.1967 -2.1967 -2.1965 -2.1965 -1.7445 -1.7445 -1.7370 -1.7370 -1.7367 -1.7367 3.0272 3.0272 8.5717 8.5717 8.5932 8.5932 8.6677 8.6677 8.6936 8.6936 8.7452 8.7452 9.5730 9.5730 9.5768 9.5768 9.7235 9.7235 10.0110 10.0110 10.0269 10.0269 12.1868 12.1868 12.2746 12.2746 12.3816 12.3816 14.5672 14.5672 14.6685 14.6685 15.3524 15.3524 15.7371 15.7371 15.9027 15.9027 k = 0.0273 0.0157 0.0445 ( 2425 PWs) bands (ev): -36.6698 -36.6698 -15.6804 -15.6804 -15.1775 -15.1775 -15.1771 -15.1771 -2.1967 -2.1967 -2.1966 -2.1966 -1.7445 -1.7445 -1.7370 -1.7370 -1.7368 -1.7368 3.0134 3.0134 8.5809 8.5809 8.5972 8.5972 8.6668 8.6668 8.6866 8.6866 8.7367 8.7367 9.5744 9.5744 9.5768 9.5768 9.7243 9.7243 10.0199 10.0199 10.0303 10.0303 12.2321 12.2321 12.2966 12.2966 12.3663 12.3663 14.6254 14.6254 14.6987 14.6987 15.4173 15.4173 15.7104 15.7104 15.8392 15.8392 k = 0.0205 0.0118 0.0334 ( 2425 PWs) bands (ev): -36.6698 -36.6698 -15.6803 -15.6803 -15.1773 -15.1773 -15.1771 -15.1771 -2.1968 -2.1968 -2.1967 -2.1967 -1.7446 -1.7446 -1.7371 -1.7371 -1.7370 -1.7370 3.0026 3.0026 8.5894 8.5894 8.6002 8.6002 8.6667 8.6667 8.6797 8.6797 8.7298 8.7298 9.5754 9.5754 9.5768 9.5768 9.7248 9.7248 10.0269 10.0269 10.0329 10.0329 12.2654 12.2654 12.3153 12.3153 12.3556 12.3556 14.6759 14.6759 14.7219 14.7219 15.4866 15.4866 15.6896 15.6896 15.7882 15.7882 k = 0.0136 0.0079 0.0223 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1772 -15.1772 -15.1771 -15.1771 -2.1968 -2.1968 -2.1967 -2.1967 -1.7446 -1.7446 -1.7371 -1.7371 -1.7370 -1.7370 2.9949 2.9949 8.5966 8.5966 8.6021 8.6021 8.6670 8.6670 8.6736 8.6736 8.7248 8.7248 9.5762 9.5762 9.5768 9.5768 9.7253 9.7253 10.0320 10.0320 10.0347 10.0347 12.2850 12.2850 12.3314 12.3314 12.3498 12.3498 14.7158 14.7158 14.7381 14.7381 15.5456 15.5456 15.6846 15.6846 15.7522 15.7522 k = 0.0068 0.0039 0.0111 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1968 -2.1968 -1.7446 -1.7446 -1.7371 -1.7371 -1.7371 -1.7371 2.9903 2.9903 8.6017 8.6017 8.6032 8.6032 8.6673 8.6673 8.6691 8.6691 8.7217 8.7217 9.5767 9.5767 9.5768 9.5768 9.7255 9.7255 10.0351 10.0351 10.0357 10.0357 12.2934 12.2934 12.3431 12.3431 12.3477 12.3477 14.7416 14.7416 14.7475 14.7475 15.5722 15.5722 15.7069 15.7069 15.7315 15.7315 k = 0.0000 0.0000 0.0000 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1968 -2.1968 -1.7447 -1.7447 -1.7371 -1.7371 -1.7371 -1.7371 2.9887 2.9887 8.6036 8.6036 8.6036 8.6036 8.6675 8.6675 8.6675 8.6675 8.7206 8.7206 9.5768 9.5768 9.5768 9.5768 9.7256 9.7256 10.0361 10.0361 10.0361 10.0361 12.2955 12.2955 12.3474 12.3474 12.3474 12.3474 14.7506 14.7506 14.7506 14.7506 15.5762 15.5762 15.7248 15.7248 15.7248 15.7248 k = 0.0000 0.0000 0.0000 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1968 -2.1968 -1.7447 -1.7447 -1.7371 -1.7371 -1.7371 -1.7371 2.9887 2.9887 8.6036 8.6036 8.6036 8.6036 8.6675 8.6675 8.6675 8.6675 8.7206 8.7206 9.5768 9.5768 9.5768 9.5768 9.7256 9.7256 10.0361 10.0361 10.0361 10.0361 12.2955 12.2955 12.3474 12.3474 12.3474 12.3474 14.7506 14.7506 14.7506 14.7506 15.5762 15.5762 15.7248 15.7248 15.7248 15.7248 k = 0.0111 0.0064 0.0045 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1771 -15.1771 -15.1771 -15.1771 -2.1968 -2.1968 -2.1968 -2.1968 -1.7446 -1.7446 -1.7371 -1.7371 -1.7371 -1.7371 2.9903 2.9903 8.6022 8.6022 8.6027 8.6027 8.6672 8.6672 8.6693 8.6693 8.7216 8.7216 9.5767 9.5767 9.5768 9.5768 9.7255 9.7255 10.0354 10.0354 10.0355 10.0355 12.2933 12.2933 12.3430 12.3430 12.3480 12.3480 14.7443 14.7443 14.7449 14.7449 15.5719 15.5719 15.7065 15.7065 15.7323 15.7323 k = 0.0222 0.0128 0.0091 ( 2421 PWs) bands (ev): -36.6698 -36.6698 -15.6802 -15.6802 -15.1772 -15.1772 -15.1771 -15.1771 -2.1968 -2.1968 -2.1967 -2.1967 -1.7446 -1.7446 -1.7371 -1.7371 -1.7370 -1.7370 2.9949 2.9949 8.5986 8.5986 8.6002 8.6002 8.6663 8.6663 8.6742 8.6742 8.7248 8.7248 9.5762 9.5762 9.5769 9.5769 9.7253 9.7253 10.0332 10.0332 10.0335 10.0335 12.2833 12.2833 12.3332 12.3332 12.3497 12.3497 14.7262 14.7262 14.7283 14.7283 15.5401 15.5401 15.6886 15.6886 15.7543 15.7543 k = 0.0333 0.0192 0.0136 ( 2424 PWs) bands (ev): -36.6698 -36.6698 -15.6803 -15.6803 -15.1773 -15.1773 -15.1771 -15.1771 -2.1967 -2.1967 -2.1967 -2.1967 -1.7446 -1.7446 -1.7371 -1.7371 -1.7370 -1.7370 3.0025 3.0025 8.5934 8.5934 8.5964 8.5964 8.6646 8.6646 8.6816 8.6816 8.7298 8.7298 9.5754 9.5754 9.5769 9.5769 9.7248 9.7248 10.0295 10.0295 10.0303 10.0303 12.2570 12.2570 12.3269 12.3269 12.3525 12.3525 14.6980 14.6980 14.7024 14.7024 15.4689 15.4689 15.7072 15.7072 15.7894 15.7894 k = 0.0444 0.0257 0.0181 ( 2430 PWs) bands (ev): -36.6698 -36.6698 -15.6804 -15.6804 -15.1775 -15.1775 -15.1772 -15.1772 -2.1967 -2.1967 -2.1967 -2.1967 -1.7446 -1.7446 -1.7371 -1.7371 -1.7369 -1.7369 3.0133 3.0133 8.5875 8.5875 8.5916 8.5916 8.6621 8.6621 8.6905 8.6905 8.7365 8.7365 9.5742 9.5742 9.5770 9.5770 9.7242 9.7242 10.0244 10.0244 10.0258 10.0258 12.2126 12.2126 12.3264 12.3264 12.3563 12.3563 14.6623 14.6623 14.6690 14.6690 15.3820 15.3820 15.7493 15.7493 15.8355 15.8355 k = 0.0556 0.0321 0.0227 ( 2430 PWs) bands (ev): -36.6697 -36.6697 -15.6805 -15.6805 -15.1777 -15.1777 -15.1772 -15.1772 -2.1966 -2.1966 -2.1966 -2.1966 -1.7445 -1.7445 -1.7370 -1.7370 -1.7367 -1.7367 3.0270 3.0270 8.5814 8.5814 8.5860 8.5860 8.6588 8.6588 8.7006 8.7006 8.7446 8.7446 9.5727 9.5727 9.5770 9.5770 9.7235 9.7235 10.0179 10.0179 10.0201 10.0201 12.1532 12.1532 12.3293 12.3293 12.3611 12.3611 14.6215 14.6215 14.6304 14.6304 15.2932 15.2932 15.8043 15.8043 15.8906 15.8906 k = 0.0667 0.0385 0.0272 ( 2427 PWs) bands (ev): -36.6697 -36.6697 -15.6807 -15.6807 -15.1779 -15.1779 -15.1772 -15.1772 -2.1966 -2.1966 -2.1964 -2.1964 -1.7444 -1.7444 -1.7369 -1.7369 -1.7365 -1.7365 3.0439 3.0439 8.5753 8.5753 8.5800 8.5800 8.6546 8.6546 8.7115 8.7115 8.7539 8.7539 9.5710 9.5710 9.5770 9.5770 9.7227 9.7227 10.0101 10.0101 10.0132 10.0132 12.0812 12.0812 12.3340 12.3340 12.3668 12.3668 14.5775 14.5775 14.5882 14.5882 15.2075 15.2075 15.8679 15.8679 15.9529 15.9529 k = 0.0778 0.0449 0.0318 ( 2427 PWs) bands (ev): -36.6697 -36.6697 -15.6808 -15.6808 -15.1783 -15.1783 -15.1773 -15.1773 -2.1964 -2.1964 -2.1963 -2.1963 -1.7442 -1.7442 -1.7369 -1.7369 -1.7363 -1.7363 3.0637 3.0637 8.5694 8.5694 8.5735 8.5735 8.6498 8.6498 8.7230 8.7230 8.7642 8.7642 9.5689 9.5689 9.5769 9.5769 9.7217 9.7217 10.0009 10.0009 10.0052 10.0052 11.9979 11.9979 12.3398 12.3398 12.3733 12.3733 14.5320 14.5320 14.5441 14.5441 15.1266 15.1266 15.9376 15.9376 16.0208 16.0208 k = 0.0889 0.0513 0.0363 ( 2430 PWs) bands (ev): -36.6697 -36.6697 -15.6810 -15.6810 -15.1786 -15.1786 -15.1774 -15.1774 -2.1963 -2.1963 -2.1961 -2.1961 -1.7441 -1.7441 -1.7368 -1.7368 -1.7360 -1.7360 3.0865 3.0865 8.5639 8.5639 8.5667 8.5667 8.6444 8.6444 8.7350 8.7350 8.7751 8.7751 9.5665 9.5665 9.5766 9.5766 9.7205 9.7205 9.9905 9.9905 9.9960 9.9960 11.9048 11.9048 12.3466 12.3466 12.3803 12.3803 14.4861 14.4861 14.4993 14.4993 15.0512 15.0512 16.0119 16.0119 16.0932 16.0932 k = 0.1000 0.0577 0.0408 ( 2430 PWs) bands (ev): -36.6696 -36.6696 -15.6812 -15.6812 -15.1790 -15.1790 -15.1774 -15.1774 -2.1962 -2.1962 -2.1960 -2.1960 -1.7440 -1.7440 -1.7367 -1.7367 -1.7357 -1.7357 3.1124 3.1124 8.5588 8.5588 8.5596 8.5596 8.6386 8.6386 8.7474 8.7474 8.7867 8.7867 9.5638 9.5638 9.5761 9.5761 9.7191 9.7191 9.9788 9.9788 9.9858 9.9858 11.8033 11.8033 12.3539 12.3539 12.3877 12.3877 14.4410 14.4410 14.4548 14.4548 14.9815 14.9815 16.0896 16.0896 16.1690 16.1690 k = 0.1111 0.0642 0.0454 ( 2424 PWs) bands (ev): -36.6696 -36.6696 -15.6814 -15.6814 -15.1794 -15.1794 -15.1775 -15.1775 -2.1960 -2.1960 -2.1957 -2.1957 -1.7438 -1.7438 -1.7366 -1.7366 -1.7353 -1.7353 3.1412 3.1412 8.5519 8.5519 8.5542 8.5542 8.6327 8.6327 8.7601 8.7601 8.7988 8.7988 9.5607 9.5607 9.5754 9.5754 9.7175 9.7175 9.9661 9.9661 9.9747 9.9747 11.6946 11.6946 12.3615 12.3615 12.3955 12.3955 14.3973 14.3973 14.4116 14.4116 14.9174 14.9174 16.1699 16.1699 16.2475 16.2475 k = 0.1222 0.0706 0.0499 ( 2430 PWs) bands (ev): -36.6696 -36.6696 -15.6817 -15.6817 -15.1799 -15.1799 -15.1776 -15.1776 -2.1959 -2.1959 -2.1955 -2.1955 -1.7436 -1.7436 -1.7366 -1.7366 -1.7350 -1.7350 3.1729 3.1729 8.5436 8.5436 8.5501 8.5501 8.6269 8.6269 8.7731 8.7731 8.8112 8.8112 9.5573 9.5573 9.5743 9.5743 9.7157 9.7157 9.9521 9.9521 9.9625 9.9625 11.5797 11.5797 12.3693 12.3693 12.4032 12.4032 14.3558 14.3558 14.3702 14.3702 14.8585 14.8585 16.2522 16.2522 16.3279 16.3279 k = 0.1333 0.0770 0.0544 ( 2424 PWs) bands (ev): -36.6695 -36.6695 -15.6819 -15.6819 -15.1804 -15.1804 -15.1777 -15.1777 -2.1957 -2.1957 -2.1952 -2.1952 -1.7434 -1.7434 -1.7364 -1.7364 -1.7345 -1.7345 3.2075 3.2075 8.5344 8.5344 8.5465 8.5465 8.6214 8.6214 8.7863 8.7863 8.8240 8.8240 9.5536 9.5536 9.5729 9.5729 9.7138 9.7138 9.9373 9.9373 9.9496 9.9496 11.4601 11.4601 12.3771 12.3771 12.4108 12.4108 14.3169 14.3169 14.3312 14.3312 14.8045 14.8045 16.3358 16.3358 16.4097 16.4097 k = 0.1444 0.0834 0.0590 ( 2439 PWs) bands (ev): -36.6695 -36.6695 -15.6823 -15.6823 -15.1810 -15.1810 -15.1778 -15.1778 -2.1956 -2.1956 -2.1951 -2.1951 -1.7433 -1.7433 -1.7364 -1.7364 -1.7343 -1.7343 3.2450 3.2450 8.5241 8.5241 8.5434 8.5434 8.6163 8.6163 8.7997 8.7997 8.8369 8.8369 9.5496 9.5496 9.5712 9.5712 9.7115 9.7115 9.9213 9.9213 9.9357 9.9357 11.3368 11.3368 12.3844 12.3844 12.4180 12.4180 14.2811 14.2811 14.2952 14.2952 14.7550 14.7550 16.4203 16.4203 16.4924 16.4924 k = 0.1556 0.0898 0.0635 ( 2433 PWs) bands (ev): -36.6694 -36.6694 -15.6826 -15.6826 -15.1815 -15.1815 -15.1779 -15.1779 -2.1954 -2.1954 -2.1948 -2.1948 -1.7431 -1.7431 -1.7362 -1.7362 -1.7338 -1.7338 3.2854 3.2854 8.5123 8.5123 8.5410 8.5410 8.6121 8.6121 8.8132 8.8132 8.8500 8.8500 9.5452 9.5452 9.5690 9.5690 9.7089 9.7089 9.9046 9.9046 9.9214 9.9214 11.2110 11.2110 12.3913 12.3913 12.4246 12.4246 14.2489 14.2489 14.2627 14.2627 14.7098 14.7098 16.5053 16.5053 16.5755 16.5755 k = 0.1667 0.0962 0.0680 ( 2433 PWs) bands (ev): -36.6694 -36.6694 -15.6829 -15.6829 -15.1821 -15.1821 -15.1780 -15.1780 -2.1952 -2.1952 -2.1945 -2.1945 -1.7429 -1.7429 -1.7361 -1.7361 -1.7334 -1.7334 3.3285 3.3285 8.4990 8.4990 8.5391 8.5391 8.6087 8.6087 8.8269 8.8269 8.8633 8.8633 9.5405 9.5405 9.5664 9.5664 9.7060 9.7060 9.8870 9.8870 9.9063 9.9063 11.0836 11.0836 12.3975 12.3975 12.4304 12.4304 14.2206 14.2206 14.2339 14.2339 14.6683 14.6683 16.5903 16.5903 16.6586 16.6586 k = 0.1778 0.1026 0.0726 ( 2418 PWs) bands (ev): -36.6694 -36.6694 -15.6831 -15.6831 -15.1826 -15.1826 -15.1781 -15.1781 -2.1949 -2.1949 -2.1941 -2.1941 -1.7425 -1.7425 -1.7359 -1.7359 -1.7328 -1.7328 3.3744 3.3744 8.4837 8.4837 8.5379 8.5379 8.6065 8.6065 8.8407 8.8407 8.8767 8.8767 9.5355 9.5355 9.5634 9.5634 9.7028 9.7028 9.8688 9.8688 9.8907 9.8907 10.9559 10.9559 12.4027 12.4027 12.4352 12.4352 14.1965 14.1965 14.2094 14.2094 14.6304 14.6304 16.6750 16.6750 16.7414 16.7414 k = 0.1889 0.1091 0.0771 ( 2424 PWs) bands (ev): -36.6693 -36.6693 -15.6835 -15.6835 -15.1833 -15.1833 -15.1782 -15.1782 -2.1947 -2.1947 -2.1939 -2.1939 -1.7424 -1.7424 -1.7357 -1.7357 -1.7323 -1.7323 3.4230 3.4230 8.4663 8.4663 8.5372 8.5372 8.6052 8.6052 8.8545 8.8545 8.8900 8.8900 9.5301 9.5301 9.5598 9.5598 9.6989 9.6989 9.8497 9.8497 9.8745 9.8745 10.8287 10.8287 12.4067 12.4067 12.4386 12.4386 14.1768 14.1768 14.1892 14.1892 14.5957 14.5957 16.7589 16.7589 16.8232 16.8232 k = 0.2000 0.1155 0.0816 ( 2430 PWs) bands (ev): -36.6693 -36.6693 -15.6839 -15.6839 -15.1840 -15.1840 -15.1783 -15.1783 -2.1946 -2.1946 -2.1936 -2.1936 -1.7421 -1.7421 -1.7356 -1.7356 -1.7319 -1.7319 3.4742 3.4742 8.4466 8.4466 8.5371 8.5371 8.6049 8.6049 8.8683 8.8683 8.9033 8.9033 9.5244 9.5244 9.5557 9.5557 9.6944 9.6944 9.8299 9.8299 9.8578 9.8578 10.7031 10.7031 12.4095 12.4095 12.4407 12.4407 14.1616 14.1616 14.1736 14.1736 14.5640 14.5640 16.8417 16.8417 16.9038 16.9038 k = 0.2111 0.1219 0.0862 ( 2430 PWs) bands (ev): -36.6692 -36.6692 -15.6842 -15.6842 -15.1846 -15.1846 -15.1784 -15.1784 -2.1943 -2.1943 -2.1933 -2.1933 -1.7419 -1.7419 -1.7355 -1.7355 -1.7314 -1.7314 3.5281 3.5281 8.4242 8.4242 8.5376 8.5376 8.6056 8.6056 8.8821 8.8821 8.9166 8.9166 9.5184 9.5184 9.5510 9.5510 9.6892 9.6892 9.8097 9.8097 9.8409 9.8409 10.5802 10.5802 12.4109 12.4109 12.4413 12.4413 14.1513 14.1513 14.1629 14.1629 14.5351 14.5351 16.8997 16.8997 16.9230 16.9230 k = 0.2222 0.1283 0.0907 ( 2424 PWs) bands (ev): -36.6692 -36.6692 -15.6846 -15.6846 -15.1853 -15.1853 -15.1786 -15.1786 -2.1941 -2.1941 -2.1929 -2.1929 -1.7416 -1.7416 -1.7353 -1.7353 -1.7308 -1.7308 3.5845 3.5845 8.3987 8.3987 8.5386 8.5386 8.6074 8.6074 8.8960 8.8960 8.9297 8.9297 9.5121 9.5121 9.5458 9.5458 9.6831 9.6831 9.7888 9.7888 9.8238 9.8238 10.4612 10.4612 12.4109 12.4109 12.4403 12.4403 14.1459 14.1459 14.1572 14.1572 14.5087 14.5087 16.7826 16.7826 17.0020 17.0020 k = 0.2333 0.1347 0.0953 ( 2430 PWs) bands (ev): -36.6691 -36.6691 -15.6850 -15.6850 -15.1860 -15.1860 -15.1787 -15.1787 -2.1939 -2.1939 -2.1926 -2.1926 -1.7414 -1.7414 -1.7352 -1.7352 -1.7303 -1.7303 3.6433 3.6433 8.3698 8.3698 8.5402 8.5402 8.6100 8.6100 8.9098 8.9098 8.9427 8.9427 9.5053 9.5053 9.5398 9.5398 9.6758 9.6758 9.7672 9.7672 9.8064 9.8064 10.3473 10.3473 12.4093 12.4093 12.4376 12.4376 14.1454 14.1454 14.1564 14.1564 14.4848 14.4848 16.6631 16.6631 17.0783 17.0783 k = 0.2444 0.1411 0.0998 ( 2442 PWs) bands (ev): -36.6691 -36.6691 -15.6854 -15.6854 -15.1867 -15.1867 -15.1789 -15.1789 -2.1938 -2.1938 -2.1924 -2.1924 -1.7412 -1.7412 -1.7351 -1.7351 -1.7299 -1.7299 3.7045 3.7045 8.3369 8.3369 8.5422 8.5422 8.6134 8.6134 8.9235 8.9235 8.9554 8.9554 9.4982 9.4982 9.5330 9.5330 9.6673 9.6673 9.7447 9.7447 9.7889 9.7889 10.2400 10.2400 12.4062 12.4062 12.4333 12.4333 14.1497 14.1497 14.1605 14.1605 14.4632 14.4632 16.5429 16.5429 17.1509 17.1509 k = 0.2556 0.1475 0.1043 ( 2439 PWs) bands (ev): -36.6690 -36.6690 -15.6857 -15.6857 -15.1873 -15.1873 -15.1790 -15.1790 -2.1935 -2.1935 -2.1920 -2.1920 -1.7409 -1.7409 -1.7349 -1.7349 -1.7293 -1.7293 3.7681 3.7681 8.2997 8.2997 8.5448 8.5448 8.6177 8.6177 8.9372 8.9372 8.9680 8.9680 9.4908 9.4908 9.5253 9.5253 9.6573 9.6573 9.7212 9.7212 9.7714 9.7714 10.1410 10.1410 12.4017 12.4017 12.4275 12.4275 14.1589 14.1589 14.1696 14.1696 14.4438 14.4438 16.4230 16.4230 17.2187 17.2187 k = 0.2667 0.1540 0.1089 ( 2439 PWs) bands (ev): -36.6689 -36.6689 -15.6861 -15.6861 -15.1880 -15.1880 -15.1791 -15.1791 -2.1933 -2.1933 -2.1917 -2.1917 -1.7407 -1.7407 -1.7348 -1.7348 -1.7288 -1.7288 3.8338 3.8338 8.2575 8.2575 8.5478 8.5478 8.6227 8.6227 8.9509 8.9509 8.9802 8.9802 9.4831 9.4831 9.5163 9.5163 9.6457 9.6457 9.6962 9.6962 9.7541 9.7541 10.0522 10.0522 12.3958 12.3958 12.4201 12.4201 14.1727 14.1727 14.1833 14.1833 14.4266 14.4266 16.3041 16.3041 17.2799 17.2799 k = 0.2778 0.1604 0.1134 ( 2442 PWs) bands (ev): -36.6689 -36.6689 -15.6865 -15.6865 -15.1887 -15.1887 -15.1792 -15.1792 -2.1931 -2.1931 -2.1914 -2.1914 -1.7405 -1.7405 -1.7346 -1.7346 -1.7283 -1.7283 3.9016 3.9016 8.2097 8.2097 8.5513 8.5513 8.6285 8.6285 8.9644 8.9644 8.9920 8.9920 9.4749 9.4749 9.5055 9.5055 9.6322 9.6322 9.6693 9.6693 9.7368 9.7368 9.9754 9.9754 12.3886 12.3886 12.4115 12.4115 14.1911 14.1911 14.2017 14.2017 14.4113 14.4113 16.1871 16.1871 17.3314 17.3314 k = 0.2889 0.1668 0.1179 ( 2442 PWs) bands (ev): -36.6688 -36.6688 -15.6869 -15.6869 -15.1894 -15.1894 -15.1794 -15.1794 -2.1928 -2.1928 -2.1911 -2.1911 -1.7402 -1.7402 -1.7345 -1.7345 -1.7277 -1.7277 3.9714 3.9714 8.1562 8.1562 8.5552 8.5552 8.6350 8.6350 8.9778 8.9778 9.0034 9.0034 9.4665 9.4665 9.4922 9.4922 9.6170 9.6170 9.6406 9.6406 9.7199 9.7199 9.9121 9.9121 12.3804 12.3804 12.4017 12.4017 14.2136 14.2136 14.2243 14.2243 14.3982 14.3982 16.0723 16.0723 17.3686 17.3686 k = 0.3000 0.1732 0.1225 ( 2436 PWs) bands (ev): -36.6688 -36.6688 -15.6872 -15.6872 -15.1900 -15.1900 -15.1795 -15.1795 -2.1926 -2.1926 -2.1907 -2.1907 -1.7400 -1.7400 -1.7342 -1.7342 -1.7272 -1.7272 4.0431 4.0431 8.0966 8.0966 8.5595 8.5595 8.6422 8.6422 8.9912 8.9912 9.0144 9.0144 9.4576 9.4576 9.4755 9.4755 9.6001 9.6001 9.6117 9.6117 9.7032 9.7032 9.8624 9.8624 12.3713 12.3713 12.3909 12.3909 14.2402 14.2402 14.2510 14.2510 14.3870 14.3870 15.9603 15.9603 17.3848 17.3848 k = 0.3111 0.1796 0.1270 ( 2439 PWs) bands (ev): -36.6687 -36.6687 -15.6876 -15.6876 -15.1906 -15.1906 -15.1796 -15.1796 -2.1925 -2.1925 -2.1904 -2.1904 -1.7398 -1.7398 -1.7341 -1.7341 -1.7267 -1.7267 4.1164 4.1164 8.0308 8.0308 8.5640 8.5640 8.6498 8.6498 9.0043 9.0043 9.0246 9.0246 9.4484 9.4484 9.4544 9.4544 9.5806 9.5806 9.5862 9.5862 9.6870 9.6870 9.8247 9.8247 12.3614 12.3614 12.3794 12.3794 14.2705 14.2705 14.2814 14.2814 14.3777 14.3777 15.8513 15.8513 17.3738 17.3739 k = 0.3222 0.1860 0.1315 ( 2439 PWs) bands (ev): -36.6687 -36.6687 -15.6879 -15.6879 -15.1912 -15.1912 -15.1797 -15.1797 -2.1923 -2.1923 -2.1901 -2.1901 -1.7396 -1.7396 -1.7339 -1.7339 -1.7262 -1.7262 4.1912 4.1912 7.9592 7.9592 8.5688 8.5688 8.6580 8.6580 9.0174 9.0174 9.0343 9.0343 9.4292 9.4292 9.4389 9.4389 9.5595 9.5595 9.5659 9.5659 9.6712 9.6712 9.7962 9.7962 12.3510 12.3510 12.3673 12.3673 14.3040 14.3040 14.3152 14.3152 14.3705 14.3705 15.7458 15.7458 17.3359 17.3359 k = 0.3333 0.1925 0.1361 ( 2442 PWs) bands (ev): -36.6686 -36.6686 -15.6883 -15.6883 -15.1919 -15.1919 -15.1798 -15.1798 -2.1921 -2.1921 -2.1898 -2.1898 -1.7393 -1.7393 -1.7338 -1.7338 -1.7257 -1.7257 4.2674 4.2674 7.8822 7.8822 8.5738 8.5738 8.6665 8.6665 9.0303 9.0303 9.0432 9.0432 9.4020 9.4020 9.4290 9.4290 9.5414 9.5414 9.5468 9.5468 9.6560 9.6560 9.7743 9.7743 12.3403 12.3403 12.3549 12.3549 14.3404 14.3404 14.3519 14.3519 14.3654 14.3654 15.6438 15.6438 17.2775 17.2775 k = 0.3444 0.1989 0.1406 ( 2439 PWs) bands (ev): -36.6686 -36.6686 -15.6886 -15.6886 -15.1924 -15.1924 -15.1799 -15.1799 -2.1919 -2.1919 -2.1895 -2.1895 -1.7391 -1.7391 -1.7336 -1.7336 -1.7252 -1.7252 4.3446 4.3446 7.8004 7.8004 8.5789 8.5789 8.6755 8.6755 9.0431 9.0431 9.0513 9.0513 9.3753 9.3753 9.4188 9.4188 9.5246 9.5246 9.5298 9.5298 9.6415 9.6415 9.7569 9.7569 12.3295 12.3295 12.3424 12.3424 14.3615 14.3615 14.3802 14.3802 14.3912 14.3912 15.5458 15.5458 17.2068 17.2068 k = 0.3556 0.2053 0.1452 ( 2439 PWs) bands (ev): -36.6686 -36.6686 -15.6889 -15.6889 -15.1930 -15.1930 -15.1800 -15.1800 -2.1917 -2.1917 -2.1892 -2.1892 -1.7389 -1.7389 -1.7335 -1.7335 -1.7248 -1.7248 4.4225 4.4225 7.7149 7.7149 8.5842 8.5842 8.6847 8.6847 9.0557 9.0557 9.0584 9.0584 9.3512 9.3512 9.4083 9.4083 9.5059 9.5059 9.5173 9.5173 9.6277 9.6277 9.7424 9.7424 12.3186 12.3186 12.3300 12.3300 14.3605 14.3605 14.4214 14.4214 14.4326 14.4326 15.4517 15.4517 17.1296 17.1296 k = 0.3667 0.2117 0.1497 ( 2434 PWs) bands (ev): -36.6685 -36.6685 -15.6891 -15.6891 -15.1935 -15.1935 -15.1801 -15.1801 -2.1914 -2.1914 -2.1890 -2.1890 -1.7387 -1.7387 -1.7333 -1.7333 -1.7244 -1.7244 4.5008 4.5008 7.6266 7.6266 8.5894 8.5894 8.6941 8.6941 9.0646 9.0646 9.0682 9.0682 9.3307 9.3307 9.3976 9.3976 9.4867 9.4867 9.5071 9.5071 9.6147 9.6147 9.7301 9.7301 12.3081 12.3081 12.3179 12.3179 14.3614 14.3614 14.4644 14.4644 14.4758 14.4758 15.3619 15.3619 17.0498 17.0498 k = 0.3778 0.2181 0.1542 ( 2428 PWs) bands (ev): -36.6685 -36.6685 -15.6894 -15.6894 -15.1939 -15.1939 -15.1802 -15.1802 -2.1912 -2.1912 -2.1887 -2.1887 -1.7385 -1.7385 -1.7331 -1.7331 -1.7239 -1.7239 4.5792 4.5792 7.5366 7.5366 8.5947 8.5947 8.7036 8.7036 9.0697 9.0697 9.0805 9.0805 9.3143 9.3143 9.3866 9.3866 9.4678 9.4678 9.4983 9.4983 9.6026 9.6026 9.7194 9.7194 12.2977 12.2977 12.3061 12.3061 14.3644 14.3644 14.5088 14.5088 14.5201 14.5201 15.2764 15.2764 16.9695 16.9695 k = 0.3889 0.2245 0.1588 ( 2428 PWs) bands (ev): -36.6684 -36.6684 -15.6896 -15.6896 -15.1944 -15.1944 -15.1803 -15.1803 -2.1911 -2.1911 -2.1885 -2.1885 -1.7383 -1.7383 -1.7330 -1.7330 -1.7236 -1.7236 4.6570 4.6570 7.4460 7.4460 8.5998 8.5998 8.7130 8.7130 9.0739 9.0739 9.0926 9.0926 9.3018 9.3018 9.3754 9.3754 9.4493 9.4493 9.4904 9.4904 9.5913 9.5913 9.7098 9.7098 12.2879 12.2879 12.2949 12.2949 14.3695 14.3695 14.5538 14.5538 14.5650 14.5650 15.1953 15.1953 16.8904 16.8904 k = 0.4000 0.2309 0.1633 ( 2428 PWs) bands (ev): -36.6684 -36.6684 -15.6899 -15.6899 -15.1948 -15.1948 -15.1803 -15.1803 -2.1909 -2.1909 -2.1883 -2.1883 -1.7382 -1.7382 -1.7329 -1.7329 -1.7232 -1.7232 4.7336 4.7336 7.3562 7.3562 8.6047 8.6047 8.7222 8.7222 9.0771 9.0771 9.1044 9.1044 9.2930 9.2930 9.3641 9.3641 9.4315 9.4315 9.4833 9.4833 9.5811 9.5811 9.7012 9.7012 12.2787 12.2787 12.2844 12.2844 14.3769 14.3769 14.5989 14.5989 14.6099 14.6099 15.1188 15.1188 16.8138 16.8138 k = 0.4111 0.2374 0.1678 ( 2428 PWs) bands (ev): -36.6684 -36.6684 -15.6901 -15.6901 -15.1952 -15.1952 -15.1804 -15.1804 -2.1908 -2.1908 -2.1881 -2.1881 -1.7381 -1.7381 -1.7328 -1.7328 -1.7229 -1.7229 4.8083 4.8083 7.2684 7.2684 8.6093 8.6093 8.7311 8.7311 9.0796 9.0796 9.1160 9.1160 9.2874 9.2874 9.3529 9.3529 9.4146 9.4146 9.4768 9.4768 9.5718 9.5718 9.6934 9.6934 12.2701 12.2701 12.2746 12.2746 14.3865 14.3865 14.6433 14.6433 14.6541 14.6541 15.0470 15.0470 16.7408 16.7408 k = 0.4222 0.2438 0.1724 ( 2428 PWs) bands (ev): -36.6684 -36.6684 -15.6903 -15.6903 -15.1955 -15.1955 -15.1805 -15.1805 -2.1907 -2.1907 -2.1879 -2.1879 -1.7379 -1.7379 -1.7327 -1.7327 -1.7227 -1.7227 4.8801 4.8801 7.1842 7.1842 8.6136 8.6136 8.7395 8.7395 9.0814 9.0814 9.1272 9.1272 9.2844 9.2844 9.3417 9.3417 9.3985 9.3985 9.4710 9.4710 9.5636 9.5636 9.6865 9.6865 12.2624 12.2624 12.2658 12.2658 14.3983 14.3983 14.6862 14.6862 14.6967 14.6967 14.9801 14.9801 16.6723 16.6723 k = 0.4333 0.2502 0.1769 ( 2428 PWs) bands (ev): -36.6683 -36.6683 -15.6904 -15.6904 -15.1958 -15.1958 -15.1805 -15.1805 -2.1906 -2.1906 -2.1878 -2.1878 -1.7378 -1.7378 -1.7326 -1.7326 -1.7224 -1.7224 4.9477 4.9477 7.1050 7.1050 8.6175 8.6175 8.7473 8.7473 9.0828 9.0828 9.1380 9.1380 9.2836 9.2836 9.3309 9.3309 9.3836 9.3836 9.4659 9.4659 9.5564 9.5564 9.6804 9.6804 12.2555 12.2555 12.2580 12.2580 14.4123 14.4123 14.7266 14.7266 14.7368 14.7368 14.9182 14.9182 16.6094 16.6094 k = 0.4444 0.2566 0.1814 ( 2428 PWs) bands (ev): -36.6683 -36.6683 -15.6906 -15.6906 -15.1961 -15.1961 -15.1806 -15.1806 -2.1905 -2.1905 -2.1876 -2.1876 -1.7377 -1.7377 -1.7325 -1.7325 -1.7222 -1.7222 5.0098 5.0098 7.0326 7.0326 8.6209 8.6209 8.7542 8.7542 9.0838 9.0838 9.1482 9.1482 9.2844 9.2844 9.3205 9.3205 9.3700 9.3700 9.4615 9.4615 9.5503 9.5503 9.6751 9.6751 12.2496 12.2496 12.2513 12.2513 14.4283 14.4283 14.7634 14.7634 14.7735 14.7735 14.8618 14.8618 16.5533 16.5533 k = 0.4556 0.2630 0.1860 ( 2428 PWs) bands (ev): -36.6683 -36.6683 -15.6907 -15.6907 -15.1963 -15.1963 -15.1806 -15.1806 -2.1904 -2.1904 -2.1875 -2.1875 -1.7377 -1.7377 -1.7325 -1.7325 -1.7220 -1.7220 5.0646 5.0646 6.9691 6.9691 8.6238 8.6238 8.7602 8.7602 9.0846 9.0846 9.1575 9.1575 9.2865 9.2865 9.3109 9.3109 9.3577 9.3577 9.4577 9.4577 9.5453 9.5453 9.6706 9.6706 12.2447 12.2447 12.2457 12.2457 14.4459 14.4459 14.7916 14.7916 14.8057 14.8057 14.8150 14.8150 16.5051 16.5051 k = 0.4667 0.2694 0.1905 ( 2422 PWs) bands (ev): -36.6683 -36.6683 -15.6908 -15.6908 -15.1964 -15.1964 -15.1806 -15.1806 -2.1904 -2.1904 -2.1874 -2.1874 -1.7376 -1.7376 -1.7323 -1.7323 -1.7219 -1.7219 5.1102 5.1102 6.9165 6.9165 8.6260 8.6260 8.7650 8.7650 9.0851 9.0851 9.1657 9.1657 9.2895 9.2895 9.3025 9.3025 9.3471 9.3471 9.4547 9.4547 9.5414 9.5414 9.6672 9.6672 12.2408 12.2408 12.2414 12.2414 14.4644 14.4644 14.7633 14.7633 14.8257 14.8257 14.8322 14.8322 16.4659 16.4659 k = 0.4778 0.2758 0.1951 ( 2425 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1965 -15.1965 -15.1807 -15.1807 -2.1904 -2.1904 -2.1873 -2.1873 -1.7376 -1.7376 -1.7323 -1.7323 -1.7218 -1.7218 5.1446 5.1446 6.8770 6.8770 8.6277 8.6277 8.7686 8.7686 9.0855 9.0855 9.1723 9.1723 9.2927 9.2927 9.2957 9.2957 9.3384 9.3384 9.4526 9.4526 9.5385 9.5385 9.6646 9.6646 12.2380 12.2380 12.2382 12.2382 14.4820 14.4820 14.7277 14.7277 14.8453 14.8453 14.8520 14.8520 16.4370 16.4370 k = 0.4889 0.2823 0.1996 ( 2437 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1807 -15.1807 -2.1905 -2.1905 -2.1874 -2.1874 -1.7377 -1.7377 -1.7324 -1.7324 -1.7218 -1.7218 5.1662 5.1662 6.8523 6.8523 8.6286 8.6286 8.7706 8.7706 9.0856 9.0856 9.1765 9.1765 9.2913 9.2913 9.2955 9.2955 9.3323 9.3323 9.4512 9.4512 9.5368 9.5368 9.6630 9.6630 12.2363 12.2363 12.2363 12.2363 14.4957 14.4957 14.7030 14.7030 14.8576 14.8576 14.8643 14.8643 16.4192 16.4192 k = 0.5000 0.2887 0.2041 ( 2452 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1967 -15.1967 -15.1808 -15.1808 -2.1905 -2.1905 -2.1875 -2.1875 -1.7377 -1.7377 -1.7325 -1.7325 -1.7219 -1.7219 5.1735 5.1735 6.8439 6.8439 8.6288 8.6288 8.7713 8.7713 9.0856 9.0856 9.1779 9.1779 9.2897 9.2897 9.2967 9.2967 9.3299 9.3299 9.4507 9.4507 9.5362 9.5362 9.6624 9.6624 12.2356 12.2356 12.2357 12.2357 14.5011 14.5011 14.6939 14.6939 14.8618 14.8618 14.8684 14.8684 16.4131 16.4131 k = 0.5000 0.2887 0.2041 ( 2452 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1967 -15.1967 -15.1808 -15.1808 -2.1905 -2.1905 -2.1875 -2.1875 -1.7377 -1.7377 -1.7325 -1.7325 -1.7219 -1.7219 5.1735 5.1735 6.8439 6.8439 8.6288 8.6288 8.7713 8.7713 9.0856 9.0856 9.1779 9.1779 9.2897 9.2897 9.2967 9.2967 9.3299 9.3299 9.4507 9.4507 9.5362 9.5362 9.6624 9.6624 12.2356 12.2356 12.2357 12.2357 14.5011 14.5011 14.6939 14.6939 14.8618 14.8618 14.8684 14.8684 16.4131 16.4131 k = 0.5039 0.2774 0.2105 ( 2432 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1807 -15.1807 -2.1904 -2.1904 -2.1874 -2.1874 -1.7376 -1.7376 -1.7324 -1.7324 -1.7218 -1.7218 5.1742 5.1742 6.8454 6.8454 8.6288 8.6288 8.7710 8.7710 9.0852 9.0852 9.1780 9.1780 9.2829 9.2829 9.3027 9.3027 9.3315 9.3315 9.4510 9.4510 9.5363 9.5363 9.6628 9.6628 12.2290 12.2290 12.2351 12.2351 14.5066 14.5066 14.6909 14.6909 14.8618 14.8618 14.8691 14.8691 16.4091 16.4091 k = 0.5078 0.2661 0.2169 ( 2430 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1808 -15.1808 -2.1904 -2.1904 -2.1873 -2.1873 -1.7376 -1.7376 -1.7323 -1.7323 -1.7218 -1.7218 5.1763 5.1763 6.8496 6.8496 8.6280 8.6280 8.7697 8.7697 9.0836 9.0836 9.1780 9.1780 9.2733 9.2733 9.3097 9.3097 9.3359 9.3359 9.4518 9.4518 9.5366 9.5366 9.6636 9.6636 12.2092 12.2092 12.2333 12.2333 14.5220 14.5220 14.6818 14.6818 14.8596 14.8596 14.8736 14.8736 16.3970 16.3970 k = 0.5117 0.2548 0.2233 ( 2422 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1808 -15.1808 -2.1903 -2.1903 -2.1873 -2.1873 -1.7375 -1.7375 -1.7323 -1.7323 -1.7218 -1.7218 5.1798 5.1798 6.8565 6.8565 8.6266 8.6266 8.7678 8.7678 9.0811 9.0811 9.1778 9.1778 9.2637 9.2637 9.3155 9.3155 9.3428 9.3428 9.4531 9.4531 9.5370 9.5370 9.6650 9.6650 12.1771 12.1771 12.2303 12.2303 14.5443 14.5443 14.6666 14.6666 14.8542 14.8542 14.8854 14.8854 16.3769 16.3769 k = 0.5156 0.2436 0.2296 ( 2422 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1966 -15.1966 -15.1809 -15.1809 -2.1903 -2.1903 -2.1873 -2.1873 -1.7375 -1.7375 -1.7323 -1.7323 -1.7219 -1.7219 5.1847 5.1847 6.8663 6.8663 8.6240 8.6240 8.7654 8.7654 9.0778 9.0778 9.1774 9.1774 9.2545 9.2545 9.3203 9.3203 9.3512 9.3512 9.4549 9.4549 9.5377 9.5377 9.6669 9.6669 12.1341 12.1341 12.2262 12.2262 14.5657 14.5657 14.6490 14.6490 14.8464 14.8464 14.9070 14.9070 16.3493 16.3493 k = 0.5195 0.2323 0.2360 ( 2423 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1965 -15.1965 -15.1811 -15.1811 -2.1903 -2.1903 -2.1874 -2.1874 -1.7374 -1.7374 -1.7322 -1.7322 -1.7220 -1.7220 5.1910 5.1910 6.8788 6.8788 8.6201 8.6201 8.7630 8.7630 9.0737 9.0737 9.1767 9.1767 9.2460 9.2460 9.3250 9.3250 9.3601 9.3601 9.4573 9.4573 9.5386 9.5386 9.6693 9.6693 12.0816 12.0816 12.2208 12.2208 14.5663 14.5663 14.6443 14.6443 14.8364 14.8364 14.9411 14.9411 16.3151 16.3151 k = 0.5234 0.2210 0.2424 ( 2423 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1965 -15.1965 -15.1812 -15.1812 -2.1903 -2.1903 -2.1874 -2.1874 -1.7374 -1.7374 -1.7322 -1.7322 -1.7221 -1.7221 5.1986 5.1986 6.8939 6.8939 8.6141 8.6141 8.7611 8.7611 9.0689 9.0689 9.1754 9.1754 9.2385 9.2385 9.3299 9.3299 9.3688 9.3688 9.4603 9.4603 9.5398 9.5398 9.6723 9.6723 12.0212 12.0212 12.2142 12.2142 14.5350 14.5350 14.6604 14.6604 14.8247 14.8247 14.9896 14.9896 16.2761 16.2761 k = 0.5273 0.2097 0.2488 ( 2423 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1964 -15.1964 -15.1814 -15.1814 -2.1903 -2.1903 -2.1875 -2.1875 -1.7374 -1.7374 -1.7322 -1.7322 -1.7222 -1.7222 5.2076 5.2076 6.9117 6.9117 8.6058 8.6058 8.7602 8.7602 9.0638 9.0638 9.1734 9.1734 9.2322 9.2322 9.3351 9.3351 9.3770 9.3770 9.4639 9.4639 9.5415 9.5415 9.6757 9.6757 11.9545 11.9545 12.2065 12.2065 14.4868 14.4868 14.6812 14.6812 14.8115 14.8115 15.0525 15.0525 16.2339 16.2339 k = 0.5312 0.1985 0.2552 ( 2427 PWs) bands (ev): -36.6682 -36.6682 -15.6912 -15.6912 -15.1964 -15.1964 -15.1816 -15.1816 -2.1903 -2.1903 -2.1875 -2.1875 -1.7374 -1.7374 -1.7322 -1.7322 -1.7224 -1.7224 5.2179 5.2179 6.9320 6.9320 8.5945 8.5945 8.7606 8.7606 9.0582 9.0582 9.1707 9.1707 9.2272 9.2272 9.3407 9.3407 9.3844 9.3844 9.4682 9.4682 9.5437 9.5437 9.6795 9.6795 11.8827 11.8827 12.1975 12.1975 14.4288 14.4288 14.7003 14.7003 14.7969 14.7969 15.1278 15.1278 16.1903 16.1903 k = 0.5352 0.1872 0.2615 ( 2420 PWs) bands (ev): -36.6682 -36.6682 -15.6912 -15.6912 -15.1963 -15.1963 -15.1818 -15.1818 -2.1902 -2.1902 -2.1876 -2.1876 -1.7373 -1.7373 -1.7321 -1.7321 -1.7226 -1.7226 5.2295 5.2295 6.9549 6.9549 8.5803 8.5803 8.7627 8.7627 9.0523 9.0523 9.1671 9.1671 9.2238 9.2238 9.3465 9.3465 9.3909 9.3909 9.4730 9.4730 9.5465 9.5465 9.6838 9.6838 11.8072 11.8072 12.1874 12.1874 14.3636 14.3636 14.7169 14.7169 14.7815 14.7815 15.2127 15.2127 16.1468 16.1468 k = 0.5391 0.1759 0.2679 ( 2420 PWs) bands (ev): -36.6682 -36.6682 -15.6913 -15.6913 -15.1963 -15.1963 -15.1821 -15.1821 -2.1902 -2.1902 -2.1876 -2.1876 -1.7373 -1.7373 -1.7320 -1.7320 -1.7227 -1.7227 5.2423 5.2423 6.9801 6.9801 8.5629 8.5629 8.7664 8.7664 9.0462 9.0462 9.1628 9.1628 9.2219 9.2219 9.3525 9.3525 9.3966 9.3966 9.4781 9.4781 9.5500 9.5500 9.6885 9.6885 11.7289 11.7289 12.1761 12.1761 14.2927 14.2927 14.7315 14.7315 14.7656 14.7656 15.3039 15.3039 16.1045 16.1045 k = 0.5430 0.1646 0.2743 ( 2420 PWs) bands (ev): -36.6682 -36.6682 -15.6914 -15.6914 -15.1962 -15.1962 -15.1824 -15.1824 -2.1902 -2.1902 -2.1877 -2.1877 -1.7372 -1.7372 -1.7320 -1.7320 -1.7229 -1.7229 5.2564 5.2564 7.0076 7.0076 8.5425 8.5425 8.7718 8.7718 9.0399 9.0399 9.1579 9.1579 9.2213 9.2213 9.3584 9.3584 9.4017 9.4017 9.4833 9.4833 9.5542 9.5542 9.6936 9.6936 11.6488 11.6488 12.1636 12.1636 14.2172 14.2172 14.7423 14.7423 14.7520 14.7520 15.3984 15.3984 16.0650 16.0650 k = 0.5469 0.1534 0.2807 ( 2427 PWs) bands (ev): -36.6682 -36.6682 -15.6915 -15.6915 -15.1962 -15.1962 -15.1827 -15.1827 -2.1903 -2.1903 -2.1878 -2.1878 -1.7373 -1.7373 -1.7320 -1.7320 -1.7232 -1.7232 5.2716 5.2716 7.0373 7.0373 8.5191 8.5191 8.7787 8.7787 9.0333 9.0333 9.1525 9.1525 9.2219 9.2219 9.3642 9.3642 9.4063 9.4063 9.4886 9.4886 9.5592 9.5592 9.6990 9.6990 11.5676 11.5676 12.1500 12.1500 14.1382 14.1382 14.7308 14.7308 14.7600 14.7600 15.4927 15.4927 16.0301 16.0301 k = 0.5508 0.1421 0.2870 ( 2429 PWs) bands (ev): -36.6681 -36.6681 -15.6916 -15.6916 -15.1961 -15.1961 -15.1830 -15.1830 -2.1903 -2.1903 -2.1879 -2.1879 -1.7373 -1.7373 -1.7319 -1.7319 -1.7234 -1.7234 5.2880 5.2880 7.0690 7.0690 8.4932 8.4932 8.7869 8.7869 9.0267 9.0267 9.1469 9.1469 9.2236 9.2236 9.3695 9.3695 9.4109 9.4109 9.4938 9.4938 9.5649 9.5649 9.7048 9.7048 11.4861 11.4861 12.1352 12.1352 14.0567 14.0567 14.7148 14.7148 14.7726 14.7726 15.5814 15.5814 16.0036 16.0036 k = 0.5547 0.1308 0.2934 ( 2421 PWs) bands (ev): -36.6681 -36.6681 -15.6917 -15.6917 -15.1960 -15.1960 -15.1833 -15.1833 -2.1902 -2.1902 -2.1879 -2.1879 -1.7373 -1.7373 -1.7317 -1.7317 -1.7236 -1.7236 5.3054 5.3054 7.1027 7.1027 8.4649 8.4649 8.7964 8.7964 9.0201 9.0201 9.1412 9.1412 9.2262 9.2262 9.3743 9.3743 9.4156 9.4156 9.4990 9.4990 9.5711 9.5711 9.7109 9.7109 11.4049 11.4049 12.1194 12.1194 13.9735 13.9735 14.6989 14.6989 14.7855 14.7855 15.6557 15.6557 15.9930 15.9930 k = 0.5586 0.1195 0.2998 ( 2417 PWs) bands (ev): -36.6681 -36.6681 -15.6918 -15.6918 -15.1959 -15.1959 -15.1836 -15.1836 -2.1902 -2.1902 -2.1879 -2.1879 -1.7373 -1.7373 -1.7316 -1.7316 -1.7237 -1.7237 5.3237 5.3237 7.1380 7.1380 8.4344 8.4344 8.8069 8.8069 9.0133 9.0133 9.1355 9.1355 9.2296 9.2296 9.3783 9.3783 9.4207 9.4207 9.5042 9.5042 9.5777 9.5777 9.7172 9.7172 11.3242 11.3242 12.1025 12.1025 13.8896 13.8896 14.6837 14.6837 14.7986 14.7986 15.7020 15.7020 15.9891 15.9891 k = 0.5625 0.1083 0.3062 ( 2419 PWs) bands (ev): -36.6681 -36.6681 -15.6919 -15.6919 -15.1958 -15.1958 -15.1840 -15.1840 -2.1902 -2.1902 -2.1880 -2.1880 -1.7373 -1.7373 -1.7315 -1.7315 -1.7239 -1.7239 5.3430 5.3430 7.1748 7.1748 8.4020 8.4020 8.8182 8.8182 9.0066 9.0066 9.1298 9.1298 9.2338 9.2338 9.3814 9.3814 9.4263 9.4263 9.5096 9.5096 9.5844 9.5844 9.7238 9.7238 11.2447 11.2447 12.0846 12.0846 13.8056 13.8056 14.6694 14.6694 14.8119 14.8119 15.7143 15.7143 15.9460 15.9460 k = 0.5664 0.0970 0.3126 ( 2411 PWs) bands (ev): -36.6681 -36.6681 -15.6920 -15.6920 -15.1958 -15.1958 -15.1843 -15.1843 -2.1902 -2.1902 -2.1880 -2.1880 -1.7373 -1.7373 -1.7314 -1.7314 -1.7241 -1.7241 5.3631 5.3631 7.2129 7.2129 8.3680 8.3680 8.8303 8.8303 9.0000 9.0000 9.1242 9.1242 9.2386 9.2386 9.3838 9.3838 9.4325 9.4325 9.5152 9.5152 9.5910 9.5910 9.7305 9.7305 11.1668 11.1668 12.0658 12.0658 13.7222 13.7222 14.6564 14.6564 14.8255 14.8255 15.7026 15.7026 15.9015 15.9015 k = 0.5703 0.0857 0.3189 ( 2411 PWs) bands (ev): -36.6680 -36.6680 -15.6921 -15.6921 -15.1957 -15.1957 -15.1847 -15.1847 -2.1902 -2.1902 -2.1881 -2.1881 -1.7374 -1.7374 -1.7313 -1.7313 -1.7242 -1.7242 5.3838 5.3838 7.2519 7.2519 8.3326 8.3326 8.8429 8.8429 8.9934 8.9934 9.1188 9.1188 9.2439 9.2439 9.3854 9.3854 9.4391 9.4391 9.5213 9.5213 9.5974 9.5974 9.7372 9.7372 11.0909 11.0909 12.0460 12.0460 13.6400 13.6400 14.6447 14.6447 14.8394 14.8394 15.6789 15.6789 15.8566 15.8566 k = 0.5742 0.0744 0.3253 ( 2412 PWs) bands (ev): -36.6680 -36.6680 -15.6922 -15.6922 -15.1956 -15.1956 -15.1850 -15.1850 -2.1902 -2.1902 -2.1881 -2.1881 -1.7374 -1.7374 -1.7312 -1.7312 -1.7244 -1.7244 5.4051 5.4051 7.2915 7.2915 8.2962 8.2962 8.8560 8.8560 8.9871 8.9871 9.1136 9.1136 9.2497 9.2497 9.3865 9.3865 9.4461 9.4461 9.5279 9.5279 9.6033 9.6033 9.7439 9.7439 11.0174 11.0174 12.0254 12.0254 13.5594 13.5594 14.6346 14.6346 14.8535 14.8535 15.6498 15.6498 15.8114 15.8114 k = 0.5781 0.0631 0.3317 ( 2407 PWs) bands (ev): -36.6680 -36.6680 -15.6923 -15.6923 -15.1955 -15.1955 -15.1853 -15.1853 -2.1902 -2.1902 -2.1881 -2.1881 -1.7375 -1.7375 -1.7310 -1.7310 -1.7245 -1.7245 5.4268 5.4268 7.3314 7.3314 8.2591 8.2591 8.8692 8.8692 8.9812 8.9812 9.1087 9.1087 9.2558 9.2558 9.3872 9.3872 9.4535 9.4535 9.5352 9.5352 9.6088 9.6088 9.7503 9.7503 10.9469 10.9469 12.0041 12.0041 13.4810 13.4810 14.6261 14.6261 14.8678 14.8678 15.6185 15.6185 15.7662 15.7662 k = 0.5820 0.0519 0.3381 ( 2407 PWs) bands (ev): -36.6680 -36.6680 -15.6924 -15.6924 -15.1955 -15.1955 -15.1856 -15.1856 -2.1903 -2.1903 -2.1882 -2.1882 -1.7376 -1.7376 -1.7310 -1.7310 -1.7246 -1.7246 5.4488 5.4488 7.3709 7.3709 8.2218 8.2218 8.8825 8.8825 8.9757 8.9757 9.1040 9.1040 9.2622 9.2622 9.3876 9.3876 9.4614 9.4614 9.5432 9.5432 9.6138 9.6138 9.7564 9.7564 10.8796 10.8796 11.9820 11.9820 13.4050 13.4050 14.6195 14.6195 14.8822 14.8822 15.5863 15.5863 15.7209 15.7209 k = 0.5859 0.0406 0.3445 ( 2407 PWs) bands (ev): -36.6680 -36.6680 -15.6925 -15.6925 -15.1955 -15.1955 -15.1859 -15.1859 -2.1903 -2.1903 -2.1882 -2.1882 -1.7377 -1.7377 -1.7309 -1.7309 -1.7247 -1.7247 5.4708 5.4708 7.4094 7.4094 8.1850 8.1850 8.8954 8.8954 8.9710 8.9710 9.0997 9.0997 9.2686 9.2686 9.3878 9.3878 9.4698 9.4698 9.5518 9.5518 9.6182 9.6182 9.7618 9.7618 10.8161 10.8161 11.9593 11.9593 13.3318 13.3318 14.6148 14.6148 14.8966 14.8966 15.5543 15.5543 15.6757 15.6757 k = 0.5898 0.0293 0.3508 ( 2405 PWs) bands (ev): -36.6679 -36.6679 -15.6926 -15.6926 -15.1954 -15.1954 -15.1862 -15.1862 -2.1904 -2.1904 -2.1882 -2.1882 -1.7378 -1.7378 -1.7308 -1.7308 -1.7247 -1.7247 5.4926 5.4926 7.4462 7.4462 8.1493 8.1493 8.9073 8.9073 8.9676 8.9676 9.0958 9.0958 9.2749 9.2749 9.3880 9.3880 9.4788 9.4788 9.5610 9.5610 9.6221 9.6221 9.7664 9.7664 10.7569 10.7569 11.9361 11.9361 13.2615 13.2615 14.6121 14.6121 14.9107 14.9107 15.5230 15.5230 15.6306 15.6306 k = 0.5938 0.0180 0.3572 ( 2409 PWs) bands (ev): -36.6679 -36.6679 -15.6927 -15.6927 -15.1954 -15.1954 -15.1864 -15.1864 -2.1905 -2.1905 -2.1883 -2.1883 -1.7380 -1.7380 -1.7308 -1.7308 -1.7248 -1.7248 5.5140 5.5140 7.4801 7.4801 8.1159 8.1159 8.9173 8.9173 8.9663 8.9663 9.0925 9.0925 9.2809 9.2809 9.3881 9.3881 9.4886 9.4886 9.5709 9.5709 9.6255 9.6255 9.7700 9.7700 10.7025 10.7025 11.9124 11.9124 13.1943 13.1943 14.6113 14.6113 14.9244 14.9244 15.4930 15.4930 15.5857 15.5857 k = 0.5977 0.0068 0.3636 ( 2411 PWs) bands (ev): -36.6679 -36.6679 -15.6928 -15.6928 -15.1954 -15.1954 -15.1867 -15.1867 -2.1906 -2.1906 -2.1883 -2.1883 -1.7381 -1.7381 -1.7308 -1.7308 -1.7248 -1.7248 5.5348 5.5348 7.5099 7.5099 8.0862 8.0862 8.9241 8.9241 8.9682 8.9682 9.0899 9.0899 9.2863 9.2863 9.3885 9.3885 9.4993 9.4993 9.5812 9.5812 9.6285 9.6285 9.7722 9.7722 10.6532 10.6532 11.8885 11.8885 13.1303 13.1303 14.6127 14.6127 14.9373 14.9373 15.4649 15.4649 15.5411 15.5411 k = 0.6016-0.0045 0.3700 ( 2419 PWs) bands (ev): -36.6679 -36.6679 -15.6929 -15.6929 -15.1954 -15.1954 -15.1869 -15.1869 -2.1907 -2.1907 -2.1883 -2.1883 -1.7384 -1.7384 -1.7309 -1.7309 -1.7248 -1.7248 5.5545 5.5545 7.5339 7.5339 8.0616 8.0616 8.9271 8.9271 8.9736 8.9736 9.0881 9.0881 9.2910 9.2910 9.3889 9.3889 9.5110 9.5110 9.5920 9.5920 9.6313 9.6313 9.7729 9.7729 10.6098 10.6098 11.8642 11.8642 13.0695 13.0695 14.6162 14.6162 14.9491 14.9491 15.4392 15.4392 15.4969 15.4969 k = 0.6055-0.0158 0.3764 ( 2411 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1954 -15.1954 -15.1870 -15.1870 -2.1908 -2.1908 -2.1883 -2.1883 -1.7385 -1.7385 -1.7308 -1.7308 -1.7248 -1.7248 5.5730 5.5730 7.5504 7.5504 8.0444 8.0444 8.9276 8.9276 8.9811 8.9811 9.0875 9.0875 9.2947 9.2947 9.3897 9.3897 9.5237 9.5237 9.6031 9.6031 9.6343 9.6343 9.7722 9.7722 10.5726 10.5726 11.8398 11.8398 13.0121 13.0121 14.6217 14.6217 14.9592 14.9592 15.4166 15.4166 15.4534 15.4534 k = 0.6094-0.0271 0.3827 ( 2409 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1954 -15.1954 -15.1872 -15.1872 -2.1909 -2.1909 -2.1882 -2.1882 -1.7386 -1.7386 -1.7308 -1.7308 -1.7247 -1.7247 5.5896 5.5896 7.5580 7.5580 8.0358 8.0358 8.9270 8.9270 8.9889 8.9889 9.0882 9.0882 9.2973 9.2973 9.3905 9.3905 9.5371 9.5371 9.6142 9.6142 9.6379 9.6379 9.7702 9.7702 10.5419 10.5419 11.8153 11.8153 12.9580 12.9580 14.6293 14.6293 14.9672 14.9672 15.3974 15.3974 15.4107 15.4107 k = 0.6133-0.0383 0.3891 ( 2415 PWs) bands (ev): -36.6679 -36.6679 -15.6931 -15.6931 -15.1955 -15.1955 -15.1873 -15.1873 -2.1911 -2.1911 -2.1883 -2.1883 -1.7388 -1.7388 -1.7309 -1.7309 -1.7246 -1.7246 5.6041 5.6041 7.5562 7.5562 8.0366 8.0366 8.9261 8.9261 8.9958 8.9958 9.0906 9.0906 9.2986 9.2986 9.3913 9.3913 9.5506 9.5506 9.6246 9.6246 9.6429 9.6429 9.7673 9.7673 10.5179 10.5179 11.7909 11.7909 12.9070 12.9070 14.6389 14.6389 14.9725 14.9725 15.3675 15.3675 15.3842 15.3842 k = 0.6172-0.0496 0.3955 ( 2417 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1956 -15.1956 -15.1873 -15.1873 -2.1912 -2.1912 -2.1882 -2.1882 -1.7390 -1.7390 -1.7309 -1.7309 -1.7246 -1.7246 5.6159 5.6159 7.5460 7.5460 8.0462 8.0462 8.9255 8.9255 9.0011 9.0011 9.0948 9.0948 9.2990 9.2990 9.3920 9.3920 9.5630 9.5630 9.6340 9.6340 9.6503 9.6503 9.7649 9.7649 10.5006 10.5006 11.7666 11.7666 12.8592 12.8592 14.6505 14.6505 14.9746 14.9746 15.3266 15.3266 15.3747 15.3747 k = 0.6211-0.0609 0.4019 ( 2421 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1956 -15.1956 -15.1874 -15.1874 -2.1914 -2.1914 -2.1882 -2.1882 -1.7393 -1.7393 -1.7310 -1.7310 -1.7245 -1.7245 5.6246 5.6246 7.5291 7.5291 8.0631 8.0631 8.9255 8.9255 9.0045 9.0045 9.1006 9.1006 9.2983 9.2983 9.3922 9.3922 9.5728 9.5728 9.6431 9.6431 9.6595 9.6595 9.7646 9.7646 10.4899 10.4899 11.7424 11.7424 12.8144 12.8144 14.6639 14.6639 14.9735 14.9735 15.2865 15.2865 15.3710 15.3710 k = 0.6250-0.0722 0.4082 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7310 -1.7310 -1.7244 -1.7244 5.6296 5.6296 7.5079 7.5079 8.0855 8.0855 8.9261 8.9261 9.0062 9.0062 9.1075 9.1075 9.2968 9.2968 9.3920 9.3920 9.5786 9.5786 9.6529 9.6529 9.6688 9.6688 9.7691 9.7691 10.4857 10.4857 11.7186 11.7186 12.7725 12.7725 14.6790 14.6790 14.9693 14.9693 15.2477 15.2477 15.3730 15.3730 k = 0.6250-0.0722 0.4082 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7310 -1.7310 -1.7244 -1.7244 5.6296 5.6296 7.5079 7.5079 8.0855 8.0855 8.9261 8.9261 9.0062 9.0062 9.1075 9.1075 9.2968 9.2968 9.3920 9.3920 9.5786 9.5786 9.6529 9.6529 9.6688 9.6688 9.7691 9.7691 10.4857 10.4857 11.7186 11.7186 12.7725 12.7725 14.6790 14.6790 14.9693 14.9693 15.2477 15.2477 15.3730 15.3730 k = 0.6184-0.0684 0.4190 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1957 -15.1957 -15.1874 -15.1874 -2.1916 -2.1916 -2.1882 -2.1882 -1.7395 -1.7395 -1.7310 -1.7310 -1.7244 -1.7244 5.6300 5.6300 7.5087 7.5087 8.0847 8.0847 8.9256 8.9256 9.0071 9.0071 9.1087 9.1087 9.2969 9.2969 9.3919 9.3919 9.5771 9.5771 9.6487 9.6487 9.6723 9.6723 9.7714 9.7714 10.4857 10.4857 11.7053 11.7053 12.7848 12.7848 14.6765 14.6765 14.9697 14.9697 15.2356 15.2356 15.3837 15.3837 k = 0.6118-0.0646 0.4297 ( 2420 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7309 -1.7309 -1.7245 -1.7245 5.6312 5.6312 7.5112 7.5112 8.0822 8.0822 8.9242 8.9242 9.0097 9.0097 9.1121 9.1121 9.2972 9.2972 9.3918 9.3918 9.5727 9.5727 9.6414 9.6414 9.6779 9.6779 9.7781 9.7781 10.4859 10.4859 11.6672 11.6672 12.8201 12.8201 14.6693 14.6693 14.9709 14.9709 15.2074 15.2074 15.4080 15.4080 k = 0.6053-0.0608 0.4405 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1956 -15.1956 -15.1875 -15.1875 -2.1915 -2.1915 -2.1882 -2.1882 -1.7395 -1.7395 -1.7309 -1.7309 -1.7245 -1.7245 5.6331 5.6331 7.5153 7.5153 8.0781 8.0781 8.9221 8.9221 9.0137 9.0137 9.1177 9.1177 9.2977 9.2977 9.3916 9.3916 9.5652 9.5652 9.6349 9.6349 9.6824 9.6824 9.7885 9.7885 10.4862 10.4862 11.6089 11.6089 12.8737 12.8737 14.6575 14.6575 14.9727 14.9727 15.1728 15.1728 15.4361 15.4361 k = 0.5987-0.0570 0.4512 ( 2419 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1956 -15.1956 -15.1875 -15.1875 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7308 -1.7308 -1.7246 -1.7246 5.6358 5.6358 7.5210 7.5210 8.0724 8.0724 8.9197 8.9197 9.0188 9.0188 9.1253 9.1253 9.2985 9.2985 9.3912 9.3912 9.5552 9.5552 9.6301 9.6301 9.6855 9.6855 9.8017 9.8017 10.4866 10.4866 11.5359 11.5359 12.9405 12.9405 14.6414 14.6414 14.9748 14.9748 15.1359 15.1359 15.4640 15.4640 k = 0.5921-0.0532 0.4620 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1955 -15.1955 -15.1876 -15.1876 -2.1914 -2.1914 -2.1883 -2.1883 -1.7394 -1.7394 -1.7307 -1.7307 -1.7247 -1.7247 5.6392 5.6392 7.5283 7.5283 8.0651 8.0651 8.9171 8.9171 9.0246 9.0246 9.1347 9.1347 9.2998 9.2998 9.3906 9.3906 9.5434 9.5434 9.6268 9.6268 9.6874 9.6874 9.8167 9.8167 10.4871 10.4871 11.4529 11.4529 13.0159 13.0159 14.6214 14.6214 14.9771 14.9771 15.0990 15.0990 15.4897 15.4897 k = 0.5855-0.0494 0.4727 ( 2413 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1955 -15.1955 -15.1877 -15.1877 -2.1913 -2.1913 -2.1883 -2.1883 -1.7393 -1.7393 -1.7305 -1.7305 -1.7248 -1.7248 5.6433 5.6433 7.5372 7.5372 8.0562 8.0562 8.9146 8.9146 9.0309 9.0309 9.1454 9.1454 9.3018 9.3018 9.3899 9.3899 9.5308 9.5308 9.6249 9.6249 9.6886 9.6886 9.8328 9.8328 10.4877 10.4877 11.3635 11.3635 13.0966 13.0966 14.5977 14.5977 14.9792 14.9792 15.0628 15.0628 15.5125 15.5125 k = 0.5789-0.0456 0.4835 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1954 -15.1954 -15.1878 -15.1878 -2.1913 -2.1913 -2.1883 -2.1883 -1.7394 -1.7394 -1.7304 -1.7304 -1.7249 -1.7249 5.6479 5.6479 7.5478 7.5478 8.0456 8.0456 8.9121 8.9121 9.0376 9.0376 9.1567 9.1567 9.3047 9.3047 9.3888 9.3888 9.5183 9.5183 9.6239 9.6239 9.6892 9.6892 9.8492 9.8492 10.4884 10.4884 11.2705 11.2705 13.1800 13.1800 14.5707 14.5707 14.9809 14.9809 15.0283 15.0283 15.5322 15.5322 k = 0.5724-0.0418 0.4942 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1953 -15.1953 -15.1880 -15.1880 -2.1912 -2.1912 -2.1884 -2.1884 -1.7394 -1.7394 -1.7302 -1.7302 -1.7251 -1.7251 5.6530 5.6530 7.5599 7.5599 8.0334 8.0334 8.9099 8.9099 9.0447 9.0447 9.1677 9.1677 9.3091 9.3091 9.3875 9.3875 9.5065 9.5065 9.6236 9.6236 9.6897 9.6897 9.8654 9.8654 10.4892 10.4892 11.1762 11.1762 13.2645 13.2645 14.5407 14.5407 14.9814 14.9814 14.9965 14.9965 15.5486 15.5486 k = 0.5658-0.0380 0.5049 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1952 -15.1952 -15.1881 -15.1881 -2.1911 -2.1911 -2.1884 -2.1884 -1.7393 -1.7393 -1.7300 -1.7300 -1.7252 -1.7252 5.6586 5.6586 7.5736 7.5736 8.0197 8.0197 8.9079 8.9079 9.0521 9.0521 9.1774 9.1774 9.3153 9.3153 9.3859 9.3859 9.4959 9.4959 9.6239 9.6239 9.6902 9.6902 9.8809 9.8809 10.4901 10.4901 11.0825 11.0825 13.3487 13.3487 14.5078 14.5078 14.9636 14.9636 14.9848 14.9848 15.5620 15.5620 k = 0.5592-0.0342 0.5157 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1951 -15.1951 -15.1882 -15.1882 -2.1910 -2.1910 -2.1885 -2.1885 -1.7393 -1.7393 -1.7299 -1.7299 -1.7254 -1.7254 5.6645 5.6645 7.5889 7.5889 8.0043 8.0043 8.9062 8.9062 9.0598 9.0598 9.1848 9.1848 9.3238 9.3238 9.3840 9.3840 9.4868 9.4868 9.6248 9.6248 9.6910 9.6910 9.8952 9.8952 10.4911 10.4911 10.9909 10.9909 13.4318 13.4318 14.4723 14.4723 14.9362 14.9362 14.9847 14.9847 15.5725 15.5725 k = 0.5526-0.0304 0.5264 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1951 -15.1951 -15.1884 -15.1884 -2.1910 -2.1910 -2.1886 -2.1886 -1.7394 -1.7394 -1.7297 -1.7297 -1.7257 -1.7257 5.6705 5.6705 7.6057 7.6057 7.9873 7.9873 8.9046 8.9046 9.0677 9.0677 9.1892 9.1892 9.3345 9.3345 9.3818 9.3818 9.4795 9.4795 9.6262 9.6262 9.6924 9.6924 9.9077 9.9077 10.4922 10.4922 10.9030 10.9030 13.5130 13.5130 14.4343 14.4343 14.9111 14.9111 14.9846 14.9846 15.5805 15.5805 k = 0.5461-0.0266 0.5372 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1950 -15.1950 -15.1886 -15.1886 -2.1909 -2.1909 -2.1887 -2.1887 -1.7394 -1.7394 -1.7295 -1.7295 -1.7259 -1.7259 5.6767 5.6767 7.6241 7.6241 7.9687 7.9687 8.9033 8.9033 9.0761 9.0761 9.1904 9.1904 9.3467 9.3467 9.3798 9.3798 9.4741 9.4741 9.6281 9.6281 9.6951 9.6951 9.9176 9.9176 10.4933 10.4933 10.8205 10.8205 13.5920 13.5920 14.3940 14.3940 14.8887 14.8887 14.9842 14.9842 15.5863 15.5863 k = 0.5395-0.0228 0.5479 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1949 -15.1949 -15.1887 -15.1887 -2.1908 -2.1908 -2.1888 -2.1888 -1.7393 -1.7393 -1.7292 -1.7292 -1.7261 -1.7261 5.6827 5.6827 7.6440 7.6440 7.9484 7.9484 8.9022 8.9022 9.0848 9.0848 9.1886 9.1886 9.3594 9.3594 9.3782 9.3782 9.4706 9.4706 9.6303 9.6303 9.6995 9.6995 9.9243 9.9243 10.4943 10.4943 10.7449 10.7449 13.6682 13.6682 14.3515 14.3515 14.8694 14.8694 14.9834 14.9834 15.5903 15.5903 k = 0.5329-0.0190 0.5587 ( 2426 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1948 -15.1948 -15.1888 -15.1888 -2.1907 -2.1907 -2.1888 -2.1888 -1.7393 -1.7393 -1.7290 -1.7290 -1.7263 -1.7263 5.6885 5.6885 7.6654 7.6654 7.9266 7.9266 8.9013 8.9013 9.0938 9.0938 9.1842 9.1842 9.3694 9.3694 9.3789 9.3789 9.4687 9.4687 9.6325 9.6325 9.7063 9.7063 9.9266 9.9266 10.4952 10.4952 10.6784 10.6784 13.7415 13.7415 14.3069 14.3069 14.8531 14.8531 14.9823 14.9823 15.5927 15.5927 k = 0.5263-0.0152 0.5694 ( 2423 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1947 -15.1947 -15.1890 -15.1890 -2.1906 -2.1906 -2.1889 -2.1889 -1.7393 -1.7393 -1.7287 -1.7287 -1.7266 -1.7266 5.6937 5.6937 7.6882 7.6882 7.9033 7.9033 8.9005 8.9005 9.1030 9.1030 9.1779 9.1779 9.3721 9.3721 9.3859 9.3859 9.4682 9.4682 9.6346 9.6346 9.7163 9.7163 9.9238 9.9238 10.4956 10.4956 10.6228 10.6228 13.8115 13.8115 14.2604 14.2604 14.8398 14.8398 14.9812 14.9812 15.5939 15.5939 k = 0.5197-0.0114 0.5801 ( 2423 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1947 -15.1947 -15.1890 -15.1890 -2.1905 -2.1905 -2.1889 -2.1889 -1.7393 -1.7393 -1.7285 -1.7285 -1.7269 -1.7269 5.6983 5.6983 7.7124 7.7124 7.8785 7.8785 8.8999 8.8999 9.1124 9.1124 9.1702 9.1702 9.3720 9.3720 9.3936 9.3936 9.4687 9.4687 9.6360 9.6360 9.7294 9.7294 9.9158 9.9158 10.4949 10.4949 10.5803 10.5803 13.8781 13.8781 14.2120 14.2120 14.8297 14.8297 14.9800 14.9800 15.5943 15.5943 k = 0.5132-0.0076 0.5909 ( 2421 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1904 -2.1904 -2.1890 -2.1890 -1.7392 -1.7392 -1.7282 -1.7282 -1.7271 -1.7271 5.7019 5.7019 7.7377 7.7377 7.8526 7.8526 8.8994 8.8994 9.1219 9.1219 9.1616 9.1616 9.3718 9.3718 9.3992 9.3992 9.4696 9.4696 9.6370 9.6370 9.7447 9.7447 9.9033 9.9033 10.4922 10.4922 10.5526 10.5526 13.9411 13.9411 14.1619 14.1619 14.8227 14.8227 14.9790 14.9790 15.5942 15.5942 k = 0.5066-0.0038 0.6016 ( 2414 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1903 -2.1903 -2.1890 -2.1890 -1.7392 -1.7392 -1.7280 -1.7280 -1.7272 -1.7272 5.7043 5.7043 7.7636 7.7636 7.8262 7.8262 8.8992 8.8992 9.1313 9.1313 9.1527 9.1527 9.3719 9.3719 9.4024 9.4024 9.4703 9.4703 9.6375 9.6375 9.7591 9.7591 9.8899 9.8899 10.4881 10.4881 10.5392 10.5392 14.0005 14.0005 14.1103 14.1103 14.8186 14.8186 14.9783 14.9783 15.5939 15.5939 k = 0.5000 0.0000 0.6124 ( 2400 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1945 -15.1945 -15.1891 -15.1891 -2.1902 -2.1902 -2.1889 -2.1889 -1.7390 -1.7390 -1.7278 -1.7278 -1.7272 -1.7272 5.7052 5.7052 7.7821 7.7821 7.8076 7.8076 8.8991 8.8991 9.1377 9.1377 9.1465 9.1465 9.3721 9.3721 9.4034 9.4034 9.4706 9.4706 9.6376 9.6376 9.7658 9.7658 9.8833 9.8833 10.4861 10.4861 10.5358 10.5358 14.0516 14.0516 14.0619 14.0619 14.8174 14.8174 14.9780 14.9780 15.5937 15.5937 k = 0.5000 0.0000 0.6124 ( 2400 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1945 -15.1945 -15.1891 -15.1891 -2.1902 -2.1902 -2.1889 -2.1889 -1.7390 -1.7390 -1.7278 -1.7278 -1.7272 -1.7272 5.7052 5.7052 7.7821 7.7821 7.8076 7.8076 8.8991 8.8991 9.1377 9.1377 9.1465 9.1465 9.3721 9.3721 9.4034 9.4034 9.4706 9.4706 9.6376 9.6376 9.7658 9.7658 9.8833 9.8833 10.4861 10.4861 10.5358 10.5358 14.0516 14.0516 14.0619 14.0619 14.8174 14.8174 14.9780 14.9780 15.5937 15.5937 k = 0.5000 0.0078 0.6013 ( 2412 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1902 -2.1902 -2.1890 -2.1890 -1.7391 -1.7391 -1.7280 -1.7280 -1.7272 -1.7272 5.7038 5.7038 7.7820 7.7820 7.8078 7.8078 8.8991 8.8991 9.1377 9.1377 9.1464 9.1464 9.3711 9.3711 9.4017 9.4017 9.4694 9.4694 9.6371 9.6371 9.7643 9.7643 9.8824 9.8824 10.4910 10.4910 10.5414 10.5414 14.0505 14.0505 14.0614 14.0614 14.8205 14.8205 14.9788 14.9788 15.5943 15.5943 k = 0.5000 0.0156 0.5903 ( 2428 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1904 -2.1904 -2.1891 -2.1891 -1.7392 -1.7392 -1.7281 -1.7281 -1.7273 -1.7273 5.6995 5.6995 7.7800 7.7800 7.8103 7.8103 8.8991 8.8991 9.1376 9.1376 9.1461 9.1461 9.3677 9.3677 9.3971 9.3971 9.4664 9.4664 9.6354 9.6354 9.7601 9.7601 9.8797 9.8797 10.5037 10.5037 10.5600 10.5600 14.0450 14.0450 14.0628 14.0628 14.8295 14.8295 14.9816 14.9816 15.5963 15.5963 k = 0.5000 0.0234 0.5793 ( 2428 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1946 -15.1946 -15.1891 -15.1891 -2.1904 -2.1904 -2.1891 -2.1891 -1.7392 -1.7392 -1.7282 -1.7282 -1.7272 -1.7272 5.6927 5.6927 7.7730 7.7730 7.8182 7.8182 8.8992 8.8992 9.1374 9.1374 9.1459 9.1459 9.3597 9.3597 9.3916 9.3916 9.4628 9.4628 9.6330 9.6330 9.7540 9.7540 9.8753 9.8753 10.5201 10.5201 10.5939 10.5939 14.0338 14.0338 14.0678 14.0678 14.8431 14.8431 14.9870 14.9870 15.5996 15.5996 k = 0.5000 0.0312 0.5682 ( 2430 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1947 -15.1947 -15.1890 -15.1890 -2.1904 -2.1904 -2.1891 -2.1891 -1.7392 -1.7392 -1.7284 -1.7284 -1.7271 -1.7271 5.6832 5.6832 7.7606 7.7606 7.8317 7.8317 8.8994 8.8994 9.1369 9.1369 9.1456 9.1456 9.3450 9.3450 9.3873 9.3873 9.4594 9.4594 9.6298 9.6298 9.7469 9.7469 9.8691 9.8691 10.5386 10.5386 10.6424 10.6424 14.0188 14.0188 14.0756 14.0756 14.8590 14.8590 14.9965 14.9965 15.6043 15.6043 k = 0.5000 0.0390 0.5572 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1947 -15.1947 -15.1888 -15.1888 -2.1903 -2.1903 -2.1890 -2.1890 -1.7390 -1.7390 -1.7285 -1.7285 -1.7269 -1.7269 5.6714 5.6714 7.7437 7.7437 7.8498 7.8498 8.8996 8.8996 9.1356 9.1356 9.1454 9.1454 9.3247 9.3247 9.3848 9.3848 9.4569 9.4569 9.6259 9.6259 9.7394 9.7394 9.8615 9.8615 10.5598 10.5598 10.7025 10.7025 14.0011 14.0011 14.0857 14.0857 14.8744 14.8744 15.0119 15.0119 15.6102 15.6102 k = 0.5000 0.0468 0.5462 ( 2422 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1947 -15.1947 -15.1886 -15.1886 -2.1903 -2.1903 -2.1889 -2.1889 -1.7389 -1.7389 -1.7287 -1.7287 -1.7268 -1.7268 5.6574 5.6574 7.7229 7.7229 7.8719 7.8719 8.8999 8.8999 9.1328 9.1328 9.1456 9.1456 9.3013 9.3013 9.3832 9.3832 9.4550 9.4550 9.6215 9.6215 9.7317 9.7317 9.8528 9.8528 10.5839 10.5839 10.7715 10.7715 13.9820 13.9820 14.0981 14.0981 14.8867 14.8867 15.0348 15.0348 15.6174 15.6174 k = 0.5000 0.0546 0.5351 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1947 -15.1947 -15.1884 -15.1884 -2.1903 -2.1903 -2.1889 -2.1889 -1.7388 -1.7388 -1.7288 -1.7288 -1.7266 -1.7266 5.6415 5.6415 7.6985 7.6985 7.8975 7.8975 8.9003 8.9003 9.1280 9.1280 9.1460 9.1460 9.2775 9.2775 9.3821 9.3821 9.4538 9.4538 9.6165 9.6165 9.7239 9.7239 9.8431 9.8431 10.6111 10.6111 10.8472 10.8472 13.9624 13.9624 14.1127 14.1127 14.8949 14.8949 15.0654 15.0654 15.6259 15.6259 k = 0.5000 0.0624 0.5241 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1948 -15.1948 -15.1882 -15.1882 -2.1903 -2.1903 -2.1888 -2.1888 -1.7387 -1.7387 -1.7290 -1.7290 -1.7264 -1.7264 5.6238 5.6238 7.6708 7.6708 7.9260 7.9260 8.9006 8.9006 9.1203 9.1203 9.1467 9.1467 9.2556 9.2556 9.3812 9.3812 9.4528 9.4528 9.6108 9.6108 9.7160 9.7160 9.8330 9.8330 10.6415 10.6415 10.9278 10.9278 13.9432 13.9432 14.1292 14.1292 14.8995 14.8995 15.1026 15.1026 15.6356 15.6356 k = 0.5000 0.0702 0.5131 ( 2416 PWs) bands (ev): -36.6679 -36.6679 -15.6931 -15.6931 -15.1948 -15.1948 -15.1880 -15.1880 -2.1902 -2.1902 -2.1888 -2.1888 -1.7386 -1.7386 -1.7291 -1.7291 -1.7263 -1.7263 5.6047 5.6047 7.6402 7.6402 7.9572 7.9572 8.9008 8.9008 9.1091 9.1091 9.1475 9.1475 9.2373 9.2373 9.3805 9.3805 9.4520 9.4520 9.6046 9.6046 9.7079 9.7079 9.8226 9.8226 10.6749 10.6749 11.0120 11.0120 13.9254 13.9254 14.1476 14.1476 14.9014 14.9014 15.1446 15.1446 15.6465 15.6465 k = 0.5000 0.0780 0.5020 ( 2420 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1949 -15.1949 -15.1877 -15.1877 -2.1903 -2.1903 -2.1888 -2.1888 -1.7385 -1.7385 -1.7294 -1.7294 -1.7262 -1.7262 5.5843 5.5843 7.6070 7.6070 7.9907 7.9907 8.9009 8.9009 9.0945 9.0945 9.1484 9.1484 9.2237 9.2237 9.3798 9.3798 9.4514 9.4514 9.5977 9.5977 9.6995 9.6995 9.8122 9.8122 10.7114 10.7114 11.0986 11.0986 13.9096 13.9096 14.1677 14.1677 14.9015 14.9015 15.1902 15.1902 15.6586 15.6586 k = 0.5000 0.0858 0.4910 ( 2422 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1950 -15.1950 -15.1875 -15.1875 -2.1903 -2.1903 -2.1887 -2.1887 -1.7384 -1.7384 -1.7296 -1.7296 -1.7260 -1.7260 5.5631 5.5631 7.5715 7.5715 8.0259 8.0259 8.9006 8.9006 9.0775 9.0775 9.1494 9.1494 9.2143 9.2143 9.3792 9.3792 9.4507 9.4507 9.5903 9.5903 9.6909 9.6909 9.8021 9.8021 10.7509 10.7509 11.1864 11.1864 13.8965 13.8965 14.1895 14.1895 14.9002 14.9002 15.2384 15.2384 15.6717 15.6717 k = 0.5000 0.0936 0.4800 ( 2422 PWs) bands (ev): -36.6679 -36.6679 -15.6929 -15.6929 -15.1951 -15.1951 -15.1872 -15.1872 -2.1902 -2.1902 -2.1887 -2.1887 -1.7383 -1.7383 -1.7298 -1.7298 -1.7259 -1.7259 5.5411 5.5411 7.5342 7.5342 8.0627 8.0627 8.8996 8.8996 9.0596 9.0596 9.1503 9.1503 9.2084 9.2084 9.3786 9.3786 9.4501 9.4501 9.5824 9.5824 9.6819 9.6819 9.7922 9.7922 10.7933 10.7933 11.2746 11.2746 13.8868 13.8868 14.2128 14.2128 14.8980 14.8980 15.2884 15.2884 15.6857 15.6857 k = 0.5000 0.1014 0.4689 ( 2416 PWs) bands (ev): -36.6679 -36.6679 -15.6927 -15.6927 -15.1951 -15.1951 -15.1868 -15.1868 -2.1902 -2.1902 -2.1886 -2.1886 -1.7381 -1.7381 -1.7299 -1.7299 -1.7256 -1.7256 5.5186 5.5186 7.4954 7.4954 8.1005 8.1005 8.8976 8.8976 9.0425 9.0425 9.1513 9.1513 9.2048 9.2048 9.3781 9.3781 9.4493 9.4493 9.5741 9.5741 9.6726 9.6726 9.7829 9.7829 10.8387 10.8387 11.3620 11.3620 13.8811 13.8811 14.2375 14.2375 14.8951 14.8951 15.3398 15.3398 15.7004 15.7004 k = 0.5000 0.1092 0.4579 ( 2416 PWs) bands (ev): -36.6679 -36.6679 -15.6926 -15.6926 -15.1952 -15.1952 -15.1865 -15.1865 -2.1902 -2.1902 -2.1885 -2.1885 -1.7380 -1.7380 -1.7301 -1.7301 -1.7255 -1.7255 5.4958 5.4958 7.4555 7.4555 8.1390 8.1390 8.8939 8.8939 9.0275 9.0275 9.1521 9.1521 9.2028 9.2028 9.3775 9.3775 9.4484 9.4484 9.5656 9.5656 9.6630 9.6630 9.7740 9.7740 10.8871 10.8871 11.4480 11.4480 13.8800 13.8800 14.2633 14.2633 14.8918 14.8918 15.3920 15.3920 15.7157 15.7157 k = 0.5000 0.1170 0.4469 ( 2420 PWs) bands (ev): -36.6680 -36.6680 -15.6926 -15.6926 -15.1953 -15.1953 -15.1862 -15.1862 -2.1902 -2.1902 -2.1885 -2.1885 -1.7379 -1.7379 -1.7303 -1.7303 -1.7253 -1.7253 5.4730 5.4730 7.4149 7.4149 8.1778 8.1778 8.8881 8.8881 9.0157 9.0157 9.1529 9.1529 9.2019 9.2019 9.3769 9.3769 9.4472 9.4472 9.5569 9.5569 9.6532 9.6532 9.7655 9.7655 10.9383 10.9383 11.5315 11.5315 13.8839 13.8839 14.2900 14.2900 14.8880 14.8880 15.4448 15.4448 15.7311 15.7311 k = 0.5000 0.1248 0.4358 ( 2418 PWs) bands (ev): -36.6680 -36.6680 -15.6924 -15.6924 -15.1954 -15.1954 -15.1858 -15.1858 -2.1902 -2.1902 -2.1884 -2.1884 -1.7378 -1.7378 -1.7305 -1.7305 -1.7251 -1.7251 5.4502 5.4502 7.3738 7.3738 8.2167 8.2167 8.8801 8.8801 9.0075 9.0075 9.1537 9.1537 9.2016 9.2016 9.3762 9.3762 9.4456 9.4456 9.5483 9.5483 9.6432 9.6432 9.7574 9.7574 10.9924 10.9924 11.6118 11.6118 13.8934 13.8934 14.3174 14.3174 14.8841 14.8841 15.4979 15.4979 15.7461 15.7461 k = 0.5000 0.1326 0.4248 ( 2420 PWs) bands (ev): -36.6680 -36.6680 -15.6923 -15.6923 -15.1955 -15.1955 -15.1855 -15.1855 -2.1902 -2.1902 -2.1883 -2.1883 -1.7377 -1.7377 -1.7307 -1.7307 -1.7249 -1.7249 5.4277 5.4277 7.3328 7.3328 8.2553 8.2553 8.8700 8.8700 9.0029 9.0029 9.1544 9.1544 9.2019 9.2019 9.3753 9.3753 9.4436 9.4436 9.5399 9.5399 9.6331 9.6331 9.7498 9.7498 11.0494 11.0494 11.6881 11.6881 13.9090 13.9090 14.3454 14.3454 14.8799 14.8799 15.5511 15.5511 15.7598 15.7598 k = 0.5000 0.1404 0.4138 ( 2422 PWs) bands (ev): -36.6680 -36.6680 -15.6922 -15.6922 -15.1956 -15.1956 -15.1851 -15.1851 -2.1902 -2.1902 -2.1883 -2.1883 -1.7376 -1.7376 -1.7309 -1.7309 -1.7247 -1.7247 5.4056 5.4056 7.2920 7.2920 8.2932 8.2932 8.8584 8.8584 9.0014 9.0014 9.1552 9.1552 9.2025 9.2025 9.3744 9.3744 9.4412 9.4412 9.5318 9.5318 9.6229 9.6229 9.7424 9.7424 11.1092 11.1092 11.7598 11.7598 13.9308 13.9308 14.3737 14.3737 14.8757 14.8757 15.6043 15.6043 15.7706 15.7706 k = 0.5000 0.1482 0.4027 ( 2422 PWs) bands (ev): -36.6680 -36.6680 -15.6921 -15.6921 -15.1957 -15.1957 -15.1848 -15.1848 -2.1902 -2.1902 -2.1882 -2.1882 -1.7375 -1.7375 -1.7311 -1.7311 -1.7244 -1.7244 5.3840 5.3840 7.2518 7.2518 8.3302 8.3302 8.8460 8.8460 9.0024 9.0024 9.1559 9.1559 9.2034 9.2034 9.3732 9.3732 9.4383 9.4383 9.5243 9.5243 9.6128 9.6128 9.7354 9.7354 11.1716 11.1716 11.8263 11.8263 13.9589 13.9589 14.4021 14.4021 14.8715 14.8715 15.6574 15.6574 15.7762 15.7762 k = 0.5000 0.1560 0.3917 ( 2418 PWs) bands (ev): -36.6681 -36.6681 -15.6920 -15.6920 -15.1957 -15.1957 -15.1844 -15.1844 -2.1902 -2.1902 -2.1881 -2.1881 -1.7374 -1.7374 -1.7312 -1.7312 -1.7242 -1.7242 5.3631 5.3631 7.2125 7.2125 8.3661 8.3661 8.8334 8.8334 9.0052 9.0052 9.1568 9.1568 9.2045 9.2045 9.3716 9.3716 9.4348 9.4348 9.5174 9.5174 9.6029 9.6029 9.7287 9.7287 11.2368 11.2368 11.8872 11.8872 13.9935 13.9935 14.4303 14.4303 14.8673 14.8673 15.7099 15.7099 15.7729 15.7729 k = 0.5000 0.1638 0.3807 ( 2420 PWs) bands (ev): -36.6681 -36.6681 -15.6919 -15.6919 -15.1958 -15.1958 -15.1840 -15.1840 -2.1902 -2.1902 -2.1880 -2.1880 -1.7374 -1.7374 -1.7314 -1.7314 -1.7240 -1.7240 5.3429 5.3429 7.1743 7.1743 8.4005 8.4005 8.8210 8.8210 9.0093 9.0093 9.1577 9.1577 9.2057 9.2057 9.3697 9.3697 9.4309 9.4309 9.5109 9.5109 9.5933 9.5933 9.7222 9.7222 11.3044 11.3044 11.9421 11.9421 14.0341 14.0341 14.4579 14.4579 14.8632 14.8632 15.7484 15.7484 15.7685 15.7685 k = 0.5000 0.1716 0.3696 ( 2418 PWs) bands (ev): -36.6681 -36.6681 -15.6918 -15.6918 -15.1959 -15.1959 -15.1837 -15.1837 -2.1902 -2.1902 -2.1879 -2.1879 -1.7373 -1.7373 -1.7315 -1.7315 -1.7238 -1.7238 5.3236 5.3236 7.1375 7.1375 8.4332 8.4332 8.8092 8.8092 9.0144 9.0144 9.1588 9.1588 9.2071 9.2071 9.3673 9.3673 9.4265 9.4265 9.5050 9.5050 9.5841 9.5841 9.7159 9.7159 11.3742 11.3742 11.9911 11.9911 14.0803 14.0803 14.4848 14.4848 14.8593 14.8593 15.7131 15.7131 15.8175 15.8175 k = 0.5000 0.1794 0.3586 ( 2420 PWs) bands (ev): -36.6681 -36.6681 -15.6917 -15.6917 -15.1960 -15.1960 -15.1833 -15.1833 -2.1902 -2.1902 -2.1879 -2.1879 -1.7373 -1.7373 -1.7317 -1.7317 -1.7236 -1.7236 5.3052 5.3052 7.1021 7.1021 8.4640 8.4640 8.7983 8.7983 9.0202 9.0202 9.1601 9.1601 9.2086 9.2086 9.3645 9.3645 9.4218 9.4218 9.4994 9.4994 9.5756 9.5756 9.7099 9.7099 11.4459 11.4459 12.0341 12.0341 14.1314 14.1314 14.5106 14.5106 14.8556 14.8556 15.6527 15.6527 15.8698 15.8698 k = 0.5000 0.1872 0.3476 ( 2420 PWs) bands (ev): -36.6681 -36.6681 -15.6916 -15.6916 -15.1961 -15.1961 -15.1830 -15.1830 -2.1902 -2.1902 -2.1878 -2.1878 -1.7373 -1.7373 -1.7318 -1.7318 -1.7234 -1.7234 5.2878 5.2878 7.0685 7.0685 8.4926 8.4926 8.7884 8.7884 9.0263 9.0263 9.1617 9.1617 9.2104 9.2104 9.3611 9.3611 9.4168 9.4168 9.4939 9.4939 9.5679 9.5679 9.7040 9.7040 11.5193 11.5193 12.0716 12.0716 14.1863 14.1863 14.5349 14.5349 14.8522 14.8522 15.5747 15.5747 15.9222 15.9222 k = 0.5000 0.1951 0.3365 ( 2422 PWs) bands (ev): -36.6682 -36.6682 -15.6915 -15.6915 -15.1961 -15.1961 -15.1827 -15.1827 -2.1902 -2.1902 -2.1878 -2.1878 -1.7373 -1.7373 -1.7319 -1.7319 -1.7232 -1.7232 5.2714 5.2714 7.0368 7.0368 8.5187 8.5187 8.7797 8.7797 9.0328 9.0328 9.1636 9.1636 9.2125 9.2125 9.3572 9.3572 9.4115 9.4115 9.4885 9.4885 9.5611 9.5611 9.6985 9.6985 11.5937 11.5937 12.1036 12.1036 14.2441 14.2441 14.5573 14.5573 14.8492 14.8492 15.4860 15.4860 15.9745 15.9745 k = 0.5000 0.2029 0.3255 ( 2422 PWs) bands (ev): -36.6682 -36.6682 -15.6914 -15.6914 -15.1962 -15.1962 -15.1824 -15.1824 -2.1902 -2.1902 -2.1877 -2.1877 -1.7373 -1.7373 -1.7320 -1.7320 -1.7230 -1.7230 5.2562 5.2562 7.0072 7.0072 8.5422 8.5422 8.7725 8.7725 9.0393 9.0393 9.1657 9.1657 9.2150 9.2150 9.3529 9.3529 9.4059 9.4059 9.4832 9.4832 9.5553 9.5553 9.6932 9.6932 11.6687 11.6687 12.1309 12.1309 14.3033 14.3033 14.5773 14.5773 14.8466 14.8466 15.3924 15.3924 16.0266 16.0266 k = 0.5000 0.2107 0.3145 ( 2422 PWs) bands (ev): -36.6682 -36.6682 -15.6913 -15.6913 -15.1963 -15.1963 -15.1821 -15.1821 -2.1902 -2.1902 -2.1876 -2.1876 -1.7373 -1.7373 -1.7320 -1.7320 -1.7228 -1.7228 5.2422 5.2422 6.9797 6.9797 8.5628 8.5628 8.7668 8.7668 9.0457 9.0457 9.1679 9.1679 9.2180 9.2180 9.3483 9.3483 9.3998 9.3998 9.4779 9.4779 9.5506 9.5506 9.6883 9.6883 11.7437 11.7437 12.1538 12.1538 14.3626 14.3626 14.5943 14.5943 14.8446 14.8446 15.2982 15.2982 16.0784 16.0784 k = 0.5000 0.2185 0.3034 ( 2430 PWs) bands (ev): -36.6682 -36.6682 -15.6913 -15.6913 -15.1964 -15.1964 -15.1819 -15.1819 -2.1903 -2.1903 -2.1876 -2.1876 -1.7374 -1.7374 -1.7322 -1.7322 -1.7226 -1.7226 5.2294 5.2294 6.9546 6.9546 8.5802 8.5802 8.7629 8.7629 9.0519 9.0519 9.1701 9.1701 9.2217 9.2217 9.3435 9.3435 9.3932 9.3932 9.4728 9.4728 9.5468 9.5468 9.6837 9.6837 11.8177 11.8177 12.1728 12.1728 14.4206 14.4206 14.6073 14.6073 14.8433 14.8433 15.2069 15.2069 16.1296 16.1296 k = 0.5000 0.2263 0.2924 ( 2428 PWs) bands (ev): -36.6682 -36.6682 -15.6912 -15.6912 -15.1964 -15.1964 -15.1817 -15.1817 -2.1903 -2.1903 -2.1875 -2.1875 -1.7374 -1.7374 -1.7322 -1.7322 -1.7224 -1.7224 5.2178 5.2178 6.9318 6.9318 8.5945 8.5945 8.7607 8.7607 9.0580 9.0580 9.1723 9.1723 9.2263 9.2263 9.3387 9.3387 9.3859 9.3859 9.4680 9.4680 9.5438 9.5438 9.6794 9.6794 11.8898 11.8898 12.1885 12.1885 14.4757 14.4757 14.6153 14.6153 14.8428 14.8428 15.1219 15.1219 16.1797 16.1797 k = 0.5000 0.2341 0.2814 ( 2426 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1965 -15.1965 -15.1814 -15.1814 -2.1903 -2.1903 -2.1875 -2.1875 -1.7374 -1.7374 -1.7322 -1.7322 -1.7223 -1.7223 5.2075 5.2075 6.9115 6.9115 8.6058 8.6058 8.7602 8.7602 9.0637 9.0637 9.1742 9.1742 9.2319 9.2319 9.3338 9.3338 9.3779 9.3779 9.4639 9.4639 9.5415 9.5415 9.6756 9.6756 11.9591 11.9591 12.2012 12.2012 14.5266 14.5266 14.6166 14.6166 14.8433 14.8433 15.0463 15.0463 16.2279 16.2279 k = 0.5000 0.2419 0.2703 ( 2424 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1965 -15.1965 -15.1812 -15.1812 -2.1903 -2.1903 -2.1874 -2.1874 -1.7374 -1.7374 -1.7322 -1.7322 -1.7221 -1.7221 5.1986 5.1986 6.8938 6.8938 8.6142 8.6142 8.7611 8.7611 9.0689 9.0689 9.1757 9.1757 9.2385 9.2385 9.3292 9.3292 9.3693 9.3693 9.4602 9.4602 9.5398 9.5398 9.6722 9.6722 12.0240 12.0240 12.2114 12.2114 14.5716 14.5716 14.6100 14.6100 14.8449 14.8449 14.9836 14.9836 16.2731 16.2731 k = 0.5000 0.2497 0.2593 ( 2424 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1965 -15.1965 -15.1811 -15.1811 -2.1903 -2.1903 -2.1874 -2.1874 -1.7375 -1.7375 -1.7322 -1.7322 -1.7220 -1.7220 5.1909 5.1909 6.8787 6.8787 8.6201 8.6201 8.7630 8.7630 9.0737 9.0737 9.1768 9.1768 9.2461 9.2461 9.3246 9.3246 9.3603 9.3603 9.4572 9.4572 9.5386 9.5386 9.6693 9.6693 12.0831 12.0831 12.2195 12.2195 14.5922 14.5922 14.6122 14.6122 14.8477 14.8477 14.9361 14.9361 16.3140 16.3140 k = 0.5000 0.2575 0.2483 ( 2426 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1966 -15.1966 -15.1809 -15.1809 -2.1903 -2.1903 -2.1874 -2.1874 -1.7375 -1.7375 -1.7323 -1.7323 -1.7219 -1.7219 5.1847 5.1847 6.8662 6.8662 8.6240 8.6240 8.7654 8.7654 9.0778 9.0778 9.1774 9.1774 9.2546 9.2546 9.3201 9.3201 9.3513 9.3513 9.4548 9.4548 9.5377 9.5377 9.6669 9.6669 12.1348 12.1348 12.2256 12.2256 14.5701 14.5701 14.6424 14.6424 14.8516 14.8516 14.9038 14.9038 16.3490 16.3490 k = 0.5000 0.2653 0.2372 ( 2426 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1808 -15.1808 -2.1903 -2.1903 -2.1873 -2.1873 -1.7375 -1.7375 -1.7323 -1.7323 -1.7218 -1.7218 5.1798 5.1798 6.8565 6.8565 8.6266 8.6266 8.7678 8.7678 9.0811 9.0811 9.1778 9.1778 9.2638 9.2638 9.3154 9.3154 9.3428 9.3428 9.4530 9.4530 9.5370 9.5370 9.6650 9.6650 12.1774 12.1774 12.2302 12.2302 14.5447 14.5447 14.6658 14.6658 14.8560 14.8560 14.8840 14.8840 16.3769 16.3769 k = 0.5000 0.2731 0.2262 ( 2426 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1808 -15.1808 -2.1903 -2.1903 -2.1873 -2.1873 -1.7375 -1.7375 -1.7323 -1.7323 -1.7218 -1.7218 5.1763 5.1763 6.8495 6.8495 8.6280 8.6280 8.7697 8.7697 9.0837 9.0837 9.1780 9.1780 9.2734 9.2734 9.3097 9.3097 9.3359 9.3359 9.4518 9.4518 9.5366 9.5366 9.6636 9.6636 12.2093 12.2093 12.2333 12.2333 14.5220 14.5220 14.6817 14.6817 14.8599 14.8599 14.8733 14.8733 16.3970 16.3970 k = 0.5000 0.2809 0.2152 ( 2434 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1807 -15.1807 -2.1904 -2.1904 -2.1874 -2.1874 -1.7376 -1.7376 -1.7324 -1.7324 -1.7218 -1.7218 5.1742 5.1742 6.8454 6.8454 8.6288 8.6288 8.7710 8.7710 9.0852 9.0852 9.1780 9.1780 9.2829 9.2829 9.3027 9.3027 9.3315 9.3315 9.4510 9.4510 9.5363 9.5363 9.6628 9.6628 12.2290 12.2290 12.2351 12.2351 14.5065 14.5065 14.6909 14.6909 14.8618 14.8618 14.8690 14.8690 16.4091 16.4091 k = 0.5000 0.2887 0.2041 ( 2452 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1967 -15.1967 -15.1808 -15.1808 -2.1905 -2.1905 -2.1875 -2.1875 -1.7377 -1.7377 -1.7325 -1.7325 -1.7219 -1.7219 5.1735 5.1735 6.8439 6.8439 8.6288 8.6288 8.7713 8.7713 9.0856 9.0856 9.1779 9.1779 9.2897 9.2897 9.2967 9.2967 9.3299 9.3299 9.4507 9.4507 9.5362 9.5362 9.6624 9.6624 12.2356 12.2356 12.2357 12.2357 14.5011 14.5011 14.6939 14.6939 14.8618 14.8618 14.8684 14.8684 16.4131 16.4131 k = 0.5000 0.2887 0.2041 ( 2452 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1967 -15.1967 -15.1808 -15.1808 -2.1905 -2.1905 -2.1875 -2.1875 -1.7377 -1.7377 -1.7325 -1.7325 -1.7219 -1.7219 5.1735 5.1735 6.8439 6.8439 8.6288 8.6288 8.7713 8.7713 9.0856 9.0856 9.1779 9.1779 9.2897 9.2897 9.2967 9.2967 9.3299 9.3299 9.4507 9.4507 9.5362 9.5362 9.6624 9.6624 12.2356 12.2356 12.2357 12.2357 14.5011 14.5011 14.6939 14.6939 14.8618 14.8618 14.8684 14.8684 16.4131 16.4131 k = 0.4961 0.2864 0.2169 ( 2432 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1807 -15.1807 -2.1904 -2.1904 -2.1874 -2.1874 -1.7376 -1.7376 -1.7324 -1.7324 -1.7218 -1.7218 5.1742 5.1742 6.8454 6.8454 8.6288 8.6288 8.7710 8.7710 9.0852 9.0852 9.1780 9.1780 9.2829 9.2829 9.3027 9.3027 9.3315 9.3315 9.4510 9.4510 9.5363 9.5363 9.6628 9.6628 12.2290 12.2290 12.2351 12.2351 14.5066 14.5066 14.6909 14.6909 14.8618 14.8618 14.8691 14.8691 16.4091 16.4091 k = 0.4922 0.2842 0.2296 ( 2430 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1808 -15.1808 -2.1904 -2.1904 -2.1873 -2.1873 -1.7376 -1.7376 -1.7323 -1.7323 -1.7218 -1.7218 5.1763 5.1763 6.8496 6.8496 8.6280 8.6280 8.7697 8.7697 9.0836 9.0836 9.1780 9.1780 9.2733 9.2733 9.3097 9.3097 9.3359 9.3359 9.4518 9.4518 9.5366 9.5366 9.6636 9.6636 12.2092 12.2092 12.2333 12.2333 14.5220 14.5220 14.6818 14.6818 14.8596 14.8596 14.8736 14.8736 16.3970 16.3970 k = 0.4883 0.2819 0.2424 ( 2422 PWs) bands (ev): -36.6683 -36.6683 -15.6909 -15.6909 -15.1966 -15.1966 -15.1808 -15.1808 -2.1903 -2.1903 -2.1873 -2.1873 -1.7375 -1.7375 -1.7323 -1.7323 -1.7218 -1.7218 5.1798 5.1798 6.8565 6.8565 8.6266 8.6266 8.7678 8.7678 9.0811 9.0811 9.1778 9.1778 9.2637 9.2637 9.3155 9.3155 9.3428 9.3428 9.4531 9.4531 9.5370 9.5370 9.6650 9.6650 12.1771 12.1771 12.2303 12.2303 14.5443 14.5443 14.6666 14.6666 14.8542 14.8542 14.8854 14.8854 16.3769 16.3769 k = 0.4844 0.2797 0.2552 ( 2422 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1966 -15.1966 -15.1809 -15.1809 -2.1903 -2.1903 -2.1873 -2.1873 -1.7375 -1.7375 -1.7323 -1.7323 -1.7219 -1.7219 5.1847 5.1847 6.8663 6.8663 8.6240 8.6240 8.7654 8.7654 9.0778 9.0778 9.1774 9.1774 9.2545 9.2545 9.3203 9.3203 9.3512 9.3512 9.4549 9.4549 9.5377 9.5377 9.6669 9.6669 12.1341 12.1341 12.2262 12.2262 14.5657 14.5657 14.6490 14.6490 14.8464 14.8464 14.9070 14.9070 16.3493 16.3493 k = 0.4805 0.2774 0.2679 ( 2423 PWs) bands (ev): -36.6683 -36.6683 -15.6910 -15.6910 -15.1965 -15.1965 -15.1811 -15.1811 -2.1903 -2.1903 -2.1874 -2.1874 -1.7374 -1.7374 -1.7322 -1.7322 -1.7220 -1.7220 5.1910 5.1910 6.8788 6.8788 8.6201 8.6201 8.7630 8.7630 9.0737 9.0737 9.1767 9.1767 9.2460 9.2460 9.3250 9.3250 9.3601 9.3601 9.4573 9.4573 9.5386 9.5386 9.6693 9.6693 12.0816 12.0816 12.2208 12.2208 14.5663 14.5663 14.6443 14.6443 14.8364 14.8364 14.9411 14.9411 16.3151 16.3151 k = 0.4766 0.2751 0.2807 ( 2423 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1965 -15.1965 -15.1812 -15.1812 -2.1903 -2.1903 -2.1874 -2.1874 -1.7374 -1.7374 -1.7322 -1.7322 -1.7221 -1.7221 5.1986 5.1986 6.8939 6.8939 8.6141 8.6141 8.7611 8.7611 9.0689 9.0689 9.1754 9.1754 9.2385 9.2385 9.3299 9.3299 9.3688 9.3688 9.4603 9.4603 9.5398 9.5398 9.6723 9.6723 12.0212 12.0212 12.2142 12.2142 14.5350 14.5350 14.6604 14.6604 14.8247 14.8247 14.9896 14.9896 16.2761 16.2761 k = 0.4727 0.2729 0.2934 ( 2423 PWs) bands (ev): -36.6682 -36.6682 -15.6911 -15.6911 -15.1964 -15.1964 -15.1814 -15.1814 -2.1903 -2.1903 -2.1875 -2.1875 -1.7374 -1.7374 -1.7322 -1.7322 -1.7222 -1.7222 5.2076 5.2076 6.9117 6.9117 8.6058 8.6058 8.7602 8.7602 9.0638 9.0638 9.1734 9.1734 9.2322 9.2322 9.3351 9.3351 9.3770 9.3770 9.4639 9.4639 9.5415 9.5415 9.6757 9.6757 11.9545 11.9545 12.2065 12.2065 14.4868 14.4868 14.6812 14.6812 14.8115 14.8115 15.0525 15.0525 16.2339 16.2339 k = 0.4688 0.2706 0.3062 ( 2427 PWs) bands (ev): -36.6682 -36.6682 -15.6912 -15.6912 -15.1964 -15.1964 -15.1816 -15.1816 -2.1903 -2.1903 -2.1875 -2.1875 -1.7374 -1.7374 -1.7322 -1.7322 -1.7224 -1.7224 5.2179 5.2179 6.9320 6.9320 8.5945 8.5945 8.7606 8.7606 9.0582 9.0582 9.1707 9.1707 9.2272 9.2272 9.3407 9.3407 9.3844 9.3844 9.4682 9.4682 9.5437 9.5437 9.6795 9.6795 11.8827 11.8827 12.1975 12.1975 14.4288 14.4288 14.7003 14.7003 14.7969 14.7969 15.1278 15.1278 16.1903 16.1903 k = 0.4648 0.2684 0.3189 ( 2420 PWs) bands (ev): -36.6682 -36.6682 -15.6912 -15.6912 -15.1963 -15.1963 -15.1818 -15.1818 -2.1902 -2.1902 -2.1876 -2.1876 -1.7373 -1.7373 -1.7321 -1.7321 -1.7226 -1.7226 5.2295 5.2295 6.9549 6.9549 8.5803 8.5803 8.7627 8.7627 9.0523 9.0523 9.1671 9.1671 9.2238 9.2238 9.3465 9.3465 9.3909 9.3909 9.4730 9.4730 9.5465 9.5465 9.6838 9.6838 11.8072 11.8072 12.1874 12.1874 14.3636 14.3636 14.7169 14.7169 14.7815 14.7815 15.2127 15.2127 16.1468 16.1468 k = 0.4609 0.2661 0.3317 ( 2420 PWs) bands (ev): -36.6682 -36.6682 -15.6913 -15.6913 -15.1963 -15.1963 -15.1821 -15.1821 -2.1902 -2.1902 -2.1876 -2.1876 -1.7373 -1.7373 -1.7320 -1.7320 -1.7227 -1.7227 5.2423 5.2423 6.9801 6.9801 8.5629 8.5629 8.7664 8.7664 9.0462 9.0462 9.1628 9.1628 9.2219 9.2219 9.3525 9.3525 9.3966 9.3966 9.4781 9.4781 9.5500 9.5500 9.6885 9.6885 11.7289 11.7289 12.1761 12.1761 14.2927 14.2927 14.7315 14.7315 14.7656 14.7656 15.3039 15.3039 16.1045 16.1045 k = 0.4570 0.2639 0.3445 ( 2420 PWs) bands (ev): -36.6682 -36.6682 -15.6914 -15.6914 -15.1962 -15.1962 -15.1824 -15.1824 -2.1902 -2.1902 -2.1877 -2.1877 -1.7372 -1.7372 -1.7320 -1.7320 -1.7229 -1.7229 5.2564 5.2564 7.0076 7.0076 8.5425 8.5425 8.7718 8.7718 9.0399 9.0399 9.1579 9.1579 9.2213 9.2213 9.3584 9.3584 9.4017 9.4017 9.4833 9.4833 9.5542 9.5542 9.6936 9.6936 11.6488 11.6488 12.1636 12.1636 14.2172 14.2172 14.7423 14.7423 14.7520 14.7520 15.3984 15.3984 16.0650 16.0650 k = 0.4531 0.2616 0.3572 ( 2427 PWs) bands (ev): -36.6682 -36.6682 -15.6915 -15.6915 -15.1962 -15.1962 -15.1827 -15.1827 -2.1903 -2.1903 -2.1878 -2.1878 -1.7373 -1.7373 -1.7320 -1.7320 -1.7232 -1.7232 5.2716 5.2716 7.0373 7.0373 8.5191 8.5191 8.7787 8.7787 9.0333 9.0333 9.1525 9.1525 9.2219 9.2219 9.3642 9.3642 9.4063 9.4063 9.4886 9.4886 9.5592 9.5592 9.6990 9.6990 11.5676 11.5676 12.1500 12.1500 14.1382 14.1382 14.7308 14.7308 14.7600 14.7600 15.4927 15.4927 16.0301 16.0301 k = 0.4492 0.2594 0.3700 ( 2429 PWs) bands (ev): -36.6681 -36.6681 -15.6916 -15.6916 -15.1961 -15.1961 -15.1830 -15.1830 -2.1903 -2.1903 -2.1879 -2.1879 -1.7373 -1.7373 -1.7319 -1.7319 -1.7234 -1.7234 5.2880 5.2880 7.0690 7.0690 8.4932 8.4932 8.7869 8.7869 9.0267 9.0267 9.1469 9.1469 9.2236 9.2236 9.3695 9.3695 9.4109 9.4109 9.4938 9.4938 9.5649 9.5649 9.7048 9.7048 11.4861 11.4861 12.1352 12.1352 14.0567 14.0567 14.7148 14.7148 14.7726 14.7726 15.5814 15.5814 16.0036 16.0036 k = 0.4453 0.2571 0.3827 ( 2421 PWs) bands (ev): -36.6681 -36.6681 -15.6917 -15.6917 -15.1960 -15.1960 -15.1833 -15.1833 -2.1902 -2.1902 -2.1879 -2.1879 -1.7373 -1.7373 -1.7317 -1.7317 -1.7236 -1.7236 5.3054 5.3054 7.1027 7.1027 8.4649 8.4649 8.7964 8.7964 9.0201 9.0201 9.1412 9.1412 9.2262 9.2262 9.3743 9.3743 9.4156 9.4156 9.4990 9.4990 9.5711 9.5711 9.7109 9.7109 11.4049 11.4049 12.1194 12.1194 13.9735 13.9735 14.6989 14.6989 14.7855 14.7855 15.6557 15.6557 15.9930 15.9930 k = 0.4414 0.2548 0.3955 ( 2417 PWs) bands (ev): -36.6681 -36.6681 -15.6918 -15.6918 -15.1959 -15.1959 -15.1836 -15.1836 -2.1902 -2.1902 -2.1879 -2.1879 -1.7373 -1.7373 -1.7316 -1.7316 -1.7237 -1.7237 5.3237 5.3237 7.1380 7.1380 8.4344 8.4344 8.8069 8.8069 9.0133 9.0133 9.1355 9.1355 9.2296 9.2296 9.3783 9.3783 9.4207 9.4207 9.5042 9.5042 9.5777 9.5777 9.7172 9.7172 11.3242 11.3242 12.1025 12.1025 13.8896 13.8896 14.6837 14.6837 14.7986 14.7986 15.7020 15.7020 15.9891 15.9891 k = 0.4375 0.2526 0.4082 ( 2419 PWs) bands (ev): -36.6681 -36.6681 -15.6919 -15.6919 -15.1958 -15.1958 -15.1840 -15.1840 -2.1902 -2.1902 -2.1880 -2.1880 -1.7373 -1.7373 -1.7315 -1.7315 -1.7239 -1.7239 5.3430 5.3430 7.1748 7.1748 8.4020 8.4020 8.8182 8.8182 9.0066 9.0066 9.1298 9.1298 9.2338 9.2338 9.3814 9.3814 9.4263 9.4263 9.5096 9.5096 9.5844 9.5844 9.7238 9.7238 11.2447 11.2447 12.0846 12.0846 13.8056 13.8056 14.6694 14.6694 14.8119 14.8119 15.7143 15.7143 15.9460 15.9460 k = 0.4336 0.2503 0.4210 ( 2411 PWs) bands (ev): -36.6681 -36.6681 -15.6920 -15.6920 -15.1958 -15.1958 -15.1843 -15.1843 -2.1902 -2.1902 -2.1880 -2.1880 -1.7373 -1.7373 -1.7314 -1.7314 -1.7241 -1.7241 5.3631 5.3631 7.2129 7.2129 8.3680 8.3680 8.8303 8.8303 9.0000 9.0000 9.1242 9.1242 9.2386 9.2386 9.3838 9.3838 9.4325 9.4325 9.5152 9.5152 9.5910 9.5910 9.7305 9.7305 11.1668 11.1668 12.0658 12.0658 13.7222 13.7222 14.6564 14.6564 14.8255 14.8255 15.7026 15.7026 15.9015 15.9015 k = 0.4297 0.2481 0.4338 ( 2411 PWs) bands (ev): -36.6680 -36.6680 -15.6921 -15.6921 -15.1957 -15.1957 -15.1847 -15.1847 -2.1902 -2.1902 -2.1881 -2.1881 -1.7374 -1.7374 -1.7313 -1.7313 -1.7242 -1.7242 5.3838 5.3838 7.2519 7.2519 8.3326 8.3326 8.8429 8.8429 8.9934 8.9934 9.1188 9.1188 9.2439 9.2439 9.3854 9.3854 9.4391 9.4391 9.5213 9.5213 9.5974 9.5974 9.7372 9.7372 11.0909 11.0909 12.0460 12.0460 13.6400 13.6400 14.6447 14.6447 14.8394 14.8394 15.6789 15.6789 15.8566 15.8566 k = 0.4258 0.2458 0.4465 ( 2412 PWs) bands (ev): -36.6680 -36.6680 -15.6922 -15.6922 -15.1956 -15.1956 -15.1850 -15.1850 -2.1902 -2.1902 -2.1881 -2.1881 -1.7374 -1.7374 -1.7312 -1.7312 -1.7244 -1.7244 5.4051 5.4051 7.2915 7.2915 8.2962 8.2962 8.8560 8.8560 8.9871 8.9871 9.1136 9.1136 9.2497 9.2497 9.3865 9.3865 9.4461 9.4461 9.5279 9.5279 9.6033 9.6033 9.7439 9.7439 11.0174 11.0174 12.0254 12.0254 13.5594 13.5594 14.6346 14.6346 14.8535 14.8535 15.6498 15.6498 15.8114 15.8114 k = 0.4219 0.2436 0.4593 ( 2407 PWs) bands (ev): -36.6680 -36.6680 -15.6923 -15.6923 -15.1955 -15.1955 -15.1853 -15.1853 -2.1902 -2.1902 -2.1881 -2.1881 -1.7375 -1.7375 -1.7310 -1.7310 -1.7245 -1.7245 5.4268 5.4268 7.3314 7.3314 8.2591 8.2591 8.8692 8.8692 8.9812 8.9812 9.1087 9.1087 9.2558 9.2558 9.3872 9.3872 9.4535 9.4535 9.5352 9.5352 9.6088 9.6088 9.7503 9.7503 10.9469 10.9469 12.0041 12.0041 13.4810 13.4810 14.6261 14.6261 14.8678 14.8678 15.6185 15.6185 15.7662 15.7662 k = 0.4180 0.2413 0.4720 ( 2407 PWs) bands (ev): -36.6680 -36.6680 -15.6924 -15.6924 -15.1955 -15.1955 -15.1856 -15.1856 -2.1903 -2.1903 -2.1882 -2.1882 -1.7376 -1.7376 -1.7310 -1.7310 -1.7246 -1.7246 5.4488 5.4488 7.3709 7.3709 8.2218 8.2218 8.8825 8.8825 8.9757 8.9757 9.1040 9.1040 9.2622 9.2622 9.3876 9.3876 9.4614 9.4614 9.5432 9.5432 9.6138 9.6138 9.7564 9.7564 10.8796 10.8796 11.9820 11.9820 13.4050 13.4050 14.6195 14.6195 14.8822 14.8822 15.5863 15.5863 15.7209 15.7209 k = 0.4141 0.2391 0.4848 ( 2407 PWs) bands (ev): -36.6680 -36.6680 -15.6925 -15.6925 -15.1955 -15.1955 -15.1859 -15.1859 -2.1903 -2.1903 -2.1882 -2.1882 -1.7377 -1.7377 -1.7309 -1.7309 -1.7247 -1.7247 5.4708 5.4708 7.4094 7.4094 8.1850 8.1850 8.8954 8.8954 8.9710 8.9710 9.0997 9.0997 9.2686 9.2686 9.3878 9.3878 9.4698 9.4698 9.5518 9.5518 9.6182 9.6182 9.7618 9.7618 10.8161 10.8161 11.9593 11.9593 13.3318 13.3318 14.6148 14.6148 14.8966 14.8966 15.5543 15.5543 15.6757 15.6757 k = 0.4102 0.2368 0.4976 ( 2405 PWs) bands (ev): -36.6679 -36.6679 -15.6926 -15.6926 -15.1954 -15.1954 -15.1862 -15.1862 -2.1904 -2.1904 -2.1882 -2.1882 -1.7378 -1.7378 -1.7308 -1.7308 -1.7247 -1.7247 5.4926 5.4926 7.4462 7.4462 8.1493 8.1493 8.9073 8.9073 8.9676 8.9676 9.0958 9.0958 9.2749 9.2749 9.3880 9.3880 9.4788 9.4788 9.5610 9.5610 9.6221 9.6221 9.7664 9.7664 10.7569 10.7569 11.9361 11.9361 13.2615 13.2615 14.6121 14.6121 14.9107 14.9107 15.5230 15.5230 15.6306 15.6306 k = 0.4062 0.2345 0.5103 ( 2409 PWs) bands (ev): -36.6679 -36.6679 -15.6927 -15.6927 -15.1954 -15.1954 -15.1864 -15.1864 -2.1905 -2.1905 -2.1883 -2.1883 -1.7380 -1.7380 -1.7308 -1.7308 -1.7248 -1.7248 5.5140 5.5140 7.4801 7.4801 8.1159 8.1159 8.9173 8.9173 8.9663 8.9663 9.0925 9.0925 9.2809 9.2809 9.3881 9.3881 9.4886 9.4886 9.5709 9.5709 9.6255 9.6255 9.7700 9.7700 10.7025 10.7025 11.9124 11.9124 13.1943 13.1943 14.6113 14.6113 14.9244 14.9244 15.4930 15.4930 15.5857 15.5857 k = 0.4023 0.2323 0.5231 ( 2411 PWs) bands (ev): -36.6679 -36.6679 -15.6928 -15.6928 -15.1954 -15.1954 -15.1867 -15.1867 -2.1906 -2.1906 -2.1883 -2.1883 -1.7381 -1.7381 -1.7308 -1.7308 -1.7248 -1.7248 5.5348 5.5348 7.5099 7.5099 8.0862 8.0862 8.9241 8.9241 8.9682 8.9682 9.0899 9.0899 9.2863 9.2863 9.3885 9.3885 9.4993 9.4993 9.5812 9.5812 9.6285 9.6285 9.7722 9.7722 10.6532 10.6532 11.8885 11.8885 13.1303 13.1303 14.6127 14.6127 14.9373 14.9373 15.4649 15.4649 15.5411 15.5411 k = 0.3984 0.2300 0.5358 ( 2419 PWs) bands (ev): -36.6679 -36.6679 -15.6929 -15.6929 -15.1954 -15.1954 -15.1869 -15.1869 -2.1907 -2.1907 -2.1883 -2.1883 -1.7384 -1.7384 -1.7309 -1.7309 -1.7248 -1.7248 5.5545 5.5545 7.5339 7.5339 8.0616 8.0616 8.9271 8.9271 8.9736 8.9736 9.0881 9.0881 9.2910 9.2910 9.3889 9.3889 9.5110 9.5110 9.5920 9.5920 9.6313 9.6313 9.7729 9.7729 10.6098 10.6098 11.8642 11.8642 13.0695 13.0695 14.6162 14.6162 14.9491 14.9491 15.4392 15.4392 15.4969 15.4969 k = 0.3945 0.2278 0.5486 ( 2411 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1954 -15.1954 -15.1870 -15.1870 -2.1908 -2.1908 -2.1883 -2.1883 -1.7385 -1.7385 -1.7308 -1.7308 -1.7248 -1.7248 5.5730 5.5730 7.5504 7.5504 8.0444 8.0444 8.9276 8.9276 8.9811 8.9811 9.0875 9.0875 9.2947 9.2947 9.3897 9.3897 9.5237 9.5237 9.6031 9.6031 9.6343 9.6343 9.7722 9.7722 10.5726 10.5726 11.8398 11.8398 13.0121 13.0121 14.6217 14.6217 14.9592 14.9592 15.4166 15.4166 15.4534 15.4534 k = 0.3906 0.2255 0.5613 ( 2409 PWs) bands (ev): -36.6679 -36.6679 -15.6930 -15.6930 -15.1954 -15.1954 -15.1872 -15.1872 -2.1909 -2.1909 -2.1882 -2.1882 -1.7386 -1.7386 -1.7308 -1.7308 -1.7247 -1.7247 5.5896 5.5896 7.5580 7.5580 8.0358 8.0358 8.9270 8.9270 8.9889 8.9889 9.0882 9.0882 9.2973 9.2973 9.3905 9.3905 9.5371 9.5371 9.6142 9.6142 9.6379 9.6379 9.7702 9.7702 10.5419 10.5419 11.8153 11.8153 12.9580 12.9580 14.6293 14.6293 14.9672 14.9672 15.3974 15.3974 15.4107 15.4107 k = 0.3867 0.2233 0.5741 ( 2415 PWs) bands (ev): -36.6679 -36.6679 -15.6931 -15.6931 -15.1955 -15.1955 -15.1873 -15.1873 -2.1911 -2.1911 -2.1883 -2.1883 -1.7388 -1.7388 -1.7309 -1.7309 -1.7246 -1.7246 5.6041 5.6041 7.5562 7.5562 8.0366 8.0366 8.9261 8.9261 8.9958 8.9958 9.0906 9.0906 9.2986 9.2986 9.3913 9.3913 9.5506 9.5506 9.6246 9.6246 9.6429 9.6429 9.7673 9.7673 10.5179 10.5179 11.7909 11.7909 12.9070 12.9070 14.6389 14.6389 14.9725 14.9725 15.3675 15.3675 15.3842 15.3842 k = 0.3828 0.2210 0.5869 ( 2417 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1956 -15.1956 -15.1873 -15.1873 -2.1912 -2.1912 -2.1882 -2.1882 -1.7390 -1.7390 -1.7309 -1.7309 -1.7246 -1.7246 5.6159 5.6159 7.5460 7.5460 8.0462 8.0462 8.9255 8.9255 9.0011 9.0011 9.0948 9.0948 9.2990 9.2990 9.3920 9.3920 9.5630 9.5630 9.6340 9.6340 9.6503 9.6503 9.7649 9.7649 10.5006 10.5006 11.7666 11.7666 12.8592 12.8592 14.6505 14.6505 14.9746 14.9746 15.3266 15.3266 15.3747 15.3747 k = 0.3789 0.2188 0.5996 ( 2421 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1956 -15.1956 -15.1874 -15.1874 -2.1914 -2.1914 -2.1882 -2.1882 -1.7393 -1.7393 -1.7310 -1.7310 -1.7245 -1.7245 5.6246 5.6246 7.5291 7.5291 8.0631 8.0631 8.9255 8.9255 9.0045 9.0045 9.1006 9.1006 9.2983 9.2983 9.3922 9.3922 9.5728 9.5728 9.6431 9.6431 9.6595 9.6595 9.7646 9.7646 10.4899 10.4899 11.7424 11.7424 12.8144 12.8144 14.6639 14.6639 14.9735 14.9735 15.2865 15.2865 15.3710 15.3710 k = 0.3750 0.2165 0.6124 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7310 -1.7310 -1.7244 -1.7244 5.6296 5.6296 7.5079 7.5079 8.0855 8.0855 8.9261 8.9261 9.0062 9.0062 9.1075 9.1075 9.2968 9.2968 9.3920 9.3920 9.5786 9.5786 9.6529 9.6529 9.6688 9.6688 9.7691 9.7691 10.4857 10.4857 11.7186 11.7186 12.7725 12.7725 14.6790 14.6790 14.9693 14.9693 15.2477 15.2477 15.3730 15.3730 k = 0.6250-0.0722 0.4082 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6932 -15.6932 -15.1957 -15.1957 -15.1874 -15.1874 -2.1915 -2.1915 -2.1882 -2.1882 -1.7394 -1.7394 -1.7310 -1.7310 -1.7244 -1.7244 5.6296 5.6296 7.5079 7.5079 8.0855 8.0855 8.9261 8.9261 9.0062 9.0062 9.1075 9.1075 9.2968 9.2968 9.3920 9.3920 9.5786 9.5786 9.6529 9.6529 9.6688 9.6688 9.7691 9.7691 10.4857 10.4857 11.7186 11.7186 12.7725 12.7725 14.6790 14.6790 14.9693 14.9693 15.2477 15.2477 15.3730 15.3730 k = 0.6184-0.0836 0.4082 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1958 -15.1958 -15.1874 -15.1874 -2.1919 -2.1919 -2.1881 -2.1881 -1.7398 -1.7398 -1.7311 -1.7311 -1.7243 -1.7243 5.6334 5.6334 7.4709 7.4709 8.1266 8.1266 8.9278 8.9278 9.0066 9.0066 9.1208 9.1208 9.2934 9.2934 9.3905 9.3905 9.5798 9.5798 9.6677 9.6677 9.6848 9.6848 9.7922 9.7922 10.4837 10.4837 11.6790 11.6790 12.7050 12.7050 14.7050 14.7050 14.9603 14.9603 15.1850 15.1850 15.3793 15.3793 k = 0.6118-0.0950 0.4082 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1959 -15.1959 -15.1873 -15.1873 -2.1920 -2.1920 -2.1880 -2.1880 -1.7401 -1.7401 -1.7311 -1.7311 -1.7241 -1.7241 5.6347 5.6347 7.4358 7.4358 8.1669 8.1669 8.9295 8.9295 9.0053 9.0053 9.1353 9.1353 9.2898 9.2898 9.3883 9.3883 9.5723 9.5723 9.6764 9.6764 9.7064 9.7064 9.8328 9.8328 10.4819 10.4819 11.6402 11.6402 12.6392 12.6392 14.7295 14.7295 14.9527 14.9527 15.1250 15.1250 15.3823 15.3823 k = 0.6053-0.1064 0.4082 ( 2416 PWs) bands (ev): -36.6678 -36.6678 -15.6933 -15.6933 -15.1960 -15.1960 -15.1872 -15.1872 -2.1923 -2.1923 -2.1879 -2.1879 -1.7404 -1.7404 -1.7311 -1.7311 -1.7239 -1.7239 5.6340 5.6340 7.4028 7.4028 8.2057 8.2057 8.9313 8.9313 9.0031 9.0031 9.1500 9.1500 9.2859 9.2859 9.3855 9.3855 9.5588 9.5588 9.6829 9.6829 9.7307 9.7307 9.8865 9.8865 10.4802 10.4802 11.6019 11.6019 12.5747 12.5747 14.7524 14.7524 14.9463 14.9463 15.0680 15.0680 15.3816 15.3816 k = 0.5987-0.1177 0.4082 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1961 -15.1961 -15.1871 -15.1871 -2.1926 -2.1926 -2.1879 -2.1879 -1.7408 -1.7408 -1.7312 -1.7312 -1.7238 -1.7238 5.6315 5.6315 7.3716 7.3716 8.2428 8.2428 8.9330 8.9330 9.0003 9.0003 9.1643 9.1643 9.2821 9.2821 9.3823 9.3823 9.5415 9.5415 9.6894 9.6894 9.7556 9.7556 9.9502 9.9502 10.4787 10.4787 11.5643 11.5643 12.5113 12.5113 14.7738 14.7738 14.9409 14.9409 15.0140 15.0140 15.3769 15.3769 k = 0.5921-0.1291 0.4082 ( 2414 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1962 -15.1962 -15.1870 -15.1870 -2.1928 -2.1928 -2.1878 -2.1878 -1.7411 -1.7411 -1.7312 -1.7312 -1.7236 -1.7236 5.6279 5.6279 7.3424 7.3424 8.2778 8.2778 8.9347 8.9347 8.9974 8.9974 9.1779 9.1779 9.2786 9.2786 9.3788 9.3788 9.5225 9.5225 9.6961 9.6961 9.7809 9.7809 10.0220 10.0220 10.4773 10.4773 11.5276 11.5276 12.4486 12.4486 14.7937 14.7937 14.9358 14.9358 14.9638 14.9638 15.3677 15.3677 k = 0.5855-0.1405 0.4082 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1964 -15.1964 -15.1869 -15.1869 -2.1931 -2.1931 -2.1878 -2.1878 -1.7415 -1.7415 -1.7313 -1.7313 -1.7235 -1.7235 5.6231 5.6231 7.3152 7.3152 8.3104 8.3104 8.9364 8.9364 8.9944 8.9944 9.1903 9.1903 9.2753 9.2753 9.3751 9.3751 9.5027 9.5027 9.7028 9.7028 9.8061 9.8061 10.1004 10.1004 10.4762 10.4762 11.4918 11.4918 12.3863 12.3863 14.8120 14.8120 14.9128 14.9128 14.9355 14.9355 15.3538 15.3538 k = 0.5789-0.1519 0.4082 ( 2420 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1965 -15.1965 -15.1868 -15.1868 -2.1933 -2.1933 -2.1877 -2.1877 -1.7418 -1.7418 -1.7314 -1.7314 -1.7234 -1.7234 5.6178 5.6178 7.2900 7.2900 8.3405 8.3405 8.9381 8.9381 8.9915 8.9915 9.2013 9.2013 9.2725 9.2725 9.3714 9.3714 9.4829 9.4829 9.7094 9.7094 9.8312 9.8312 10.1843 10.1843 10.4755 10.4755 11.4572 11.4572 12.3241 12.3241 14.8286 14.8286 14.8696 14.8696 14.9318 14.9318 15.3350 15.3350 k = 0.5724-0.1633 0.4082 ( 2418 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1966 -15.1966 -15.1866 -15.1866 -2.1935 -2.1935 -2.1877 -2.1877 -1.7421 -1.7421 -1.7314 -1.7314 -1.7232 -1.7232 5.6120 5.6120 7.2667 7.2667 8.3681 8.3681 8.9398 8.9398 8.9888 8.9888 9.2106 9.2106 9.2704 9.2704 9.3678 9.3678 9.4638 9.4638 9.7156 9.7156 9.8561 9.8561 10.2724 10.2724 10.4754 10.4754 11.4239 11.4239 12.2615 12.2615 14.8259 14.8259 14.8464 14.8464 14.9298 14.9298 15.3114 15.3114 k = 0.5658-0.1747 0.4082 ( 2420 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1968 -15.1968 -15.1865 -15.1865 -2.1938 -2.1938 -2.1877 -2.1877 -1.7424 -1.7424 -1.7315 -1.7315 -1.7231 -1.7231 5.6060 5.6060 7.2455 7.2455 8.3932 8.3932 8.9414 8.9414 8.9862 8.9862 9.2179 9.2179 9.2691 9.2691 9.3642 9.3642 9.4456 9.4456 9.7215 9.7215 9.8803 9.8803 10.3622 10.3622 10.4777 10.4777 11.3921 11.3921 12.1982 12.1982 14.7890 14.7890 14.8593 14.8593 14.9285 14.9285 15.2835 15.2835 k = 0.5592-0.1861 0.4082 ( 2420 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1969 -15.1969 -15.1864 -15.1864 -2.1940 -2.1940 -2.1876 -2.1876 -1.7427 -1.7427 -1.7315 -1.7315 -1.7229 -1.7229 5.6000 5.6000 7.2263 7.2263 8.4158 8.4158 8.9431 8.9431 8.9838 8.9838 9.2233 9.2233 9.2685 9.2685 9.3609 9.3609 9.4287 9.4287 9.7268 9.7268 9.9038 9.9038 10.4390 10.4390 10.4961 10.4961 11.3619 11.3619 12.1339 12.1339 14.7545 14.7545 14.8717 14.8717 14.9277 14.9277 15.2520 15.2520 k = 0.5526-0.1975 0.4082 ( 2424 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1970 -15.1970 -15.1863 -15.1863 -2.1942 -2.1942 -2.1876 -2.1876 -1.7430 -1.7430 -1.7316 -1.7316 -1.7228 -1.7228 5.5942 5.5942 7.2091 7.2091 8.4359 8.4359 8.9448 8.9448 8.9816 8.9816 9.2268 9.2268 9.2684 9.2684 9.3579 9.3579 9.4135 9.4135 9.7317 9.7317 9.9262 9.9262 10.4603 10.4603 10.5721 10.5721 11.3338 11.3338 12.0680 12.0680 14.7234 14.7234 14.8828 14.8828 14.9275 14.9275 15.2180 15.2180 k = 0.5461-0.2089 0.4082 ( 2430 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1971 -15.1971 -15.1862 -15.1862 -2.1944 -2.1944 -2.1877 -2.1877 -1.7432 -1.7432 -1.7317 -1.7317 -1.7228 -1.7228 5.5888 5.5888 7.1940 7.1940 8.4537 8.4537 8.9464 8.9464 8.9796 8.9796 9.2287 9.2287 9.2683 9.2683 9.3552 9.3552 9.4002 9.4002 9.7360 9.7360 9.9472 9.9472 10.4631 10.4631 10.6678 10.6678 11.3079 11.3079 12.0007 12.0007 14.6957 14.6957 14.8923 14.8923 14.9276 14.9276 15.1828 15.1828 k = 0.5395-0.2203 0.4082 ( 2428 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1972 -15.1972 -15.1861 -15.1861 -2.1945 -2.1945 -2.1876 -2.1876 -1.7434 -1.7434 -1.7318 -1.7318 -1.7227 -1.7227 5.5839 5.5839 7.1808 7.1808 8.4690 8.4690 8.9479 8.9479 8.9778 8.9778 9.2298 9.2298 9.2677 9.2677 9.3532 9.3532 9.3891 9.3891 9.7398 9.7398 9.9663 9.9663 10.4637 10.4637 10.7659 10.7659 11.2846 11.2846 11.9317 11.9317 14.6716 14.6716 14.9004 14.9004 14.9281 14.9281 15.1480 15.1480 k = 0.5329-0.2317 0.4082 ( 2432 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1972 -15.1972 -15.1860 -15.1860 -2.1947 -2.1947 -2.1876 -2.1876 -1.7436 -1.7436 -1.7318 -1.7318 -1.7226 -1.7226 5.5795 5.5795 7.1697 7.1697 8.4820 8.4820 8.9494 8.9494 8.9763 8.9763 9.2303 9.2303 9.2663 9.2663 9.3518 9.3518 9.3800 9.3800 9.7430 9.7430 9.9834 9.9834 10.4637 10.4637 10.8636 10.8636 11.2642 11.2642 11.8612 11.8612 14.6511 14.6511 14.9068 14.9068 14.9290 14.9290 15.1152 15.1152 k = 0.5263-0.2431 0.4082 ( 2434 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1973 -15.1973 -15.1860 -15.1860 -2.1948 -2.1948 -2.1876 -2.1876 -1.7438 -1.7438 -1.7319 -1.7319 -1.7226 -1.7226 5.5758 5.5758 7.1606 7.1606 8.4926 8.4926 8.9507 8.9507 8.9750 8.9750 9.2306 9.2306 9.2641 9.2641 9.3512 9.3512 9.3728 9.3728 9.7456 9.7456 9.9979 9.9979 10.4635 10.4635 10.9585 10.9585 11.2470 11.2470 11.7899 11.7899 14.6343 14.6343 14.9117 14.9117 14.9302 14.9302 15.0860 15.0860 k = 0.5197-0.2545 0.4082 ( 2434 PWs) bands (ev): -36.6678 -36.6678 -15.6934 -15.6934 -15.1974 -15.1974 -15.1859 -15.1859 -2.1949 -2.1949 -2.1876 -2.1876 -1.7439 -1.7439 -1.7319 -1.7319 -1.7225 -1.7225 5.5729 5.5729 7.1535 7.1535 8.5009 8.5009 8.9519 8.9519 8.9740 8.9740 9.2309 9.2309 9.2614 9.2614 9.3513 9.3513 9.3673 9.3673 9.7477 9.7477 10.0096 10.0096 10.4633 10.4633 11.0483 11.0483 11.2335 11.2335 11.7194 11.7194 14.6212 14.6212 14.9150 14.9150 14.9317 14.9317 15.0617 15.0617 k = 0.5132-0.2659 0.4082 ( 2446 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1974 -15.1974 -15.1859 -15.1859 -2.1950 -2.1950 -2.1877 -2.1877 -1.7440 -1.7440 -1.7320 -1.7320 -1.7226 -1.7226 5.5707 5.5707 7.1484 7.1484 8.5068 8.5068 8.9528 8.9528 8.9732 8.9732 9.2312 9.2312 9.2589 9.2589 9.3519 9.3519 9.3630 9.3630 9.7491 9.7491 10.0180 10.0180 10.4632 10.4632 11.1278 11.1278 11.2241 11.2241 11.6535 11.6535 14.6118 14.6118 14.9171 14.9171 14.9330 14.9330 15.0435 15.0435 k = 0.5066-0.2773 0.4082 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1974 -15.1974 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7441 -1.7441 -1.7320 -1.7320 -1.7226 -1.7226 5.5694 5.5694 7.1454 7.1454 8.5103 8.5103 8.9533 8.9533 8.9727 8.9727 9.2315 9.2315 9.2571 9.2571 9.3529 9.3529 9.3601 9.3601 9.7500 9.7500 10.0232 10.0232 10.4631 10.4631 11.1853 11.1853 11.2213 11.2213 11.6015 11.6015 14.6061 14.6061 14.9182 14.9182 14.9339 14.9339 15.0322 15.0322 k = 0.5000-0.2887 0.4082 ( 2450 PWs) bands (ev): -36.6678 -36.6678 -15.6935 -15.6935 -15.1975 -15.1975 -15.1859 -15.1859 -2.1951 -2.1951 -2.1877 -2.1877 -1.7442 -1.7442 -1.7320 -1.7320 -1.7225 -1.7225 5.5690 5.5690 7.1443 7.1443 8.5115 8.5115 8.9535 8.9535 8.9725 8.9725 9.2316 9.2316 9.2565 9.2565 9.3535 9.3535 9.3589 9.3589 9.7503 9.7503 10.0250 10.0250 10.4631 10.4631 11.2020 11.2020 11.2268 11.2268 11.5802 11.5802 14.6043 14.6043 14.9186 14.9186 14.9343 14.9343 15.0284 15.0284 Writing output data file ScGaCu2.save init_run : 0.30s CPU 0.47s WALL ( 1 calls) electrons : 135.28s CPU 138.30s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.03s WALL ( 1 calls) potinit : 0.01s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 135.27s CPU 138.29s 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 : 0.08s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.05s WALL ( 346 calls) cegterg : 122.43s CPU 124.21s WALL ( 363 calls) Called by sum_band: Called by *egterg: h_psi : 71.23s CPU 72.65s WALL ( 6443 calls) s_psi : 4.32s CPU 4.57s WALL ( 6443 calls) g_psi : 0.16s CPU 0.13s WALL ( 5734 calls) cdiaghg : 46.84s CPU 47.47s WALL ( 6080 calls) cegterg:over : 4.16s CPU 4.09s WALL ( 5734 calls) cegterg:upda : 2.67s CPU 2.75s WALL ( 5734 calls) cegterg:last : 1.88s CPU 1.88s WALL ( 1055 calls) cdiaghg:chol : 2.52s CPU 2.59s WALL ( 6080 calls) cdiaghg:inve : 1.66s CPU 1.79s WALL ( 6080 calls) cdiaghg:para : 2.76s CPU 2.87s WALL ( 12160 calls) Called by h_psi: h_psi:vloc : 61.97s CPU 63.23s WALL ( 6443 calls) h_psi:vnl : 9.12s CPU 9.29s WALL ( 6443 calls) add_vuspsi : 4.84s CPU 5.11s WALL ( 6443 calls) General routines calbec : 4.27s CPU 4.17s WALL ( 6443 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 57.73s CPU 59.03s WALL ( 781864 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.15s CPU 0.16s WALL ( 692 calls) Parallel routines fft_scatter : 20.52s CPU 20.86s WALL ( 781887 calls) PWSCF : 2m30.46s CPU 2m45.75s WALL This run was terminated on: 17:34: 4 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=