Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21: 1:24 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: ./ZrSiO4.save/ 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 71 44 12 2421 1163 179 Max 72 45 13 2423 1188 184 Sum 2579 1591 457 87185 42253 6537 bravais-lattice index = 14 lattice parameter (alat) = 10.5033 a.u. unit-cell volume = 885.8567 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.503267 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.289298 celldm(5)= -0.289298 celldm(6)= -0.421403 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.421403 0.906873 0.000000 ) a(3) = ( -0.289298 -0.453437 0.843031 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.464677 0.593098 ) b(2) = ( 0.000000 1.102690 0.593098 ) b(3) = ( 0.000000 0.000000 1.186196 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 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 Zr 4.00 91.22400 Zr( 1.00) O 6.00 15.99940 O( 1.00) Si 4.00 28.08550 Si( 1.00) 4 Sym. Ops., with inversion, found ( 3 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 1 1 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.2107016 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.4534367 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.7107016 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.4534367 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( -1 -1 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 301 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0000000 0.0174441), wk = 0.0033223 k( 3) = ( 0.0000000 0.0000000 0.0348881), wk = 0.0033223 k( 4) = ( 0.0000000 0.0000000 0.0523322), wk = 0.0033223 k( 5) = ( 0.0000000 0.0000000 0.0697762), wk = 0.0033223 k( 6) = ( 0.0000000 0.0000000 0.0872203), wk = 0.0033223 k( 7) = ( 0.0000000 0.0000000 0.1046643), wk = 0.0033223 k( 8) = ( 0.0000000 0.0000000 0.1221084), wk = 0.0033223 k( 9) = ( 0.0000000 0.0000000 0.1395524), wk = 0.0033223 k( 10) = ( 0.0000000 0.0000000 0.1569965), wk = 0.0033223 k( 11) = ( 0.0000000 0.0000000 0.1744405), wk = 0.0033223 k( 12) = ( 0.0000000 0.0000000 0.1918846), wk = 0.0033223 k( 13) = ( 0.0000000 0.0000000 0.2093287), wk = 0.0033223 k( 14) = ( 0.0000000 0.0000000 0.2267727), wk = 0.0033223 k( 15) = ( 0.0000000 0.0000000 0.2442168), wk = 0.0033223 k( 16) = ( 0.0000000 0.0000000 0.2616608), wk = 0.0033223 k( 17) = ( 0.0000000 0.0000000 0.2791049), wk = 0.0033223 k( 18) = ( 0.0000000 0.0000000 0.2965489), wk = 0.0033223 k( 19) = ( 0.0000000 0.0000000 0.3139930), wk = 0.0033223 k( 20) = ( 0.0000000 0.0000000 0.3314370), wk = 0.0033223 k( 21) = ( 0.0000000 0.0000000 0.3488811), wk = 0.0033223 k( 22) = ( 0.0000000 0.0000000 0.3663251), wk = 0.0033223 k( 23) = ( 0.0000000 0.0000000 0.3837692), wk = 0.0033223 k( 24) = ( 0.0000000 0.0000000 0.4012132), wk = 0.0033223 k( 25) = ( 0.0000000 0.0000000 0.4186573), wk = 0.0033223 k( 26) = ( 0.0000000 0.0000000 0.4361014), wk = 0.0033223 k( 27) = ( 0.0000000 0.0000000 0.4535454), wk = 0.0033223 k( 28) = ( 0.0000000 0.0000000 0.4709895), wk = 0.0033223 k( 29) = ( 0.0000000 0.0000000 0.4884335), wk = 0.0033223 k( 30) = ( 0.0000000 0.0000000 0.5058776), wk = 0.0033223 k( 31) = ( 0.0000000 0.0000000 0.5233216), wk = 0.0033223 k( 32) = ( 0.0000000 0.0000000 0.5407657), wk = 0.0033223 k( 33) = ( 0.0000000 0.0000000 0.5582098), wk = 0.0033223 k( 34) = ( 0.0000000 0.0000000 0.5756538), wk = 0.0033223 k( 35) = ( 0.0000000 0.0000000 0.5930979), wk = 0.0033223 k( 36) = ( 0.0000000 0.0000000 0.5930979), wk = 0.0033223 k( 37) = ( -0.0147059 0.0093825 0.5930979), wk = 0.0033223 k( 38) = ( -0.0294118 0.0187651 0.5930979), wk = 0.0033223 k( 39) = ( -0.0441177 0.0281476 0.5930979), wk = 0.0033223 k( 40) = ( -0.0588235 0.0375302 0.5930979), wk = 0.0033223 k( 41) = ( -0.0735294 0.0469127 0.5930979), wk = 0.0033223 k( 42) = ( -0.0882353 0.0562952 0.5930979), wk = 0.0033223 k( 43) = ( -0.1029412 0.0656778 0.5930979), wk = 0.0033223 k( 44) = ( -0.1176471 0.0750603 0.5930979), wk = 0.0033223 k( 45) = ( -0.1323529 0.0844429 0.5930979), wk = 0.0033223 k( 46) = ( -0.1470588 0.0938254 0.5930979), wk = 0.0033223 k( 47) = ( -0.1617647 0.1032079 0.5930979), wk = 0.0033223 k( 48) = ( -0.1764706 0.1125905 0.5930979), wk = 0.0033223 k( 49) = ( -0.1911765 0.1219730 0.5930979), wk = 0.0033223 k( 50) = ( -0.2058823 0.1313556 0.5930979), wk = 0.0033223 k( 51) = ( -0.2205882 0.1407381 0.5930979), wk = 0.0033223 k( 52) = ( -0.2352941 0.1501206 0.5930979), wk = 0.0033223 k( 53) = ( -0.2500000 0.1595032 0.5930979), wk = 0.0033223 k( 54) = ( -0.2647059 0.1688857 0.5930979), wk = 0.0033223 k( 55) = ( -0.2794118 0.1782683 0.5930979), wk = 0.0033223 k( 56) = ( -0.2941177 0.1876508 0.5930979), wk = 0.0033223 k( 57) = ( -0.3088235 0.1970333 0.5930979), wk = 0.0033223 k( 58) = ( -0.3235294 0.2064159 0.5930979), wk = 0.0033223 k( 59) = ( -0.3382353 0.2157984 0.5930979), wk = 0.0033223 k( 60) = ( -0.3529412 0.2251810 0.5930979), wk = 0.0033223 k( 61) = ( -0.3676471 0.2345635 0.5930979), wk = 0.0033223 k( 62) = ( -0.3823529 0.2439460 0.5930979), wk = 0.0033223 k( 63) = ( -0.3970588 0.2533286 0.5930979), wk = 0.0033223 k( 64) = ( -0.4117647 0.2627111 0.5930979), wk = 0.0033223 k( 65) = ( -0.4264706 0.2720937 0.5930979), wk = 0.0033223 k( 66) = ( -0.4411765 0.2814762 0.5930979), wk = 0.0033223 k( 67) = ( -0.4558823 0.2908587 0.5930979), wk = 0.0033223 k( 68) = ( -0.4705882 0.3002413 0.5930979), wk = 0.0033223 k( 69) = ( -0.4852941 0.3096238 0.5930979), wk = 0.0033223 k( 70) = ( -0.5000000 0.3190064 0.5930979), wk = 0.0033223 k( 71) = ( -0.5000000 0.3190064 0.5930979), wk = 0.0033223 k( 72) = ( -0.4895833 0.3123604 0.5807416), wk = 0.0033223 k( 73) = ( -0.4791667 0.3057144 0.5683854), wk = 0.0033223 k( 74) = ( -0.4687500 0.2990685 0.5560292), wk = 0.0033223 k( 75) = ( -0.4583333 0.2924225 0.5436730), wk = 0.0033223 k( 76) = ( -0.4479167 0.2857765 0.5313168), wk = 0.0033223 k( 77) = ( -0.4375000 0.2791306 0.5189606), wk = 0.0033223 k( 78) = ( -0.4270833 0.2724846 0.5066044), wk = 0.0033223 k( 79) = ( -0.4166667 0.2658386 0.4942482), wk = 0.0033223 k( 80) = ( -0.4062500 0.2591927 0.4818920), wk = 0.0033223 k( 81) = ( -0.3958333 0.2525467 0.4695358), wk = 0.0033223 k( 82) = ( -0.3854167 0.2459007 0.4571796), wk = 0.0033223 k( 83) = ( -0.3750000 0.2392548 0.4448234), wk = 0.0033223 k( 84) = ( -0.3645833 0.2326088 0.4324672), wk = 0.0033223 k( 85) = ( -0.3541667 0.2259628 0.4201110), wk = 0.0033223 k( 86) = ( -0.3437500 0.2193169 0.4077548), wk = 0.0033223 k( 87) = ( -0.3333333 0.2126709 0.3953986), wk = 0.0033223 k( 88) = ( -0.3229167 0.2060250 0.3830424), wk = 0.0033223 k( 89) = ( -0.3125000 0.1993790 0.3706862), wk = 0.0033223 k( 90) = ( -0.3020833 0.1927330 0.3583299), wk = 0.0033223 k( 91) = ( -0.2916667 0.1860871 0.3459738), wk = 0.0033223 k( 92) = ( -0.2812500 0.1794411 0.3336175), wk = 0.0033223 k( 93) = ( -0.2708333 0.1727951 0.3212613), wk = 0.0033223 k( 94) = ( -0.2604167 0.1661492 0.3089051), wk = 0.0033223 k( 95) = ( -0.2500000 0.1595032 0.2965489), wk = 0.0033223 k( 96) = ( -0.2395833 0.1528572 0.2841927), wk = 0.0033223 k( 97) = ( -0.2291667 0.1462113 0.2718365), wk = 0.0033223 k( 98) = ( -0.2187500 0.1395653 0.2594803), wk = 0.0033223 k( 99) = ( -0.2083333 0.1329193 0.2471241), wk = 0.0033223 k( 100) = ( -0.1979167 0.1262734 0.2347679), wk = 0.0033223 k( 101) = ( -0.1875000 0.1196274 0.2224117), wk = 0.0033223 k( 102) = ( -0.1770833 0.1129814 0.2100555), wk = 0.0033223 k( 103) = ( -0.1666667 0.1063355 0.1976993), wk = 0.0033223 k( 104) = ( -0.1562500 0.0996895 0.1853431), wk = 0.0033223 k( 105) = ( -0.1458333 0.0930435 0.1729869), wk = 0.0033223 k( 106) = ( -0.1354167 0.0863976 0.1606307), wk = 0.0033223 k( 107) = ( -0.1250000 0.0797516 0.1482745), wk = 0.0033223 k( 108) = ( -0.1145833 0.0731056 0.1359183), wk = 0.0033223 k( 109) = ( -0.1041667 0.0664597 0.1235621), wk = 0.0033223 k( 110) = ( -0.0937500 0.0598137 0.1112058), wk = 0.0033223 k( 111) = ( -0.0833333 0.0531677 0.0988496), wk = 0.0033223 k( 112) = ( -0.0729167 0.0465218 0.0864934), wk = 0.0033223 k( 113) = ( -0.0625000 0.0398758 0.0741372), wk = 0.0033223 k( 114) = ( -0.0520833 0.0332298 0.0617810), wk = 0.0033223 k( 115) = ( -0.0416667 0.0265839 0.0494248), wk = 0.0033223 k( 116) = ( -0.0312500 0.0199379 0.0370686), wk = 0.0033223 k( 117) = ( -0.0208333 0.0132919 0.0247124), wk = 0.0033223 k( 118) = ( -0.0104167 0.0066460 0.0123562), wk = 0.0033223 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 121) = ( 0.0094485 0.0148093 -0.0000000), wk = 0.0033223 k( 122) = ( 0.0188971 0.0296187 -0.0000000), wk = 0.0033223 k( 123) = ( 0.0283456 0.0444280 -0.0000000), wk = 0.0033223 k( 124) = ( 0.0377942 0.0592373 -0.0000000), wk = 0.0033223 k( 125) = ( 0.0472427 0.0740467 -0.0000000), wk = 0.0033223 k( 126) = ( 0.0566913 0.0888560 -0.0000000), wk = 0.0033223 k( 127) = ( 0.0661398 0.1036653 -0.0000000), wk = 0.0033223 k( 128) = ( 0.0755884 0.1184747 -0.0000000), wk = 0.0033223 k( 129) = ( 0.0850369 0.1332840 -0.0000000), wk = 0.0033223 k( 130) = ( 0.0944854 0.1480933 -0.0000000), wk = 0.0033223 k( 131) = ( 0.1039340 0.1629027 -0.0000000), wk = 0.0033223 k( 132) = ( 0.1133825 0.1777120 -0.0000000), wk = 0.0033223 k( 133) = ( 0.1228311 0.1925214 -0.0000000), wk = 0.0033223 k( 134) = ( 0.1322796 0.2073307 -0.0000000), wk = 0.0033223 k( 135) = ( 0.1417282 0.2221400 -0.0000000), wk = 0.0033223 k( 136) = ( 0.1511767 0.2369494 -0.0000000), wk = 0.0033223 k( 137) = ( 0.1606252 0.2517587 -0.0000000), wk = 0.0033223 k( 138) = ( 0.1700738 0.2665680 -0.0000000), wk = 0.0033223 k( 139) = ( 0.1795223 0.2813774 -0.0000000), wk = 0.0033223 k( 140) = ( 0.1889709 0.2961867 -0.0000000), wk = 0.0033223 k( 141) = ( 0.1984194 0.3109960 -0.0000000), wk = 0.0033223 k( 142) = ( 0.2078680 0.3258054 -0.0000000), wk = 0.0033223 k( 143) = ( 0.2173165 0.3406147 -0.0000000), wk = 0.0033223 k( 144) = ( 0.2267651 0.3554240 -0.0000000), wk = 0.0033223 k( 145) = ( 0.2362136 0.3702334 -0.0000000), wk = 0.0033223 k( 146) = ( 0.2456621 0.3850427 -0.0000000), wk = 0.0033223 k( 147) = ( 0.2551107 0.3998520 -0.0000000), wk = 0.0033223 k( 148) = ( 0.2645592 0.4146614 -0.0000000), wk = 0.0033223 k( 149) = ( 0.2740078 0.4294707 -0.0000000), wk = 0.0033223 k( 150) = ( 0.2834563 0.4442800 -0.0000000), wk = 0.0033223 k( 151) = ( 0.2929049 0.4590894 -0.0000000), wk = 0.0033223 k( 152) = ( 0.3023534 0.4738987 -0.0000000), wk = 0.0033223 k( 153) = ( 0.3118020 0.4887080 -0.0000000), wk = 0.0033223 k( 154) = ( 0.3212505 0.5035174 -0.0000000), wk = 0.0033223 k( 155) = ( 0.3306990 0.5183267 -0.0000000), wk = 0.0033223 k( 156) = ( 0.3401476 0.5331361 -0.0000000), wk = 0.0033223 k( 157) = ( 0.3495961 0.5479454 -0.0000000), wk = 0.0033223 k( 158) = ( 0.3590447 0.5627547 -0.0000000), wk = 0.0033223 k( 159) = ( 0.3684932 0.5775641 -0.0000000), wk = 0.0033223 k( 160) = ( 0.3779418 0.5923734 -0.0000000), wk = 0.0033223 k( 161) = ( 0.3873903 0.6071827 -0.0000000), wk = 0.0033223 k( 162) = ( 0.3968389 0.6219921 -0.0000000), wk = 0.0033223 k( 163) = ( 0.4062874 0.6368014 -0.0000000), wk = 0.0033223 k( 164) = ( 0.4157360 0.6516107 -0.0000000), wk = 0.0033223 k( 165) = ( 0.4251845 0.6664201 -0.0000000), wk = 0.0033223 k( 166) = ( 0.4346330 0.6812294 -0.0000000), wk = 0.0033223 k( 167) = ( 0.4440816 0.6960387 -0.0000000), wk = 0.0033223 k( 168) = ( 0.4535301 0.7108481 -0.0000000), wk = 0.0033223 k( 169) = ( 0.4535301 0.7108481 -0.0000000), wk = 0.0033223 k( 170) = ( 0.4484419 0.7028729 0.0148274), wk = 0.0033223 k( 171) = ( 0.4433536 0.6948978 0.0296549), wk = 0.0033223 k( 172) = ( 0.4382654 0.6869226 0.0444823), wk = 0.0033223 k( 173) = ( 0.4331771 0.6789474 0.0593098), wk = 0.0033223 k( 174) = ( 0.4280889 0.6709723 0.0741372), wk = 0.0033223 k( 175) = ( 0.4230006 0.6629971 0.0889647), wk = 0.0033223 k( 176) = ( 0.4179124 0.6550220 0.1037921), wk = 0.0033223 k( 177) = ( 0.4128241 0.6470468 0.1186196), wk = 0.0033223 k( 178) = ( 0.4077359 0.6390716 0.1334470), wk = 0.0033223 k( 179) = ( 0.4026476 0.6310965 0.1482745), wk = 0.0033223 k( 180) = ( 0.3975593 0.6231213 0.1631019), wk = 0.0033223 k( 181) = ( 0.3924711 0.6151462 0.1779294), wk = 0.0033223 k( 182) = ( 0.3873828 0.6071710 0.1927568), wk = 0.0033223 k( 183) = ( 0.3822946 0.5991958 0.2075842), wk = 0.0033223 k( 184) = ( 0.3772063 0.5912207 0.2224117), wk = 0.0033223 k( 185) = ( 0.3721181 0.5832455 0.2372391), wk = 0.0033223 k( 186) = ( 0.3670298 0.5752704 0.2520666), wk = 0.0033223 k( 187) = ( 0.3619416 0.5672952 0.2668940), wk = 0.0033223 k( 188) = ( 0.3568533 0.5593201 0.2817215), wk = 0.0033223 k( 189) = ( 0.3517651 0.5513449 0.2965489), wk = 0.0033223 k( 190) = ( 0.3466768 0.5433697 0.3113764), wk = 0.0033223 k( 191) = ( 0.3415886 0.5353946 0.3262038), wk = 0.0033223 k( 192) = ( 0.3365003 0.5274194 0.3410313), wk = 0.0033223 k( 193) = ( 0.3314121 0.5194442 0.3558587), wk = 0.0033223 k( 194) = ( 0.3263238 0.5114691 0.3706862), wk = 0.0033223 k( 195) = ( 0.3212355 0.5034939 0.3855136), wk = 0.0033223 k( 196) = ( 0.3161473 0.4955188 0.4003411), wk = 0.0033223 k( 197) = ( 0.3110590 0.4875436 0.4151685), wk = 0.0033223 k( 198) = ( 0.3059708 0.4795685 0.4299959), wk = 0.0033223 k( 199) = ( 0.3008825 0.4715933 0.4448234), wk = 0.0033223 k( 200) = ( 0.2957943 0.4636181 0.4596508), wk = 0.0033223 k( 201) = ( 0.2907060 0.4556430 0.4744783), wk = 0.0033223 k( 202) = ( 0.2856178 0.4476678 0.4893057), wk = 0.0033223 k( 203) = ( 0.2805295 0.4396927 0.5041332), wk = 0.0033223 k( 204) = ( 0.2754413 0.4317175 0.5189606), wk = 0.0033223 k( 205) = ( 0.2703530 0.4237423 0.5337881), wk = 0.0033223 k( 206) = ( 0.2652648 0.4157672 0.5486155), wk = 0.0033223 k( 207) = ( 0.2601765 0.4077920 0.5634430), wk = 0.0033223 k( 208) = ( 0.2550883 0.3998169 0.5782704), wk = 0.0033223 k( 209) = ( 0.2500000 0.3918417 0.5930979), wk = 0.0033223 k( 210) = ( 0.2500000 0.3918417 0.5930979), wk = 0.0033223 k( 211) = ( 0.2395833 0.3984877 0.5807416), wk = 0.0033223 k( 212) = ( 0.2291667 0.4051336 0.5683854), wk = 0.0033223 k( 213) = ( 0.2187500 0.4117796 0.5560292), wk = 0.0033223 k( 214) = ( 0.2083333 0.4184256 0.5436730), wk = 0.0033223 k( 215) = ( 0.1979167 0.4250715 0.5313168), wk = 0.0033223 k( 216) = ( 0.1875000 0.4317175 0.5189606), wk = 0.0033223 k( 217) = ( 0.1770833 0.4383635 0.5066044), wk = 0.0033223 k( 218) = ( 0.1666667 0.4450094 0.4942482), wk = 0.0033223 k( 219) = ( 0.1562500 0.4516554 0.4818920), wk = 0.0033223 k( 220) = ( 0.1458333 0.4583014 0.4695358), wk = 0.0033223 k( 221) = ( 0.1354167 0.4649473 0.4571796), wk = 0.0033223 k( 222) = ( 0.1250000 0.4715933 0.4448234), wk = 0.0033223 k( 223) = ( 0.1145833 0.4782393 0.4324672), wk = 0.0033223 k( 224) = ( 0.1041667 0.4848852 0.4201110), wk = 0.0033223 k( 225) = ( 0.0937500 0.4915312 0.4077548), wk = 0.0033223 k( 226) = ( 0.0833333 0.4981772 0.3953986), wk = 0.0033223 k( 227) = ( 0.0729167 0.5048231 0.3830424), wk = 0.0033223 k( 228) = ( 0.0625000 0.5114691 0.3706862), wk = 0.0033223 k( 229) = ( 0.0520833 0.5181151 0.3583299), wk = 0.0033223 k( 230) = ( 0.0416667 0.5247610 0.3459738), wk = 0.0033223 k( 231) = ( 0.0312500 0.5314070 0.3336175), wk = 0.0033223 k( 232) = ( 0.0208333 0.5380530 0.3212613), wk = 0.0033223 k( 233) = ( 0.0104167 0.5446989 0.3089051), wk = 0.0033223 k( 234) = ( 0.0000000 0.5513449 0.2965489), wk = 0.0033223 k( 235) = ( 0.0000000 0.5513449 0.2965489), wk = 0.0033223 k( 236) = ( -0.0141728 0.5463604 0.3058161), wk = 0.0033223 k( 237) = ( -0.0283456 0.5413759 0.3150832), wk = 0.0033223 k( 238) = ( -0.0425184 0.5363915 0.3243504), wk = 0.0033223 k( 239) = ( -0.0566913 0.5314070 0.3336175), wk = 0.0033223 k( 240) = ( -0.0708641 0.5264225 0.3428847), wk = 0.0033223 k( 241) = ( -0.0850369 0.5214380 0.3521519), wk = 0.0033223 k( 242) = ( -0.0992097 0.5164536 0.3614190), wk = 0.0033223 k( 243) = ( -0.1133825 0.5114691 0.3706862), wk = 0.0033223 k( 244) = ( -0.1275554 0.5064846 0.3799533), wk = 0.0033223 k( 245) = ( -0.1417282 0.5015001 0.3892205), wk = 0.0033223 k( 246) = ( -0.1559010 0.4965157 0.3984876), wk = 0.0033223 k( 247) = ( -0.1700738 0.4915312 0.4077548), wk = 0.0033223 k( 248) = ( -0.1842466 0.4865467 0.4170219), wk = 0.0033223 k( 249) = ( -0.1984194 0.4815622 0.4262891), wk = 0.0033223 k( 250) = ( -0.2125923 0.4765778 0.4355562), wk = 0.0033223 k( 251) = ( -0.2267651 0.4715933 0.4448234), wk = 0.0033223 k( 252) = ( -0.2409379 0.4666088 0.4540905), wk = 0.0033223 k( 253) = ( -0.2551107 0.4616243 0.4633577), wk = 0.0033223 k( 254) = ( -0.2692835 0.4566399 0.4726249), wk = 0.0033223 k( 255) = ( -0.2834563 0.4516554 0.4818920), wk = 0.0033223 k( 256) = ( -0.2976292 0.4466709 0.4911592), wk = 0.0033223 k( 257) = ( -0.3118020 0.4416865 0.5004263), wk = 0.0033223 k( 258) = ( -0.3259748 0.4367020 0.5096935), wk = 0.0033223 k( 259) = ( -0.3401476 0.4317175 0.5189606), wk = 0.0033223 k( 260) = ( -0.3543204 0.4267330 0.5282278), wk = 0.0033223 k( 261) = ( -0.3684932 0.4217486 0.5374949), wk = 0.0033223 k( 262) = ( -0.3826660 0.4167641 0.5467621), wk = 0.0033223 k( 263) = ( -0.3968389 0.4117796 0.5560292), wk = 0.0033223 k( 264) = ( -0.4110117 0.4067951 0.5652964), wk = 0.0033223 k( 265) = ( -0.4251845 0.4018106 0.5745635), wk = 0.0033223 k( 266) = ( -0.4393573 0.3968262 0.5838307), wk = 0.0033223 k( 267) = ( -0.4535301 0.3918417 0.5930979), wk = 0.0033223 k( 268) = ( -0.4535301 0.3918417 0.5930979), wk = 0.0033223 k( 269) = ( -0.4628241 0.3772746 0.5930979), wk = 0.0033223 k( 270) = ( -0.4721181 0.3627076 0.5930979), wk = 0.0033223 k( 271) = ( -0.4814120 0.3481405 0.5930979), wk = 0.0033223 k( 272) = ( -0.4907060 0.3335734 0.5930979), wk = 0.0033223 k( 273) = ( -0.5000000 0.3190064 0.5930979), wk = 0.0033223 k( 274) = ( 0.0000000 0.0000000 0.5930979), wk = 0.0033223 k( 275) = ( 0.0092593 0.0145127 0.5930979), wk = 0.0033223 k( 276) = ( 0.0185185 0.0290253 0.5930979), wk = 0.0033223 k( 277) = ( 0.0277778 0.0435380 0.5930979), wk = 0.0033223 k( 278) = ( 0.0370370 0.0580506 0.5930979), wk = 0.0033223 k( 279) = ( 0.0462963 0.0725633 0.5930979), wk = 0.0033223 k( 280) = ( 0.0555556 0.0870759 0.5930979), wk = 0.0033223 k( 281) = ( 0.0648148 0.1015886 0.5930979), wk = 0.0033223 k( 282) = ( 0.0740741 0.1161012 0.5930979), wk = 0.0033223 k( 283) = ( 0.0833333 0.1306139 0.5930979), wk = 0.0033223 k( 284) = ( 0.0925926 0.1451266 0.5930979), wk = 0.0033223 k( 285) = ( 0.1018518 0.1596392 0.5930979), wk = 0.0033223 k( 286) = ( 0.1111111 0.1741519 0.5930979), wk = 0.0033223 k( 287) = ( 0.1203704 0.1886645 0.5930979), wk = 0.0033223 k( 288) = ( 0.1296296 0.2031772 0.5930979), wk = 0.0033223 k( 289) = ( 0.1388889 0.2176898 0.5930979), wk = 0.0033223 k( 290) = ( 0.1481482 0.2322025 0.5930979), wk = 0.0033223 k( 291) = ( 0.1574074 0.2467152 0.5930979), wk = 0.0033223 k( 292) = ( 0.1666667 0.2612278 0.5930979), wk = 0.0033223 k( 293) = ( 0.1759259 0.2757405 0.5930979), wk = 0.0033223 k( 294) = ( 0.1851852 0.2902531 0.5930979), wk = 0.0033223 k( 295) = ( 0.1944444 0.3047658 0.5930979), wk = 0.0033223 k( 296) = ( 0.2037037 0.3192784 0.5930979), wk = 0.0033223 k( 297) = ( 0.2129630 0.3337911 0.5930979), wk = 0.0033223 k( 298) = ( 0.2222222 0.3483037 0.5930979), wk = 0.0033223 k( 299) = ( 0.2314815 0.3628164 0.5930979), wk = 0.0033223 k( 300) = ( 0.2407407 0.3773290 0.5930979), wk = 0.0033223 k( 301) = ( 0.2500000 0.3918417 0.5930979), wk = 0.0033223 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0000000 0.0147059), wk = 0.0033223 k( 3) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0033223 k( 4) = ( 0.0000000 0.0000000 0.0441177), wk = 0.0033223 k( 5) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0033223 k( 6) = ( 0.0000000 0.0000000 0.0735294), wk = 0.0033223 k( 7) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0033223 k( 8) = ( 0.0000000 0.0000000 0.1029412), wk = 0.0033223 k( 9) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0033223 k( 10) = ( 0.0000000 0.0000000 0.1323529), wk = 0.0033223 k( 11) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0033223 k( 12) = ( 0.0000000 0.0000000 0.1617647), wk = 0.0033223 k( 13) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0033223 k( 14) = ( 0.0000000 0.0000000 0.1911765), wk = 0.0033223 k( 15) = ( 0.0000000 0.0000000 0.2058824), wk = 0.0033223 k( 16) = ( 0.0000000 0.0000000 0.2205882), wk = 0.0033223 k( 17) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0033223 k( 18) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0033223 k( 19) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0033223 k( 20) = ( 0.0000000 0.0000000 0.2794118), wk = 0.0033223 k( 21) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0033223 k( 22) = ( 0.0000000 0.0000000 0.3088235), wk = 0.0033223 k( 23) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0033223 k( 24) = ( 0.0000000 0.0000000 0.3382353), wk = 0.0033223 k( 25) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0033223 k( 26) = ( 0.0000000 0.0000000 0.3676471), wk = 0.0033223 k( 27) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0033223 k( 28) = ( 0.0000000 0.0000000 0.3970588), wk = 0.0033223 k( 29) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0033223 k( 30) = ( 0.0000000 0.0000000 0.4264706), wk = 0.0033223 k( 31) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0033223 k( 32) = ( 0.0000000 0.0000000 0.4558824), wk = 0.0033223 k( 33) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0033223 k( 34) = ( 0.0000000 0.0000000 0.4852941), wk = 0.0033223 k( 35) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 36) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 37) = ( -0.0147059 0.0147059 0.5000000), wk = 0.0033223 k( 38) = ( -0.0294118 0.0294118 0.5000000), wk = 0.0033223 k( 39) = ( -0.0441177 0.0441177 0.5000000), wk = 0.0033223 k( 40) = ( -0.0588235 0.0588235 0.5000000), wk = 0.0033223 k( 41) = ( -0.0735294 0.0735294 0.5000000), wk = 0.0033223 k( 42) = ( -0.0882353 0.0882353 0.5000000), wk = 0.0033223 k( 43) = ( -0.1029412 0.1029412 0.5000000), wk = 0.0033223 k( 44) = ( -0.1176471 0.1176471 0.5000000), wk = 0.0033223 k( 45) = ( -0.1323529 0.1323529 0.5000000), wk = 0.0033223 k( 46) = ( -0.1470588 0.1470588 0.5000000), wk = 0.0033223 k( 47) = ( -0.1617647 0.1617647 0.5000000), wk = 0.0033223 k( 48) = ( -0.1764706 0.1764706 0.5000000), wk = 0.0033223 k( 49) = ( -0.1911765 0.1911765 0.5000000), wk = 0.0033223 k( 50) = ( -0.2058823 0.2058823 0.5000000), wk = 0.0033223 k( 51) = ( -0.2205882 0.2205882 0.5000000), wk = 0.0033223 k( 52) = ( -0.2352941 0.2352941 0.5000000), wk = 0.0033223 k( 53) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0033223 k( 54) = ( -0.2647059 0.2647059 0.5000000), wk = 0.0033223 k( 55) = ( -0.2794118 0.2794118 0.5000000), wk = 0.0033223 k( 56) = ( -0.2941177 0.2941177 0.5000000), wk = 0.0033223 k( 57) = ( -0.3088235 0.3088235 0.5000000), wk = 0.0033223 k( 58) = ( -0.3235294 0.3235294 0.5000000), wk = 0.0033223 k( 59) = ( -0.3382353 0.3382353 0.5000000), wk = 0.0033223 k( 60) = ( -0.3529412 0.3529412 0.5000000), wk = 0.0033223 k( 61) = ( -0.3676471 0.3676471 0.5000000), wk = 0.0033223 k( 62) = ( -0.3823529 0.3823529 0.5000000), wk = 0.0033223 k( 63) = ( -0.3970588 0.3970588 0.5000000), wk = 0.0033223 k( 64) = ( -0.4117647 0.4117647 0.5000000), wk = 0.0033223 k( 65) = ( -0.4264706 0.4264706 0.5000000), wk = 0.0033223 k( 66) = ( -0.4411765 0.4411765 0.5000000), wk = 0.0033223 k( 67) = ( -0.4558823 0.4558823 0.5000000), wk = 0.0033223 k( 68) = ( -0.4705882 0.4705882 0.5000000), wk = 0.0033223 k( 69) = ( -0.4852941 0.4852941 0.5000000), wk = 0.0033223 k( 70) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 71) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 72) = ( -0.4895833 0.4895833 0.4895833), wk = 0.0033223 k( 73) = ( -0.4791667 0.4791667 0.4791667), wk = 0.0033223 k( 74) = ( -0.4687500 0.4687500 0.4687500), wk = 0.0033223 k( 75) = ( -0.4583333 0.4583333 0.4583333), wk = 0.0033223 k( 76) = ( -0.4479167 0.4479167 0.4479167), wk = 0.0033223 k( 77) = ( -0.4375000 0.4375000 0.4375000), wk = 0.0033223 k( 78) = ( -0.4270833 0.4270833 0.4270833), wk = 0.0033223 k( 79) = ( -0.4166667 0.4166667 0.4166667), wk = 0.0033223 k( 80) = ( -0.4062500 0.4062500 0.4062500), wk = 0.0033223 k( 81) = ( -0.3958333 0.3958333 0.3958333), wk = 0.0033223 k( 82) = ( -0.3854167 0.3854167 0.3854167), wk = 0.0033223 k( 83) = ( -0.3750000 0.3750000 0.3750000), wk = 0.0033223 k( 84) = ( -0.3645833 0.3645833 0.3645833), wk = 0.0033223 k( 85) = ( -0.3541667 0.3541667 0.3541667), wk = 0.0033223 k( 86) = ( -0.3437500 0.3437500 0.3437500), wk = 0.0033223 k( 87) = ( -0.3333333 0.3333333 0.3333333), wk = 0.0033223 k( 88) = ( -0.3229167 0.3229167 0.3229167), wk = 0.0033223 k( 89) = ( -0.3125000 0.3125000 0.3125000), wk = 0.0033223 k( 90) = ( -0.3020833 0.3020833 0.3020833), wk = 0.0033223 k( 91) = ( -0.2916667 0.2916667 0.2916667), wk = 0.0033223 k( 92) = ( -0.2812500 0.2812500 0.2812500), wk = 0.0033223 k( 93) = ( -0.2708333 0.2708333 0.2708333), wk = 0.0033223 k( 94) = ( -0.2604167 0.2604167 0.2604167), wk = 0.0033223 k( 95) = ( -0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 96) = ( -0.2395833 0.2395833 0.2395833), wk = 0.0033223 k( 97) = ( -0.2291667 0.2291667 0.2291667), wk = 0.0033223 k( 98) = ( -0.2187500 0.2187500 0.2187500), wk = 0.0033223 k( 99) = ( -0.2083333 0.2083333 0.2083333), wk = 0.0033223 k( 100) = ( -0.1979167 0.1979167 0.1979167), wk = 0.0033223 k( 101) = ( -0.1875000 0.1875000 0.1875000), wk = 0.0033223 k( 102) = ( -0.1770833 0.1770833 0.1770833), wk = 0.0033223 k( 103) = ( -0.1666667 0.1666667 0.1666667), wk = 0.0033223 k( 104) = ( -0.1562500 0.1562500 0.1562500), wk = 0.0033223 k( 105) = ( -0.1458333 0.1458333 0.1458333), wk = 0.0033223 k( 106) = ( -0.1354167 0.1354167 0.1354167), wk = 0.0033223 k( 107) = ( -0.1250000 0.1250000 0.1250000), wk = 0.0033223 k( 108) = ( -0.1145833 0.1145833 0.1145833), wk = 0.0033223 k( 109) = ( -0.1041667 0.1041667 0.1041667), wk = 0.0033223 k( 110) = ( -0.0937500 0.0937500 0.0937500), wk = 0.0033223 k( 111) = ( -0.0833333 0.0833333 0.0833333), wk = 0.0033223 k( 112) = ( -0.0729167 0.0729167 0.0729167), wk = 0.0033223 k( 113) = ( -0.0625000 0.0625000 0.0625000), wk = 0.0033223 k( 114) = ( -0.0520833 0.0520833 0.0520833), wk = 0.0033223 k( 115) = ( -0.0416667 0.0416667 0.0416667), wk = 0.0033223 k( 116) = ( -0.0312500 0.0312500 0.0312500), wk = 0.0033223 k( 117) = ( -0.0208333 0.0208333 0.0208333), wk = 0.0033223 k( 118) = ( -0.0104167 0.0104167 0.0104167), wk = 0.0033223 k( 119) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 121) = ( 0.0094485 0.0094485 -0.0094485), wk = 0.0033223 k( 122) = ( 0.0188971 0.0188971 -0.0188971), wk = 0.0033223 k( 123) = ( 0.0283456 0.0283456 -0.0283456), wk = 0.0033223 k( 124) = ( 0.0377942 0.0377942 -0.0377942), wk = 0.0033223 k( 125) = ( 0.0472427 0.0472427 -0.0472427), wk = 0.0033223 k( 126) = ( 0.0566913 0.0566913 -0.0566913), wk = 0.0033223 k( 127) = ( 0.0661398 0.0661398 -0.0661398), wk = 0.0033223 k( 128) = ( 0.0755884 0.0755884 -0.0755884), wk = 0.0033223 k( 129) = ( 0.0850369 0.0850369 -0.0850369), wk = 0.0033223 k( 130) = ( 0.0944854 0.0944854 -0.0944854), wk = 0.0033223 k( 131) = ( 0.1039340 0.1039340 -0.1039340), wk = 0.0033223 k( 132) = ( 0.1133825 0.1133825 -0.1133825), wk = 0.0033223 k( 133) = ( 0.1228311 0.1228311 -0.1228311), wk = 0.0033223 k( 134) = ( 0.1322796 0.1322796 -0.1322796), wk = 0.0033223 k( 135) = ( 0.1417282 0.1417282 -0.1417282), wk = 0.0033223 k( 136) = ( 0.1511767 0.1511767 -0.1511767), wk = 0.0033223 k( 137) = ( 0.1606252 0.1606252 -0.1606252), wk = 0.0033223 k( 138) = ( 0.1700738 0.1700738 -0.1700738), wk = 0.0033223 k( 139) = ( 0.1795223 0.1795223 -0.1795223), wk = 0.0033223 k( 140) = ( 0.1889709 0.1889709 -0.1889709), wk = 0.0033223 k( 141) = ( 0.1984194 0.1984194 -0.1984194), wk = 0.0033223 k( 142) = ( 0.2078680 0.2078680 -0.2078680), wk = 0.0033223 k( 143) = ( 0.2173165 0.2173165 -0.2173165), wk = 0.0033223 k( 144) = ( 0.2267651 0.2267651 -0.2267651), wk = 0.0033223 k( 145) = ( 0.2362136 0.2362136 -0.2362136), wk = 0.0033223 k( 146) = ( 0.2456621 0.2456621 -0.2456621), wk = 0.0033223 k( 147) = ( 0.2551107 0.2551107 -0.2551107), wk = 0.0033223 k( 148) = ( 0.2645592 0.2645592 -0.2645592), wk = 0.0033223 k( 149) = ( 0.2740078 0.2740078 -0.2740078), wk = 0.0033223 k( 150) = ( 0.2834563 0.2834563 -0.2834563), wk = 0.0033223 k( 151) = ( 0.2929049 0.2929049 -0.2929049), wk = 0.0033223 k( 152) = ( 0.3023534 0.3023534 -0.3023534), wk = 0.0033223 k( 153) = ( 0.3118020 0.3118020 -0.3118020), wk = 0.0033223 k( 154) = ( 0.3212505 0.3212505 -0.3212505), wk = 0.0033223 k( 155) = ( 0.3306990 0.3306990 -0.3306990), wk = 0.0033223 k( 156) = ( 0.3401476 0.3401476 -0.3401476), wk = 0.0033223 k( 157) = ( 0.3495961 0.3495961 -0.3495961), wk = 0.0033223 k( 158) = ( 0.3590447 0.3590447 -0.3590447), wk = 0.0033223 k( 159) = ( 0.3684932 0.3684932 -0.3684932), wk = 0.0033223 k( 160) = ( 0.3779418 0.3779418 -0.3779418), wk = 0.0033223 k( 161) = ( 0.3873903 0.3873903 -0.3873903), wk = 0.0033223 k( 162) = ( 0.3968389 0.3968389 -0.3968389), wk = 0.0033223 k( 163) = ( 0.4062874 0.4062874 -0.4062874), wk = 0.0033223 k( 164) = ( 0.4157360 0.4157359 -0.4157359), wk = 0.0033223 k( 165) = ( 0.4251845 0.4251845 -0.4251845), wk = 0.0033223 k( 166) = ( 0.4346330 0.4346330 -0.4346330), wk = 0.0033223 k( 167) = ( 0.4440816 0.4440816 -0.4440816), wk = 0.0033223 k( 168) = ( 0.4535301 0.4535301 -0.4535301), wk = 0.0033223 k( 169) = ( 0.4535301 0.4535301 -0.4535301), wk = 0.0033223 k( 170) = ( 0.4484419 0.4484419 -0.4359419), wk = 0.0033223 k( 171) = ( 0.4433536 0.4433536 -0.4183536), wk = 0.0033223 k( 172) = ( 0.4382654 0.4382654 -0.4007654), wk = 0.0033223 k( 173) = ( 0.4331771 0.4331771 -0.3831771), wk = 0.0033223 k( 174) = ( 0.4280889 0.4280889 -0.3655889), wk = 0.0033223 k( 175) = ( 0.4230006 0.4230006 -0.3480006), wk = 0.0033223 k( 176) = ( 0.4179124 0.4179124 -0.3304124), wk = 0.0033223 k( 177) = ( 0.4128241 0.4128241 -0.3128241), wk = 0.0033223 k( 178) = ( 0.4077359 0.4077358 -0.2952359), wk = 0.0033223 k( 179) = ( 0.4026476 0.4026476 -0.2776476), wk = 0.0033223 k( 180) = ( 0.3975593 0.3975593 -0.2600593), wk = 0.0033223 k( 181) = ( 0.3924711 0.3924711 -0.2424711), wk = 0.0033223 k( 182) = ( 0.3873828 0.3873828 -0.2248828), wk = 0.0033223 k( 183) = ( 0.3822946 0.3822946 -0.2072946), wk = 0.0033223 k( 184) = ( 0.3772063 0.3772063 -0.1897063), wk = 0.0033223 k( 185) = ( 0.3721181 0.3721181 -0.1721181), wk = 0.0033223 k( 186) = ( 0.3670298 0.3670298 -0.1545298), wk = 0.0033223 k( 187) = ( 0.3619416 0.3619416 -0.1369416), wk = 0.0033223 k( 188) = ( 0.3568533 0.3568533 -0.1193533), wk = 0.0033223 k( 189) = ( 0.3517651 0.3517651 -0.1017651), wk = 0.0033223 k( 190) = ( 0.3466768 0.3466768 -0.0841768), wk = 0.0033223 k( 191) = ( 0.3415886 0.3415886 -0.0665886), wk = 0.0033223 k( 192) = ( 0.3365003 0.3365003 -0.0490003), wk = 0.0033223 k( 193) = ( 0.3314121 0.3314121 -0.0314121), wk = 0.0033223 k( 194) = ( 0.3263238 0.3263238 -0.0138238), wk = 0.0033223 k( 195) = ( 0.3212355 0.3212355 0.0037645), wk = 0.0033223 k( 196) = ( 0.3161473 0.3161473 0.0213527), wk = 0.0033223 k( 197) = ( 0.3110590 0.3110590 0.0389410), wk = 0.0033223 k( 198) = ( 0.3059708 0.3059708 0.0565292), wk = 0.0033223 k( 199) = ( 0.3008825 0.3008825 0.0741175), wk = 0.0033223 k( 200) = ( 0.2957943 0.2957943 0.0917057), wk = 0.0033223 k( 201) = ( 0.2907060 0.2907060 0.1092940), wk = 0.0033223 k( 202) = ( 0.2856178 0.2856178 0.1268822), wk = 0.0033223 k( 203) = ( 0.2805295 0.2805295 0.1444705), wk = 0.0033223 k( 204) = ( 0.2754413 0.2754413 0.1620587), wk = 0.0033223 k( 205) = ( 0.2703530 0.2703530 0.1796470), wk = 0.0033223 k( 206) = ( 0.2652648 0.2652648 0.1972352), wk = 0.0033223 k( 207) = ( 0.2601765 0.2601765 0.2148235), wk = 0.0033223 k( 208) = ( 0.2550883 0.2550883 0.2324118), wk = 0.0033223 k( 209) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 210) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 211) = ( 0.2395833 0.2604167 0.2395833), wk = 0.0033223 k( 212) = ( 0.2291667 0.2708333 0.2291667), wk = 0.0033223 k( 213) = ( 0.2187500 0.2812500 0.2187500), wk = 0.0033223 k( 214) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0033223 k( 215) = ( 0.1979167 0.3020833 0.1979167), wk = 0.0033223 k( 216) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0033223 k( 217) = ( 0.1770833 0.3229167 0.1770833), wk = 0.0033223 k( 218) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0033223 k( 219) = ( 0.1562500 0.3437500 0.1562500), wk = 0.0033223 k( 220) = ( 0.1458333 0.3541667 0.1458333), wk = 0.0033223 k( 221) = ( 0.1354167 0.3645833 0.1354167), wk = 0.0033223 k( 222) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0033223 k( 223) = ( 0.1145833 0.3854167 0.1145833), wk = 0.0033223 k( 224) = ( 0.1041667 0.3958333 0.1041667), wk = 0.0033223 k( 225) = ( 0.0937500 0.4062500 0.0937500), wk = 0.0033223 k( 226) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0033223 k( 227) = ( 0.0729167 0.4270833 0.0729167), wk = 0.0033223 k( 228) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0033223 k( 229) = ( 0.0520833 0.4479167 0.0520833), wk = 0.0033223 k( 230) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0033223 k( 231) = ( 0.0312500 0.4687500 0.0312500), wk = 0.0033223 k( 232) = ( 0.0208333 0.4791667 0.0208333), wk = 0.0033223 k( 233) = ( 0.0104167 0.4895833 0.0104167), wk = 0.0033223 k( 234) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 235) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0033223 k( 236) = ( -0.0141728 0.5014522 0.0141728), wk = 0.0033223 k( 237) = ( -0.0283456 0.5029044 0.0283456), wk = 0.0033223 k( 238) = ( -0.0425184 0.5043566 0.0425185), wk = 0.0033223 k( 239) = ( -0.0566913 0.5058087 0.0566913), wk = 0.0033223 k( 240) = ( -0.0708641 0.5072609 0.0708641), wk = 0.0033223 k( 241) = ( -0.0850369 0.5087131 0.0850369), wk = 0.0033223 k( 242) = ( -0.0992097 0.5101653 0.0992097), wk = 0.0033223 k( 243) = ( -0.1133825 0.5116175 0.1133825), wk = 0.0033223 k( 244) = ( -0.1275554 0.5130697 0.1275554), wk = 0.0033223 k( 245) = ( -0.1417282 0.5145218 0.1417282), wk = 0.0033223 k( 246) = ( -0.1559010 0.5159740 0.1559010), wk = 0.0033223 k( 247) = ( -0.1700738 0.5174262 0.1700738), wk = 0.0033223 k( 248) = ( -0.1842466 0.5188784 0.1842466), wk = 0.0033223 k( 249) = ( -0.1984194 0.5203306 0.1984194), wk = 0.0033223 k( 250) = ( -0.2125923 0.5217828 0.2125923), wk = 0.0033223 k( 251) = ( -0.2267651 0.5232349 0.2267651), wk = 0.0033223 k( 252) = ( -0.2409379 0.5246871 0.2409379), wk = 0.0033223 k( 253) = ( -0.2551107 0.5261393 0.2551107), wk = 0.0033223 k( 254) = ( -0.2692835 0.5275915 0.2692835), wk = 0.0033223 k( 255) = ( -0.2834563 0.5290437 0.2834563), wk = 0.0033223 k( 256) = ( -0.2976292 0.5304958 0.2976292), wk = 0.0033223 k( 257) = ( -0.3118020 0.5319480 0.3118020), wk = 0.0033223 k( 258) = ( -0.3259748 0.5334002 0.3259748), wk = 0.0033223 k( 259) = ( -0.3401476 0.5348524 0.3401476), wk = 0.0033223 k( 260) = ( -0.3543204 0.5363046 0.3543204), wk = 0.0033223 k( 261) = ( -0.3684932 0.5377568 0.3684932), wk = 0.0033223 k( 262) = ( -0.3826660 0.5392090 0.3826661), wk = 0.0033223 k( 263) = ( -0.3968389 0.5406611 0.3968389), wk = 0.0033223 k( 264) = ( -0.4110117 0.5421133 0.4110117), wk = 0.0033223 k( 265) = ( -0.4251845 0.5435655 0.4251845), wk = 0.0033223 k( 266) = ( -0.4393573 0.5450177 0.4393573), wk = 0.0033223 k( 267) = ( -0.4535301 0.5464699 0.4535301), wk = 0.0033223 k( 268) = ( -0.4535301 0.5464699 0.4535301), wk = 0.0033223 k( 269) = ( -0.4628241 0.5371759 0.4628241), wk = 0.0033223 k( 270) = ( -0.4721181 0.5278819 0.4721181), wk = 0.0033223 k( 271) = ( -0.4814120 0.5185880 0.4814120), wk = 0.0033223 k( 272) = ( -0.4907060 0.5092940 0.4907060), wk = 0.0033223 k( 273) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 274) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 275) = ( 0.0092593 0.0092593 0.4907407), wk = 0.0033223 k( 276) = ( 0.0185185 0.0185185 0.4814815), wk = 0.0033223 k( 277) = ( 0.0277778 0.0277778 0.4722222), wk = 0.0033223 k( 278) = ( 0.0370370 0.0370370 0.4629630), wk = 0.0033223 k( 279) = ( 0.0462963 0.0462963 0.4537037), wk = 0.0033223 k( 280) = ( 0.0555556 0.0555556 0.4444444), wk = 0.0033223 k( 281) = ( 0.0648148 0.0648148 0.4351852), wk = 0.0033223 k( 282) = ( 0.0740741 0.0740741 0.4259259), wk = 0.0033223 k( 283) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0033223 k( 284) = ( 0.0925926 0.0925926 0.4074074), wk = 0.0033223 k( 285) = ( 0.1018518 0.1018518 0.3981481), wk = 0.0033223 k( 286) = ( 0.1111111 0.1111111 0.3888889), wk = 0.0033223 k( 287) = ( 0.1203704 0.1203704 0.3796296), wk = 0.0033223 k( 288) = ( 0.1296296 0.1296296 0.3703704), wk = 0.0033223 k( 289) = ( 0.1388889 0.1388889 0.3611111), wk = 0.0033223 k( 290) = ( 0.1481482 0.1481482 0.3518519), wk = 0.0033223 k( 291) = ( 0.1574074 0.1574074 0.3425926), wk = 0.0033223 k( 292) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0033223 k( 293) = ( 0.1759259 0.1759259 0.3240741), wk = 0.0033223 k( 294) = ( 0.1851852 0.1851852 0.3148148), wk = 0.0033223 k( 295) = ( 0.1944444 0.1944444 0.3055556), wk = 0.0033223 k( 296) = ( 0.2037037 0.2037037 0.2962963), wk = 0.0033223 k( 297) = ( 0.2129630 0.2129630 0.2870370), wk = 0.0033223 k( 298) = ( 0.2222222 0.2222222 0.2777778), wk = 0.0033223 k( 299) = ( 0.2314815 0.2314815 0.2685185), wk = 0.0033223 k( 300) = ( 0.2407407 0.2407407 0.2592593), wk = 0.0033223 k( 301) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 Dense grid: 87185 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 42253 G-vectors FFT dimensions: ( 48, 48, 48) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.35 Mb ( 304, 76) NL pseudopotentials 0.49 Mb ( 152, 212) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 2423) G-vector shells 0.01 Mb ( 1120) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.41 Mb ( 304, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.49 Mb ( 212, 2, 76) The potential is recalculated from file : ./ZrSiO4.save/charge-density.dat Starting wfc are 116 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.8 secs Computing kpt #: 2 total cpu time spent up to now is 4.0 secs Computing kpt #: 3 total cpu time spent up to now is 5.2 secs Computing kpt #: 4 total cpu time spent up to now is 6.3 secs Computing kpt #: 5 total cpu time spent up to now is 7.6 secs Computing kpt #: 6 total cpu time spent up to now is 8.9 secs Computing kpt #: 7 total cpu time spent up to now is 10.2 secs Computing kpt #: 8 total cpu time spent up to now is 11.6 secs Computing kpt #: 9 total cpu time spent up to now is 13.1 secs Computing kpt #: 10 total cpu time spent up to now is 15.8 secs Computing kpt #: 11 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 18.6 secs Computing kpt #: 12 total cpu time spent up to now is 20.4 secs Computing kpt #: 13 total cpu time spent up to now is 22.6 secs Computing kpt #: 14 total cpu time spent up to now is 24.5 secs Computing kpt #: 15 total cpu time spent up to now is 26.4 secs Computing kpt #: 16 total cpu time spent up to now is 28.1 secs Computing kpt #: 17 total cpu time spent up to now is 29.6 secs Computing kpt #: 18 total cpu time spent up to now is 30.9 secs Computing kpt #: 19 total cpu time spent up to now is 32.2 secs Computing kpt #: 20 total cpu time spent up to now is 33.3 secs Computing kpt #: 21 total cpu time spent up to now is 34.5 secs Computing kpt #: 22 total cpu time spent up to now is 35.7 secs Computing kpt #: 23 total cpu time spent up to now is 36.8 secs Computing kpt #: 24 total cpu time spent up to now is 38.0 secs Computing kpt #: 25 total cpu time spent up to now is 39.1 secs Computing kpt #: 26 total cpu time spent up to now is 40.2 secs Computing kpt #: 27 total cpu time spent up to now is 41.4 secs Computing kpt #: 28 total cpu time spent up to now is 42.5 secs Computing kpt #: 29 total cpu time spent up to now is 43.6 secs Computing kpt #: 30 total cpu time spent up to now is 44.7 secs Computing kpt #: 31 total cpu time spent up to now is 45.9 secs Computing kpt #: 32 total cpu time spent up to now is 47.0 secs Computing kpt #: 33 total cpu time spent up to now is 48.1 secs Computing kpt #: 34 total cpu time spent up to now is 49.3 secs Computing kpt #: 35 total cpu time spent up to now is 50.4 secs Computing kpt #: 36 total cpu time spent up to now is 51.5 secs Computing kpt #: 37 total cpu time spent up to now is 52.7 secs Computing kpt #: 38 total cpu time spent up to now is 53.8 secs Computing kpt #: 39 total cpu time spent up to now is 54.9 secs Computing kpt #: 40 total cpu time spent up to now is 56.0 secs Computing kpt #: 41 total cpu time spent up to now is 57.2 secs Computing kpt #: 42 total cpu time spent up to now is 58.3 secs Computing kpt #: 43 total cpu time spent up to now is 59.4 secs Computing kpt #: 44 total cpu time spent up to now is 60.6 secs Computing kpt #: 45 total cpu time spent up to now is 61.7 secs Computing kpt #: 46 total cpu time spent up to now is 62.8 secs Computing kpt #: 47 total cpu time spent up to now is 64.0 secs Computing kpt #: 48 total cpu time spent up to now is 65.1 secs Computing kpt #: 49 total cpu time spent up to now is 66.3 secs Computing kpt #: 50 total cpu time spent up to now is 67.4 secs Computing kpt #: 51 total cpu time spent up to now is 68.5 secs Computing kpt #: 52 total cpu time spent up to now is 69.7 secs Computing kpt #: 53 total cpu time spent up to now is 70.8 secs Computing kpt #: 54 total cpu time spent up to now is 71.9 secs Computing kpt #: 55 total cpu time spent up to now is 73.1 secs Computing kpt #: 56 total cpu time spent up to now is 74.2 secs Computing kpt #: 57 total cpu time spent up to now is 75.4 secs Computing kpt #: 58 total cpu time spent up to now is 76.5 secs Computing kpt #: 59 total cpu time spent up to now is 77.7 secs Computing kpt #: 60 total cpu time spent up to now is 78.8 secs Computing kpt #: 61 total cpu time spent up to now is 79.9 secs Computing kpt #: 62 total cpu time spent up to now is 81.1 secs Computing kpt #: 63 total cpu time spent up to now is 82.2 secs Computing kpt #: 64 total cpu time spent up to now is 83.3 secs Computing kpt #: 65 total cpu time spent up to now is 84.5 secs Computing kpt #: 66 total cpu time spent up to now is 85.6 secs Computing kpt #: 67 total cpu time spent up to now is 86.7 secs Computing kpt #: 68 total cpu time spent up to now is 87.9 secs Computing kpt #: 69 total cpu time spent up to now is 89.0 secs Computing kpt #: 70 total cpu time spent up to now is 90.3 secs Computing kpt #: 71 total cpu time spent up to now is 91.5 secs Computing kpt #: 72 total cpu time spent up to now is 92.7 secs Computing kpt #: 73 total cpu time spent up to now is 93.8 secs Computing kpt #: 74 total cpu time spent up to now is 94.9 secs Computing kpt #: 75 total cpu time spent up to now is 96.1 secs Computing kpt #: 76 total cpu time spent up to now is 97.2 secs Computing kpt #: 77 total cpu time spent up to now is 98.3 secs Computing kpt #: 78 total cpu time spent up to now is 99.4 secs Computing kpt #: 79 total cpu time spent up to now is 100.5 secs Computing kpt #: 80 total cpu time spent up to now is 101.7 secs Computing kpt #: 81 total cpu time spent up to now is 102.8 secs Computing kpt #: 82 total cpu time spent up to now is 103.9 secs Computing kpt #: 83 total cpu time spent up to now is 105.1 secs Computing kpt #: 84 total cpu time spent up to now is 106.2 secs Computing kpt #: 85 total cpu time spent up to now is 107.3 secs Computing kpt #: 86 total cpu time spent up to now is 108.5 secs Computing kpt #: 87 total cpu time spent up to now is 109.6 secs Computing kpt #: 88 total cpu time spent up to now is 110.7 secs Computing kpt #: 89 total cpu time spent up to now is 111.8 secs Computing kpt #: 90 total cpu time spent up to now is 113.0 secs Computing kpt #: 91 total cpu time spent up to now is 114.1 secs Computing kpt #: 92 total cpu time spent up to now is 115.2 secs Computing kpt #: 93 total cpu time spent up to now is 116.4 secs Computing kpt #: 94 total cpu time spent up to now is 117.5 secs Computing kpt #: 95 total cpu time spent up to now is 118.7 secs Computing kpt #: 96 total cpu time spent up to now is 119.8 secs Computing kpt #: 97 total cpu time spent up to now is 121.0 secs Computing kpt #: 98 total cpu time spent up to now is 122.2 secs Computing kpt #: 99 total cpu time spent up to now is 123.4 secs Computing kpt #: 100 total cpu time spent up to now is 124.7 secs Computing kpt #: 101 total cpu time spent up to now is 126.5 secs Computing kpt #: 102 total cpu time spent up to now is 128.0 secs Computing kpt #: 103 total cpu time spent up to now is 130.0 secs Computing kpt #: 104 total cpu time spent up to now is 132.0 secs Computing kpt #: 105 total cpu time spent up to now is 134.2 secs Computing kpt #: 106 total cpu time spent up to now is 136.4 secs Computing kpt #: 107 total cpu time spent up to now is 139.1 secs Computing kpt #: 108 total cpu time spent up to now is 140.6 secs Computing kpt #: 109 total cpu time spent up to now is 142.7 secs Computing kpt #: 110 total cpu time spent up to now is 144.0 secs Computing kpt #: 111 total cpu time spent up to now is 145.5 secs Computing kpt #: 112 total cpu time spent up to now is 146.7 secs Computing kpt #: 113 total cpu time spent up to now is 148.0 secs Computing kpt #: 114 total cpu time spent up to now is 149.2 secs Computing kpt #: 115 total cpu time spent up to now is 150.4 secs Computing kpt #: 116 total cpu time spent up to now is 151.6 secs Computing kpt #: 117 total cpu time spent up to now is 153.1 secs Computing kpt #: 118 total cpu time spent up to now is 154.3 secs Computing kpt #: 119 total cpu time spent up to now is 155.5 secs Computing kpt #: 120 total cpu time spent up to now is 156.7 secs Computing kpt #: 121 total cpu time spent up to now is 157.9 secs Computing kpt #: 122 total cpu time spent up to now is 159.1 secs Computing kpt #: 123 total cpu time spent up to now is 160.3 secs Computing kpt #: 124 total cpu time spent up to now is 161.5 secs Computing kpt #: 125 total cpu time spent up to now is 162.6 secs Computing kpt #: 126 total cpu time spent up to now is 163.8 secs Computing kpt #: 127 total cpu time spent up to now is 165.0 secs Computing kpt #: 128 total cpu time spent up to now is 166.1 secs Computing kpt #: 129 total cpu time spent up to now is 167.3 secs Computing kpt #: 130 total cpu time spent up to now is 168.5 secs Computing kpt #: 131 total cpu time spent up to now is 169.6 secs Computing kpt #: 132 total cpu time spent up to now is 170.7 secs Computing kpt #: 133 total cpu time spent up to now is 171.8 secs Computing kpt #: 134 total cpu time spent up to now is 173.0 secs Computing kpt #: 135 total cpu time spent up to now is 174.1 secs Computing kpt #: 136 total cpu time spent up to now is 175.2 secs Computing kpt #: 137 total cpu time spent up to now is 176.3 secs Computing kpt #: 138 total cpu time spent up to now is 177.4 secs Computing kpt #: 139 total cpu time spent up to now is 178.6 secs Computing kpt #: 140 total cpu time spent up to now is 179.7 secs Computing kpt #: 141 total cpu time spent up to now is 180.9 secs Computing kpt #: 142 total cpu time spent up to now is 182.0 secs Computing kpt #: 143 total cpu time spent up to now is 183.2 secs Computing kpt #: 144 total cpu time spent up to now is 184.4 secs Computing kpt #: 145 total cpu time spent up to now is 185.6 secs Computing kpt #: 146 total cpu time spent up to now is 186.7 secs Computing kpt #: 147 total cpu time spent up to now is 187.9 secs Computing kpt #: 148 total cpu time spent up to now is 189.1 secs Computing kpt #: 149 total cpu time spent up to now is 190.3 secs Computing kpt #: 150 total cpu time spent up to now is 191.4 secs Computing kpt #: 151 total cpu time spent up to now is 192.5 secs Computing kpt #: 152 total cpu time spent up to now is 193.7 secs Computing kpt #: 153 total cpu time spent up to now is 194.9 secs Computing kpt #: 154 total cpu time spent up to now is 196.1 secs Computing kpt #: 155 total cpu time spent up to now is 197.3 secs Computing kpt #: 156 total cpu time spent up to now is 198.6 secs Computing kpt #: 157 total cpu time spent up to now is 199.8 secs Computing kpt #: 158 total cpu time spent up to now is 201.1 secs Computing kpt #: 159 total cpu time spent up to now is 202.3 secs Computing kpt #: 160 total cpu time spent up to now is 203.6 secs Computing kpt #: 161 total cpu time spent up to now is 204.8 secs Computing kpt #: 162 total cpu time spent up to now is 206.0 secs Computing kpt #: 163 total cpu time spent up to now is 207.2 secs Computing kpt #: 164 total cpu time spent up to now is 208.4 secs Computing kpt #: 165 total cpu time spent up to now is 209.5 secs Computing kpt #: 166 total cpu time spent up to now is 210.7 secs Computing kpt #: 167 total cpu time spent up to now is 211.8 secs Computing kpt #: 168 total cpu time spent up to now is 213.0 secs Computing kpt #: 169 total cpu time spent up to now is 214.1 secs Computing kpt #: 170 total cpu time spent up to now is 215.3 secs Computing kpt #: 171 total cpu time spent up to now is 216.4 secs Computing kpt #: 172 total cpu time spent up to now is 217.6 secs Computing kpt #: 173 total cpu time spent up to now is 218.7 secs Computing kpt #: 174 total cpu time spent up to now is 219.9 secs Computing kpt #: 175 total cpu time spent up to now is 221.1 secs Computing kpt #: 176 total cpu time spent up to now is 222.3 secs Computing kpt #: 177 total cpu time spent up to now is 223.5 secs Computing kpt #: 178 total cpu time spent up to now is 224.6 secs Computing kpt #: 179 total cpu time spent up to now is 225.9 secs Computing kpt #: 180 total cpu time spent up to now is 227.1 secs Computing kpt #: 181 total cpu time spent up to now is 228.2 secs Computing kpt #: 182 total cpu time spent up to now is 229.5 secs Computing kpt #: 183 total cpu time spent up to now is 230.7 secs Computing kpt #: 184 total cpu time spent up to now is 231.9 secs Computing kpt #: 185 total cpu time spent up to now is 233.1 secs Computing kpt #: 186 total cpu time spent up to now is 234.2 secs Computing kpt #: 187 total cpu time spent up to now is 235.4 secs Computing kpt #: 188 total cpu time spent up to now is 236.6 secs Computing kpt #: 189 total cpu time spent up to now is 237.7 secs Computing kpt #: 190 total cpu time spent up to now is 238.9 secs Computing kpt #: 191 total cpu time spent up to now is 240.0 secs Computing kpt #: 192 total cpu time spent up to now is 241.2 secs Computing kpt #: 193 total cpu time spent up to now is 242.3 secs Computing kpt #: 194 total cpu time spent up to now is 243.4 secs Computing kpt #: 195 total cpu time spent up to now is 244.6 secs Computing kpt #: 196 total cpu time spent up to now is 245.8 secs Computing kpt #: 197 total cpu time spent up to now is 247.1 secs Computing kpt #: 198 total cpu time spent up to now is 248.3 secs Computing kpt #: 199 total cpu time spent up to now is 249.4 secs Computing kpt #: 200 total cpu time spent up to now is 250.6 secs Computing kpt #: 201 total cpu time spent up to now is 251.8 secs Computing kpt #: 202 total cpu time spent up to now is 253.0 secs Computing kpt #: 203 total cpu time spent up to now is 254.1 secs Computing kpt #: 204 total cpu time spent up to now is 255.2 secs Computing kpt #: 205 total cpu time spent up to now is 256.4 secs Computing kpt #: 206 total cpu time spent up to now is 257.5 secs Computing kpt #: 207 total cpu time spent up to now is 258.6 secs Computing kpt #: 208 total cpu time spent up to now is 259.8 secs Computing kpt #: 209 total cpu time spent up to now is 260.9 secs Computing kpt #: 210 total cpu time spent up to now is 262.0 secs Computing kpt #: 211 total cpu time spent up to now is 263.2 secs Computing kpt #: 212 total cpu time spent up to now is 264.3 secs Computing kpt #: 213 total cpu time spent up to now is 265.5 secs Computing kpt #: 214 total cpu time spent up to now is 266.6 secs Computing kpt #: 215 total cpu time spent up to now is 267.8 secs Computing kpt #: 216 total cpu time spent up to now is 269.0 secs Computing kpt #: 217 total cpu time spent up to now is 270.2 secs Computing kpt #: 218 total cpu time spent up to now is 271.5 secs Computing kpt #: 219 total cpu time spent up to now is 272.6 secs Computing kpt #: 220 total cpu time spent up to now is 273.8 secs Computing kpt #: 221 total cpu time spent up to now is 275.0 secs Computing kpt #: 222 total cpu time spent up to now is 276.2 secs Computing kpt #: 223 total cpu time spent up to now is 277.4 secs Computing kpt #: 224 total cpu time spent up to now is 278.6 secs Computing kpt #: 225 total cpu time spent up to now is 279.8 secs Computing kpt #: 226 total cpu time spent up to now is 280.9 secs Computing kpt #: 227 total cpu time spent up to now is 282.2 secs Computing kpt #: 228 total cpu time spent up to now is 283.3 secs Computing kpt #: 229 total cpu time spent up to now is 284.5 secs Computing kpt #: 230 total cpu time spent up to now is 285.6 secs Computing kpt #: 231 total cpu time spent up to now is 286.8 secs Computing kpt #: 232 total cpu time spent up to now is 287.9 secs Computing kpt #: 233 total cpu time spent up to now is 289.1 secs Computing kpt #: 234 total cpu time spent up to now is 290.3 secs Computing kpt #: 235 total cpu time spent up to now is 291.4 secs Computing kpt #: 236 total cpu time spent up to now is 292.6 secs Computing kpt #: 237 total cpu time spent up to now is 293.7 secs Computing kpt #: 238 total cpu time spent up to now is 294.8 secs Computing kpt #: 239 total cpu time spent up to now is 296.0 secs Computing kpt #: 240 total cpu time spent up to now is 297.2 secs Computing kpt #: 241 total cpu time spent up to now is 298.3 secs Computing kpt #: 242 total cpu time spent up to now is 299.5 secs Computing kpt #: 243 total cpu time spent up to now is 300.6 secs Computing kpt #: 244 total cpu time spent up to now is 301.8 secs Computing kpt #: 245 total cpu time spent up to now is 303.0 secs Computing kpt #: 246 total cpu time spent up to now is 304.2 secs Computing kpt #: 247 total cpu time spent up to now is 305.3 secs Computing kpt #: 248 total cpu time spent up to now is 306.5 secs Computing kpt #: 249 total cpu time spent up to now is 307.7 secs Computing kpt #: 250 total cpu time spent up to now is 308.9 secs Computing kpt #: 251 total cpu time spent up to now is 310.1 secs Computing kpt #: 252 total cpu time spent up to now is 311.3 secs Computing kpt #: 253 total cpu time spent up to now is 312.5 secs Computing kpt #: 254 total cpu time spent up to now is 313.7 secs Computing kpt #: 255 total cpu time spent up to now is 315.0 secs Computing kpt #: 256 total cpu time spent up to now is 316.2 secs Computing kpt #: 257 total cpu time spent up to now is 317.4 secs Computing kpt #: 258 total cpu time spent up to now is 318.6 secs Computing kpt #: 259 total cpu time spent up to now is 319.8 secs Computing kpt #: 260 total cpu time spent up to now is 321.0 secs Computing kpt #: 261 total cpu time spent up to now is 322.2 secs Computing kpt #: 262 total cpu time spent up to now is 323.4 secs Computing kpt #: 263 total cpu time spent up to now is 324.5 secs Computing kpt #: 264 total cpu time spent up to now is 325.7 secs Computing kpt #: 265 total cpu time spent up to now is 326.9 secs Computing kpt #: 266 total cpu time spent up to now is 328.0 secs Computing kpt #: 267 total cpu time spent up to now is 329.2 secs Computing kpt #: 268 total cpu time spent up to now is 330.3 secs Computing kpt #: 269 total cpu time spent up to now is 331.5 secs Computing kpt #: 270 total cpu time spent up to now is 332.6 secs Computing kpt #: 271 total cpu time spent up to now is 333.7 secs Computing kpt #: 272 total cpu time spent up to now is 334.8 secs Computing kpt #: 273 total cpu time spent up to now is 336.1 secs Computing kpt #: 274 total cpu time spent up to now is 337.3 secs Computing kpt #: 275 total cpu time spent up to now is 338.4 secs Computing kpt #: 276 total cpu time spent up to now is 339.5 secs Computing kpt #: 277 total cpu time spent up to now is 340.6 secs Computing kpt #: 278 total cpu time spent up to now is 341.8 secs Computing kpt #: 279 total cpu time spent up to now is 342.9 secs Computing kpt #: 280 total cpu time spent up to now is 344.0 secs Computing kpt #: 281 total cpu time spent up to now is 345.2 secs Computing kpt #: 282 total cpu time spent up to now is 346.3 secs Computing kpt #: 283 total cpu time spent up to now is 347.4 secs Computing kpt #: 284 total cpu time spent up to now is 348.6 secs Computing kpt #: 285 total cpu time spent up to now is 349.7 secs Computing kpt #: 286 total cpu time spent up to now is 350.8 secs Computing kpt #: 287 total cpu time spent up to now is 352.0 secs Computing kpt #: 288 total cpu time spent up to now is 353.1 secs Computing kpt #: 289 total cpu time spent up to now is 354.2 secs Computing kpt #: 290 total cpu time spent up to now is 355.4 secs Computing kpt #: 291 total cpu time spent up to now is 356.6 secs Computing kpt #: 292 total cpu time spent up to now is 357.7 secs Computing kpt #: 293 total cpu time spent up to now is 358.9 secs Computing kpt #: 294 total cpu time spent up to now is 360.0 secs Computing kpt #: 295 total cpu time spent up to now is 361.2 secs Computing kpt #: 296 total cpu time spent up to now is 362.3 secs Computing kpt #: 297 total cpu time spent up to now is 363.5 secs Computing kpt #: 298 total cpu time spent up to now is 364.6 secs Computing kpt #: 299 total cpu time spent up to now is 365.8 secs Computing kpt #: 300 total cpu time spent up to now is 366.9 secs Computing kpt #: 301 total cpu time spent up to now is 368.0 secs ethr = 1.56E-08, avg # of iterations = 28.2 total cpu time spent up to now is 368.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5277 PWs) bands (ev): -13.0322 -13.0322 -12.0722 -12.0722 -11.2574 -11.2574 -11.2487 -11.2487 -10.7604 -10.7604 -10.7285 -10.7285 -10.6635 -10.6635 -10.6544 -10.6544 -1.3212 -1.3212 0.2996 0.2996 0.3444 0.3444 0.7982 0.7982 0.8197 0.8197 1.5917 1.5917 1.9579 1.9579 2.0273 2.0273 2.8687 2.8687 2.9405 2.9405 2.9642 2.9642 3.2016 3.2016 3.6416 3.6416 3.6965 3.6965 4.5966 4.5966 4.6092 4.6092 5.2400 5.2400 5.2809 5.2809 5.2986 5.2986 5.4047 5.4047 5.5540 5.5540 5.5635 5.5635 5.5965 5.5965 6.0786 6.0786 10.7117 10.7117 11.0981 11.0981 11.2053 11.2053 11.2863 11.2863 12.2515 12.2515 12.2833 12.2833 k = 0.0000 0.0000 0.0174 ( 5273 PWs) bands (ev): -13.0316 -13.0316 -12.0725 -12.0725 -11.2572 -11.2572 -11.2485 -11.2485 -10.7607 -10.7607 -10.7288 -10.7288 -10.6638 -10.6638 -10.6548 -10.6548 -1.3196 -1.3196 0.3007 0.3007 0.3457 0.3457 0.7980 0.7980 0.8194 0.8194 1.5937 1.5937 1.9592 1.9592 2.0287 2.0287 2.8439 2.8439 2.9447 2.9447 2.9803 2.9803 3.2029 3.2029 3.6402 3.6402 3.6950 3.6950 4.5969 4.5969 4.6095 4.6095 5.2396 5.2396 5.2803 5.2803 5.2981 5.2981 5.4050 5.4050 5.5476 5.5476 5.5655 5.5655 5.5965 5.5965 6.0777 6.0777 10.7111 10.7111 11.0968 11.0968 11.2052 11.2052 11.2861 11.2861 12.2526 12.2526 12.2837 12.2837 k = 0.0000 0.0000 0.0349 ( 5281 PWs) bands (ev): -13.0298 -13.0298 -12.0733 -12.0733 -11.2566 -11.2566 -11.2480 -11.2480 -10.7616 -10.7616 -10.7298 -10.7298 -10.6647 -10.6647 -10.6557 -10.6557 -1.3147 -1.3147 0.3040 0.3040 0.3497 0.3497 0.7975 0.7975 0.8188 0.8188 1.5998 1.5998 1.9630 1.9630 2.0332 2.0332 2.7989 2.7989 2.9347 2.9347 3.0222 3.0222 3.2062 3.2062 3.6359 3.6359 3.6905 3.6905 4.5976 4.5976 4.6103 4.6103 5.2383 5.2383 5.2785 5.2785 5.2965 5.2965 5.4055 5.4055 5.5352 5.5352 5.5637 5.5637 5.5974 5.5974 6.0751 6.0751 10.7094 10.7094 11.0927 11.0927 11.2050 11.2050 11.2855 11.2855 12.2553 12.2553 12.2854 12.2854 k = 0.0000 0.0000 0.0523 ( 5288 PWs) bands (ev): -13.0268 -13.0268 -12.0745 -12.0745 -11.2557 -11.2557 -11.2471 -11.2471 -10.7631 -10.7631 -10.7314 -10.7314 -10.6663 -10.6663 -10.6573 -10.6573 -1.3066 -1.3066 0.3093 0.3093 0.3563 0.3563 0.7968 0.7968 0.8177 0.8177 1.6097 1.6097 1.9692 1.9692 2.0406 2.0406 2.7498 2.7498 2.9155 2.9155 3.0699 3.0699 3.2108 3.2108 3.6288 3.6288 3.6832 3.6832 4.5983 4.5983 4.6121 4.6121 5.2362 5.2362 5.2751 5.2751 5.2945 5.2945 5.4063 5.4063 5.5197 5.5197 5.5551 5.5551 5.5996 5.5996 6.0707 6.0707 10.7067 10.7067 11.0860 11.0860 11.2047 11.2047 11.2846 11.2846 12.2576 12.2576 12.2900 12.2900 k = 0.0000 0.0000 0.0698 ( 5282 PWs) bands (ev): -13.0225 -13.0225 -12.0763 -12.0763 -11.2545 -11.2545 -11.2459 -11.2459 -10.7652 -10.7652 -10.7336 -10.7336 -10.6685 -10.6685 -10.6596 -10.6596 -1.2953 -1.2953 0.3168 0.3168 0.3656 0.3656 0.7958 0.7958 0.8164 0.8164 1.6235 1.6235 1.9778 1.9778 2.0509 2.0509 2.6994 2.6994 2.8897 2.8897 3.1187 3.1187 3.2155 3.2155 3.6189 3.6189 3.6732 3.6732 4.5988 4.5988 4.6150 4.6150 5.2329 5.2329 5.2697 5.2697 5.2925 5.2925 5.4068 5.4068 5.5018 5.5018 5.5404 5.5404 5.6022 5.6022 6.0647 6.0647 10.7029 10.7029 11.0768 11.0768 11.2044 11.2044 11.2835 11.2835 12.2577 12.2577 12.2993 12.2993 k = 0.0000 0.0000 0.0872 ( 5270 PWs) bands (ev): -13.0171 -13.0171 -12.0787 -12.0787 -11.2528 -11.2528 -11.2443 -11.2443 -10.7679 -10.7679 -10.7363 -10.7363 -10.6713 -10.6713 -10.6624 -10.6624 -1.2809 -1.2809 0.3263 0.3263 0.3775 0.3775 0.7947 0.7947 0.8149 0.8149 1.6408 1.6408 1.9887 1.9887 2.0641 2.0641 2.6485 2.6485 2.8587 2.8587 3.1678 3.1678 3.2196 3.2196 3.6060 3.6060 3.6609 3.6609 4.5985 4.5985 4.6193 4.6193 5.2284 5.2284 5.2626 5.2626 5.2908 5.2908 5.4064 5.4064 5.4820 5.4820 5.5209 5.5209 5.6042 5.6042 6.0569 6.0569 10.6983 10.6983 11.0651 11.0651 11.2040 11.2040 11.2823 11.2823 12.2551 12.2551 12.3130 12.3130 k = 0.0000 0.0000 0.1047 ( 5280 PWs) bands (ev): -13.0105 -13.0105 -12.0816 -12.0816 -11.2509 -11.2509 -11.2424 -11.2424 -10.7713 -10.7713 -10.7394 -10.7394 -10.6748 -10.6748 -10.6657 -10.6657 -1.2633 -1.2633 0.3377 0.3377 0.3920 0.3920 0.7935 0.7935 0.8134 0.8134 1.6615 1.6615 2.0016 2.0016 2.0802 2.0802 2.5973 2.5973 2.8234 2.8234 3.2158 3.2158 3.2233 3.2233 3.5900 3.5900 3.6468 3.6468 4.5975 4.5975 4.6250 4.6250 5.2224 5.2224 5.2539 5.2539 5.2893 5.2893 5.4040 5.4040 5.4614 5.4614 5.4974 5.4974 5.6052 5.6052 6.0475 6.0475 10.6928 10.6928 11.0511 11.0511 11.2037 11.2037 11.2810 11.2810 12.2506 12.2506 12.3297 12.3297 k = 0.0000 0.0000 0.1221 ( 5282 PWs) bands (ev): -13.0027 -13.0027 -12.0851 -12.0851 -11.2486 -11.2486 -11.2402 -11.2402 -10.7754 -10.7754 -10.7429 -10.7429 -10.6789 -10.6789 -10.6696 -10.6696 -1.2426 -1.2426 0.3509 0.3509 0.4091 0.4091 0.7922 0.7922 0.8120 0.8120 1.6852 1.6852 2.0166 2.0166 2.0990 2.0990 2.5460 2.5460 2.7845 2.7845 3.2229 3.2229 3.2656 3.2656 3.5710 3.5710 3.6314 3.6314 4.5954 4.5954 4.6321 4.6321 5.2143 5.2143 5.2441 5.2441 5.2879 5.2879 5.3966 5.3966 5.4424 5.4424 5.4711 5.4711 5.6052 5.6052 6.0365 6.0365 10.6867 10.6867 11.0351 11.0351 11.2035 11.2035 11.2799 11.2799 12.2446 12.2446 12.3480 12.3480 k = 0.0000 0.0000 0.1396 ( 5282 PWs) bands (ev): -12.9937 -12.9937 -12.0891 -12.0891 -11.2459 -11.2459 -11.2377 -11.2377 -10.7801 -10.7801 -10.7467 -10.7467 -10.6836 -10.6836 -10.6739 -10.6739 -1.2189 -1.2189 0.3659 0.3659 0.4287 0.4287 0.7908 0.7908 0.8111 0.8111 1.7118 1.7118 2.0336 2.0336 2.1202 2.1202 2.4947 2.4947 2.7425 2.7425 3.2218 3.2218 3.3135 3.3135 3.5490 3.5490 3.6152 3.6152 4.5922 4.5922 4.6404 4.6404 5.2037 5.2037 5.2333 5.2333 5.2865 5.2865 5.3802 5.3802 5.4265 5.4265 5.4453 5.4453 5.6043 5.6043 6.0240 6.0240 10.6801 10.6801 11.0172 11.0172 11.2036 11.2036 11.2791 11.2791 12.2371 12.2371 12.3657 12.3657 k = 0.0000 0.0000 0.1570 ( 5280 PWs) bands (ev): -12.9837 -12.9837 -12.0939 -12.0939 -11.2430 -11.2430 -11.2348 -11.2348 -10.7855 -10.7855 -10.7508 -10.7508 -10.6890 -10.6890 -10.6787 -10.6787 -1.1922 -1.1922 0.3824 0.3824 0.4508 0.4508 0.7894 0.7894 0.8109 0.8109 1.7408 1.7408 2.0526 2.0526 2.1436 2.1436 2.4435 2.4435 2.6978 2.6978 3.2183 3.2183 3.3607 3.3607 3.5241 3.5241 3.5987 3.5987 4.5875 4.5875 4.6500 4.6500 5.1901 5.1901 5.2215 5.2215 5.2851 5.2851 5.3556 5.3556 5.4028 5.4028 5.4314 5.4314 5.6024 5.6024 6.0100 6.0100 10.6730 10.6730 10.9978 10.9978 11.2041 11.2041 11.2786 11.2786 12.2283 12.2283 12.3782 12.3782 k = 0.0000 0.0000 0.1744 ( 5272 PWs) bands (ev): -12.9725 -12.9725 -12.0992 -12.0992 -11.2397 -11.2397 -11.2317 -11.2317 -10.7914 -10.7914 -10.7550 -10.7550 -10.6949 -10.6949 -10.6839 -10.6839 -1.1626 -1.1626 0.4003 0.4003 0.4753 0.4753 0.7878 0.7878 0.8116 0.8116 1.7719 1.7719 2.0735 2.0735 2.1689 2.1689 2.3925 2.3925 2.6508 2.6508 3.2126 3.2126 3.4063 3.4063 3.4971 3.4971 3.5825 3.5825 4.5811 4.5811 4.6606 4.6606 5.1727 5.1727 5.2087 5.2087 5.2836 5.2836 5.3264 5.3264 5.3720 5.3720 5.4264 5.4264 5.5997 5.5997 5.9946 5.9946 10.6657 10.6657 10.9769 10.9769 11.2050 11.2050 11.2786 11.2786 12.2182 12.2182 12.3780 12.3780 k = 0.0000 0.0000 0.1919 ( 5272 PWs) bands (ev): -12.9602 -12.9602 -12.1053 -12.1053 -11.2361 -11.2361 -11.2283 -11.2283 -10.7979 -10.7979 -10.7594 -10.7594 -10.7014 -10.7014 -10.6895 -10.6895 -1.1302 -1.1302 0.4193 0.4193 0.5023 0.5023 0.7863 0.7863 0.8134 0.8134 1.8047 1.8047 2.0964 2.0964 2.1957 2.1957 2.3417 2.3417 2.6018 2.6018 3.2045 3.2045 3.4439 3.4439 3.4749 3.4749 3.5669 3.5669 4.5725 4.5725 4.6724 4.6724 5.1508 5.1508 5.1946 5.1946 5.2816 5.2816 5.2948 5.2948 5.3408 5.3408 5.4232 5.4232 5.5963 5.5963 5.9779 5.9779 10.6583 10.6583 10.9550 10.9550 11.2066 11.2066 11.2793 11.2793 12.2066 12.2066 12.3638 12.3638 k = 0.0000 0.0000 0.2093 ( 5276 PWs) bands (ev): -12.9468 -12.9468 -12.1121 -12.1121 -11.2323 -11.2323 -11.2246 -11.2246 -10.8049 -10.8049 -10.7639 -10.7639 -10.7084 -10.7084 -10.6955 -10.6955 -1.0951 -1.0951 0.4392 0.4392 0.5316 0.5316 0.7848 0.7848 0.8165 0.8165 1.8389 1.8389 2.1213 2.1213 2.2234 2.2234 2.2915 2.2915 2.5511 2.5511 3.1942 3.1942 3.4286 3.4286 3.5023 3.5023 3.5527 3.5527 4.5611 4.5611 4.6853 4.6853 5.1235 5.1235 5.1792 5.1792 5.2599 5.2599 5.2806 5.2806 5.3122 5.3122 5.4204 5.4204 5.5923 5.5923 5.9600 5.9600 10.6509 10.6509 10.9323 10.9323 11.2088 11.2088 11.2807 11.2807 12.1937 12.1937 12.3421 12.3421 k = 0.0000 0.0000 0.2268 ( 5284 PWs) bands (ev): -12.9325 -12.9325 -12.1196 -12.1196 -11.2282 -11.2282 -11.2207 -11.2207 -10.8121 -10.8121 -10.7685 -10.7685 -10.7159 -10.7159 -10.7017 -10.7017 -1.0573 -1.0573 0.4595 0.4595 0.5632 0.5632 0.7835 0.7835 0.8209 0.8209 1.8738 1.8738 2.1481 2.1481 2.2372 2.2372 2.2564 2.2564 2.4989 2.4989 3.1816 3.1816 3.3962 3.3962 3.5350 3.5350 3.5493 3.5493 4.5465 4.5465 4.6993 4.6993 5.0909 5.0909 5.1627 5.1627 5.2233 5.2233 5.2784 5.2784 5.2879 5.2879 5.4173 5.4173 5.5877 5.5877 5.9410 5.9410 10.6436 10.6436 10.9090 10.9090 11.2119 11.2119 11.2830 11.2830 12.1791 12.1791 12.3171 12.3171 k = 0.0000 0.0000 0.2442 ( 5292 PWs) bands (ev): -12.9171 -12.9171 -12.1279 -12.1279 -11.2238 -11.2238 -11.2166 -11.2166 -10.8196 -10.8196 -10.7733 -10.7733 -10.7238 -10.7238 -10.7083 -10.7083 -1.0170 -1.0170 0.4797 0.4797 0.5971 0.5971 0.7829 0.7829 0.8266 0.8266 1.9091 1.9091 2.1767 2.1767 2.1900 2.1900 2.2832 2.2832 2.4454 2.4454 3.1670 3.1670 3.3619 3.3619 3.5274 3.5274 3.5880 3.5880 4.5279 4.5279 4.7142 4.7142 5.0537 5.0537 5.1445 5.1445 5.1849 5.1849 5.2672 5.2672 5.2768 5.2768 5.4138 5.4138 5.5828 5.5828 5.9209 5.9209 10.6364 10.6364 10.8855 10.8855 11.2160 11.2160 11.2862 11.2862 12.1631 12.1631 12.2904 12.2904 k = 0.0000 0.0000 0.2617 ( 5298 PWs) bands (ev): -12.9007 -12.9007 -12.1371 -12.1371 -11.2192 -11.2192 -11.2122 -11.2122 -10.8272 -10.8272 -10.7781 -10.7781 -10.7321 -10.7321 -10.7152 -10.7152 -0.9743 -0.9743 0.4992 0.4992 0.6331 0.6331 0.7833 0.7833 0.8338 0.8338 1.9439 1.9439 2.1406 2.1406 2.2075 2.2075 2.3126 2.3126 2.3909 2.3909 3.1504 3.1504 3.3272 3.3272 3.5196 3.5196 3.6284 3.6284 4.5046 4.5046 4.7302 4.7302 5.0134 5.0134 5.1220 5.1220 5.1482 5.1482 5.2504 5.2504 5.2744 5.2744 5.4098 5.4098 5.5776 5.5776 5.8999 5.8999 10.6294 10.6294 10.8618 10.8618 11.2211 11.2211 11.2905 11.2905 12.1454 12.1454 12.2626 12.2626 k = 0.0000 0.0000 0.2791 ( 5298 PWs) bands (ev): -12.8835 -12.8835 -12.1471 -12.1471 -11.2145 -11.2145 -11.2077 -11.2077 -10.8349 -10.8349 -10.7829 -10.7829 -10.7407 -10.7407 -10.7223 -10.7223 -0.9292 -0.9292 0.5172 0.5172 0.6711 0.6711 0.7853 0.7853 0.8425 0.8425 1.9773 1.9773 2.0921 2.0921 2.2396 2.2396 2.3353 2.3353 2.3425 2.3425 3.1320 3.1320 3.2929 3.2929 3.5148 3.5148 3.6673 3.6673 4.4760 4.4760 4.7471 4.7471 4.9714 4.9714 5.0882 5.0882 5.1206 5.1206 5.2360 5.2360 5.2720 5.2720 5.4052 5.4052 5.5722 5.5722 5.8781 5.8781 10.6228 10.6228 10.8383 10.8383 11.2275 11.2275 11.2960 11.2960 12.1262 12.1262 12.2340 12.2340 k = 0.0000 0.0000 0.2965 ( 5300 PWs) bands (ev): -12.8653 -12.8653 -12.1579 -12.1579 -11.2095 -11.2095 -11.2031 -11.2031 -10.8424 -10.8424 -10.7879 -10.7879 -10.7495 -10.7495 -10.7296 -10.7296 -0.8820 -0.8820 0.5326 0.5326 0.7111 0.7111 0.7897 0.7897 0.8527 0.8527 2.0059 2.0059 2.0469 2.0469 2.2714 2.2714 2.2810 2.2810 2.3721 2.3721 3.1120 3.1120 3.2601 3.2601 3.5139 3.5139 3.7042 3.7042 4.4417 4.4417 4.7650 4.7650 4.9288 4.9288 5.0465 5.0465 5.0996 5.0996 5.2235 5.2235 5.2694 5.2694 5.4000 5.4000 5.5667 5.5667 5.8556 5.8556 10.6164 10.6164 10.8151 10.8151 11.2351 11.2351 11.3028 11.3028 12.1053 12.1053 12.2048 12.2048 k = 0.0000 0.0000 0.3140 ( 5302 PWs) bands (ev): -12.8463 -12.8463 -12.1697 -12.1697 -11.2045 -11.2045 -11.1983 -11.1983 -10.8497 -10.8497 -10.7928 -10.7928 -10.7586 -10.7586 -10.7371 -10.7371 -0.8328 -0.8328 0.5442 0.5442 0.7529 0.7529 0.7975 0.7975 0.8644 0.8644 1.9897 1.9897 2.0445 2.0445 2.2225 2.2225 2.3075 2.3075 2.4023 2.4023 3.0904 3.0904 3.2298 3.2298 3.5173 3.5173 3.7386 3.7386 4.4012 4.4012 4.7835 4.7835 4.8865 4.8865 5.0025 5.0025 5.0801 5.0801 5.2125 5.2125 5.2666 5.2666 5.3942 5.3942 5.5612 5.5612 5.8326 5.8326 10.6105 10.6105 10.7925 10.7925 11.2440 11.2440 11.3109 11.3109 12.0829 12.0829 12.1750 12.1750 k = 0.0000 0.0000 0.3314 ( 5304 PWs) bands (ev): -12.8265 -12.8265 -12.1824 -12.1824 -11.1993 -11.1993 -11.1934 -11.1934 -10.8567 -10.8567 -10.7977 -10.7977 -10.7677 -10.7677 -10.7447 -10.7447 -0.7816 -0.7816 0.5509 0.5509 0.7960 0.7960 0.8097 0.8097 0.8777 0.8777 1.9443 1.9443 2.0679 2.0679 2.1656 2.1656 2.3414 2.3414 2.4336 2.4336 3.0674 3.0674 3.2031 3.2031 3.5253 3.5253 3.7702 3.7702 4.3546 4.3546 4.8023 4.8023 4.8452 4.8452 4.9584 4.9584 5.0606 5.0606 5.2029 5.2029 5.2636 5.2636 5.3877 5.3877 5.5558 5.5558 5.8093 5.8093 10.6049 10.6049 10.7706 10.7706 11.2545 11.2545 11.3205 11.3205 12.0589 12.0589 12.1445 12.1445 k = 0.0000 0.0000 0.3489 ( 5304 PWs) bands (ev): -12.8060 -12.8060 -12.1960 -12.1960 -11.1940 -11.1940 -11.1885 -11.1885 -10.8633 -10.8633 -10.8026 -10.8026 -10.7770 -10.7770 -10.7523 -10.7523 -0.7287 -0.7287 0.5520 0.5520 0.8250 0.8250 0.8420 0.8420 0.8927 0.8927 1.8980 1.8980 2.0876 2.0876 2.1088 2.1088 2.3738 2.3738 2.4673 2.4673 3.0433 3.0433 3.1813 3.1813 3.5384 3.5384 3.7983 3.7983 4.3022 4.3022 4.8007 4.8007 4.8251 4.8251 4.9155 4.9155 5.0409 5.0409 5.1947 5.1947 5.2604 5.2604 5.3805 5.3805 5.5506 5.5506 5.7857 5.7857 10.5997 10.5997 10.7495 10.7495 11.2664 11.2664 11.3316 11.3316 12.0335 12.0335 12.1135 12.1135 k = 0.0000 0.0000 0.3663 ( 5306 PWs) bands (ev): -12.7847 -12.7847 -12.2105 -12.2105 -11.1888 -11.1888 -11.1836 -11.1836 -10.8694 -10.8694 -10.8074 -10.8074 -10.7863 -10.7863 -10.7600 -10.7600 -0.6742 -0.6742 0.5471 0.5471 0.8462 0.8462 0.8871 0.8871 0.9104 0.9104 1.8522 1.8522 2.0509 2.0509 2.1023 2.1023 2.4033 2.4033 2.5047 2.5047 3.0181 3.0181 3.1657 3.1657 3.5565 3.5565 3.8225 3.8225 4.2445 4.2445 4.7610 4.7610 4.8404 4.8404 4.8778 4.8778 5.0208 5.0208 5.1878 5.1878 5.2570 5.2570 5.3725 5.3725 5.5456 5.5456 5.7621 5.7621 10.5948 10.5948 10.7293 10.7293 11.2798 11.2798 11.3443 11.3443 12.0066 12.0066 12.0820 12.0820 k = 0.0000 0.0000 0.3838 ( 5302 PWs) bands (ev): -12.7629 -12.7629 -12.2260 -12.2260 -11.1835 -11.1835 -11.1787 -11.1787 -10.8750 -10.8750 -10.8120 -10.8120 -10.7955 -10.7955 -10.7677 -10.7677 -0.6183 -0.6183 0.5365 0.5365 0.8714 0.8714 0.9221 0.9221 0.9410 0.9410 1.8074 1.8074 1.9938 1.9938 2.1091 2.1091 2.4294 2.4294 2.5467 2.5467 2.9920 2.9920 3.1573 3.1573 3.5798 3.5798 3.8418 3.8418 4.1822 4.1822 4.7198 4.7198 4.8257 4.8257 4.8745 4.8745 5.0004 5.0004 5.1823 5.1823 5.2533 5.2533 5.3638 5.3638 5.5410 5.5410 5.7386 5.7386 10.5904 10.5904 10.7103 10.7103 11.2949 11.2949 11.3586 11.3586 11.9786 11.9786 12.0500 12.0500 k = 0.0000 0.0000 0.4012 ( 5306 PWs) bands (ev): -12.7404 -12.7404 -12.2424 -12.2424 -11.1784 -11.1784 -11.1739 -11.1739 -10.8799 -10.8799 -10.8164 -10.8164 -10.8047 -10.8047 -10.7753 -10.7753 -0.5612 -0.5612 0.5206 0.5206 0.9001 0.9001 0.9434 0.9434 0.9877 0.9877 1.7638 1.7638 1.9369 1.9369 2.1080 2.1080 2.4523 2.4523 2.5931 2.5931 2.9653 2.9653 3.1571 3.1571 3.6080 3.6080 3.8555 3.8555 4.1160 4.1160 4.6778 4.6778 4.7918 4.7918 4.8946 4.8946 4.9796 4.9796 5.1781 5.1781 5.2494 5.2494 5.3541 5.3541 5.5368 5.5368 5.7156 5.7156 10.5864 10.5864 10.6923 10.6923 11.3115 11.3115 11.3746 11.3746 11.9494 11.9494 12.0175 12.0175 k = 0.0000 0.0000 0.4187 ( 5310 PWs) bands (ev): -12.7174 -12.7174 -12.2598 -12.2598 -11.1734 -11.1734 -11.1692 -11.1692 -10.8842 -10.8842 -10.8206 -10.8206 -10.8137 -10.8137 -10.7827 -10.7827 -0.5030 -0.5030 0.4997 0.4997 0.9318 0.9318 0.9645 0.9645 1.0367 1.0367 1.7217 1.7217 1.8802 1.8802 2.0986 2.0986 2.4727 2.4727 2.6435 2.6435 2.9380 2.9380 3.1653 3.1653 3.6408 3.6408 3.8628 3.8628 4.0467 4.0467 4.6347 4.6347 4.7604 4.7604 4.9172 4.9172 4.9586 4.9586 5.1752 5.1752 5.2453 5.2453 5.3434 5.3434 5.5331 5.5331 5.6931 5.6931 10.5828 10.5828 10.6756 10.6756 11.3298 11.3298 11.3921 11.3921 11.9191 11.9191 11.9846 11.9846 k = 0.0000 0.0000 0.4361 ( 5310 PWs) bands (ev): -12.6940 -12.6940 -12.2780 -12.2780 -11.1685 -11.1685 -11.1647 -11.1647 -10.8877 -10.8877 -10.8245 -10.8245 -10.8225 -10.8225 -10.7900 -10.7900 -0.4440 -0.4440 0.4742 0.4742 0.9660 0.9660 0.9867 0.9867 1.0861 1.0861 1.6816 1.6816 1.8239 1.8239 2.0809 2.0809 2.4915 2.4915 2.6974 2.6974 2.9103 2.9103 3.1820 3.1820 3.6778 3.6778 3.8630 3.8630 3.9749 3.9749 4.5903 4.5903 4.7338 4.7338 4.9350 4.9350 4.9431 4.9431 5.1736 5.1736 5.2410 5.2410 5.3316 5.3316 5.5300 5.5300 5.6714 5.6714 10.5797 10.5797 10.6602 10.6602 11.3496 11.3496 11.4113 11.4113 11.8880 11.8880 11.9513 11.9513 k = 0.0000 0.0000 0.4535 ( 5304 PWs) bands (ev): -12.6702 -12.6702 -12.2971 -12.2971 -11.1639 -11.1639 -11.1605 -11.1605 -10.8904 -10.8904 -10.8311 -10.8311 -10.8279 -10.8279 -10.7969 -10.7969 -0.3844 -0.3844 0.4445 0.4445 1.0023 1.0023 1.0102 1.0102 1.1347 1.1347 1.6442 1.6442 1.7681 1.7681 2.0555 2.0555 2.5095 2.5095 2.7544 2.7544 2.8824 2.8824 3.2065 3.2065 3.7186 3.7186 3.8551 3.8551 3.9016 3.9016 4.5443 4.5443 4.7132 4.7132 4.9149 4.9149 4.9659 4.9659 5.1731 5.1731 5.2365 5.2365 5.3186 5.3186 5.5275 5.5275 5.6508 5.6508 10.5770 10.5770 10.6460 10.6460 11.3710 11.3710 11.4321 11.4321 11.8562 11.8562 11.9178 11.9178 k = 0.0000 0.0000 0.4710 ( 5308 PWs) bands (ev): -12.6460 -12.6460 -12.3170 -12.3170 -11.1596 -11.1596 -11.1566 -11.1566 -10.8924 -10.8924 -10.8393 -10.8393 -10.8310 -10.8310 -10.8036 -10.8036 -0.3243 -0.3243 0.4108 0.4108 1.0348 1.0348 1.0406 1.0406 1.1813 1.1813 1.6108 1.6108 1.7129 1.7129 2.0233 2.0233 2.5272 2.5272 2.8142 2.8142 2.8544 2.8544 3.2379 3.2379 3.7626 3.7626 3.8234 3.8234 3.8432 3.8432 4.4967 4.4967 4.6991 4.6991 4.8930 4.8930 4.9907 4.9907 5.1737 5.1737 5.2318 5.2318 5.3044 5.3044 5.5258 5.5258 5.6315 5.6315 10.5749 10.5749 10.6332 10.6332 11.3939 11.3939 11.4544 11.4544 11.8239 11.8239 11.8842 11.8842 k = 0.0000 0.0000 0.4884 ( 5304 PWs) bands (ev): -12.6216 -12.6216 -12.3376 -12.3376 -11.1557 -11.1557 -11.1530 -11.1530 -10.8935 -10.8935 -10.8471 -10.8471 -10.8335 -10.8335 -10.8098 -10.8098 -0.2641 -0.2641 0.3735 0.3735 1.0607 1.0607 1.0804 1.0804 1.2234 1.2234 1.5835 1.5835 1.6586 1.6586 1.9854 1.9854 2.5450 2.5450 2.8265 2.8265 2.8765 2.8765 3.2753 3.2753 3.7489 3.7489 3.8054 3.8054 3.8228 3.8228 4.4475 4.4475 4.6913 4.6913 4.8710 4.8710 5.0159 5.0159 5.1752 5.1752 5.2270 5.2270 5.2887 5.2887 5.5250 5.5250 5.6136 5.6136 10.5733 10.5733 10.6217 10.6217 11.4182 11.4182 11.4781 11.4781 11.7913 11.7913 11.8505 11.8505 k = 0.0000 0.0000 0.5059 ( 5296 PWs) bands (ev): -12.5971 -12.5971 -12.3590 -12.3590 -11.1522 -11.1522 -11.1500 -11.1500 -10.8938 -10.8938 -10.8545 -10.8545 -10.8354 -10.8354 -10.8155 -10.8155 -0.2040 -0.2040 0.3326 0.3326 1.0877 1.0877 1.1219 1.1219 1.2573 1.2573 1.5656 1.5656 1.6055 1.6055 1.9428 1.9428 2.5634 2.5634 2.7989 2.7989 2.9411 2.9411 3.3175 3.3175 3.6725 3.6725 3.7865 3.7865 3.8609 3.8609 4.3968 4.3968 4.6896 4.6896 4.8489 4.8489 5.0412 5.0412 5.1775 5.1775 5.2220 5.2220 5.2716 5.2716 5.5250 5.5250 5.5974 5.5974 10.5723 10.5723 10.6115 10.6115 11.4439 11.4439 11.5031 11.5031 11.7585 11.7585 11.8168 11.8168 k = 0.0000 0.0000 0.5233 ( 5296 PWs) bands (ev): -12.5724 -12.5724 -12.3810 -12.3810 -11.1492 -11.1492 -11.1474 -11.1474 -10.8932 -10.8932 -10.8614 -10.8614 -10.8368 -10.8368 -10.8207 -10.8207 -0.1442 -0.1442 0.2886 0.2886 1.1155 1.1155 1.1647 1.1647 1.2781 1.2781 1.5480 1.5480 1.5674 1.5674 1.8966 1.8966 2.5826 2.5826 2.7716 2.7716 3.0079 3.0079 3.3633 3.3633 3.5958 3.5958 3.7506 3.7506 3.9119 3.9119 4.3448 4.3448 4.6932 4.6932 4.8270 4.8270 5.0667 5.0667 5.1805 5.1805 5.2170 5.2170 5.2532 5.2532 5.5260 5.5260 5.5829 5.5829 10.5720 10.5720 10.6026 10.6026 11.4708 11.4708 11.5292 11.5292 11.7260 11.7260 11.7834 11.7834 k = 0.0000 0.0000 0.5408 ( 5300 PWs) bands (ev): -12.5477 -12.5477 -12.4036 -12.4036 -11.1468 -11.1468 -11.1454 -11.1454 -10.8919 -10.8919 -10.8677 -10.8677 -10.8374 -10.8374 -10.8252 -10.8252 -0.0850 -0.0850 0.2417 0.2417 1.1439 1.1439 1.2089 1.2089 1.2827 1.2827 1.4985 1.4985 1.5798 1.5798 1.8479 1.8479 2.6027 2.6027 2.7449 2.7449 3.0766 3.0766 3.4118 3.4118 3.5193 3.5193 3.7093 3.7093 3.9646 3.9646 4.2917 4.2917 4.7014 4.7014 4.8054 4.8054 5.0920 5.0920 5.1840 5.1840 5.2118 5.2118 5.2334 5.2334 5.5282 5.5282 5.5701 5.5701 10.5725 10.5725 10.5950 10.5950 11.4988 11.4988 11.5559 11.5559 11.6941 11.6941 11.7504 11.7504 k = 0.0000 0.0000 0.5582 ( 5298 PWs) bands (ev): -12.5231 -12.5231 -12.4268 -12.4268 -11.1449 -11.1449 -11.1440 -11.1440 -10.8897 -10.8897 -10.8735 -10.8735 -10.8372 -10.8372 -10.8291 -10.8291 -0.0266 -0.0266 0.1921 0.1921 1.1727 1.1727 1.2543 1.2543 1.2729 1.2729 1.4477 1.4477 1.6099 1.6099 1.7976 1.7976 2.6239 2.6239 2.7189 2.7189 3.1470 3.1470 3.4412 3.4412 3.4641 3.4641 3.6639 3.6639 4.0186 4.0186 4.2377 4.2377 4.7134 4.7134 4.7844 4.7844 5.1171 5.1171 5.1879 5.1879 5.2059 5.2059 5.2133 5.2133 5.5315 5.5315 5.5591 5.5591 10.5738 10.5738 10.5885 10.5885 11.5275 11.5275 11.5818 11.5818 11.6645 11.6645 11.7181 11.7181 k = 0.0000 0.0000 0.5757 ( 5290 PWs) bands (ev): -12.4986 -12.4986 -12.4504 -12.4504 -11.1437 -11.1437 -11.1432 -11.1432 -10.8867 -10.8867 -10.8786 -10.8786 -10.8364 -10.8364 -10.8323 -10.8323 0.0305 0.0305 0.1402 0.1402 1.2012 1.2012 1.2533 1.2533 1.3011 1.3011 1.3978 1.3978 1.6506 1.6506 1.7470 1.7470 2.6461 2.6461 2.6937 2.6937 3.2191 3.2191 3.3670 3.3670 3.5141 3.5141 3.6155 3.6155 4.0732 4.0732 4.1831 4.1831 4.7283 4.7283 4.7643 4.7643 5.1417 5.1417 5.1874 5.1874 5.1940 5.1940 5.2028 5.2028 5.5362 5.5362 5.5499 5.5499 10.5759 10.5759 10.5833 10.5833 11.5565 11.5565 11.5979 11.5979 11.6460 11.6460 11.6871 11.6871 k = 0.0000 0.0000 0.5931 ( 5288 PWs) bands (ev): -12.4744 -12.4744 -12.4743 -12.4743 -11.1431 -11.1431 -11.1431 -11.1431 -10.8830 -10.8830 -10.8830 -10.8830 -10.8347 -10.8347 -10.8347 -10.8347 0.0862 0.0862 0.0863 0.0863 1.2286 1.2286 1.2286 1.2286 1.3489 1.3489 1.3489 1.3489 1.6973 1.6973 1.6973 1.6973 2.6694 2.6694 2.6694 2.6694 3.2925 3.2925 3.2925 3.2925 3.5652 3.5652 3.5653 3.5653 4.1282 4.1282 4.1282 4.1282 4.7454 4.7454 4.7454 4.7454 5.1656 5.1656 5.1657 5.1657 5.1976 5.1976 5.1977 5.1977 5.5422 5.5422 5.5422 5.5422 10.5791 10.5791 10.5791 10.5791 11.5838 11.5838 11.5838 11.5838 11.6592 11.6592 11.6592 11.6592 k = 0.0000 0.0000 0.5931 ( 5288 PWs) bands (ev): -12.4744 -12.4744 -12.4743 -12.4743 -11.1431 -11.1431 -11.1431 -11.1431 -10.8830 -10.8830 -10.8830 -10.8830 -10.8347 -10.8347 -10.8347 -10.8347 0.0862 0.0862 0.0863 0.0863 1.2286 1.2286 1.2286 1.2286 1.3489 1.3489 1.3489 1.3489 1.6973 1.6973 1.6973 1.6973 2.6694 2.6694 2.6694 2.6694 3.2925 3.2925 3.2925 3.2925 3.5652 3.5652 3.5653 3.5653 4.1282 4.1282 4.1282 4.1282 4.7454 4.7454 4.7454 4.7454 5.1656 5.1656 5.1657 5.1657 5.1976 5.1976 5.1977 5.1977 5.5422 5.5422 5.5422 5.5422 10.5791 10.5791 10.5791 10.5791 11.5838 11.5838 11.5838 11.5838 11.6592 11.6592 11.6592 11.6592 k =-0.0147 0.0094 0.5931 ( 5290 PWs) bands (ev): -12.4745 -12.4745 -12.4744 -12.4744 -11.1439 -11.1439 -11.1437 -11.1437 -10.8837 -10.8837 -10.8833 -10.8833 -10.8334 -10.8334 -10.8333 -10.8333 0.0834 0.0834 0.0840 0.0840 1.2205 1.2205 1.2211 1.2211 1.3578 1.3578 1.3599 1.3599 1.6980 1.6980 1.6986 1.6986 2.6699 2.6699 2.6701 2.6701 3.2828 3.2828 3.2864 3.2864 3.5709 3.5709 3.5746 3.5746 4.1290 4.1290 4.1316 4.1316 4.7444 4.7444 4.7459 4.7459 5.1638 5.1638 5.1650 5.1650 5.1944 5.1944 5.1971 5.1971 5.5414 5.5414 5.5429 5.5429 10.5800 10.5800 10.5811 10.5811 11.5791 11.5792 11.5876 11.5876 11.6554 11.6554 11.6657 11.6657 k =-0.0294 0.0188 0.5931 ( 5294 PWs) bands (ev): -12.4748 -12.4748 -12.4745 -12.4745 -11.1459 -11.1459 -11.1456 -11.1456 -10.8851 -10.8851 -10.8844 -10.8844 -10.8296 -10.8296 -10.8293 -10.8293 0.0756 0.0756 0.0766 0.0766 1.2023 1.2023 1.2029 1.2029 1.3818 1.3818 1.3853 1.3853 1.7006 1.7006 1.7018 1.7018 2.6716 2.6716 2.6720 2.6720 3.2603 3.2603 3.2663 3.2663 3.5898 3.5898 3.5962 3.5962 4.1339 4.1339 4.1392 4.1392 4.7428 4.7428 4.7458 4.7458 5.1594 5.1594 5.1615 5.1615 5.1879 5.1879 5.1932 5.1932 5.5405 5.5405 5.5434 5.5434 10.5839 10.5839 10.5861 10.5861 11.5743 11.5743 11.5901 11.5901 11.6548 11.6548 11.6741 11.6741 k =-0.0441 0.0281 0.5931 ( 5314 PWs) bands (ev): -12.4753 -12.4753 -12.4748 -12.4748 -11.1492 -11.1492 -11.1487 -11.1487 -10.8868 -10.8868 -10.8859 -10.8859 -10.8238 -10.8238 -10.8233 -10.8233 0.0629 0.0629 0.0645 0.0645 1.1807 1.1807 1.1809 1.1809 1.4137 1.4137 1.4182 1.4182 1.7051 1.7051 1.7068 1.7068 2.6744 2.6744 2.6750 2.6750 3.2295 3.2295 3.2369 3.2369 3.6172 3.6172 3.6252 3.6252 4.1430 4.1430 4.1510 4.1510 4.7406 4.7406 4.7453 4.7453 5.1516 5.1516 5.1541 5.1541 5.1797 5.1797 5.1867 5.1867 5.5392 5.5392 5.5435 5.5435 10.5908 10.5908 10.5940 10.5940 11.5697 11.5697 11.5909 11.5909 11.6576 11.6576 11.6840 11.6840 k =-0.0588 0.0375 0.5931 ( 5312 PWs) bands (ev): -12.4758 -12.4758 -12.4752 -12.4752 -11.1537 -11.1537 -11.1531 -11.1531 -10.8885 -10.8885 -10.8875 -10.8875 -10.8163 -10.8163 -10.8156 -10.8156 0.0458 0.0458 0.0478 0.0478 1.1585 1.1585 1.1589 1.1589 1.4498 1.4498 1.4549 1.4549 1.7116 1.7116 1.7136 1.7136 2.6784 2.6784 2.6792 2.6792 3.1945 3.1945 3.2024 3.2024 3.6492 3.6492 3.6580 3.6580 4.1560 4.1560 4.1668 4.1668 4.7380 4.7380 4.7443 4.7443 5.1393 5.1393 5.1409 5.1409 5.1719 5.1719 5.1792 5.1792 5.5375 5.5375 5.5428 5.5428 10.6005 10.6005 10.6048 10.6048 11.5656 11.5656 11.5903 11.5903 11.6636 11.6636 11.6952 11.6952 k =-0.0735 0.0469 0.5931 ( 5316 PWs) bands (ev): -12.4765 -12.4765 -12.4757 -12.4757 -11.1591 -11.1591 -11.1584 -11.1584 -10.8900 -10.8900 -10.8889 -10.8889 -10.8077 -10.8077 -10.8067 -10.8067 0.0246 0.0246 0.0270 0.0270 1.1370 1.1370 1.1380 1.1380 1.4880 1.4880 1.4936 1.4936 1.7202 1.7202 1.7223 1.7223 2.6835 2.6835 2.6844 2.6844 3.1575 3.1575 3.1655 3.1655 3.6831 3.6831 3.6923 3.6923 4.1727 4.1727 4.1863 4.1863 4.7350 4.7350 4.7431 4.7431 5.1222 5.1222 5.1223 5.1223 5.1648 5.1648 5.1713 5.1713 5.5349 5.5349 5.5411 5.5411 10.6130 10.6130 10.6183 10.6183 11.5622 11.5622 11.5889 11.5889 11.6720 11.6720 11.7073 11.7073 k =-0.0882 0.0563 0.5931 ( 5304 PWs) bands (ev): -12.4774 -12.4774 -12.4764 -12.4764 -11.1654 -11.1654 -11.1646 -11.1646 -10.8912 -10.8912 -10.8900 -10.8900 -10.7981 -10.7981 -10.7968 -10.7968 -0.0003 -0.0003 0.0026 0.0026 1.1171 1.1171 1.1186 1.1186 1.5270 1.5270 1.5327 1.5327 1.7312 1.7312 1.7330 1.7330 2.6896 2.6896 2.6906 2.6906 3.1203 3.1203 3.1281 3.1281 3.7175 3.7175 3.7267 3.7267 4.1928 4.1928 4.2094 4.2094 4.7318 4.7318 4.7417 4.7417 5.0991 5.0991 5.1008 5.1008 5.1577 5.1577 5.1634 5.1634 5.5313 5.5313 5.5382 5.5382 10.6281 10.6281 10.6345 10.6345 11.5596 11.5596 11.5874 11.5874 11.6821 11.6821 11.7201 11.7201 k =-0.1029 0.0657 0.5931 ( 5308 PWs) bands (ev): -12.4783 -12.4783 -12.4772 -12.4772 -11.1724 -11.1724 -11.1716 -11.1716 -10.8919 -10.8919 -10.8907 -10.8907 -10.7878 -10.7878 -10.7863 -10.7863 -0.0283 -0.0283 -0.0250 -0.0250 1.0989 1.0989 1.1009 1.1009 1.5654 1.5654 1.5707 1.5707 1.7453 1.7453 1.7462 1.7462 2.6968 2.6968 2.6978 2.6978 3.0840 3.0840 3.0912 3.0912 3.7514 3.7514 3.7607 3.7607 4.2158 4.2158 4.2353 4.2353 4.7286 4.7286 4.7405 4.7405 5.0727 5.0727 5.0756 5.0756 5.1501 5.1501 5.1551 5.1551 5.5263 5.5263 5.5337 5.5337 10.6457 10.6457 10.6531 10.6531 11.5577 11.5577 11.5861 11.5861 11.6934 11.6934 11.7335 11.7335 k =-0.1176 0.0751 0.5931 ( 5310 PWs) bands (ev): -12.4794 -12.4794 -12.4782 -12.4782 -11.1800 -11.1800 -11.1792 -11.1792 -10.8922 -10.8922 -10.8911 -10.8911 -10.7769 -10.7769 -10.7751 -10.7751 -0.0588 -0.0588 -0.0552 -0.0552 1.0825 1.0825 1.0850 1.0850 1.6013 1.6013 1.6054 1.6054 1.7629 1.7629 1.7637 1.7637 2.7048 2.7048 2.7057 2.7057 3.0495 3.0495 3.0559 3.0559 3.7846 3.7846 3.7938 3.7938 4.2409 4.2409 4.2635 4.2635 4.7257 4.7257 4.7397 4.7397 5.0435 5.0435 5.0473 5.0473 5.1418 5.1418 5.1463 5.1463 5.5198 5.5198 5.5276 5.5276 10.6657 10.6657 10.6740 10.6740 11.5567 11.5567 11.5853 11.5853 11.7055 11.7055 11.7473 11.7473 k =-0.1324 0.0844 0.5931 ( 5310 PWs) bands (ev): -12.4805 -12.4805 -12.4792 -12.4792 -11.1880 -11.1880 -11.1873 -11.1873 -10.8921 -10.8921 -10.8910 -10.8910 -10.7656 -10.7656 -10.7636 -10.7636 -0.0915 -0.0915 -0.0875 -0.0875 1.0679 1.0679 1.0708 1.0708 1.6324 1.6324 1.6346 1.6346 1.7848 1.7848 1.7880 1.7880 2.7136 2.7136 2.7142 2.7142 3.0175 3.0175 3.0230 3.0230 3.8167 3.8167 3.8260 3.8260 4.2674 4.2674 4.2929 4.2929 4.7236 4.7236 4.7398 4.7398 5.0123 5.0123 5.0167 5.0167 5.1328 5.1328 5.1368 5.1368 5.5117 5.5117 5.5197 5.5197 10.6878 10.6878 10.6970 10.6970 11.5566 11.5566 11.5851 11.5851 11.7181 11.7181 11.7613 11.7613 k =-0.1471 0.0938 0.5931 ( 5306 PWs) bands (ev): -12.4817 -12.4817 -12.4803 -12.4803 -11.1964 -11.1964 -11.1957 -11.1957 -10.8917 -10.8917 -10.8907 -10.8907 -10.7540 -10.7540 -10.7518 -10.7518 -0.1257 -0.1257 -0.1215 -0.1215 1.0552 1.0552 1.0584 1.0584 1.6566 1.6566 1.6567 1.6567 1.8130 1.8130 1.8190 1.8190 2.7228 2.7228 2.7230 2.7230 2.9887 2.9887 2.9931 2.9931 3.8479 3.8479 3.8573 3.8573 4.2942 4.2942 4.3226 4.3226 4.7228 4.7228 4.7412 4.7412 4.9794 4.9794 4.9841 4.9841 5.1229 5.1229 5.1266 5.1266 5.5019 5.5019 5.5100 5.5100 10.7119 10.7119 10.7220 10.7220 11.5572 11.5572 11.5855 11.5855 11.7310 11.7310 11.7753 11.7753 k =-0.1618 0.1032 0.5931 ( 5292 PWs) bands (ev): -12.4831 -12.4831 -12.4816 -12.4816 -11.2050 -11.2050 -11.2044 -11.2044 -10.8910 -10.8910 -10.8900 -10.8900 -10.7422 -10.7422 -10.7398 -10.7398 -0.1611 -0.1611 -0.1567 -0.1567 1.0442 1.0442 1.0478 1.0478 1.6716 1.6716 1.6734 1.6734 1.8476 1.8476 1.8560 1.8560 2.7317 2.7317 2.7322 2.7322 2.9640 2.9640 2.9669 2.9669 3.8783 3.8783 3.8878 3.8878 4.3202 4.3202 4.3513 4.3513 4.7240 4.7240 4.7446 4.7446 4.9453 4.9453 4.9501 4.9501 5.1123 5.1123 5.1158 5.1158 5.4904 5.4904 5.4986 5.4986 10.7377 10.7377 10.7486 10.7486 11.5587 11.5587 11.5867 11.5867 11.7439 11.7439 11.7892 11.7892 k =-0.1765 0.1126 0.5931 ( 5296 PWs) bands (ev): -12.4844 -12.4844 -12.4829 -12.4829 -11.2137 -11.2137 -11.2132 -11.2132 -10.8900 -10.8900 -10.8891 -10.8891 -10.7303 -10.7303 -10.7278 -10.7278 -0.1973 -0.1973 -0.1927 -0.1927 1.0350 1.0350 1.0388 1.0388 1.6804 1.6804 1.6834 1.6834 1.8870 1.8870 1.8973 1.8973 2.7399 2.7399 2.7414 2.7414 2.9441 2.9441 2.9453 2.9453 3.9079 3.9079 3.9177 3.9177 4.3442 4.3442 4.3774 4.3774 4.7282 4.7282 4.7505 4.7505 4.9104 4.9104 4.9151 4.9151 5.1009 5.1009 5.1042 5.1042 5.4772 5.4772 5.4853 5.4853 10.7650 10.7650 10.7767 10.7767 11.5608 11.5608 11.5885 11.5885 11.7567 11.7567 11.8027 11.8027 k =-0.1912 0.1220 0.5931 ( 5288 PWs) bands (ev): -12.4859 -12.4859 -12.4842 -12.4842 -11.2224 -11.2224 -11.2220 -11.2220 -10.8887 -10.8887 -10.8879 -10.8879 -10.7184 -10.7184 -10.7158 -10.7158 -0.2338 -0.2338 -0.2291 -0.2291 1.0275 1.0275 1.0316 1.0316 1.6842 1.6842 1.6879 1.6879 1.9296 1.9296 1.9412 1.9412 2.7472 2.7472 2.7498 2.7498 2.9290 2.9290 2.9297 2.9297 3.9368 3.9368 3.9471 3.9471 4.3649 4.3649 4.3994 4.3994 4.7364 4.7364 4.7596 4.7596 4.8751 4.8751 4.8795 4.8795 5.0888 5.0888 5.0919 5.0919 5.4624 5.4624 5.4705 5.4705 10.7937 10.7937 10.8059 10.8059 11.5636 11.5636 11.5910 11.5910 11.7691 11.7691 11.8157 11.8157 k =-0.2059 0.1314 0.5931 ( 5278 PWs) bands (ev): -12.4874 -12.4874 -12.4857 -12.4857 -11.2311 -11.2311 -11.2307 -11.2307 -10.8873 -10.8873 -10.8865 -10.8865 -10.7066 -10.7066 -10.7038 -10.7038 -0.2704 -0.2704 -0.2656 -0.2656 1.0218 1.0218 1.0261 1.0261 1.6838 1.6838 1.6879 1.6879 1.9737 1.9737 1.9862 1.9862 2.7531 2.7531 2.7570 2.7570 2.9186 2.9186 2.9212 2.9212 3.9653 3.9653 3.9760 3.9760 4.3815 4.3815 4.4162 4.4162 4.7492 4.7492 4.7722 4.7722 4.8400 4.8400 4.8438 4.8438 5.0761 5.0761 5.0790 5.0790 5.4462 5.4462 5.4542 5.4542 10.8233 10.8233 10.8362 10.8362 11.5669 11.5669 11.5940 11.5940 11.7809 11.7809 11.8279 11.8279 k =-0.2206 0.1407 0.5931 ( 5282 PWs) bands (ev): -12.4889 -12.4889 -12.4871 -12.4871 -11.2396 -11.2396 -11.2394 -11.2394 -10.8857 -10.8857 -10.8850 -10.8850 -10.6949 -10.6949 -10.6921 -10.6921 -0.3067 -0.3067 -0.3018 -0.3018 1.0177 1.0177 1.0222 1.0222 1.6797 1.6797 1.6839 1.6839 2.0184 2.0184 2.0314 2.0314 2.7577 2.7577 2.7629 2.7629 2.9144 2.9144 2.9188 2.9188 3.9932 3.9932 4.0046 4.0046 4.3932 4.3932 4.4270 4.4270 4.7669 4.7669 4.7858 4.7858 4.8082 4.8082 4.8083 4.8083 5.0627 5.0627 5.0655 5.0655 5.4288 5.4288 5.4366 5.4366 10.8538 10.8538 10.8671 10.8671 11.5708 11.5708 11.5975 11.5975 11.7919 11.7919 11.8392 11.8392 k =-0.2353 0.1501 0.5931 ( 5278 PWs) bands (ev): -12.4904 -12.4904 -12.4886 -12.4886 -11.2480 -11.2480 -11.2479 -11.2479 -10.8840 -10.8840 -10.8834 -10.8834 -10.6834 -10.6834 -10.6805 -10.6805 -0.3425 -0.3425 -0.3375 -0.3375 1.0153 1.0153 1.0199 1.0199 1.6722 1.6722 1.6764 1.6764 2.0627 2.0627 2.0761 2.0761 2.7616 2.7616 2.7677 2.7677 2.9161 2.9161 2.9220 2.9220 4.0207 4.0207 4.0328 4.0328 4.4000 4.4000 4.4318 4.4318 4.7669 4.7669 4.7722 4.7722 4.7904 4.7904 4.8131 4.8131 5.0488 5.0488 5.0514 5.0514 5.4104 5.4104 5.4181 5.4181 10.8847 10.8847 10.8985 10.8985 11.5750 11.5750 11.6014 11.6014 11.8019 11.8019 11.8492 11.8492 k =-0.2500 0.1595 0.5931 ( 5286 PWs) bands (ev): -12.4919 -12.4919 -12.4902 -12.4902 -11.2562 -11.2562 -11.2561 -11.2561 -10.8822 -10.8822 -10.8817 -10.8817 -10.6721 -10.6721 -10.6693 -10.6693 -0.3774 -0.3774 -0.3725 -0.3725 1.0145 1.0145 1.0193 1.0193 1.6617 1.6617 1.6657 1.6657 2.1061 2.1061 2.1196 2.1196 2.7656 2.7656 2.7723 2.7723 2.9228 2.9228 2.9296 2.9296 4.0475 4.0475 4.0605 4.0605 4.4020 4.4020 4.4311 4.4311 4.7343 4.7343 4.7386 4.7386 4.8158 4.8158 4.8356 4.8356 5.0346 5.0346 5.0367 5.0367 5.3914 5.3914 5.3988 5.3988 10.9160 10.9160 10.9300 10.9300 11.5796 11.5796 11.6056 11.6056 11.8107 11.8107 11.8577 11.8577 k =-0.2647 0.1689 0.5931 ( 5278 PWs) bands (ev): -12.4934 -12.4934 -12.4917 -12.4917 -11.2641 -11.2641 -11.2640 -11.2640 -10.8803 -10.8803 -10.8799 -10.8799 -10.6612 -10.6612 -10.6584 -10.6584 -0.4113 -0.4113 -0.4065 -0.4065 1.0154 1.0154 1.0202 1.0202 1.6483 1.6483 1.6522 1.6522 2.1479 2.1479 2.1613 2.1613 2.7708 2.7708 2.7777 2.7777 2.9334 2.9334 2.9407 2.9407 4.0736 4.0736 4.0876 4.0876 4.3999 4.3999 4.4258 4.4258 4.7023 4.7023 4.7059 4.7059 4.8440 4.8440 4.8606 4.8606 5.0201 5.0201 5.0217 5.0217 5.3721 5.3721 5.3793 5.3793 10.9473 10.9473 10.9614 10.9614 11.5844 11.5844 11.6101 11.6101 11.8181 11.8181 11.8646 11.8646 k =-0.2794 0.1783 0.5931 ( 5286 PWs) bands (ev): -12.4949 -12.4949 -12.4932 -12.4932 -11.2717 -11.2717 -11.2716 -11.2716 -10.8784 -10.8784 -10.8781 -10.8781 -10.6507 -10.6507 -10.6479 -10.6479 -0.4441 -0.4441 -0.4393 -0.4393 1.0178 1.0178 1.0227 1.0227 1.6324 1.6324 1.6361 1.6361 2.1878 2.1878 2.2008 2.2008 2.7778 2.7778 2.7849 2.7849 2.9468 2.9468 2.9543 2.9543 4.0987 4.0987 4.1138 4.1138 4.3943 4.3943 4.4169 4.4169 4.6720 4.6720 4.6748 4.6748 4.8730 4.8730 4.8861 4.8861 5.0059 5.0059 5.0064 5.0064 5.3529 5.3529 5.3598 5.3598 10.9783 10.9783 10.9925 10.9925 11.5894 11.5894 11.6147 11.6147 11.8240 11.8240 11.8697 11.8697 k =-0.2941 0.1877 0.5931 ( 5286 PWs) bands (ev): -12.4964 -12.4964 -12.4947 -12.4947 -11.2789 -11.2789 -11.2789 -11.2789 -10.8765 -10.8765 -10.8762 -10.8762 -10.6406 -10.6406 -10.6379 -10.6379 -0.4754 -0.4754 -0.4707 -0.4707 1.0218 1.0218 1.0267 1.0267 1.6143 1.6143 1.6178 1.6178 2.2251 2.2251 2.2377 2.2377 2.7873 2.7873 2.7944 2.7944 2.9620 2.9620 2.9694 2.9694 4.1224 4.1224 4.1388 4.1388 4.3860 4.3860 4.4052 4.4052 4.6439 4.6439 4.6459 4.6459 4.9007 4.9007 4.9095 4.9095 4.9917 4.9917 4.9934 4.9934 5.3342 5.3342 5.3408 5.3408 11.0089 11.0089 11.0230 11.0230 11.5944 11.5944 11.6193 11.6193 11.8282 11.8282 11.8728 11.8728 k =-0.3088 0.1970 0.5931 ( 5290 PWs) bands (ev): -12.4978 -12.4978 -12.4962 -12.4962 -11.2858 -11.2858 -11.2857 -11.2857 -10.8747 -10.8747 -10.8744 -10.8744 -10.6310 -10.6310 -10.6283 -10.6283 -0.5051 -0.5051 -0.5007 -0.5007 1.0273 1.0273 1.0322 1.0322 1.5942 1.5942 1.5976 1.5976 2.2597 2.2597 2.2716 2.2716 2.7994 2.7994 2.8066 2.8066 2.9784 2.9784 2.9856 2.9856 4.1443 4.1443 4.1621 4.1621 4.3758 4.3758 4.3918 4.3918 4.6185 4.6185 4.6196 4.6196 4.9234 4.9234 4.9254 4.9254 4.9804 4.9804 4.9871 4.9871 5.3168 5.3168 5.3230 5.3230 11.0387 11.0387 11.0526 11.0526 11.5994 11.5994 11.6239 11.6239 11.8307 11.8307 11.8738 11.8738 k =-0.3235 0.2064 0.5931 ( 5280 PWs) bands (ev): -12.4991 -12.4991 -12.4976 -12.4976 -11.2923 -11.2923 -11.2921 -11.2921 -10.8728 -10.8728 -10.8726 -10.8726 -10.6219 -10.6219 -10.6193 -10.6193 -0.5332 -0.5332 -0.5289 -0.5289 1.0343 1.0343 1.0392 1.0392 1.5726 1.5726 1.5758 1.5758 2.2911 2.2911 2.3023 2.3023 2.8143 2.8143 2.8214 2.8214 2.9953 2.9953 3.0022 3.0022 4.1636 4.1636 4.1830 4.1830 4.3646 4.3646 4.3775 4.3775 4.5963 4.5963 4.5963 4.5963 4.9258 4.9258 4.9304 4.9304 4.9821 4.9821 4.9937 4.9937 5.3011 5.3011 5.3068 5.3068 11.0675 11.0675 11.0810 11.0810 11.6044 11.6044 11.6283 11.6283 11.8315 11.8315 11.8728 11.8728 k =-0.3382 0.2158 0.5931 ( 5276 PWs) bands (ev): -12.5004 -12.5004 -12.4989 -12.4989 -11.2983 -11.2983 -11.2981 -11.2981 -10.8711 -10.8711 -10.8709 -10.8709 -10.6133 -10.6133 -10.6109 -10.6109 -0.5594 -0.5594 -0.5554 -0.5554 1.0426 1.0426 1.0475 1.0475 1.5497 1.5497 1.5528 1.5528 2.3194 2.3194 2.3296 2.3296 2.8315 2.8315 2.8386 2.8386 3.0125 3.0125 3.0190 3.0190 4.1796 4.1796 4.2005 4.2005 4.3534 4.3534 4.3633 4.3633 4.5767 4.5767 4.5777 4.5777 4.9140 4.9140 4.9197 4.9197 4.9979 4.9979 5.0094 5.0094 5.2878 5.2878 5.2931 5.2931 11.0951 11.0951 11.1082 11.1082 11.6091 11.6091 11.6324 11.6324 11.8307 11.8307 11.8699 11.8699 k =-0.3529 0.2252 0.5931 ( 5276 PWs) bands (ev): -12.5016 -12.5016 -12.5002 -12.5002 -11.3038 -11.3038 -11.3036 -11.3036 -10.8694 -10.8694 -10.8692 -10.8692 -10.6054 -10.6054 -10.6031 -10.6031 -0.5837 -0.5837 -0.5799 -0.5799 1.0523 1.0523 1.0572 1.0572 1.5260 1.5260 1.5290 1.5290 2.3444 2.3444 2.3536 2.3536 2.8507 2.8507 2.8578 2.8578 3.0295 3.0295 3.0355 3.0355 4.1913 4.1913 4.2134 4.2134 4.3429 4.3429 4.3504 4.3504 4.5613 4.5613 4.5635 4.5635 4.8971 4.8971 4.9023 4.9023 5.0161 5.0161 5.0261 5.0261 5.2777 5.2777 5.2824 5.2824 11.1212 11.1212 11.1337 11.1337 11.6137 11.6137 11.6362 11.6362 11.8285 11.8285 11.8653 11.8653 k =-0.3676 0.2346 0.5931 ( 5278 PWs) bands (ev): -12.5027 -12.5027 -12.5014 -12.5014 -11.3089 -11.3089 -11.3087 -11.3087 -10.8678 -10.8678 -10.8677 -10.8677 -10.5981 -10.5981 -10.5960 -10.5960 -0.6059 -0.6059 -0.6025 -0.6025 1.0632 1.0632 1.0680 1.0680 1.5016 1.5016 1.5046 1.5046 2.3661 2.3661 2.3743 2.3743 2.8714 2.8714 2.8783 2.8783 3.0460 3.0460 3.0514 3.0514 4.1980 4.1980 4.2203 4.2203 4.3341 4.3341 4.3399 4.3399 4.5507 4.5507 4.5541 4.5541 4.8778 4.8778 4.8825 4.8825 5.0317 5.0317 5.0403 5.0403 5.2711 5.2711 5.2753 5.2753 11.1457 11.1457 11.1574 11.1574 11.6179 11.6179 11.6395 11.6395 11.8252 11.8252 11.8593 11.8593 k =-0.3824 0.2439 0.5931 ( 5278 PWs) bands (ev): -12.5037 -12.5037 -12.5025 -12.5025 -11.3135 -11.3135 -11.3133 -11.3133 -10.8663 -10.8663 -10.8663 -10.8663 -10.5915 -10.5915 -10.5896 -10.5896 -0.6260 -0.6260 -0.6229 -0.6229 1.0753 1.0753 1.0799 1.0799 1.4770 1.4770 1.4800 1.4800 2.3849 2.3849 2.3920 2.3920 2.8928 2.8928 2.8995 2.8995 3.0618 3.0618 3.0666 3.0666 4.1994 4.1994 4.2207 4.2207 4.3271 4.3271 4.3323 4.3323 4.5456 4.5456 4.5499 4.5499 4.8570 4.8570 4.8613 4.8613 5.0435 5.0435 5.0508 5.0508 5.2685 5.2685 5.2720 5.2720 11.1683 11.1683 11.1791 11.1791 11.6219 11.6219 11.6423 11.6423 11.8211 11.8211 11.8523 11.8523 k =-0.3971 0.2533 0.5931 ( 5270 PWs) bands (ev): -12.5046 -12.5046 -12.5036 -12.5036 -11.3175 -11.3175 -11.3173 -11.3173 -10.8650 -10.8650 -10.8650 -10.8650 -10.5855 -10.5855 -10.5838 -10.5838 -0.6439 -0.6439 -0.6411 -0.6411 1.0883 1.0883 1.0927 1.0927 1.4526 1.4526 1.4555 1.4555 2.4007 2.4007 2.4069 2.4069 2.9141 2.9141 2.9204 2.9204 3.0765 3.0765 3.0807 3.0807 4.1963 4.1963 4.2155 4.2155 4.3216 4.3216 4.3268 4.3268 4.5462 4.5462 4.5511 4.5511 4.8353 4.8353 4.8391 4.8391 5.0513 5.0513 5.0575 5.0575 5.2693 5.2693 5.2724 5.2724 11.1888 11.1888 11.1985 11.1985 11.6255 11.6255 11.6445 11.6445 11.8166 11.8166 11.8447 11.8447 k =-0.4118 0.2627 0.5931 ( 5270 PWs) bands (ev): -12.5054 -12.5054 -12.5045 -12.5045 -11.3211 -11.3211 -11.3209 -11.3209 -10.8638 -10.8638 -10.8638 -10.8638 -10.5803 -10.5803 -10.5788 -10.5788 -0.6595 -0.6595 -0.6571 -0.6571 1.1020 1.1020 1.1062 1.1062 1.4287 1.4287 1.4315 1.4315 2.4140 2.4140 2.4192 2.4192 2.9347 2.9347 2.9404 2.9404 3.0901 3.0901 3.0936 3.0936 4.1903 4.1903 4.2068 4.2068 4.3170 4.3170 4.3223 4.3223 4.5523 4.5523 4.5573 4.5573 4.8129 4.8129 4.8164 4.8164 5.0558 5.0558 5.0609 5.0609 5.2730 5.2730 5.2755 5.2755 11.2071 11.2071 11.2157 11.2157 11.6288 11.6288 11.6460 11.6460 11.8121 11.8121 11.8368 11.8368 k =-0.4265 0.2721 0.5931 ( 5266 PWs) bands (ev): -12.5060 -12.5060 -12.5053 -12.5053 -11.3241 -11.3241 -11.3239 -11.3239 -10.8628 -10.8628 -10.8628 -10.8628 -10.5759 -10.5759 -10.5746 -10.5746 -0.6728 -0.6728 -0.6707 -0.6707 1.1161 1.1161 1.1201 1.1201 1.4058 1.4058 1.4086 1.4086 2.4250 2.4250 2.4292 2.4292 2.9536 2.9536 2.9587 2.9587 3.1021 3.1021 3.1049 3.1049 4.1830 4.1830 4.1966 4.1966 4.3127 4.3127 4.3179 4.3179 4.5629 4.5629 4.5677 4.5677 4.7902 4.7902 4.7932 4.7932 5.0577 5.0577 5.0619 5.0619 5.2783 5.2783 5.2803 5.2803 11.2229 11.2229 11.2303 11.2303 11.6318 11.6318 11.6469 11.6469 11.8081 11.8081 11.8292 11.8292 k =-0.4412 0.2815 0.5931 ( 5270 PWs) bands (ev): -12.5066 -12.5066 -12.5059 -12.5059 -11.3266 -11.3266 -11.3264 -11.3264 -10.8620 -10.8620 -10.8620 -10.8620 -10.5721 -10.5721 -10.5711 -10.5711 -0.6837 -0.6837 -0.6820 -0.6820 1.1302 1.1302 1.1338 1.1338 1.3845 1.3845 1.3871 1.3871 2.4337 2.4337 2.4370 2.4370 2.9703 2.9703 2.9745 2.9745 3.1125 3.1125 3.1146 3.1146 4.1756 4.1756 4.1863 4.1863 4.3088 4.3088 4.3134 4.3134 4.5771 4.5771 4.5815 4.5815 4.7673 4.7673 4.7701 4.7701 5.0581 5.0581 5.0614 5.0614 5.2841 5.2841 5.2857 5.2857 11.2362 11.2362 11.2422 11.2422 11.6345 11.6345 11.6471 11.6471 11.8048 11.8048 11.8220 11.8220 k =-0.4559 0.2909 0.5931 ( 5264 PWs) bands (ev): -12.5070 -12.5070 -12.5065 -12.5065 -11.3285 -11.3285 -11.3284 -11.3284 -10.8613 -10.8613 -10.8613 -10.8613 -10.5692 -10.5692 -10.5684 -10.5684 -0.6921 -0.6921 -0.6909 -0.6909 1.1435 1.1435 1.1466 1.1466 1.3657 1.3657 1.3680 1.3680 2.4404 2.4404 2.4428 2.4428 2.9840 2.9840 2.9872 2.9872 3.1208 3.1208 3.1224 3.1224 4.1692 4.1692 4.1772 4.1772 4.3054 4.3054 4.3091 4.3091 4.5936 4.5936 4.5974 4.5974 4.7449 4.7449 4.7474 4.7474 5.0577 5.0577 5.0601 5.0601 5.2896 5.2896 5.2908 5.2908 11.2469 11.2469 11.2515 11.2515 11.6370 11.6370 11.6468 11.6468 11.8025 11.8025 11.8156 11.8156 k =-0.4706 0.3002 0.5931 ( 5262 PWs) bands (ev): -12.5072 -12.5072 -12.5069 -12.5069 -11.3298 -11.3298 -11.3298 -11.3298 -10.8609 -10.8609 -10.8608 -10.8608 -10.5671 -10.5671 -10.5665 -10.5665 -0.6981 -0.6981 -0.6973 -0.6973 1.1550 1.1550 1.1573 1.1573 1.3506 1.3506 1.3524 1.3524 2.4452 2.4452 2.4468 2.4468 2.9943 2.9943 2.9965 2.9965 3.1271 3.1271 3.1281 3.1281 4.1645 4.1645 4.1698 4.1698 4.3029 4.3029 4.3055 4.3055 4.6110 4.6110 4.6141 4.6141 4.7239 4.7239 4.7261 4.7261 5.0572 5.0572 5.0588 5.0588 5.2941 5.2941 5.2949 5.2949 11.2548 11.2548 11.2579 11.2579 11.6393 11.6393 11.6460 11.6460 11.8014 11.8014 11.8103 11.8103 k =-0.4853 0.3096 0.5931 ( 5266 PWs) bands (ev): -12.5074 -12.5074 -12.5072 -12.5072 -11.3307 -11.3307 -11.3306 -11.3306 -10.8606 -10.8606 -10.8606 -10.8606 -10.5657 -10.5657 -10.5655 -10.5655 -0.7016 -0.7016 -0.7012 -0.7012 1.1632 1.1632 1.1645 1.1645 1.3407 1.3407 1.3417 1.3417 2.4482 2.4482 2.4490 2.4490 3.0009 3.0009 3.0020 3.0020 3.1310 3.1310 3.1315 3.1315 4.1620 4.1620 4.1647 4.1647 4.3016 4.3016 4.3029 4.3029 4.6267 4.6267 4.6287 4.6287 4.7067 4.7067 4.7083 4.7083 5.0569 5.0569 5.0577 5.0577 5.2970 5.2970 5.2974 5.2974 11.2599 11.2599 11.2614 11.2614 11.6413 11.6413 11.6447 11.6447 11.8016 11.8016 11.8061 11.8061 k =-0.5000 0.3190 0.5931 ( 5256 PWs) bands (ev): -12.5074 -12.5074 -12.5074 -12.5074 -11.3309 -11.3309 -11.3309 -11.3309 -10.8605 -10.8605 -10.8605 -10.8605 -10.5652 -10.5652 -10.5652 -10.5652 -0.7027 -0.7027 -0.7027 -0.7027 1.1667 1.1667 1.1667 1.1667 1.3376 1.3376 1.3376 1.3376 2.4495 2.4495 2.4495 2.4495 3.0035 3.0035 3.0035 3.0035 3.1325 3.1325 3.1325 3.1325 4.1621 4.1621 4.1621 4.1621 4.3016 4.3016 4.3016 4.3016 4.6347 4.6347 4.6347 4.6347 4.6998 4.6998 4.6998 4.6998 5.0570 5.0570 5.0570 5.0570 5.2981 5.2981 5.2981 5.2981 11.2621 11.2621 11.2621 11.2621 11.6431 11.6431 11.6431 11.6431 11.8032 11.8032 11.8032 11.8032 k =-0.5000 0.3190 0.5931 ( 5256 PWs) bands (ev): -12.5074 -12.5074 -12.5074 -12.5074 -11.3309 -11.3309 -11.3309 -11.3309 -10.8605 -10.8605 -10.8605 -10.8605 -10.5652 -10.5652 -10.5652 -10.5652 -0.7027 -0.7027 -0.7027 -0.7027 1.1667 1.1667 1.1667 1.1667 1.3376 1.3376 1.3376 1.3376 2.4495 2.4495 2.4495 2.4495 3.0035 3.0035 3.0035 3.0035 3.1325 3.1325 3.1325 3.1325 4.1621 4.1621 4.1621 4.1621 4.3016 4.3016 4.3016 4.3016 4.6347 4.6347 4.6347 4.6347 4.6998 4.6998 4.6998 4.6998 5.0570 5.0570 5.0570 5.0570 5.2981 5.2981 5.2981 5.2981 11.2621 11.2621 11.2621 11.2621 11.6431 11.6431 11.6431 11.6431 11.8032 11.8032 11.8032 11.8032 k =-0.4896 0.3124 0.5807 ( 5268 PWs) bands (ev): -12.5078 -12.5078 -12.5068 -12.5068 -11.3307 -11.3307 -11.3306 -11.3306 -10.8608 -10.8608 -10.8603 -10.8603 -10.5659 -10.5659 -10.5653 -10.5653 -0.7025 -0.7025 -0.7003 -0.7003 1.1607 1.1607 1.1672 1.1672 1.3365 1.3365 1.3457 1.3457 2.4470 2.4470 2.4502 2.4502 2.9996 2.9996 3.0033 3.0033 3.1309 3.1309 3.1315 3.1315 4.1607 4.1607 4.1660 4.1660 4.3016 4.3016 4.3029 4.3029 4.6217 4.6217 4.6348 4.6348 4.7002 4.7002 4.7138 4.7138 5.0566 5.0566 5.0579 5.0579 5.2959 5.2959 5.2985 5.2985 11.2599 11.2599 11.2614 11.2614 11.6413 11.6413 11.6447 11.6447 11.8016 11.8016 11.8061 11.8061 k =-0.4792 0.3057 0.5684 ( 5264 PWs) bands (ev): -12.5092 -12.5092 -12.5050 -12.5050 -11.3299 -11.3299 -11.3297 -11.3297 -10.8617 -10.8617 -10.8600 -10.8600 -10.5680 -10.5680 -10.5656 -10.5656 -0.7019 -0.7019 -0.6935 -0.6935 1.1457 1.1457 1.1688 1.1688 1.3335 1.3335 1.3673 1.3673 2.4397 2.4397 2.4523 2.4523 2.9885 2.9885 3.0024 3.0024 3.1266 3.1266 3.1285 3.1285 4.1579 4.1579 4.1764 4.1764 4.3027 4.3027 4.3055 4.3055 4.5972 4.5972 4.6351 4.6351 4.7015 4.7015 4.7415 4.7415 5.0556 5.0556 5.0603 5.0603 5.2895 5.2895 5.2995 5.2995 11.2548 11.2548 11.2579 11.2579 11.6393 11.6393 11.6460 11.6460 11.8013 11.8013 11.8103 11.8103 k =-0.4688 0.2991 0.5560 ( 5260 PWs) bands (ev): -12.5114 -12.5114 -12.5021 -12.5021 -11.3286 -11.3286 -11.3282 -11.3282 -10.8633 -10.8633 -10.8594 -10.8594 -10.5716 -10.5716 -10.5661 -10.5661 -0.7009 -0.7009 -0.6821 -0.6821 1.1267 1.1267 1.1713 1.1713 1.3286 1.3286 1.3971 1.3971 2.4276 2.4276 2.4558 2.4558 2.9707 2.9707 3.0011 3.0011 3.1195 3.1195 3.1235 3.1235 4.1533 4.1533 4.1930 4.1930 4.3047 4.3047 4.3088 4.3088 4.5721 4.5721 4.6356 4.6356 4.7038 4.7038 4.7730 4.7730 5.0531 5.0531 5.0641 5.0641 5.2798 5.2798 5.3011 5.3011 11.2469 11.2469 11.2515 11.2515 11.6371 11.6371 11.6468 11.6468 11.8020 11.8020 11.8159 11.8159 k =-0.4583 0.2924 0.5437 ( 5264 PWs) bands (ev): -12.5145 -12.5145 -12.4980 -12.4980 -11.3269 -11.3269 -11.3261 -11.3261 -10.8654 -10.8654 -10.8585 -10.8585 -10.5764 -10.5764 -10.5668 -10.5668 -0.6997 -0.6997 -0.6662 -0.6662 1.1070 1.1070 1.1749 1.1749 1.3218 1.3218 1.4315 1.4315 2.4106 2.4106 2.4608 2.4608 2.9472 2.9472 2.9991 2.9991 3.1098 3.1098 3.1166 3.1166 4.1471 4.1471 4.2149 4.2149 4.3064 4.3064 4.3121 4.3121 4.5504 4.5504 4.6365 4.6365 4.7070 4.7070 4.8057 4.8057 5.0482 5.0482 5.0693 5.0693 5.2679 5.2679 5.3036 5.3036 11.2363 11.2363 11.2424 11.2424 11.6347 11.6347 11.6472 11.6472 11.8034 11.8034 11.8226 11.8226 k =-0.4479 0.2858 0.5313 ( 5276 PWs) bands (ev): -12.5186 -12.5186 -12.4929 -12.4929 -11.3246 -11.3246 -11.3234 -11.3234 -10.8681 -10.8681 -10.8575 -10.8575 -10.5826 -10.5826 -10.5677 -10.5677 -0.6983 -0.6983 -0.6461 -0.6461 1.0885 1.0885 1.1794 1.1794 1.3131 1.3131 1.4682 1.4682 2.3888 2.3888 2.4674 2.4674 2.9192 2.9192 2.9967 2.9967 3.0979 3.0979 3.1079 3.1079 4.1393 4.1393 4.2408 4.2408 4.3050 4.3050 4.3159 4.3159 4.5350 4.5350 4.6379 4.6379 4.7111 4.7111 4.8390 4.8390 5.0390 5.0390 5.0758 5.0758 5.2558 5.2558 5.3068 5.3068 11.2232 11.2232 11.2306 11.2306 11.6323 11.6323 11.6470 11.6470 11.8048 11.8048 11.8305 11.8305 k =-0.4375 0.2791 0.5190 ( 5284 PWs) bands (ev): -12.5236 -12.5236 -12.4866 -12.4866 -11.3218 -11.3218 -11.3200 -11.3200 -10.8713 -10.8713 -10.8561 -10.8561 -10.5901 -10.5901 -10.5688 -10.5688 -0.6968 -0.6968 -0.6217 -0.6217 1.0723 1.0723 1.1851 1.1851 1.3027 1.3027 1.5055 1.5055 2.3621 2.3621 2.4756 2.4756 2.8878 2.8878 2.9939 2.9939 3.0843 3.0843 3.0975 3.0975 4.1303 4.1303 4.2695 4.2695 4.2974 4.2974 4.3210 4.3210 4.5285 4.5285 4.6398 4.6398 4.7162 4.7162 4.8725 4.8725 5.0238 5.0238 5.0834 5.0834 5.2457 5.2457 5.3108 5.3108 11.2077 11.2077 11.2165 11.2165 11.6298 11.6298 11.6463 11.6463 11.8053 11.8053 11.8397 11.8397 k =-0.4271 0.2725 0.5066 ( 5284 PWs) bands (ev): -12.5294 -12.5294 -12.4793 -12.4793 -11.3186 -11.3186 -11.3161 -11.3161 -10.8749 -10.8749 -10.8546 -10.8546 -10.5987 -10.5987 -10.5701 -10.5701 -0.6953 -0.6953 -0.5934 -0.5934 1.0590 1.0590 1.1917 1.1917 1.2908 1.2908 1.5419 1.5419 2.3308 2.3308 2.4855 2.4855 2.8541 2.8541 2.9907 2.9907 3.0695 3.0695 3.0854 3.0854 4.1203 4.1203 4.2819 4.2819 4.3001 4.3001 4.3271 4.3271 4.5318 4.5318 4.6424 4.6424 4.7224 4.7224 4.9062 4.9062 5.0013 5.0013 5.0920 5.0920 5.2395 5.2395 5.3158 5.3158 11.1901 11.1901 11.2001 11.2001 11.6272 11.6272 11.6450 11.6450 11.8039 11.8039 11.8503 11.8503 k =-0.4167 0.2658 0.4942 ( 5284 PWs) bands (ev): -12.5362 -12.5362 -12.4709 -12.4709 -11.3149 -11.3149 -11.3116 -11.3116 -10.8789 -10.8789 -10.8529 -10.8529 -10.6084 -10.6084 -10.5715 -10.5715 -0.6939 -0.6939 -0.5613 -0.5613 1.0489 1.0489 1.1993 1.1993 1.2774 1.2774 1.5763 1.5763 2.2950 2.2950 2.4973 2.4973 2.8191 2.8191 2.9871 2.9871 3.0544 3.0544 3.0717 3.0717 4.1096 4.1096 4.2606 4.2606 4.3300 4.3300 4.3341 4.3341 4.5441 4.5441 4.6457 4.6457 4.7295 4.7295 4.9400 4.9400 4.9714 4.9714 5.1014 5.1014 5.2380 5.2380 5.3218 5.3218 11.1705 11.1705 11.1817 11.1817 11.6245 11.6245 11.6434 11.6434 11.7999 11.7999 11.8624 11.8624 k =-0.4062 0.2592 0.4819 ( 5284 PWs) bands (ev): -12.5439 -12.5439 -12.4616 -12.4616 -11.3108 -11.3108 -11.3065 -11.3065 -10.8832 -10.8832 -10.8509 -10.8509 -10.6192 -10.6192 -10.5732 -10.5732 -0.6929 -0.6929 -0.5256 -0.5256 1.0424 1.0424 1.2079 1.2079 1.2627 1.2627 1.6072 1.6072 2.2550 2.2550 2.5109 2.5109 2.7837 2.7837 2.9833 2.9833 3.0400 3.0400 3.0565 3.0565 4.0984 4.0984 4.2343 4.2343 4.3417 4.3417 4.3583 4.3583 4.5635 4.5635 4.6499 4.6499 4.7378 4.7378 4.9356 4.9356 4.9740 4.9740 5.1113 5.1113 5.2408 5.2408 5.3289 5.3289 11.1492 11.1492 11.1617 11.1617 11.6215 11.6215 11.6417 11.6417 11.7924 11.7924 11.8759 11.8759 k =-0.3958 0.2525 0.4695 ( 5276 PWs) bands (ev): -12.5526 -12.5526 -12.4514 -12.4514 -11.3062 -11.3062 -11.3008 -11.3008 -10.8878 -10.8878 -10.8487 -10.8487 -10.6309 -10.6309 -10.5750 -10.5750 -0.6924 -0.6924 -0.4867 -0.4867 1.0397 1.0397 1.2174 1.2174 1.2468 1.2468 1.6332 1.6332 2.2113 2.2113 2.5263 2.5263 2.7483 2.7483 2.9793 2.9793 3.0275 3.0275 3.0399 3.0399 4.0871 4.0871 4.2050 4.2050 4.3500 4.3500 4.3823 4.3823 4.5881 4.5881 4.6549 4.6549 4.7471 4.7471 4.8968 4.8968 5.0083 5.0083 5.1215 5.1215 5.2472 5.2472 5.3372 5.3372 11.1263 11.1263 11.1403 11.1403 11.6179 11.6179 11.6402 11.6402 11.7813 11.7813 11.8909 11.8909 k =-0.3854 0.2459 0.4572 ( 5276 PWs) bands (ev): -12.5621 -12.5621 -12.4403 -12.4403 -11.3013 -11.3013 -11.2947 -11.2947 -10.8925 -10.8925 -10.8463 -10.8463 -10.6433 -10.6433 -10.5770 -10.5770 -0.6926 -0.6926 -0.4449 -0.4449 1.0409 1.0409 1.2267 1.2267 1.2311 1.2311 1.6528 1.6528 2.1646 2.1646 2.5433 2.5433 2.7134 2.7134 2.9752 2.9752 3.0174 3.0174 3.0231 3.0231 4.0760 4.0760 4.1740 4.1740 4.3588 4.3588 4.3989 4.3989 4.6163 4.6163 4.6608 4.6608 4.7576 4.7576 4.8587 4.8587 5.0428 5.0428 5.1318 5.1318 5.2563 5.2563 5.3469 5.3469 11.1021 11.1021 11.1178 11.1178 11.6133 11.6133 11.6393 11.6393 11.7667 11.7667 11.9071 11.9071 k =-0.3750 0.2393 0.4448 ( 5284 PWs) bands (ev): -12.5725 -12.5725 -12.4284 -12.4284 -11.2960 -11.2960 -11.2880 -11.2880 -10.8972 -10.8972 -10.8438 -10.8438 -10.6564 -10.6564 -10.5791 -10.5791 -0.6935 -0.6935 -0.4005 -0.4005 1.0461 1.0461 1.2119 1.2119 1.2392 1.2392 1.6648 1.6648 2.1153 2.1153 2.5614 2.5614 2.6793 2.6793 2.9713 2.9713 3.0008 3.0008 3.0165 3.0165 4.0653 4.0653 4.1423 4.1423 4.3679 4.3679 4.4040 4.4040 4.6465 4.6465 4.6679 4.6679 4.7692 4.7692 4.8261 4.8261 5.0778 5.0778 5.1419 5.1419 5.2671 5.2671 5.3578 5.3578 11.0768 11.0768 11.0948 11.0948 11.6075 11.6075 11.6388 11.6388 11.7492 11.7492 11.9245 11.9245 k =-0.3646 0.2326 0.4325 ( 5296 PWs) bands (ev): -12.5838 -12.5838 -12.4157 -12.4157 -11.2904 -11.2904 -11.2809 -11.2809 -10.9019 -10.9019 -10.8410 -10.8410 -10.6701 -10.6701 -10.5814 -10.5814 -0.6953 -0.6953 -0.3539 -0.3539 1.0554 1.0554 1.1936 1.1936 1.2508 1.2508 1.6680 1.6680 2.0645 2.0645 2.5799 2.5799 2.6461 2.6461 2.9673 2.9673 2.9800 2.9800 3.0198 3.0198 4.0550 4.0550 4.1106 4.1106 4.3773 4.3773 4.3929 4.3929 4.6711 4.6711 4.6830 4.6830 4.7820 4.7820 4.8042 4.8042 5.1134 5.1134 5.1519 5.1519 5.2791 5.2791 5.3701 5.3701 11.0506 11.0506 11.0714 11.0714 11.6004 11.6004 11.6380 11.6380 11.7304 11.7304 11.9429 11.9429 k =-0.3542 0.2260 0.4201 ( 5300 PWs) bands (ev): -12.5959 -12.5959 -12.4025 -12.4025 -11.2845 -11.2845 -11.2735 -11.2735 -10.9063 -10.9063 -10.8381 -10.8381 -10.6842 -10.6842 -10.5838 -10.5838 -0.6983 -0.6983 -0.3055 -0.3055 1.0687 1.0687 1.1746 1.1746 1.2625 1.2625 1.6619 1.6619 2.0130 2.0130 2.5981 2.5981 2.6142 2.6142 2.9568 2.9568 2.9640 2.9640 3.0320 3.0320 4.0448 4.0448 4.0801 4.0801 4.3633 4.3633 4.3870 4.3870 4.6808 4.6808 4.7145 4.7145 4.7954 4.7954 4.7964 4.7964 5.1494 5.1494 5.1615 5.1615 5.2918 5.2918 5.3837 5.3837 11.0236 11.0236 11.0481 11.0481 11.5916 11.5916 11.6346 11.6346 11.7135 11.7135 11.9622 11.9622 k =-0.3438 0.2193 0.4078 ( 5300 PWs) bands (ev): -12.6088 -12.6088 -12.3886 -12.3886 -11.2784 -11.2784 -11.2659 -11.2659 -10.9104 -10.9104 -10.8351 -10.8351 -10.6985 -10.6985 -10.5863 -10.5863 -0.7024 -0.7024 -0.2558 -0.2558 1.0861 1.0861 1.1554 1.1554 1.2740 1.2740 1.6461 1.6461 1.9619 1.9619 2.5829 2.5829 2.6160 2.6160 2.9328 2.9328 2.9599 2.9599 3.0538 3.0538 4.0321 4.0321 4.0542 4.0542 4.3166 4.3166 4.3967 4.3967 4.6892 4.6892 4.7480 4.7480 4.8003 4.8003 4.8110 4.8110 5.1703 5.1703 5.1866 5.1866 5.3048 5.3048 5.3984 5.3984 10.9963 10.9963 11.0252 11.0252 11.5806 11.5806 11.6253 11.6253 11.7030 11.7030 11.9823 11.9823 k =-0.3333 0.2127 0.3954 ( 5284 PWs) bands (ev): -12.6225 -12.6225 -12.3743 -12.3743 -11.2721 -11.2721 -11.2581 -11.2581 -10.9140 -10.9140 -10.8319 -10.8319 -10.7129 -10.7129 -10.5889 -10.5889 -0.7079 -0.7079 -0.2051 -0.2051 1.1069 1.1069 1.1364 1.1364 1.2843 1.2843 1.6209 1.6209 1.9124 1.9124 2.5532 2.5532 2.6325 2.6325 2.9071 2.9071 2.9561 2.9561 3.0851 3.0851 4.0098 4.0098 4.0402 4.0402 4.2566 4.2566 4.4065 4.4065 4.6977 4.6977 4.7815 4.7815 4.8144 4.8144 4.8271 4.8271 5.1790 5.1790 5.2241 5.2241 5.3178 5.3178 5.4142 5.4142 10.9687 10.9687 11.0029 11.0029 11.5662 11.5662 11.6095 11.6095 11.7015 11.7015 12.0031 12.0031 k =-0.3229 0.2060 0.3830 ( 5290 PWs) bands (ev): -12.6369 -12.6369 -12.3595 -12.3595 -11.2658 -11.2658 -11.2503 -11.2503 -10.9170 -10.9170 -10.8286 -10.8286 -10.7273 -10.7273 -10.5916 -10.5916 -0.7148 -0.7148 -0.1540 -0.1540 1.1140 1.1140 1.1351 1.1351 1.2925 1.2925 1.5870 1.5870 1.8661 1.8661 2.5248 2.5248 2.6481 2.6481 2.8799 2.8799 2.9525 2.9525 3.1250 3.1250 3.9825 3.9825 4.0341 4.0341 4.1877 4.1877 4.4163 4.4163 4.7062 4.7062 4.8145 4.8145 4.8347 4.8347 4.8444 4.8444 5.1871 5.1871 5.2625 5.2625 5.3305 5.3305 5.4309 5.4309 10.9412 10.9412 10.9817 10.9817 11.5465 11.5465 11.5918 11.5918 11.7072 11.7072 12.0244 12.0244 k =-0.3125 0.1994 0.3707 ( 5282 PWs) bands (ev): -12.6520 -12.6520 -12.3444 -12.3444 -11.2594 -11.2594 -11.2427 -11.2427 -10.9191 -10.9191 -10.8251 -10.8251 -10.7413 -10.7413 -10.5945 -10.5945 -0.7232 -0.7232 -0.1029 -0.1029 1.0954 1.0954 1.1633 1.1633 1.2971 1.2971 1.5453 1.5453 1.8248 1.8248 2.4977 2.4977 2.6632 2.6632 2.8512 2.8512 2.9490 2.9490 3.1718 3.1718 3.9551 3.9551 4.0304 4.0304 4.1141 4.1141 4.4261 4.4261 4.7147 4.7147 4.8464 4.8464 4.8585 4.8585 4.8630 4.8630 5.1950 5.1950 5.3016 5.3016 5.3428 5.3428 5.4481 5.4481 10.9140 10.9140 10.9616 10.9616 11.5207 11.5207 11.5758 11.5758 11.7177 11.7177 12.0461 12.0461 k =-0.3021 0.1927 0.3583 ( 5278 PWs) bands (ev): -12.6677 -12.6677 -12.3291 -12.3291 -11.2531 -11.2531 -11.2354 -11.2354 -10.9202 -10.9202 -10.8216 -10.8216 -10.7550 -10.7550 -10.5974 -10.5974 -0.7332 -0.7332 -0.0523 -0.0523 1.0761 1.0761 1.1962 1.1962 1.2962 1.2962 1.4969 1.4969 1.7905 1.7905 2.4722 2.4722 2.6781 2.6781 2.8211 2.8211 2.9459 2.9459 3.2237 3.2237 3.9287 3.9287 4.0140 4.0140 4.0531 4.0531 4.4357 4.4357 4.7230 4.7230 4.8762 4.8762 4.8819 4.8819 4.8856 4.8856 5.2025 5.2025 5.3407 5.3407 5.3550 5.3550 5.4658 5.4658 10.8873 10.8873 10.9430 10.9430 11.4907 11.4907 11.5618 11.5618 11.7315 11.7315 12.0681 12.0681 k =-0.2917 0.1861 0.3460 ( 5282 PWs) bands (ev): -12.6839 -12.6839 -12.3137 -12.3137 -11.2470 -11.2470 -11.2286 -11.2286 -10.9201 -10.9201 -10.8181 -10.8181 -10.7680 -10.7680 -10.6003 -10.6003 -0.7447 -0.7447 -0.0027 -0.0027 1.0569 1.0569 1.2328 1.2328 1.2883 1.2883 1.4430 1.4430 1.7650 1.7650 2.4485 2.4485 2.6931 2.6931 2.7897 2.7897 2.9430 2.9430 3.2781 3.2781 3.9030 3.9030 3.9445 3.9445 4.0478 4.0478 4.4452 4.4452 4.7311 4.7311 4.8999 4.8999 4.9071 4.9071 4.9129 4.9129 5.2098 5.2098 5.3639 5.3639 5.3831 5.3831 5.4836 5.4836 10.8614 10.8614 10.9260 10.9260 11.4587 11.4587 11.5486 11.5486 11.7480 11.7480 12.0903 12.0903 k =-0.2812 0.1794 0.3336 ( 5278 PWs) bands (ev): -12.7006 -12.7006 -12.2982 -12.2982 -11.2411 -11.2411 -11.2225 -11.2225 -10.9186 -10.9186 -10.8145 -10.8145 -10.7801 -10.7801 -10.6033 -10.6033 -0.7579 -0.7579 0.0455 0.0455 1.0380 1.0380 1.2692 1.2692 1.2757 1.2757 1.3850 1.3850 1.7495 1.7495 2.4266 2.4266 2.7084 2.7084 2.7574 2.7574 2.9404 2.9404 3.3328 3.3328 3.8593 3.8593 3.8835 3.8835 4.0581 4.0581 4.4545 4.4545 4.7388 4.7388 4.9208 4.9208 4.9340 4.9340 4.9407 4.9407 5.2170 5.2170 5.3743 5.3743 5.4235 5.4235 5.5014 5.5014 10.8366 10.8366 10.9109 10.9109 11.4261 11.4261 11.5358 11.5358 11.7668 11.7668 12.1126 12.1126 k =-0.2708 0.1728 0.3213 ( 5286 PWs) bands (ev): -12.7176 -12.7176 -12.2827 -12.2827 -11.2357 -11.2357 -11.2172 -11.2172 -10.9157 -10.9157 -10.8112 -10.8112 -10.7910 -10.7910 -10.6063 -10.6063 -0.7728 -0.7728 0.0919 0.0919 1.0196 1.0196 1.2472 1.2472 1.3156 1.3156 1.3247 1.3247 1.7438 1.7438 2.4068 2.4068 2.7168 2.7168 2.7315 2.7315 2.9382 2.9382 3.3851 3.3851 3.7790 3.7790 3.8599 3.8599 4.0762 4.0762 4.4637 4.4637 4.7460 4.7460 4.9419 4.9419 4.9602 4.9602 4.9678 4.9678 5.2243 5.2243 5.3834 5.3834 5.4645 5.4645 5.5189 5.5189 10.8129 10.8129 10.8979 10.8979 11.3939 11.3939 11.5230 11.5230 11.7876 11.7876 12.1348 12.1348 k =-0.2604 0.1661 0.3089 ( 5286 PWs) bands (ev): -12.7350 -12.7350 -12.2674 -12.2674 -11.2307 -11.2307 -11.2128 -11.2128 -10.9113 -10.9113 -10.8092 -10.8092 -10.7993 -10.7993 -10.6094 -10.6094 -0.7894 -0.7894 0.1361 0.1361 1.0017 1.0017 1.2155 1.2155 1.2603 1.2603 1.3632 1.3632 1.7464 1.7464 2.3893 2.3893 2.6865 2.6865 2.7440 2.7440 2.9364 2.9364 3.4325 3.4325 3.6984 3.6984 3.8394 3.8394 4.1025 4.1025 4.4726 4.4726 4.7527 4.7527 4.9632 4.9632 4.9854 4.9854 4.9938 4.9938 5.2317 5.2317 5.3915 5.3915 5.5054 5.5054 5.5360 5.5360 10.7907 10.7907 10.8870 10.8870 11.3627 11.3627 11.5101 11.5101 11.8102 11.8102 12.1570 12.1570 k =-0.2500 0.1595 0.2965 ( 5278 PWs) bands (ev): -12.7526 -12.7526 -12.2523 -12.2523 -11.2265 -11.2265 -11.2094 -11.2094 -10.9052 -10.9052 -10.8131 -10.8131 -10.8005 -10.8005 -10.6125 -10.6125 -0.8076 -0.8076 0.1778 0.1778 0.9845 0.9845 1.1780 1.1780 1.1964 1.1964 1.4126 1.4126 1.7549 1.7549 2.3742 2.3742 2.6511 2.6511 2.7615 2.7615 2.9348 2.9348 3.4730 3.4730 3.6203 3.6203 3.8207 3.8207 4.1380 4.1380 4.4814 4.4814 4.7589 4.7589 4.9847 4.9847 5.0097 5.0097 5.0186 5.0186 5.2393 5.2393 5.3987 5.3987 5.5445 5.5445 5.5539 5.5539 10.7701 10.7701 10.8784 10.8784 11.3330 11.3330 11.4970 11.4970 11.8343 11.8343 12.1791 12.1791 k =-0.2396 0.1529 0.2842 ( 5276 PWs) bands (ev): -12.7703 -12.7703 -12.2376 -12.2376 -11.2229 -11.2229 -11.2071 -11.2071 -10.8975 -10.8975 -10.8195 -10.8195 -10.7976 -10.7976 -10.6155 -10.6155 -0.8274 -0.8274 0.2167 0.2167 0.9679 0.9679 1.1290 1.1290 1.1404 1.1404 1.4647 1.4647 1.7668 1.7668 2.3616 2.3616 2.6147 2.6147 2.7799 2.7799 2.9337 2.9337 3.5034 3.5034 3.5479 3.5479 3.8036 3.8036 4.1830 4.1830 4.4899 4.4899 4.7645 4.7645 5.0060 5.0060 5.0329 5.0329 5.0422 5.0422 5.2473 5.2473 5.4049 5.4049 5.5662 5.5662 5.5880 5.5880 10.7511 10.7511 10.8721 10.8721 11.3051 11.3051 11.4838 11.4838 11.8598 11.8598 12.2009 12.2009 k =-0.2292 0.1462 0.2718 ( 5280 PWs) bands (ev): -12.7881 -12.7881 -12.2232 -12.2232 -11.2202 -11.2202 -11.2058 -11.2058 -10.8884 -10.8884 -10.8251 -10.8251 -10.7940 -10.7940 -10.6186 -10.6186 -0.8489 -0.8489 0.2527 0.2527 0.9521 0.9521 1.0659 1.0659 1.0972 1.0972 1.5192 1.5192 1.7799 1.7799 2.3511 2.3511 2.5777 2.5777 2.7991 2.7991 2.9329 2.9329 3.4732 3.4732 3.5327 3.5327 3.7880 3.7880 4.2369 4.2369 4.4982 4.4982 4.7696 4.7696 5.0271 5.0271 5.0550 5.0550 5.0645 5.0645 5.2558 5.2558 5.4103 5.4103 5.5809 5.5809 5.6274 5.6274 10.7340 10.7340 10.8684 10.8684 11.2795 11.2795 11.4704 11.4704 11.8865 11.8865 12.2224 12.2224 k =-0.2188 0.1396 0.2595 ( 5278 PWs) bands (ev): -12.8058 -12.8058 -12.2092 -12.2092 -11.2183 -11.2183 -11.2055 -11.2055 -10.8779 -10.8779 -10.8291 -10.8291 -10.7902 -10.7902 -10.6216 -10.6216 -0.8718 -0.8718 0.2854 0.2854 0.9369 0.9369 1.0030 1.0030 1.0546 1.0546 1.5761 1.5761 1.7923 1.7923 2.3424 2.3424 2.5405 2.5405 2.8188 2.8188 2.9325 2.9325 3.4118 3.4118 3.5472 3.5472 3.7739 3.7739 4.2982 4.2982 4.5063 4.5063 4.7744 4.7744 5.0478 5.0478 5.0759 5.0759 5.0857 5.0857 5.2650 5.2650 5.4148 5.4148 5.5941 5.5941 5.6661 5.6661 10.7188 10.7188 10.8671 10.8671 11.2562 11.2562 11.4569 11.4569 11.9140 11.9140 12.2435 12.2435 k =-0.2083 0.1329 0.2471 ( 5272 PWs) bands (ev): -12.8233 -12.8233 -12.1958 -12.1958 -11.2174 -11.2174 -11.2059 -11.2059 -10.8662 -10.8662 -10.8316 -10.8316 -10.7864 -10.7864 -10.6246 -10.6246 -0.8962 -0.8962 0.3146 0.3146 0.9216 0.9216 0.9426 0.9426 1.0128 1.0128 1.6350 1.6350 1.8026 1.8026 2.3342 2.3342 2.5030 2.5030 2.8389 2.8389 2.9323 2.9323 3.3580 3.3580 3.5554 3.5554 3.7611 3.7611 4.3648 4.3648 4.5142 4.5142 4.7796 4.7796 5.0676 5.0676 5.0956 5.0956 5.1058 5.1058 5.2749 5.2749 5.4186 5.4186 5.6060 5.6060 5.7037 5.7037 10.7057 10.7057 10.8682 10.8682 11.2356 11.2356 11.4434 11.4434 11.9422 11.9422 12.2643 12.2643 k =-0.1979 0.1263 0.2348 ( 5274 PWs) bands (ev): -12.8407 -12.8407 -12.1830 -12.1830 -11.2173 -11.2173 -11.2071 -11.2071 -10.8536 -10.8536 -10.8324 -10.8324 -10.7827 -10.7827 -10.6275 -10.6275 -0.9218 -0.9218 0.3403 0.3403 0.8804 0.8804 0.9111 0.9111 0.9727 0.9727 1.6956 1.6956 1.8098 1.8098 2.3254 2.3254 2.4657 2.4657 2.8593 2.8593 2.9325 2.9325 3.3143 3.3143 3.5575 3.5575 3.7495 3.7495 4.4341 4.4341 4.5218 4.5218 4.7860 4.7860 5.0865 5.0865 5.1142 5.1142 5.1248 5.1248 5.2856 5.2856 5.4216 5.4216 5.6165 5.6165 5.7401 5.7401 10.6945 10.6945 10.8718 10.8718 11.2177 11.2177 11.4298 11.4298 11.9708 11.9708 12.2846 12.2846 k =-0.1875 0.1196 0.2224 ( 5272 PWs) bands (ev): -12.8578 -12.8578 -12.1709 -12.1709 -11.2181 -11.2181 -11.2089 -11.2089 -10.8403 -10.8403 -10.8315 -10.8315 -10.7789 -10.7789 -10.6303 -10.6303 -0.9486 -0.9486 0.3621 0.3621 0.8242 0.8242 0.8980 0.8980 0.9351 0.9351 1.7576 1.7576 1.8139 1.8139 2.3142 2.3142 2.4287 2.4287 2.8798 2.8798 2.9330 2.9330 3.2822 3.2822 3.5544 3.5544 3.7391 3.7391 4.5023 4.5023 4.5292 4.5292 4.7955 4.7955 5.1043 5.1043 5.1316 5.1316 5.1427 5.1427 5.2973 5.2973 5.4241 5.4241 5.6256 5.6256 5.7749 5.7749 10.6853 10.6853 10.8777 10.8777 11.2027 11.2027 11.4163 11.4163 11.9995 11.9995 12.3046 12.3046 k =-0.1771 0.1130 0.2101 ( 5276 PWs) bands (ev): -12.8744 -12.8744 -12.1594 -12.1594 -11.2196 -11.2196 -11.2112 -11.2112 -10.8304 -10.8304 -10.8252 -10.8252 -10.7752 -10.7752 -10.6331 -10.6331 -0.9764 -0.9764 0.3798 0.3798 0.7703 0.7703 0.8859 0.8859 0.9011 0.9011 1.8090 1.8090 1.8262 1.8262 2.2993 2.2993 2.3922 2.3922 2.9003 2.9003 2.9339 2.9339 3.2628 3.2628 3.5469 3.5469 3.7297 3.7297 4.5362 4.5362 4.5647 4.5647 4.8119 4.8119 5.1208 5.1208 5.1479 5.1479 5.1596 5.1596 5.3100 5.3100 5.4259 5.4259 5.6332 5.6332 5.8081 5.8081 10.6782 10.6782 10.8859 10.8859 11.1905 11.1905 11.4029 11.4029 12.0280 12.0280 12.3241 12.3241 k =-0.1667 0.1063 0.1977 ( 5272 PWs) bands (ev): -12.8906 -12.8906 -12.1486 -12.1486 -11.2217 -11.2217 -11.2139 -11.2139 -10.8267 -10.8267 -10.8112 -10.8112 -10.7715 -10.7715 -10.6358 -10.6358 -1.0048 -1.0048 0.3932 0.3932 0.7193 0.7193 0.8682 0.8682 0.8777 0.8777 1.8087 1.8087 1.8881 1.8881 2.2799 2.2799 2.3564 2.3564 2.9203 2.9203 2.9353 2.9353 3.2565 3.2565 3.5355 3.5355 3.7213 3.7213 4.5431 4.5431 4.6144 4.6144 4.8404 4.8404 5.1359 5.1359 5.1631 5.1631 5.1754 5.1754 5.3237 5.3237 5.4274 5.4274 5.6394 5.6394 5.8396 5.8396 10.6729 10.6729 10.8961 10.8961 11.1812 11.1812 11.3896 11.3896 12.0560 12.0560 12.3432 12.3432 k =-0.1562 0.0997 0.1853 ( 5272 PWs) bands (ev): -12.9062 -12.9062 -12.1386 -12.1386 -11.2243 -11.2243 -11.2168 -11.2168 -10.8222 -10.8222 -10.7967 -10.7967 -10.7679 -10.7679 -10.6383 -10.6383 -1.0337 -1.0337 0.4020 0.4020 0.6716 0.6716 0.8429 0.8429 0.8671 0.8671 1.8024 1.8024 1.9539 1.9539 2.2557 2.2557 2.3214 2.3214 2.9340 2.9340 2.9431 2.9431 3.2623 3.2623 3.5209 3.5209 3.7138 3.7138 4.5497 4.5497 4.6465 4.6465 4.8849 4.8849 5.1497 5.1497 5.1773 5.1773 5.1902 5.1902 5.3384 5.3384 5.4284 5.4284 5.6440 5.6440 5.8692 5.8692 10.6695 10.6695 10.9082 10.9082 11.1746 11.1746 11.3766 11.3766 12.0832 12.0832 12.3618 12.3618 k =-0.1458 0.0930 0.1730 ( 5280 PWs) bands (ev): -12.9212 -12.9212 -12.1294 -12.1294 -11.2273 -11.2273 -11.2199 -11.2199 -10.8170 -10.8170 -10.7822 -10.7822 -10.7644 -10.7644 -10.6408 -10.6408 -1.0629 -1.0629 0.4063 0.4063 0.6273 0.6273 0.8218 0.8218 0.8583 0.8583 1.7930 1.7930 2.0205 2.0205 2.2276 2.2276 2.2876 2.2876 2.9364 2.9364 2.9618 2.9618 3.2790 3.2790 3.5032 3.5032 3.7071 3.7071 4.5560 4.5560 4.6629 4.6629 4.9430 4.9430 5.1623 5.1623 5.1905 5.1905 5.2039 5.2039 5.3538 5.3538 5.4290 5.4290 5.6472 5.6472 5.8969 5.8969 10.6679 10.6679 10.9220 10.9220 11.1707 11.1707 11.3639 11.3639 12.1093 12.1093 12.3799 12.3799 k =-0.1354 0.0864 0.1606 ( 5272 PWs) bands (ev): -12.9355 -12.9355 -12.1209 -12.1209 -11.2304 -11.2304 -11.2231 -11.2231 -10.8112 -10.8112 -10.7680 -10.7680 -10.7607 -10.7607 -10.6431 -10.6431 -1.0919 -1.0919 0.4060 0.4060 0.5864 0.5864 0.8055 0.8055 0.8505 0.8505 1.7811 1.7811 2.0877 2.0877 2.1969 2.1969 2.2551 2.2551 2.9380 2.9380 2.9808 2.9808 3.3044 3.3044 3.4828 3.4828 3.7013 3.7013 4.5619 4.5619 4.6688 4.6688 5.0085 5.0085 5.1736 5.1736 5.2028 5.2028 5.2166 5.2166 5.3697 5.3697 5.4295 5.4295 5.6490 5.6490 5.9226 5.9226 10.6678 10.6678 10.9371 10.9371 11.1691 11.1691 11.3516 11.3516 12.1339 12.1339 12.3972 12.3972 k =-0.1250 0.0798 0.1483 ( 5276 PWs) bands (ev): -12.9490 -12.9490 -12.1131 -12.1131 -11.2337 -11.2337 -11.2263 -11.2263 -10.8050 -10.8050 -10.7582 -10.7582 -10.7531 -10.7531 -10.6453 -10.6453 -1.1204 -1.1204 0.4018 0.4018 0.5489 0.5489 0.7940 0.7940 0.8435 0.8435 1.7670 1.7670 2.1536 2.1536 2.1663 2.1663 2.2243 2.2243 2.9396 2.9396 2.9991 2.9991 3.3362 3.3362 3.4600 3.4600 3.6962 3.6962 4.5676 4.5676 4.6686 4.6686 5.0761 5.0761 5.1840 5.1840 5.2142 5.2142 5.2284 5.2284 5.3860 5.3860 5.4299 5.4299 5.6494 5.6494 5.9463 5.9463 10.6691 10.6691 10.9533 10.9533 11.1698 11.1698 11.3399 11.3399 12.1568 12.1568 12.4124 12.4124 k =-0.1146 0.0731 0.1359 ( 5268 PWs) bands (ev): -12.9617 -12.9617 -12.1061 -12.1061 -11.2370 -11.2370 -11.2295 -11.2295 -10.7987 -10.7987 -10.7546 -10.7546 -10.7400 -10.7400 -10.6473 -10.6473 -1.1483 -1.1483 0.3941 0.3941 0.5148 0.5148 0.7869 0.7869 0.8375 0.8375 1.7510 1.7510 2.1323 2.1323 2.1936 2.1936 2.2248 2.2248 2.9411 2.9411 3.0164 3.0164 3.3723 3.3723 3.4349 3.4349 3.6918 3.6918 4.5728 4.5728 4.6648 4.6648 5.1422 5.1422 5.1939 5.1939 5.2251 5.2251 5.2394 5.2394 5.4018 5.4018 5.4309 5.4309 5.6484 5.6484 5.9680 5.9680 10.6716 10.6716 10.9702 10.9702 11.1723 11.1723 11.3288 11.3288 12.1777 12.1777 12.4206 12.4206 k =-0.1042 0.0665 0.1236 ( 5264 PWs) bands (ev): -12.9735 -12.9735 -12.0999 -12.0999 -11.2402 -11.2402 -11.2325 -11.2325 -10.7925 -10.7925 -10.7512 -10.7512 -10.7272 -10.7272 -10.6492 -10.6492 -1.1750 -1.1750 0.3840 0.3840 0.4841 0.4841 0.7833 0.7833 0.8323 0.8323 1.7333 1.7333 2.1017 2.1017 2.1669 2.1669 2.2916 2.2916 2.9427 2.9427 3.0324 3.0324 3.4027 3.4027 3.4159 3.4159 3.6880 3.6880 4.5777 4.5777 4.6589 4.6589 5.1949 5.1949 5.2106 5.2106 5.2373 5.2373 5.2504 5.2504 5.4153 5.4153 5.4341 5.4341 5.6462 5.6462 5.9877 5.9877 10.6751 10.6751 10.9875 10.9875 11.1762 11.1762 11.3186 11.3186 12.1964 12.1964 12.4132 12.4132 k =-0.0938 0.0598 0.1112 ( 5262 PWs) bands (ev): -12.9843 -12.9843 -12.0943 -12.0943 -11.2432 -11.2432 -11.2353 -11.2353 -10.7865 -10.7865 -10.7480 -10.7480 -10.7152 -10.7152 -10.6509 -10.6509 -1.2003 -1.2003 0.3723 0.3723 0.4567 0.4567 0.7826 0.7826 0.8279 0.8279 1.7144 1.7144 2.0733 2.0733 2.1417 2.1417 2.3588 2.3588 2.9442 2.9442 3.0466 3.0466 3.3771 3.3771 3.4516 3.4516 3.6850 3.6850 4.5822 4.5822 4.6518 4.6518 5.2071 5.2071 5.2377 5.2377 5.2553 5.2553 5.2791 5.2791 5.4223 5.4223 5.4440 5.4440 5.6429 5.6429 6.0053 6.0053 10.6793 10.6793 11.0047 11.0047 11.1811 11.1811 11.3094 11.3094 12.2126 12.2126 12.3944 12.3944 k =-0.0833 0.0532 0.0988 ( 5280 PWs) bands (ev): -12.9941 -12.9941 -12.0895 -12.0895 -11.2461 -11.2461 -11.2380 -11.2380 -10.7810 -10.7810 -10.7448 -10.7448 -10.7042 -10.7042 -10.6524 -10.6524 -1.2239 -1.2239 0.3600 0.3600 0.4325 0.4325 0.7837 0.7837 0.8243 0.8243 1.6948 1.6948 2.0478 2.0478 2.1185 2.1185 2.4254 2.4254 2.9457 2.9457 3.0586 3.0586 3.3467 3.3467 3.4899 3.4899 3.6827 3.6827 4.5862 4.5862 4.6441 4.6441 5.2143 5.2143 5.2477 5.2477 5.2648 5.2648 5.3301 5.3301 5.4254 5.4254 5.4587 5.4587 5.6385 5.6385 6.0210 6.0210 10.6841 10.6841 11.0216 11.0216 11.1864 11.1864 11.3014 11.3014 12.2265 12.2265 12.3727 12.3727 k =-0.0729 0.0465 0.0865 ( 5286 PWs) bands (ev): -13.0029 -13.0029 -12.0853 -12.0853 -11.2486 -11.2486 -11.2404 -11.2404 -10.7760 -10.7760 -10.7417 -10.7417 -10.6942 -10.6942 -10.6538 -10.6538 -1.2455 -1.2455 0.3477 0.3477 0.4114 0.4114 0.7862 0.7862 0.8215 0.8215 1.6751 1.6751 2.0257 2.0257 2.0978 2.0978 2.4913 2.4913 2.9471 2.9471 3.0674 3.0674 3.3155 3.3155 3.5261 3.5261 3.6811 3.6811 4.5897 4.5897 4.6364 4.6364 5.2203 5.2203 5.2553 5.2553 5.2724 5.2724 5.3743 5.3743 5.4311 5.4311 5.4747 5.4747 5.6332 5.6332 6.0347 6.0347 10.6891 10.6891 11.0376 11.0376 11.1917 11.1917 11.2950 11.2950 12.2378 12.2378 12.3512 12.3512 k =-0.0625 0.0399 0.0741 ( 5290 PWs) bands (ev): -13.0105 -13.0105 -12.0817 -12.0817 -11.2509 -11.2509 -11.2425 -11.2425 -10.7717 -10.7717 -10.7387 -10.7387 -10.6854 -10.6854 -10.6548 -10.6548 -1.2648 -1.2648 0.3360 0.3360 0.3933 0.3933 0.7891 0.7891 0.8195 0.8195 1.6559 1.6559 2.0068 2.0068 2.0794 2.0794 2.5559 2.5559 2.9483 2.9483 3.0719 3.0719 3.2847 3.2847 3.5589 3.5589 3.6804 3.6804 4.5927 4.5927 4.6290 4.6290 5.2255 5.2255 5.2619 5.2619 5.2790 5.2790 5.3992 5.3992 5.4495 5.4495 5.4912 5.4912 5.6270 5.6270 6.0465 6.0465 10.6941 10.6941 11.0524 11.0524 11.1964 11.1964 11.2902 11.2902 12.2467 12.2468 12.3311 12.3311 k =-0.0521 0.0332 0.0618 ( 5294 PWs) bands (ev): -13.0171 -13.0171 -12.0788 -12.0788 -11.2529 -11.2529 -11.2444 -11.2444 -10.7682 -10.7682 -10.7359 -10.7359 -10.6779 -10.6779 -10.6556 -10.6556 -1.2816 -1.2816 0.3255 0.3255 0.3782 0.3782 0.7921 0.7921 0.8184 0.8184 1.6381 1.6381 1.9913 1.9913 2.0637 2.0637 2.6191 2.6191 2.9494 2.9494 3.0701 3.0701 3.2564 3.2564 3.5871 3.5871 3.6809 3.6809 4.5951 4.5951 4.6224 4.6224 5.2299 5.2299 5.2675 5.2675 5.2847 5.2847 5.4058 5.4058 5.4784 5.4784 5.5087 5.5087 5.6201 5.6201 6.0564 6.0564 10.6989 10.6989 11.0657 11.0657 11.2001 11.2001 11.2871 11.2871 12.2532 12.2532 12.3136 12.3136 k =-0.0417 0.0266 0.0494 ( 5287 PWs) bands (ev): -13.0225 -13.0225 -12.0764 -12.0764 -11.2545 -11.2545 -11.2459 -11.2459 -10.7653 -10.7653 -10.7334 -10.7334 -10.6720 -10.6720 -10.6560 -10.6560 -1.2956 -1.2956 0.3165 0.3165 0.3659 0.3659 0.7946 0.7946 0.8180 0.8180 1.6224 1.6224 1.9790 1.9790 2.0507 2.0507 2.6805 2.6805 2.9502 2.9502 3.0596 3.0596 3.2332 3.2332 3.6095 3.6095 3.6830 3.6830 4.5967 4.5967 4.6169 4.6169 5.2335 5.2335 5.2722 5.2722 5.2895 5.2895 5.4068 5.4068 5.5033 5.5033 5.5281 5.5281 5.6127 5.6127 6.0644 6.0644 10.7032 10.7032 11.0770 11.0770 11.2026 11.2026 11.2856 11.2856 12.2569 12.2569 12.2995 12.2995 k =-0.0312 0.0199 0.0371 ( 5289 PWs) bands (ev): -13.0267 -13.0267 -12.0745 -12.0745 -11.2557 -11.2557 -11.2471 -11.2471 -10.7631 -10.7631 -10.7314 -10.7314 -10.6676 -10.6676 -10.6560 -10.6560 -1.3067 -1.3067 0.3093 0.3093 0.3564 0.3564 0.7963 0.7963 0.8183 0.8183 1.6094 1.6094 1.9696 1.9696 2.0405 2.0405 2.7393 2.7393 2.9507 2.9507 3.0388 3.0388 3.2170 3.2170 3.6254 3.6254 3.6866 3.6866 4.5975 4.5975 4.6129 4.6129 5.2363 5.2363 5.2760 5.2760 5.2934 5.2934 5.4063 5.4063 5.5217 5.5217 5.5471 5.5471 5.6054 5.6054 6.0706 6.0706 10.7068 10.7068 11.0861 11.0861 11.2042 11.2042 11.2853 11.2853 12.2574 12.2574 12.2901 12.2901 k =-0.0208 0.0133 0.0247 ( 5277 PWs) bands (ev): -13.0298 -13.0298 -12.0733 -12.0733 -11.2566 -11.2566 -11.2480 -11.2480 -10.7616 -10.7616 -10.7298 -10.7298 -10.6650 -10.6650 -10.6554 -10.6554 -1.3147 -1.3147 0.3039 0.3039 0.3497 0.3497 0.7975 0.7975 0.8189 0.8189 1.5997 1.5997 1.9631 1.9631 2.0332 2.0332 2.7947 2.7947 2.9506 2.9506 3.0092 3.0092 3.2075 3.2075 3.6352 3.6352 3.6912 3.6912 4.5974 4.5974 4.6105 4.6105 5.2383 5.2383 5.2787 5.2787 5.2963 5.2963 5.4056 5.4056 5.5361 5.5361 5.5607 5.5607 5.5994 5.5994 6.0751 6.0751 10.7095 10.7095 11.0927 11.0927 11.2049 11.2049 11.2857 11.2857 12.2553 12.2553 12.2854 12.2854 k =-0.0104 0.0066 0.0124 ( 5277 PWs) bands (ev): -13.0316 -13.0316 -12.0725 -12.0725 -11.2572 -11.2572 -11.2485 -11.2485 -10.7607 -10.7607 -10.7288 -10.7288 -10.6638 -10.6638 -10.6548 -10.6548 -1.3196 -1.3196 0.3007 0.3007 0.3457 0.3457 0.7980 0.7980 0.8194 0.8194 1.5937 1.5937 1.9592 1.9592 2.0287 2.0287 2.8432 2.8432 2.9480 2.9480 2.9776 2.9776 3.2030 3.2030 3.6401 3.6401 3.6951 3.6951 4.5969 4.5969 4.6095 4.6095 5.2396 5.2396 5.2803 5.2803 5.2980 5.2980 5.4050 5.4050 5.5477 5.5477 5.5651 5.5651 5.5967 5.5967 6.0777 6.0777 10.7111 10.7111 11.0968 11.0968 11.2052 11.2052 11.2861 11.2861 12.2526 12.2526 12.2837 12.2837 k = 0.0000 0.0000 0.0000 ( 5277 PWs) bands (ev): -13.0322 -13.0322 -12.0722 -12.0722 -11.2574 -11.2574 -11.2487 -11.2487 -10.7604 -10.7604 -10.7285 -10.7285 -10.6635 -10.6635 -10.6544 -10.6544 -1.3212 -1.3212 0.2996 0.2996 0.3444 0.3444 0.7982 0.7982 0.8197 0.8197 1.5917 1.5917 1.9579 1.9579 2.0273 2.0273 2.8687 2.8687 2.9405 2.9405 2.9642 2.9642 3.2016 3.2016 3.6416 3.6416 3.6965 3.6965 4.5966 4.5966 4.6092 4.6092 5.2400 5.2400 5.2809 5.2809 5.2986 5.2986 5.4047 5.4047 5.5540 5.5540 5.5635 5.5635 5.5965 5.5965 6.0786 6.0786 10.7117 10.7117 11.0981 11.0981 11.2053 11.2053 11.2863 11.2863 12.2515 12.2515 12.2833 12.2833 k = 0.0000 0.0000 0.0000 ( 5277 PWs) bands (ev): -13.0322 -13.0322 -12.0722 -12.0722 -11.2574 -11.2574 -11.2487 -11.2487 -10.7604 -10.7604 -10.7285 -10.7285 -10.6635 -10.6635 -10.6544 -10.6544 -1.3212 -1.3212 0.2996 0.2996 0.3444 0.3444 0.7982 0.7982 0.8197 0.8197 1.5917 1.5917 1.9579 1.9579 2.0273 2.0273 2.8687 2.8687 2.9405 2.9405 2.9642 2.9642 3.2016 3.2016 3.6416 3.6416 3.6965 3.6965 4.5966 4.5966 4.6092 4.6092 5.2400 5.2400 5.2809 5.2809 5.2986 5.2986 5.4047 5.4047 5.5540 5.5540 5.5635 5.5635 5.5965 5.5965 6.0786 6.0786 10.7117 10.7117 11.0981 11.0981 11.2053 11.2053 11.2863 11.2863 12.2515 12.2515 12.2833 12.2833 k = 0.0094 0.0148-0.0000 ( 5277 PWs) bands (ev): -13.0314 -13.0314 -12.0725 -12.0725 -11.2583 -11.2583 -11.2485 -11.2485 -10.7604 -10.7604 -10.7285 -10.7285 -10.6635 -10.6635 -10.6546 -10.6546 -1.3195 -1.3195 0.2676 0.2676 0.3731 0.3731 0.7998 0.7998 0.8213 0.8213 1.5902 1.5902 1.9618 1.9618 2.0283 2.0283 2.8699 2.8699 2.9403 2.9403 2.9638 2.9638 3.2031 3.2031 3.6426 3.6426 3.6974 3.6974 4.5900 4.5900 4.6026 4.6026 5.2391 5.2391 5.2819 5.2819 5.2997 5.2997 5.4017 5.4017 5.5558 5.5558 5.5626 5.5626 5.5985 5.5985 6.0786 6.0786 10.7119 10.7119 11.0989 11.0989 11.2061 11.2061 11.2870 11.2870 12.2510 12.2510 12.2832 12.2832 k = 0.0189 0.0296-0.0000 ( 5273 PWs) bands (ev): -13.0290 -13.0290 -12.0734 -12.0734 -11.2611 -11.2611 -11.2481 -11.2481 -10.7602 -10.7602 -10.7284 -10.7284 -10.6638 -10.6638 -10.6549 -10.6549 -1.3144 -1.3144 0.2176 0.2176 0.4133 0.4133 0.8048 0.8048 0.8262 0.8262 1.5856 1.5856 1.9732 1.9732 2.0312 2.0312 2.8733 2.8733 2.9396 2.9396 2.9627 2.9627 3.2075 3.2075 3.6455 3.6455 3.6998 3.6998 4.5704 4.5704 4.5832 4.5832 5.2365 5.2365 5.2845 5.2845 5.3027 5.3027 5.3925 5.3925 5.5592 5.5592 5.5619 5.5619 5.6043 5.6043 6.0786 6.0786 10.7123 10.7123 11.1012 11.1012 11.2083 11.2083 11.2892 11.2892 12.2494 12.2494 12.2827 12.2827 k = 0.0283 0.0444-0.0000 ( 5273 PWs) bands (ev): -13.0250 -13.0250 -12.0748 -12.0748 -11.2657 -11.2657 -11.2473 -11.2473 -10.7599 -10.7599 -10.7283 -10.7283 -10.6641 -10.6641 -10.6554 -10.6554 -1.3060 -1.3060 0.1635 0.1635 0.4512 0.4512 0.8130 0.8130 0.8343 0.8343 1.5780 1.5780 1.9919 1.9919 2.0362 2.0362 2.8791 2.8791 2.9385 2.9385 2.9609 2.9609 3.2147 3.2147 3.6504 3.6504 3.7039 3.7039 4.5391 4.5391 4.5521 4.5521 5.2321 5.2321 5.2876 5.2876 5.3066 5.3066 5.3770 5.3770 5.5552 5.5552 5.5707 5.5707 5.6140 5.6140 6.0786 6.0786 10.7131 10.7131 11.1050 11.1050 11.2121 11.2121 11.2929 11.2929 12.2468 12.2468 12.2819 12.2819 k = 0.0378 0.0592-0.0000 ( 5265 PWs) bands (ev): -13.0194 -13.0194 -12.0769 -12.0769 -11.2721 -11.2721 -11.2461 -11.2461 -10.7595 -10.7595 -10.7281 -10.7281 -10.6646 -10.6646 -10.6561 -10.6561 -1.2943 -1.2943 0.1069 0.1069 0.4856 0.4856 0.8244 0.8244 0.8457 0.8457 1.5675 1.5675 2.0177 2.0177 2.0432 2.0432 2.8871 2.8871 2.9369 2.9369 2.9585 2.9585 3.2247 3.2247 3.6572 3.6572 3.7095 3.7095 4.4977 4.4977 4.5108 4.5108 5.2260 5.2260 5.2901 5.2901 5.3104 5.3104 5.3554 5.3554 5.5489 5.5489 5.5836 5.5836 5.6270 5.6270 6.0785 6.0785 10.7142 10.7142 11.1103 11.1103 11.2172 11.2172 11.2979 11.2979 12.2432 12.2432 12.2808 12.2808 k = 0.0472 0.0740-0.0000 ( 5277 PWs) bands (ev): -13.0123 -13.0123 -12.0795 -12.0795 -11.2802 -11.2802 -11.2447 -11.2447 -10.7590 -10.7590 -10.7280 -10.7280 -10.6652 -10.6652 -10.6570 -10.6570 -1.2793 -1.2793 0.0485 0.0485 0.5164 0.5164 0.8391 0.8391 0.8603 0.8603 1.5541 1.5541 2.0499 2.0499 2.0521 2.0521 2.8972 2.8972 2.9350 2.9350 2.9555 2.9555 3.2374 3.2374 3.6656 3.6656 3.7165 3.7165 4.4478 4.4478 4.4611 4.4611 5.2181 5.2181 5.2896 5.2896 5.3132 5.3132 5.3288 5.3288 5.5409 5.5409 5.5999 5.5999 5.6431 5.6431 6.0783 6.0783 10.7157 10.7157 11.1170 11.1170 11.2236 11.2236 11.3041 11.3041 12.2384 12.2384 12.2794 12.2794 k = 0.0567 0.0889-0.0000 ( 5285 PWs) bands (ev): -13.0036 -13.0036 -12.0828 -12.0828 -11.2901 -11.2901 -11.2428 -11.2428 -10.7584 -10.7584 -10.7279 -10.7279 -10.6659 -10.6659 -10.6580 -10.6580 -1.2610 -1.2610 -0.0112 -0.0112 0.5435 0.5435 0.8570 0.8570 0.8780 0.8780 1.5381 1.5381 2.0631 2.0631 2.0881 2.0881 2.9092 2.9092 2.9327 2.9327 2.9522 2.9522 3.2525 3.2525 3.6757 3.6757 3.7248 3.7248 4.3909 4.3909 4.4044 4.4044 5.2086 5.2086 5.2772 5.2772 5.3060 5.3060 5.3143 5.3143 5.5312 5.5312 5.6188 5.6188 5.6614 5.6614 6.0778 6.0778 10.7174 10.7174 11.1250 11.1250 11.2313 11.2313 11.3116 11.3116 12.2326 12.2326 12.2779 12.2779 k = 0.0661 0.1037-0.0000 ( 5281 PWs) bands (ev): -12.9934 -12.9934 -12.0867 -12.0867 -11.3017 -11.3017 -11.2406 -11.2406 -10.7578 -10.7578 -10.7279 -10.7279 -10.6666 -10.6666 -10.6592 -10.6592 -1.2395 -1.2395 -0.0718 -0.0718 0.5672 0.5672 0.8779 0.8779 0.8988 0.8988 1.5194 1.5194 2.0760 2.0760 2.1315 2.1315 2.9224 2.9224 2.9300 2.9300 2.9492 2.9492 3.2701 3.2701 3.6871 3.6871 3.7344 3.7344 4.3285 4.3285 4.3421 4.3421 5.1976 5.1976 5.2421 5.2421 5.2979 5.2979 5.3134 5.3134 5.5198 5.5198 5.6394 5.6394 5.6812 5.6812 6.0771 6.0771 10.7194 10.7194 11.1344 11.1344 11.2401 11.2401 11.3202 11.3202 12.2256 12.2256 12.2762 12.2762 k = 0.0756 0.1185-0.0000 ( 5281 PWs) bands (ev): -12.9817 -12.9817 -12.0912 -12.0912 -11.3148 -11.3148 -11.2381 -11.2381 -10.7571 -10.7571 -10.7280 -10.7280 -10.6672 -10.6672 -10.6604 -10.6604 -1.2149 -1.2149 -0.1328 -0.1328 0.5877 0.5877 0.9020 0.9020 0.9227 0.9227 1.4982 1.4982 2.0908 2.0908 2.1793 2.1793 2.9270 2.9270 2.9331 2.9331 2.9504 2.9504 3.2899 3.2899 3.6998 3.6998 3.7450 3.7450 4.2618 4.2618 4.2754 4.2754 5.1852 5.1852 5.1963 5.1963 5.2928 5.2928 5.3106 5.3106 5.5069 5.5069 5.6609 5.6609 5.7019 5.7019 6.0759 6.0759 10.7217 10.7217 11.1449 11.1449 11.2498 11.2498 11.3297 11.3297 12.2175 12.2175 12.2743 12.2743 k = 0.0850 0.1333-0.0000 ( 5277 PWs) bands (ev): -12.9685 -12.9685 -12.0964 -12.0964 -11.3295 -11.3295 -11.2351 -11.2351 -10.7565 -10.7565 -10.7283 -10.7283 -10.6678 -10.6678 -10.6617 -10.6617 -1.1872 -1.1872 -0.1939 -0.1939 0.6054 0.6054 0.9290 0.9290 0.9496 0.9496 1.4747 1.4747 2.1076 2.1076 2.2307 2.2307 2.9237 2.9237 2.9333 2.9333 2.9636 2.9636 3.3117 3.3117 3.7135 3.7135 3.7565 3.7565 4.1916 4.1916 4.2053 4.2053 5.1441 5.1441 5.1714 5.1714 5.2869 5.2869 5.3058 5.3058 5.4924 5.4924 5.6825 5.6825 5.7226 5.7226 6.0742 6.0742 10.7244 10.7244 11.1565 11.1565 11.2604 11.2604 11.3401 11.3401 12.2082 12.2082 12.2725 12.2725 k = 0.0945 0.1481-0.0000 ( 5277 PWs) bands (ev): -12.9539 -12.9539 -12.1023 -12.1023 -11.3456 -11.3456 -11.2317 -11.2317 -10.7559 -10.7559 -10.7287 -10.7287 -10.6682 -10.6682 -10.6630 -10.6630 -1.1565 -1.1565 -0.2548 -0.2548 0.6207 0.6207 0.9590 0.9590 0.9794 0.9794 1.4491 1.4491 2.1264 2.1264 2.2848 2.2848 2.9200 2.9200 2.9289 2.9289 2.9830 2.9830 3.3353 3.3353 3.7281 3.7281 3.7687 3.7687 4.1190 4.1190 4.1328 4.1328 5.0865 5.0865 5.1564 5.1564 5.2798 5.2798 5.2991 5.2991 5.4765 5.4765 5.7036 5.7036 5.7429 5.7429 6.0718 6.0718 10.7273 10.7273 11.1691 11.1691 11.2717 11.2717 11.3511 11.3511 12.1978 12.1978 12.2707 12.2707 k = 0.1039 0.1629-0.0000 ( 5265 PWs) bands (ev): -12.9379 -12.9379 -12.1089 -12.1089 -11.3630 -11.3630 -11.2279 -11.2279 -10.7554 -10.7554 -10.7295 -10.7295 -10.6684 -10.6684 -10.6643 -10.6643 -1.1230 -1.1230 -0.3152 -0.3152 0.6339 0.6339 0.9918 0.9918 1.0119 1.0119 1.4213 1.4213 2.1471 2.1471 2.3408 2.3408 2.9158 2.9158 2.9231 2.9231 3.0053 3.0053 3.3607 3.3607 3.7433 3.7433 3.7814 3.7814 4.0448 4.0448 4.0585 4.0585 5.0243 5.0243 5.1404 5.1404 5.2713 5.2713 5.2909 5.2909 5.4593 5.4593 5.7238 5.7238 5.7624 5.7624 6.0687 6.0687 10.7305 10.7305 11.1826 11.1826 11.2836 11.2836 11.3627 11.3627 12.1862 12.1862 12.2691 12.2691 k = 0.1134 0.1777-0.0000 ( 5265 PWs) bands (ev): -12.9205 -12.9205 -12.1161 -12.1161 -11.3816 -11.3816 -11.2237 -11.2237 -10.7551 -10.7551 -10.7305 -10.7305 -10.6684 -10.6684 -10.6654 -10.6654 -1.0866 -1.0866 -0.3747 -0.3747 0.6455 0.6455 1.0273 1.0273 1.0473 1.0473 1.3916 1.3916 2.1697 2.1697 2.3976 2.3976 2.9111 2.9111 2.9165 2.9165 3.0299 3.0299 3.3875 3.3875 3.7589 3.7589 3.7944 3.7944 3.9697 3.9697 3.9834 3.9834 4.9578 4.9578 5.1233 5.1233 5.2617 5.2617 5.2812 5.2812 5.4408 5.4408 5.7427 5.7427 5.7806 5.7806 6.0646 6.0646 10.7341 10.7341 11.1968 11.1968 11.2958 11.2958 11.3746 11.3746 12.1734 12.1734 12.2676 12.2676 k = 0.1228 0.1925-0.0000 ( 5265 PWs) bands (ev): -12.9019 -12.9019 -12.1241 -12.1241 -11.4014 -11.4014 -11.2191 -11.2191 -10.7550 -10.7550 -10.7320 -10.7320 -10.6680 -10.6680 -10.6663 -10.6663 -1.0475 -1.0475 -0.4332 -0.4332 0.6558 0.6558 1.0654 1.0654 1.0852 1.0852 1.3601 1.3601 2.1942 2.1942 2.4543 2.4543 2.9055 2.9055 2.9091 2.9091 3.0570 3.0570 3.4155 3.4155 3.7746 3.7746 3.8072 3.8072 3.8949 3.8949 3.9082 3.9082 4.8874 4.8874 5.1054 5.1054 5.2511 5.2511 5.2703 5.2703 5.4211 5.4211 5.7602 5.7602 5.7973 5.7973 6.0596 6.0596 10.7379 10.7379 11.2116 11.2116 11.3084 11.3084 11.3869 11.3869 12.1595 12.1595 12.2665 12.2665 k = 0.1323 0.2073-0.0000 ( 5273 PWs) bands (ev): -12.8821 -12.8821 -12.1328 -12.1328 -11.4221 -11.4221 -11.2140 -11.2140 -10.7552 -10.7552 -10.7338 -10.7338 -10.6673 -10.6673 -10.6670 -10.6670 -1.0058 -1.0058 -0.4905 -0.4905 0.6651 0.6651 1.1060 1.1060 1.1256 1.1256 1.3269 1.3269 2.2206 2.2206 2.5099 2.5099 2.8989 2.8989 2.9005 2.9005 3.0865 3.0865 3.4447 3.4447 3.7901 3.7901 3.8120 3.8120 3.8288 3.8288 3.8340 3.8340 4.8137 4.8137 5.0867 5.0867 5.2396 5.2396 5.2584 5.2584 5.4004 5.4004 5.7759 5.7759 5.8125 5.8125 6.0535 6.0535 10.7421 10.7421 11.2269 11.2269 11.3210 11.3210 11.3992 11.3992 12.1444 12.1444 12.2658 12.2658 k = 0.1417 0.2221-0.0000 ( 5273 PWs) bands (ev): -12.8611 -12.8611 -12.1421 -12.1421 -11.4438 -11.4438 -11.2086 -11.2086 -10.7556 -10.7556 -10.7360 -10.7360 -10.6674 -10.6674 -10.6662 -10.6662 -0.9616 -0.9616 -0.5463 -0.5463 0.6738 0.6738 1.1490 1.1490 1.1683 1.1683 1.2922 1.2922 2.2488 2.2488 2.5635 2.5635 2.8905 2.8905 2.8908 2.8908 3.1188 3.1188 3.4748 3.4748 3.7460 3.7460 3.7604 3.7604 3.8063 3.8063 3.8348 3.8348 4.7370 4.7370 5.0674 5.0674 5.2275 5.2275 5.2456 5.2456 5.3787 5.3787 5.7900 5.7900 5.8259 5.8259 6.0461 6.0461 10.7466 10.7466 11.2426 11.2426 11.3337 11.3337 11.4116 11.4116 12.1282 12.1282 12.2656 12.2656 k = 0.1512 0.2369-0.0000 ( 5273 PWs) bands (ev): -12.8390 -12.8390 -12.1521 -12.1521 -11.4661 -11.4661 -11.2028 -11.2028 -10.7564 -10.7564 -10.7386 -10.7386 -10.6675 -10.6675 -10.6647 -10.6647 -0.9150 -0.9150 -0.6004 -0.6004 0.6820 0.6820 1.1942 1.1942 1.2130 1.2130 1.2560 1.2560 2.2789 2.2789 2.6141 2.6141 2.8786 2.8786 2.8806 2.8806 3.1541 3.1541 3.5056 3.5056 3.6763 3.6763 3.6904 3.6904 3.8210 3.8210 3.8467 3.8467 4.6578 4.6578 5.0475 5.0475 5.2148 5.2148 5.2322 5.2322 5.3560 5.3560 5.8023 5.8023 5.8376 5.8376 6.0374 6.0374 10.7514 10.7514 11.2584 11.2584 11.3464 11.3464 11.4240 11.4240 12.1108 12.1108 12.2660 12.2660 k = 0.1606 0.2518-0.0000 ( 5269 PWs) bands (ev): -12.8159 -12.8159 -12.1628 -12.1628 -11.4891 -11.4891 -11.1967 -11.1967 -10.7576 -10.7576 -10.7416 -10.7416 -10.6671 -10.6671 -10.6630 -10.6630 -0.8661 -0.8661 -0.6527 -0.6527 0.6902 0.6902 1.2178 1.2178 1.2414 1.2414 1.2605 1.2605 2.3109 2.3109 2.6609 2.6609 2.8641 2.8641 2.8676 2.8676 3.1924 3.1924 3.5368 3.5368 3.6104 3.6104 3.6241 3.6241 3.8351 3.8351 3.8580 3.8580 4.5764 4.5764 5.0272 5.0272 5.2017 5.2017 5.2183 5.2183 5.3326 5.3326 5.8128 5.8128 5.8476 5.8476 6.0272 6.0272 10.7565 10.7565 11.2744 11.2744 11.3588 11.3588 11.4361 11.4361 12.0924 12.0924 12.2671 12.2671 k = 0.1701 0.2666-0.0000 ( 5245 PWs) bands (ev): -12.7920 -12.7920 -12.1741 -12.1741 -11.5125 -11.5125 -11.1903 -11.1903 -10.7593 -10.7593 -10.7448 -10.7448 -10.6663 -10.6663 -10.6608 -10.6608 -0.8151 -0.8151 -0.7031 -0.7031 0.6985 0.6985 1.1789 1.1789 1.2903 1.2903 1.3091 1.3091 2.3447 2.3447 2.7032 2.7032 2.8463 2.8463 2.8509 2.8509 3.2340 3.2340 3.5489 3.5489 3.5628 3.5628 3.5691 3.5691 3.8483 3.8483 3.8684 3.8684 4.4932 4.4932 5.0065 5.0065 5.1886 5.1886 5.2041 5.2041 5.3085 5.3085 5.8216 5.8216 5.8558 5.8558 6.0155 6.0155 10.7620 10.7620 11.2902 11.2902 11.3710 11.3710 11.4480 11.4480 12.0728 12.0728 12.2690 12.2690 k = 0.1795 0.2814-0.0000 ( 5249 PWs) bands (ev): -12.7673 -12.7673 -12.1859 -12.1859 -11.5361 -11.5361 -11.1837 -11.1837 -10.7613 -10.7613 -10.7484 -10.7484 -10.6651 -10.6651 -10.6584 -10.6584 -0.7620 -0.7620 -0.7514 -0.7514 0.7070 0.7070 1.1386 1.1386 1.3409 1.3409 1.3594 1.3594 2.3802 2.3802 2.7401 2.7401 2.8246 2.8246 2.8294 2.8294 3.2785 3.2785 3.4951 3.4951 3.5079 3.5079 3.6006 3.6006 3.8601 3.8601 3.8775 3.8775 4.4087 4.4087 4.9855 4.9855 5.1755 5.1755 5.1899 5.1899 5.2839 5.2839 5.8287 5.8287 5.8624 5.8624 6.0021 6.0021 10.7679 10.7679 11.3059 11.3059 11.3829 11.3829 11.4596 11.4596 12.0523 12.0523 12.2718 12.2718 k = 0.1890 0.2962-0.0000 ( 5249 PWs) bands (ev): -12.7419 -12.7419 -12.1983 -12.1983 -11.5599 -11.5599 -11.1769 -11.1769 -10.7637 -10.7637 -10.7523 -10.7523 -10.6634 -10.6634 -10.6557 -10.6557 -0.7975 -0.7975 -0.7070 -0.7070 0.7160 0.7160 1.0971 1.0971 1.3928 1.3928 1.4111 1.4111 2.4175 2.4175 2.7688 2.7688 2.8010 2.8010 2.8024 2.8024 3.3256 3.3256 3.4490 3.4490 3.4607 3.4607 3.6323 3.6323 3.8704 3.8704 3.8851 3.8851 4.3232 4.3232 4.9644 4.9644 5.1626 5.1626 5.1759 5.1759 5.2587 5.2587 5.8341 5.8341 5.8672 5.8672 5.9870 5.9870 10.7742 10.7742 11.3213 11.3213 11.3945 11.3945 11.4709 11.4709 12.0308 12.0308 12.2756 12.2756 k = 0.1984 0.3110-0.0000 ( 5265 PWs) bands (ev): -12.7159 -12.7159 -12.2112 -12.2112 -11.5835 -11.5835 -11.1700 -11.1700 -10.7665 -10.7665 -10.7564 -10.7564 -10.6614 -10.6614 -10.6528 -10.6528 -0.8412 -0.8412 -0.6503 -0.6503 0.7256 0.7256 1.0543 1.0543 1.4458 1.4458 1.4638 1.4638 2.4565 2.4565 2.7581 2.7581 2.7691 2.7691 2.8060 2.8060 3.3747 3.3747 3.4120 3.4120 3.4225 3.4225 3.6638 3.6638 3.8790 3.8790 3.8909 3.8909 4.2373 4.2373 4.9432 4.9432 5.1503 5.1503 5.1622 5.1622 5.2331 5.2331 5.8379 5.8379 5.8704 5.8704 5.9701 5.9701 10.7808 10.7808 11.3362 11.3362 11.4057 11.4057 11.4817 11.4817 12.0085 12.0085 12.2804 12.2804 k = 0.2079 0.3258-0.0000 ( 5265 PWs) bands (ev): -12.6896 -12.6896 -12.2245 -12.2245 -11.6069 -11.6069 -11.1630 -11.1630 -10.7697 -10.7697 -10.7606 -10.7606 -10.6590 -10.6590 -10.6496 -10.6496 -0.8825 -0.8825 -0.5919 -0.5919 0.7359 0.7359 1.0105 1.0105 1.4994 1.4994 1.5174 1.5174 2.4973 2.4973 2.7208 2.7208 2.7295 2.7295 2.8270 2.8270 3.3846 3.3846 3.3924 3.3924 3.4265 3.4265 3.6946 3.6946 3.8855 3.8855 3.8946 3.8946 4.1513 4.1513 4.9220 4.9220 5.1386 5.1386 5.1492 5.1492 5.2073 5.2073 5.8401 5.8401 5.8721 5.8721 5.9514 5.9514 10.7880 10.7880 11.3506 11.3506 11.4166 11.4166 11.4922 11.4922 11.9854 11.9854 12.2863 12.2863 k = 0.2173 0.3406-0.0000 ( 5277 PWs) bands (ev): -12.6632 -12.6632 -12.2382 -12.2382 -11.6298 -11.6298 -11.1561 -11.1561 -10.7731 -10.7731 -10.7650 -10.7650 -10.6562 -10.6562 -10.6463 -10.6463 -0.9213 -0.9213 -0.5320 -0.5320 0.7470 0.7470 0.9655 0.9655 1.5534 1.5534 1.5712 1.5712 2.5396 2.5396 2.6767 2.6767 2.6842 2.6842 2.8449 2.8449 3.3667 3.3667 3.3728 3.3728 3.4779 3.4779 3.7244 3.7244 3.8898 3.8898 3.8959 3.8959 4.0662 4.0662 4.9009 4.9009 5.1277 5.1277 5.1369 5.1369 5.1812 5.1812 5.8408 5.8408 5.8722 5.8722 5.9307 5.9307 10.7955 10.7955 11.3643 11.3643 11.4270 11.4270 11.5022 11.5022 11.9618 11.9618 12.2934 12.2934 k = 0.2268 0.3554-0.0000 ( 5285 PWs) bands (ev): -12.6367 -12.6367 -12.2522 -12.2522 -11.6519 -11.6519 -11.1492 -11.1492 -10.7767 -10.7767 -10.7695 -10.7695 -10.6531 -10.6531 -10.6428 -10.6428 -0.9574 -0.9574 -0.4708 -0.4708 0.7590 0.7590 0.9195 0.9195 1.6072 1.6072 1.6250 1.6250 2.5833 2.5833 2.6279 2.6279 2.6346 2.6346 2.8589 2.8589 3.3578 3.3578 3.3618 3.3618 3.5299 3.5299 3.7520 3.7520 3.8917 3.8917 3.8933 3.8933 3.9844 3.9844 4.8799 4.8799 5.1178 5.1178 5.1257 5.1257 5.1551 5.1551 5.8399 5.8399 5.8707 5.8707 5.9080 5.9080 10.8036 10.8036 11.3772 11.3772 11.4371 11.4371 11.5117 11.5117 11.9377 11.9377 12.3016 12.3016 k = 0.2362 0.3702-0.0000 ( 5277 PWs) bands (ev): -12.6104 -12.6104 -12.2664 -12.2664 -11.6730 -11.6730 -11.1426 -11.1426 -10.7806 -10.7806 -10.7741 -10.7741 -10.6498 -10.6498 -10.6392 -10.6392 -0.9909 -0.9909 -0.4084 -0.4084 0.7719 0.7719 0.8726 0.8726 1.6603 1.6603 1.6781 1.6781 2.5761 2.5761 2.5803 2.5803 2.6303 2.6303 2.8692 2.8692 3.3570 3.3570 3.3589 3.3589 3.5815 3.5815 3.7736 3.7736 3.8764 3.8764 3.8909 3.8909 3.9201 3.9201 4.8591 4.8591 5.1092 5.1092 5.1157 5.1157 5.1289 5.1289 5.8376 5.8376 5.8674 5.8674 5.8836 5.8836 10.8122 10.8122 11.3893 11.3893 11.4469 11.4469 11.5208 11.5208 11.9133 11.9133 12.3109 12.3109 k = 0.2457 0.3850-0.0000 ( 5277 PWs) bands (ev): -12.5846 -12.5846 -12.2808 -12.2808 -11.6929 -11.6929 -11.1362 -11.1362 -10.7846 -10.7846 -10.7788 -10.7788 -10.6462 -10.6462 -10.6355 -10.6355 -1.0215 -1.0215 -0.3450 -0.3450 0.7858 0.7858 0.8246 0.8246 1.7118 1.7118 1.7298 1.7298 2.5228 2.5228 2.5264 2.5264 2.6771 2.6771 2.8758 2.8758 3.3633 3.3633 3.3635 3.3635 3.6323 3.6323 3.7646 3.7646 3.8418 3.8418 3.8875 3.8875 3.9016 3.9016 4.8386 4.8386 5.1016 5.1016 5.1029 5.1029 5.1070 5.1070 5.8338 5.8338 5.8550 5.8550 5.8648 5.8648 10.8213 10.8213 11.4005 11.4005 11.4563 11.4563 11.5295 11.5295 11.8889 11.8889 12.3213 12.3213 k = 0.2551 0.3999-0.0000 ( 5281 PWs) bands (ev): -12.5596 -12.5596 -12.2953 -12.2953 -11.7111 -11.7111 -11.1302 -11.1302 -10.7888 -10.7888 -10.7835 -10.7835 -10.6425 -10.6425 -10.6317 -10.6317 -1.0493 -1.0493 -0.2807 -0.2807 0.7758 0.7758 0.8007 0.8007 1.7607 1.7607 1.7789 1.7789 2.4701 2.4701 2.4726 2.4726 2.7258 2.7258 2.8791 2.8791 3.3743 3.3743 3.3763 3.3763 3.6816 3.6816 3.7005 3.7005 3.8446 3.8446 3.8812 3.8812 3.8982 3.8982 4.8184 4.8184 5.0767 5.0767 5.0957 5.0957 5.0996 5.0996 5.8269 5.8269 5.8285 5.8285 5.8581 5.8581 10.8310 10.8310 11.4106 11.4106 11.4655 11.4655 11.5377 11.5377 11.8646 11.8646 12.3325 12.3325 k = 0.2646 0.4147-0.0000 ( 5297 PWs) bands (ev): -12.5357 -12.5357 -12.3099 -12.3099 -11.7274 -11.7274 -11.1246 -11.1246 -10.7930 -10.7930 -10.7882 -10.7882 -10.6386 -10.6386 -10.6278 -10.6278 -1.0742 -1.0742 -0.2158 -0.2158 0.7262 0.7262 0.8165 0.8165 1.8055 1.8055 1.8239 1.8239 2.4201 2.4201 2.4216 2.4216 2.7761 2.7761 2.8793 2.8793 3.3913 3.3913 3.3949 3.3949 3.6223 3.6223 3.7290 3.7290 3.8488 3.8488 3.8722 3.8722 3.9049 3.9049 4.7986 4.7986 5.0510 5.0510 5.0911 5.0911 5.0938 5.0938 5.7959 5.7959 5.8217 5.8217 5.8506 5.8506 10.8413 10.8413 11.4198 11.4198 11.4744 11.4744 11.5455 11.5455 11.8407 11.8407 12.3443 12.3443 k = 0.2740 0.4295-0.0000 ( 5297 PWs) bands (ev): -12.5132 -12.5132 -12.3244 -12.3244 -11.7413 -11.7413 -11.1196 -11.1196 -10.7973 -10.7973 -10.7929 -10.7929 -10.6346 -10.6346 -10.6239 -10.6239 -1.0960 -1.0960 -0.1506 -0.1506 0.6760 0.6760 0.8333 0.8333 1.8439 1.8439 1.8625 1.8625 2.3755 2.3755 2.3762 2.3762 2.8279 2.8279 2.8765 2.8765 3.4137 3.4137 3.4185 3.4185 3.5428 3.5428 3.7742 3.7742 3.8422 3.8422 3.8606 3.8606 3.9215 3.9215 4.7793 4.7793 5.0255 5.0255 5.0878 5.0878 5.0894 5.0894 5.7628 5.7628 5.8134 5.8134 5.8416 5.8416 10.8522 10.8522 11.4278 11.4278 11.4831 11.4831 11.5528 11.5528 11.8173 11.8173 12.3562 12.3562 k = 0.2835 0.4443-0.0000 ( 5297 PWs) bands (ev): -12.4924 -12.4924 -12.3389 -12.3389 -11.7527 -11.7527 -11.1152 -11.1152 -10.8016 -10.8016 -10.7976 -10.7976 -10.6305 -10.6305 -10.6200 -10.6200 -1.1149 -1.1149 -0.0853 -0.0853 0.6252 0.6252 0.8510 0.8510 1.8728 1.8728 1.8913 1.8913 2.3399 2.3399 2.3401 2.3401 2.8709 2.8709 2.8810 2.8810 3.4412 3.4412 3.4441 3.4441 3.4670 3.4670 3.8153 3.8153 3.8288 3.8288 3.8478 3.8478 3.9423 3.9423 4.7604 4.7604 5.0005 5.0005 5.0859 5.0859 5.0865 5.0865 5.7275 5.7275 5.8036 5.8036 5.8311 5.8311 10.8637 10.8637 11.4346 11.4346 11.4917 11.4917 11.5596 11.5596 11.7949 11.7949 12.3675 12.3675 k = 0.2929 0.4591-0.0000 ( 5317 PWs) bands (ev): -12.4739 -12.4739 -12.3531 -12.3531 -11.7610 -11.7610 -11.1116 -11.1116 -10.8058 -10.8058 -10.8022 -10.8022 -10.6264 -10.6264 -10.6161 -10.6161 -1.1306 -1.1306 -0.0204 -0.0204 0.5744 0.5744 0.8696 0.8696 1.8885 1.8885 1.9063 1.9063 2.3173 2.3173 2.3178 2.3178 2.8626 2.8626 2.9355 2.9355 3.3848 3.3848 3.4734 3.4734 3.4819 3.4819 3.8113 3.8113 3.8243 3.8243 3.8620 3.8620 3.9637 3.9637 4.7420 4.7420 4.9759 4.9759 5.0850 5.0850 5.0852 5.0852 5.6901 5.6901 5.7921 5.7921 5.8190 5.8190 10.8758 10.8758 11.4403 11.4403 11.5001 11.5001 11.5659 11.5659 11.7736 11.7736 12.3773 12.3773 k = 0.3024 0.4739-0.0000 ( 5321 PWs) bands (ev): -12.4577 -12.4577 -12.3671 -12.3671 -11.7659 -11.7659 -11.1087 -11.1087 -10.8101 -10.8101 -10.8067 -10.8067 -10.6222 -10.6222 -10.6122 -10.6122 -1.1433 -1.1433 0.0432 0.0432 0.5242 0.5242 0.8891 0.8891 1.8881 1.8881 1.9045 1.9045 2.3106 2.3106 2.3123 2.3123 2.8519 2.8519 2.9914 2.9914 3.3095 3.3095 3.5101 3.5101 3.5189 3.5189 3.7910 3.7910 3.8059 3.8059 3.8983 3.8983 3.9846 3.9846 4.7242 4.7242 4.9518 4.9518 5.0848 5.0848 5.0857 5.0857 5.6506 5.6506 5.7790 5.7790 5.8053 5.8053 10.8886 10.8886 11.4447 11.4447 11.5085 11.5085 11.5718 11.5718 11.7536 11.7536 12.3842 12.3842 k = 0.3118 0.4887-0.0000 ( 5305 PWs) bands (ev): -12.4444 -12.4444 -12.3808 -12.3808 -11.7673 -11.7673 -11.1068 -11.1068 -10.8142 -10.8142 -10.8112 -10.8112 -10.6180 -10.6180 -10.6083 -10.6083 -1.1528 -1.1528 0.1039 0.1039 0.4760 0.4760 0.9092 0.9092 1.8722 1.8722 1.8865 1.8865 2.3197 2.3197 2.3232 2.3232 2.8389 2.8389 3.0485 3.0485 3.2361 3.2361 3.5509 3.5509 3.5599 3.5599 3.7685 3.7685 3.7840 3.7840 3.9331 3.9331 4.0046 4.0046 4.7070 4.7070 4.9283 4.9283 5.0857 5.0857 5.0873 5.0873 5.6091 5.6091 5.7643 5.7643 5.7899 5.7899 10.9021 10.9021 11.4479 11.4479 11.5169 11.5169 11.5770 11.5770 11.7354 11.7354 12.3864 12.3864 k = 0.3213 0.5035-0.0000 ( 5313 PWs) bands (ev): -12.4339 -12.4339 -12.3941 -12.3941 -11.7648 -11.7648 -11.1058 -11.1058 -10.8183 -10.8183 -10.8155 -10.8155 -10.6139 -10.6139 -10.6045 -10.6045 -1.1590 -1.1590 0.1581 0.1581 0.4335 0.4335 0.9301 0.9301 1.8442 1.8442 1.8566 1.8566 2.3411 2.3411 2.3467 2.3467 2.8238 2.8238 3.1067 3.1067 3.1651 3.1651 3.5953 3.5953 3.6036 3.6036 3.7450 3.7450 3.7601 3.7601 3.9653 3.9653 4.0233 4.0233 4.6904 4.6904 4.9054 4.9054 5.0876 5.0876 5.0897 5.0897 5.5657 5.5657 5.7478 5.7478 5.7727 5.7727 10.9161 10.9161 11.4498 11.4498 11.5252 11.5252 11.5816 11.5816 11.7193 11.7193 12.3822 12.3822 k = 0.3307 0.5183-0.0000 ( 5325 PWs) bands (ev): -12.4264 -12.4264 -12.4070 -12.4070 -11.7585 -11.7585 -11.1059 -11.1059 -10.8223 -10.8223 -10.8197 -10.8197 -10.6098 -10.6098 -10.6008 -10.6008 -1.1621 -1.1621 0.1958 0.1958 0.4063 0.4063 0.9514 0.9514 1.8085 1.8085 1.8191 1.8191 2.3707 2.3707 2.3781 2.3781 2.8066 2.8066 3.0965 3.0965 3.1662 3.1662 3.6418 3.6418 3.6458 3.6458 3.7246 3.7246 3.7357 3.7357 3.9947 3.9947 4.0407 4.0407 4.6744 4.6744 4.8833 4.8833 5.0903 5.0903 5.0928 5.0928 5.5203 5.5203 5.7296 5.7296 5.7538 5.7538 10.9309 10.9309 11.4503 11.4503 11.5335 11.5335 11.5854 11.5854 11.7054 11.7054 12.3704 12.3704 k = 0.3401 0.5331-0.0000 ( 5321 PWs) bands (ev): -12.4218 -12.4218 -12.4193 -12.4193 -11.7485 -11.7485 -11.1071 -11.1071 -10.8261 -10.8261 -10.8237 -10.8237 -10.6058 -10.6058 -10.5972 -10.5972 -1.1620 -1.1620 0.2008 0.2008 0.4108 0.4108 0.9732 0.9732 1.7686 1.7686 1.7778 1.7778 2.4053 2.4053 2.4142 2.4142 2.7877 2.7877 3.0307 3.0307 3.2267 3.2267 3.6626 3.6626 3.6780 3.6780 3.7232 3.7232 3.7314 3.7314 4.0212 4.0212 4.0567 4.0567 4.6591 4.6591 4.8620 4.8620 5.0937 5.0937 5.0965 5.0965 5.4731 5.4731 5.7095 5.7095 5.7331 5.7331 10.9462 10.9462 11.4496 11.4496 11.5419 11.5419 11.5884 11.5884 11.6942 11.6942 12.3508 12.3508 k = 0.3496 0.5479-0.0000 ( 5313 PWs) bands (ev): -12.4311 -12.4311 -12.4200 -12.4200 -11.7350 -11.7350 -11.1094 -11.1094 -10.8298 -10.8298 -10.8276 -10.8276 -10.6018 -10.6018 -10.5937 -10.5937 -1.1587 -1.1587 0.1725 0.1725 0.4471 0.4471 0.9952 0.9952 1.7269 1.7269 1.7350 1.7350 2.4424 2.4424 2.4528 2.4528 2.7672 2.7672 2.9677 2.9677 3.2882 3.2882 3.6423 3.6423 3.6649 3.6649 3.7616 3.7616 3.7766 3.7766 4.0450 4.0450 4.0712 4.0712 4.6443 4.6443 4.8415 4.8415 5.0976 5.0976 5.1005 5.1005 5.4242 5.4242 5.6876 5.6876 5.7105 5.7105 10.9622 10.9622 11.4476 11.4476 11.5504 11.5504 11.5903 11.5903 11.6860 11.6860 12.3246 12.3246 k = 0.3590 0.5628-0.0000 ( 5320 PWs) bands (ev): -12.4423 -12.4423 -12.4205 -12.4205 -11.7183 -11.7183 -11.1131 -11.1131 -10.8334 -10.8334 -10.8314 -10.8314 -10.5980 -10.5980 -10.5903 -10.5903 -1.1521 -1.1521 0.1275 0.1275 0.4989 0.4989 1.0173 1.0173 1.6850 1.6850 1.6921 1.6921 2.4808 2.4808 2.4926 2.4926 2.7453 2.7453 2.9077 2.9077 3.3506 3.3506 3.6128 3.6128 3.6356 3.6356 3.8175 3.8175 3.8325 3.8325 4.0661 4.0661 4.0844 4.0844 4.6302 4.6302 4.8219 4.8219 5.1017 5.1017 5.1047 5.1047 5.3738 5.3738 5.6638 5.6638 5.6860 5.6860 10.9787 10.9787 11.4443 11.4443 11.5588 11.5588 11.5912 11.5912 11.6808 11.6808 12.2933 12.2933 k = 0.3685 0.5776-0.0000 ( 5320 PWs) bands (ev): -12.4527 -12.4527 -12.4231 -12.4231 -11.6987 -11.6987 -11.1180 -11.1180 -10.8367 -10.8367 -10.8349 -10.8349 -10.5943 -10.5943 -10.5871 -10.5871 -1.1423 -1.1423 0.0754 0.0754 0.5563 0.5563 1.0392 1.0392 1.6438 1.6438 1.6501 1.6501 2.5196 2.5196 2.5327 2.5327 2.7223 2.7223 2.8508 2.8508 3.4139 3.4139 3.5804 3.5804 3.6033 3.6033 3.8776 3.8776 3.8925 3.8925 4.0846 4.0846 4.0962 4.0962 4.6167 4.6167 4.8032 4.8032 5.1060 5.1060 5.1090 5.1090 5.3218 5.3218 5.6382 5.6382 5.6597 5.6597 10.9958 10.9958 11.4397 11.4397 11.5673 11.5673 11.5913 11.5913 11.6785 11.6785 12.2586 12.2586 k = 0.3779 0.5924-0.0000 ( 5296 PWs) bands (ev): -12.4625 -12.4625 -12.4275 -12.4275 -11.6768 -11.6768 -11.1242 -11.1242 -10.8399 -10.8399 -10.8382 -10.8382 -10.5908 -10.5908 -10.5841 -10.5841 -1.1294 -1.1294 0.0199 0.0199 0.6153 0.6153 1.0609 1.0609 1.6042 1.6042 1.6098 1.6098 2.5581 2.5581 2.5728 2.5728 2.6987 2.6987 2.7972 2.7972 3.4779 3.4779 3.5465 3.5465 3.5695 3.5695 3.9402 3.9402 3.9550 3.9550 4.1007 4.1007 4.1067 4.1067 4.6037 4.6037 4.7856 4.7856 5.1101 5.1101 5.1130 5.1130 5.2687 5.2687 5.6107 5.6107 5.6315 5.6315 11.0134 11.0134 11.4339 11.4339 11.5758 11.5758 11.5910 11.5910 11.6787 11.6787 12.2218 12.2218 k = 0.3874 0.6072-0.0000 ( 5296 PWs) bands (ev): -12.4714 -12.4714 -12.4331 -12.4331 -11.6530 -11.6530 -11.1319 -11.1319 -10.8429 -10.8429 -10.8414 -10.8414 -10.5874 -10.5874 -10.5812 -10.5812 -1.1133 -1.1133 -0.0372 -0.0372 0.6742 0.6742 1.0820 1.0820 1.5664 1.5664 1.5714 1.5714 2.5954 2.5954 2.6126 2.6126 2.6754 2.6754 2.7469 2.7469 3.5115 3.5115 3.5346 3.5346 3.5426 3.5426 4.0045 4.0045 4.0193 4.0193 4.1146 4.1146 4.1160 4.1160 4.5911 4.5911 4.7691 4.7691 5.1139 5.1139 5.1167 5.1167 5.2144 5.2144 5.5816 5.5816 5.6017 5.6017 11.0315 11.0315 11.4270 11.4270 11.5842 11.5842 11.5909 11.5909 11.6810 11.6810 12.1840 12.1840 k = 0.3968 0.6220-0.0000 ( 5276 PWs) bands (ev): -12.4795 -12.4795 -12.4397 -12.4397 -11.6275 -11.6275 -11.1409 -11.1409 -10.8457 -10.8457 -10.8443 -10.8443 -10.5843 -10.5843 -10.5785 -10.5785 -1.0941 -1.0941 -0.0953 -0.0953 0.7322 0.7322 1.1022 1.1022 1.5310 1.5310 1.5355 1.5355 2.6245 2.6245 2.6519 2.6519 2.6596 2.6596 2.7001 2.7001 3.4758 3.4758 3.4988 3.4988 3.6078 3.6078 4.0696 4.0696 4.0846 4.0846 4.1243 4.1243 4.1269 4.1269 4.5787 4.5787 4.7538 4.7538 5.1172 5.1172 5.1198 5.1198 5.1594 5.1594 5.5509 5.5509 5.5702 5.5702 11.0501 11.0501 11.4188 11.4188 11.5914 11.5914 11.5925 11.5925 11.6849 11.6849 12.1459 12.1459 k = 0.4063 0.6368-0.0000 ( 5276 PWs) bands (ev): -12.4868 -12.4868 -12.4469 -12.4469 -11.6009 -11.6009 -11.1514 -11.1514 -10.8483 -10.8483 -10.8470 -10.8470 -10.5813 -10.5813 -10.5761 -10.5761 -1.0718 -1.0718 -0.1538 -0.1538 0.7886 0.7886 1.1213 1.1213 1.4981 1.4981 1.5021 1.5021 2.6158 2.6158 2.6562 2.6562 2.6810 2.6810 2.6915 2.6915 3.4395 3.4395 3.4625 3.4625 3.6735 3.6735 4.1275 4.1275 4.1300 4.1300 4.1450 4.1450 4.1522 4.1522 4.5665 4.5665 4.7396 4.7396 5.1038 5.1038 5.1198 5.1198 5.1221 5.1221 5.5190 5.5190 5.5374 5.5374 11.0690 11.0690 11.4094 11.4094 11.5929 11.5929 11.6006 11.6006 11.6900 11.6900 12.1081 12.1081 k = 0.4157 0.6516-0.0000 ( 5252 PWs) bands (ev): -12.4932 -12.4932 -12.4545 -12.4545 -11.5734 -11.5734 -11.1633 -11.1633 -10.8506 -10.8506 -10.8495 -10.8495 -10.5785 -10.5785 -10.5738 -10.5738 -1.0465 -1.0465 -0.2125 -0.2125 0.8428 0.8428 1.1390 1.1390 1.4679 1.4679 1.4714 1.4714 2.5929 2.5929 2.6168 2.6168 2.7164 2.7164 2.7298 2.7298 3.4028 3.4028 3.4257 3.4257 3.7395 3.7395 4.1366 4.1366 4.1417 4.1417 4.2052 4.2052 4.2179 4.2179 4.5540 4.5540 4.7268 4.7268 5.0483 5.0483 5.1212 5.1212 5.1232 5.1232 5.4861 5.4861 5.5036 5.5036 11.0882 11.0882 11.3989 11.3989 11.5956 11.5956 11.6084 11.6084 11.6961 11.6961 12.0708 12.0708 k = 0.4252 0.6664-0.0000 ( 5268 PWs) bands (ev): -12.4986 -12.4986 -12.4621 -12.4621 -11.5454 -11.5454 -11.1767 -11.1767 -10.8527 -10.8527 -10.8517 -10.8517 -10.5760 -10.5760 -10.5718 -10.5718 -1.0183 -1.0183 -0.2709 -0.2709 0.8944 0.8944 1.1548 1.1548 1.4406 1.4406 1.4437 1.4437 2.5690 2.5690 2.5810 2.5810 2.7531 2.7531 2.7679 2.7679 3.3659 3.3659 3.3886 3.3886 3.8056 3.8056 4.1419 4.1419 4.1485 4.1485 4.2707 4.2707 4.2835 4.2835 4.5408 4.5408 4.7154 4.7154 4.9933 4.9933 5.1212 5.1212 5.1227 5.1227 5.4530 5.4530 5.4693 5.4693 11.1076 11.1076 11.3873 11.3873 11.5996 11.5996 11.6158 11.6158 11.7030 11.7030 12.0345 12.0345 k = 0.4346 0.6812-0.0000 ( 5284 PWs) bands (ev): -12.5031 -12.5031 -12.4697 -12.4697 -11.5172 -11.5172 -11.1915 -11.1915 -10.8546 -10.8546 -10.8537 -10.8537 -10.5737 -10.5737 -10.5701 -10.5701 -0.9873 -0.9873 -0.3290 -0.3290 0.9430 0.9430 1.1683 1.1683 1.4164 1.4164 1.4191 1.4191 2.5457 2.5457 2.5491 2.5491 2.7898 2.7898 2.8055 2.8055 3.3290 3.3290 3.3514 3.3514 3.8717 3.8717 4.1463 4.1463 4.1535 4.1535 4.3352 4.3352 4.3479 4.3479 4.5263 4.5263 4.7055 4.7055 4.9396 4.9396 5.1194 5.1194 5.1203 5.1203 5.4203 5.4203 5.4354 5.4354 11.1273 11.1273 11.3745 11.3745 11.6047 11.6047 11.6228 11.6228 11.7108 11.7108 11.9993 11.9993 k = 0.4441 0.6960-0.0000 ( 5292 PWs) bands (ev): -12.5067 -12.5067 -12.4770 -12.4770 -11.4889 -11.4889 -11.2078 -11.2078 -10.8562 -10.8562 -10.8555 -10.8555 -10.5717 -10.5717 -10.5685 -10.5685 -0.9535 -0.9535 -0.3864 -0.3864 0.9882 0.9882 1.1793 1.1793 1.3953 1.3953 1.3976 1.3976 2.5214 2.5214 2.5237 2.5237 2.8263 2.8263 2.8426 2.8426 3.2923 3.2923 3.3143 3.3143 3.9375 3.9375 4.1500 4.1500 4.1572 4.1572 4.3977 4.3977 4.4101 4.4101 4.5096 4.5096 4.6973 4.6973 4.8882 4.8882 5.1152 5.1152 5.1153 5.1153 5.3893 5.3893 5.4027 5.4027 11.1471 11.1471 11.3608 11.3608 11.6108 11.6108 11.6290 11.6290 11.7194 11.7194 11.9654 11.9654 k = 0.4535 0.7108-0.0000 ( 5280 PWs) bands (ev): -12.5092 -12.5092 -12.4838 -12.4838 -11.4608 -11.4608 -11.2254 -11.2254 -10.8576 -10.8576 -10.8570 -10.8570 -10.5699 -10.5699 -10.5673 -10.5673 -0.9170 -0.9170 -0.4430 -0.4430 1.0296 1.0296 1.1871 1.1871 1.3774 1.3774 1.3793 1.3793 2.4980 2.4980 2.5037 2.5037 2.8623 2.8623 2.8791 2.8791 3.2560 3.2560 3.2774 3.2774 4.0029 4.0029 4.1532 4.1532 4.1598 4.1598 4.4563 4.4563 4.4688 4.4688 4.4903 4.4903 4.6910 4.6910 4.8404 4.8404 5.1072 5.1072 5.1080 5.1080 5.3611 5.3611 5.3726 5.3726 11.1669 11.1669 11.3460 11.3460 11.6175 11.6175 11.6344 11.6344 11.7292 11.7292 11.9332 11.9332 k = 0.4535 0.7108-0.0000 ( 5280 PWs) bands (ev): -12.5092 -12.5092 -12.4838 -12.4838 -11.4608 -11.4608 -11.2254 -11.2254 -10.8576 -10.8576 -10.8570 -10.8570 -10.5699 -10.5699 -10.5673 -10.5673 -0.9170 -0.9170 -0.4430 -0.4430 1.0296 1.0296 1.1871 1.1871 1.3774 1.3774 1.3793 1.3793 2.4980 2.4980 2.5037 2.5037 2.8623 2.8623 2.8791 2.8791 3.2560 3.2560 3.2774 3.2774 4.0029 4.0029 4.1532 4.1532 4.1598 4.1598 4.4563 4.4563 4.4688 4.4688 4.4903 4.4903 4.6910 4.6910 4.8404 4.8404 5.1072 5.1072 5.1080 5.1080 5.3611 5.3611 5.3726 5.3726 11.1669 11.1669 11.3460 11.3460 11.6175 11.6175 11.6344 11.6344 11.7292 11.7292 11.9332 11.9332 k = 0.4484 0.7029 0.0148 ( 5280 PWs) bands (ev): -12.5079 -12.5079 -12.4801 -12.4801 -11.4756 -11.4756 -11.2156 -11.2156 -10.8569 -10.8569 -10.8563 -10.8563 -10.5711 -10.5711 -10.5682 -10.5682 -0.9360 -0.9360 -0.4118 -0.4118 1.0076 1.0076 1.1813 1.1813 1.3878 1.3878 1.3908 1.3908 2.5092 2.5092 2.5136 2.5136 2.8421 2.8421 2.8587 2.8587 3.2741 3.2741 3.2958 3.2958 3.9689 3.9689 4.1525 4.1525 4.1590 4.1590 4.4246 4.4246 4.4366 4.4366 4.5020 4.5020 4.6965 4.6965 4.8659 4.8659 5.1113 5.1113 5.1119 5.1119 5.3757 5.3757 5.3883 5.3883 11.1553 11.1553 11.3528 11.3528 11.6141 11.6141 11.6314 11.6314 11.7241 11.7241 11.9509 11.9509 k = 0.4434 0.6949 0.0297 ( 5280 PWs) bands (ev): -12.5062 -12.5062 -12.4762 -12.4762 -11.4901 -11.4901 -11.2059 -11.2059 -10.8564 -10.8564 -10.8556 -10.8556 -10.5730 -10.5730 -10.5698 -10.5698 -0.9523 -0.9523 -0.3787 -0.3787 0.9847 0.9847 1.1717 1.1717 1.3997 1.3997 1.4078 1.4078 2.5196 2.5196 2.5230 2.5230 2.8205 2.8205 2.8366 2.8366 3.2894 3.2894 3.3116 3.3116 3.9370 3.9370 4.1530 4.1530 4.1587 4.1587 4.3914 4.3914 4.4034 4.4034 4.5129 4.5129 4.7062 4.7062 4.8933 4.8933 5.1128 5.1128 5.1138 5.1138 5.3910 5.3910 5.4049 5.4049 11.1421 11.1421 11.3569 11.3569 11.6114 11.6114 11.6279 11.6279 11.7199 11.7199 11.9703 11.9703 k = 0.4383 0.6869 0.0445 ( 5284 PWs) bands (ev): -12.5040 -12.5040 -12.4721 -12.4721 -11.5041 -11.5041 -11.1963 -11.1963 -10.8560 -10.8560 -10.8550 -10.8550 -10.5756 -10.5756 -10.5720 -10.5720 -0.9659 -0.9659 -0.3437 -0.3437 0.9612 0.9612 1.1596 1.1596 1.4123 1.4123 1.4288 1.4288 2.5284 2.5284 2.5319 2.5319 2.7978 2.7978 2.8134 2.8134 3.3016 3.3016 3.3247 3.3247 3.9075 3.9075 4.1513 4.1513 4.1605 4.1605 4.3590 4.3590 4.3713 4.3713 4.5219 4.5219 4.7185 4.7185 4.9226 4.9226 5.1114 5.1114 5.1133 5.1133 5.4067 5.4067 5.4228 5.4228 11.1273 11.1273 11.3580 11.3580 11.6095 11.6095 11.6239 11.6239 11.7166 11.7166 11.9912 11.9912 k = 0.4332 0.6789 0.0593 ( 5284 PWs) bands (ev): -12.5015 -12.5015 -12.4678 -12.4678 -11.5176 -11.5176 -11.1870 -11.1870 -10.8557 -10.8557 -10.8544 -10.8544 -10.5788 -10.5788 -10.5748 -10.5748 -0.9767 -0.9767 -0.3070 -0.3070 0.9376 0.9376 1.1464 1.1464 1.4255 1.4255 1.4524 1.4524 2.5351 2.5351 2.5401 2.5401 2.7748 2.7748 2.7896 2.7896 3.3104 3.3104 3.3354 3.3354 3.8806 3.8806 4.1449 4.1449 4.1652 4.1652 4.3283 4.3283 4.3425 4.3425 4.5289 4.5289 4.7328 4.7328 4.9537 4.9537 5.1068 5.1068 5.1104 5.1104 5.4224 5.4224 5.4421 5.4421 11.1111 11.1111 11.3562 11.3562 11.6081 11.6081 11.6201 11.6201 11.7143 11.7143 12.0133 12.0133 k = 0.4281 0.6710 0.0741 ( 5279 PWs) bands (ev): -12.4985 -12.4985 -12.4633 -12.4633 -11.5305 -11.5305 -11.1779 -11.1779 -10.8556 -10.8556 -10.8538 -10.8538 -10.5827 -10.5827 -10.5781 -10.5781 -0.9847 -0.9847 -0.2685 -0.2685 0.9142 0.9142 1.1328 1.1328 1.4387 1.4387 1.4777 1.4777 2.5393 2.5393 2.5464 2.5464 2.7526 2.7526 2.7659 2.7659 3.3158 3.3158 3.3440 3.3440 3.8564 3.8564 4.1326 4.1326 4.1710 4.1710 4.2994 4.2994 4.3201 4.3201 4.5340 4.5340 4.7485 4.7485 4.9865 4.9865 5.0986 5.0986 5.1052 5.1052 5.4377 5.4377 5.4630 5.4630 11.0934 11.0934 11.3514 11.3514 11.6060 11.6060 11.6175 11.6175 11.7133 11.7133 12.0364 12.0364 k = 0.4230 0.6630 0.0890 ( 5283 PWs) bands (ev): -12.4951 -12.4951 -12.4587 -12.4587 -11.5428 -11.5428 -11.1691 -11.1691 -10.8558 -10.8558 -10.8532 -10.8532 -10.5873 -10.5873 -10.5819 -10.5819 -0.9899 -0.9899 -0.2285 -0.2285 0.8912 0.8912 1.1196 1.1196 1.4517 1.4517 1.5041 1.5041 2.5401 2.5401 2.5499 2.5499 2.7322 2.7322 2.7433 2.7433 3.3178 3.3178 3.3507 3.3507 3.8349 3.8349 4.1143 4.1143 4.1753 4.1753 4.2740 4.2740 4.3057 4.3057 4.5373 4.5373 4.7652 4.7652 5.0209 5.0209 5.0869 5.0869 5.0979 5.0979 5.4524 5.4524 5.4848 5.4848 11.0745 11.0745 11.3437 11.3437 11.6022 11.6022 11.6171 11.6171 11.7138 11.7138 12.0602 12.0602 k = 0.4179 0.6550 0.1038 ( 5288 PWs) bands (ev): -12.4913 -12.4913 -12.4539 -12.4539 -11.5545 -11.5545 -11.1607 -11.1607 -10.8561 -10.8561 -10.8526 -10.8526 -10.5927 -10.5927 -10.5861 -10.5861 -0.9922 -0.9922 -0.1870 -0.1870 0.8689 0.8689 1.1070 1.1070 1.4643 1.4643 1.5309 1.5309 2.5358 2.5358 2.5505 2.5505 2.7135 2.7135 2.7242 2.7242 3.3169 3.3169 3.3555 3.3555 3.8159 3.8159 4.0910 4.0910 4.1734 4.1734 4.2570 4.2570 4.2979 4.2979 4.5389 4.5389 4.7827 4.7827 5.0565 5.0565 5.0721 5.0721 5.0888 5.0888 5.4663 5.4663 5.5072 5.5072 11.0543 11.0543 11.3332 11.3332 11.5972 11.5972 11.6184 11.6184 11.7161 11.7161 12.0841 12.0841 k = 0.4128 0.6470 0.1186 ( 5296 PWs) bands (ev): -12.4870 -12.4870 -12.4491 -12.4491 -11.5656 -11.5656 -11.1527 -11.1527 -10.8566 -10.8566 -10.8520 -10.8520 -10.5987 -10.5987 -10.5907 -10.5907 -0.9917 -0.9917 -0.1441 -0.1441 0.8473 0.8473 1.0956 1.0956 1.4762 1.4762 1.5577 1.5577 2.5250 2.5250 2.5480 2.5480 2.6942 2.6942 2.7127 2.7127 3.3138 3.3138 3.3584 3.3584 3.7992 3.7992 4.0646 4.0646 4.1605 4.1605 4.2533 4.2533 4.2946 4.2946 4.5391 4.5391 4.8007 4.8007 5.0532 5.0532 5.0781 5.0781 5.0940 5.0940 5.4792 5.4792 5.5296 5.5296 11.0330 11.0330 11.3200 11.3200 11.5918 11.5918 11.6204 11.6204 11.7205 11.7205 12.1077 12.1077 k = 0.4077 0.6391 0.1334 ( 5294 PWs) bands (ev): -12.4823 -12.4823 -12.4441 -12.4441 -11.5759 -11.5759 -11.1451 -11.1451 -10.8573 -10.8573 -10.8513 -10.8513 -10.6054 -10.6054 -10.5957 -10.5957 -0.9883 -0.9883 -0.1000 -0.1000 0.8266 0.8266 1.0854 1.0854 1.4872 1.4872 1.5841 1.5841 2.5076 2.5076 2.5424 2.5424 2.6750 2.6750 2.7082 2.7082 3.3093 3.3093 3.3595 3.3595 3.7843 3.7843 4.0373 4.0373 4.1393 4.1393 4.2603 4.2603 4.2940 4.2940 4.5380 4.5380 4.8189 4.8189 5.0319 5.0319 5.0665 5.0665 5.1319 5.1319 5.4908 5.4908 5.5514 5.5514 11.0106 11.0106 11.3042 11.3042 11.5864 11.5864 11.6227 11.6227 11.7274 11.7274 12.1305 12.1305 k = 0.4026 0.6311 0.1483 ( 5298 PWs) bands (ev): -12.4772 -12.4772 -12.4390 -12.4390 -11.5854 -11.5854 -11.1382 -11.1382 -10.8582 -10.8582 -10.8506 -10.8506 -10.6127 -10.6127 -10.6010 -10.6010 -0.9821 -0.9821 -0.0547 -0.0547 0.8067 0.8067 1.0768 1.0768 1.4971 1.4971 1.6097 1.6097 2.4852 2.4852 2.5335 2.5335 2.6573 2.6573 2.7085 2.7085 3.3040 3.3040 3.3588 3.3588 3.7706 3.7706 4.0108 4.0108 4.1149 4.1149 4.2727 4.2727 4.2947 4.2947 4.5359 4.5359 4.8367 4.8367 5.0077 5.0077 5.0544 5.0544 5.1705 5.1705 5.5011 5.5011 5.5722 5.5722 10.9873 10.9873 11.2861 11.2861 11.5814 11.5814 11.6249 11.6249 11.7370 11.7370 12.1520 12.1520 k = 0.3976 0.6231 0.1631 ( 5306 PWs) bands (ev): -12.4717 -12.4717 -12.4339 -12.4339 -11.5942 -11.5942 -11.1319 -11.1319 -10.8593 -10.8593 -10.8499 -10.8499 -10.6206 -10.6206 -10.6067 -10.6067 -0.9730 -0.9730 -0.0085 -0.0085 0.7878 0.7878 1.0698 1.0698 1.5058 1.5058 1.6341 1.6341 2.4595 2.4595 2.5216 2.5216 2.6411 2.6411 2.7116 2.7116 3.2987 3.2987 3.3562 3.3562 3.7573 3.7573 3.9864 3.9864 4.0903 4.0903 4.2861 4.2861 4.2970 4.2970 4.5330 4.5330 4.8535 4.8535 4.9811 4.9811 5.0428 5.0428 5.2095 5.2095 5.5099 5.5099 5.5915 5.5915 10.9630 10.9630 11.2658 11.2658 11.5769 11.5769 11.6269 11.6269 11.7492 11.7492 12.1717 12.1717 k = 0.3925 0.6151 0.1779 ( 5304 PWs) bands (ev): -12.4658 -12.4658 -12.4288 -12.4288 -11.6021 -11.6021 -11.1264 -11.1264 -10.8606 -10.8606 -10.8492 -10.8492 -10.6290 -10.6290 -10.6126 -10.6126 -0.9611 -0.9611 0.0385 0.0385 0.7699 0.7699 1.0646 1.0646 1.5133 1.5133 1.6569 1.6569 2.4323 2.4323 2.5073 2.5073 2.6258 2.6258 2.7163 2.7163 3.2939 3.2939 3.3517 3.3517 3.7436 3.7436 3.9654 3.9654 4.0668 4.0668 4.2917 4.2917 4.3077 4.3077 4.5294 4.5294 4.8681 4.8681 4.9522 4.9522 5.0329 5.0329 5.2487 5.2487 5.5168 5.5168 5.6090 5.6090 10.9379 10.9379 11.2437 11.2437 11.5731 11.5731 11.6287 11.6287 11.7640 11.7640 12.1894 12.1894 k = 0.3874 0.6072 0.1928 ( 5302 PWs) bands (ev): -12.4595 -12.4595 -12.4236 -12.4236 -11.6091 -11.6091 -11.1217 -11.1217 -10.8619 -10.8619 -10.8485 -10.8485 -10.6378 -10.6378 -10.6187 -10.6187 -0.9463 -0.9463 0.0861 0.0861 0.7531 0.7531 1.0614 1.0614 1.5194 1.5194 1.6775 1.6775 2.4045 2.4045 2.4918 2.4918 2.6107 2.6107 2.7214 2.7214 3.2903 3.2903 3.3454 3.3454 3.7286 3.7286 3.9488 3.9488 4.0452 4.0452 4.2910 4.2910 4.3241 4.3241 4.5254 4.5254 4.8790 4.8790 4.9213 4.9213 5.0266 5.0266 5.2876 5.2876 5.5219 5.5219 5.6243 5.6243 10.9122 10.9122 11.2199 11.2199 11.5703 11.5703 11.6307 11.6307 11.7811 11.7811 12.2048 12.2048 k = 0.3823 0.5992 0.2076 ( 5294 PWs) bands (ev): -12.4529 -12.4529 -12.4185 -12.4185 -11.6153 -11.6153 -11.1181 -11.1181 -10.8634 -10.8634 -10.8477 -10.8477 -10.6469 -10.6469 -10.6251 -10.6251 -0.9288 -0.9288 0.1340 0.1340 0.7373 0.7373 1.0601 1.0601 1.5241 1.5241 1.6955 1.6955 2.3771 2.3771 2.4758 2.4758 2.5952 2.5952 2.7265 2.7265 3.2879 3.2879 3.3372 3.3372 3.7120 3.7120 3.9372 3.9372 4.0258 4.0258 4.2882 4.2882 4.3412 4.3412 4.5212 4.5212 4.8840 4.8840 4.8893 4.8893 5.0256 5.0256 5.3260 5.3260 5.5248 5.5248 5.6372 5.6372 10.8858 10.8858 11.1946 11.1946 11.5685 11.5685 11.6329 11.6329 11.8002 11.8002 12.2178 12.2178 k = 0.3772 0.5912 0.2224 ( 5294 PWs) bands (ev): -12.4459 -12.4459 -12.4133 -12.4133 -11.6205 -11.6205 -11.1156 -11.1156 -10.8648 -10.8648 -10.8470 -10.8470 -10.6562 -10.6562 -10.6316 -10.6316 -0.9086 -0.9086 0.1819 0.1819 0.7227 0.7227 1.0610 1.0610 1.5273 1.5273 1.7106 1.7106 2.3505 2.3505 2.4603 2.4603 2.5788 2.5788 2.7311 2.7311 3.2869 3.2869 3.3272 3.3272 3.6937 3.6937 3.9307 3.9307 4.0090 4.0090 4.2836 4.2836 4.3581 4.3581 4.5170 4.5170 4.8549 4.8549 4.8838 4.8838 5.0310 5.0310 5.3636 5.3636 5.5256 5.5256 5.6476 5.6476 10.8590 10.8590 11.1680 11.1680 11.5679 11.5679 11.6356 11.6356 11.8212 11.8212 12.2286 12.2286 k = 0.3721 0.5832 0.2372 ( 5297 PWs) bands (ev): -12.4385 -12.4385 -12.4082 -12.4082 -11.6249 -11.6249 -11.1144 -11.1144 -10.8662 -10.8662 -10.8462 -10.8462 -10.6657 -10.6657 -10.6383 -10.6383 -0.8857 -0.8857 0.2295 0.2295 0.7094 0.7094 1.0640 1.0640 1.5293 1.5293 1.7221 1.7221 2.3251 2.3251 2.4459 2.4459 2.5613 2.5613 2.7349 2.7349 3.2865 3.2865 3.3161 3.3161 3.6742 3.6742 3.9290 3.9290 3.9947 3.9947 4.2770 4.2770 4.3746 4.3746 4.5129 4.5129 4.8201 4.8201 4.8777 4.8777 5.0422 5.0422 5.3999 5.3999 5.5241 5.5241 5.6552 5.6552 10.8319 10.8319 11.1403 11.1403 11.5686 11.5686 11.6389 11.6389 11.8437 11.8437 12.2373 12.2373 k = 0.3670 0.5753 0.2521 ( 5295 PWs) bands (ev): -12.4308 -12.4308 -12.4031 -12.4031 -11.6282 -11.6282 -11.1146 -11.1146 -10.8675 -10.8675 -10.8454 -10.8454 -10.6752 -10.6752 -10.6451 -10.6451 -0.8601 -0.8601 0.2763 0.2763 0.6975 0.6975 1.0693 1.0693 1.5301 1.5301 1.7299 1.7299 2.3014 2.3014 2.4331 2.4331 2.5427 2.5427 2.7376 2.7376 3.2843 3.2843 3.3064 3.3064 3.6541 3.6541 3.9317 3.9317 3.9828 3.9828 4.2686 4.2686 4.3903 4.3903 4.5094 4.5094 4.7846 4.7846 4.8680 4.8680 5.0573 5.0573 5.4346 5.4346 5.5202 5.5202 5.6601 5.6601 10.8046 10.8046 11.1118 11.1118 11.5707 11.5707 11.6432 11.6432 11.8675 11.8675 12.2442 12.2442 k = 0.3619 0.5673 0.2669 ( 5287 PWs) bands (ev): -12.4229 -12.4229 -12.3980 -12.3980 -11.6306 -11.6306 -11.1165 -11.1165 -10.8685 -10.8685 -10.8447 -10.8447 -10.6846 -10.6846 -10.6521 -10.6521 -0.8320 -0.8320 0.3215 0.3215 0.6875 0.6875 1.0768 1.0768 1.5300 1.5300 1.7335 1.7335 2.2793 2.2793 2.4220 2.4220 2.5231 2.5231 2.7392 2.7392 3.2750 3.2750 3.3032 3.3032 3.6344 3.6344 3.9382 3.9382 3.9729 3.9729 4.2583 4.2583 4.4050 4.4050 4.5065 4.5065 4.7489 4.7489 4.8564 4.8564 5.0749 5.0749 5.4671 5.4671 5.5142 5.5142 5.6623 5.6623 10.7775 10.7775 11.0827 11.0827 11.5741 11.5741 11.6483 11.6483 11.8923 11.8923 12.2493 12.2493 k = 0.3569 0.5593 0.2817 ( 5283 PWs) bands (ev): -12.4146 -12.4146 -12.3930 -12.3930 -11.6321 -11.6321 -11.1201 -11.1201 -10.8692 -10.8692 -10.8439 -10.8439 -10.6938 -10.6938 -10.6591 -10.6591 -0.8014 -0.8014 0.3642 0.3642 0.6800 0.6800 1.0866 1.0866 1.5292 1.5292 1.7328 1.7328 2.2589 2.2589 2.4128 2.4128 2.5027 2.5027 2.7394 2.7394 3.2598 3.2598 3.3051 3.3051 3.6159 3.6159 3.9480 3.9480 3.9648 3.9648 4.2464 4.2464 4.4185 4.4185 4.5047 4.5047 4.7135 4.7135 4.8442 4.8442 5.0937 5.0937 5.4958 5.4958 5.5068 5.5068 5.6622 5.6622 10.7506 10.7506 11.0530 11.0530 11.5790 11.5790 11.6545 11.6545 11.9180 11.9180 12.2531 12.2531 k = 0.3518 0.5513 0.2965 ( 5292 PWs) bands (ev): -12.4062 -12.4062 -12.3881 -12.3881 -11.6326 -11.6326 -11.1256 -11.1256 -10.8696 -10.8696 -10.8431 -10.8431 -10.7027 -10.7027 -10.6661 -10.6661 -0.7684 -0.7684 0.4028 0.4028 0.6760 0.6760 1.0988 1.0988 1.5282 1.5282 1.7279 1.7279 2.2403 2.2403 2.4051 2.4051 2.4817 2.4817 2.7381 2.7381 3.2422 3.2422 3.3085 3.3085 3.5995 3.5995 3.9571 3.9571 3.9611 3.9611 4.2329 4.2329 4.4306 4.4306 4.5041 4.5041 4.6787 4.6787 4.8321 4.8321 5.1129 5.1129 5.4947 5.4947 5.5233 5.5233 5.6606 5.6606 10.7242 10.7242 11.0230 11.0230 11.5853 11.5853 11.6618 11.6618 11.9443 11.9443 12.2555 12.2555 k = 0.3467 0.5434 0.3114 ( 5286 PWs) bands (ev): -12.3976 -12.3976 -12.3831 -12.3831 -11.6321 -11.6321 -11.1330 -11.1330 -10.8695 -10.8695 -10.8424 -10.8424 -10.7114 -10.7114 -10.6732 -10.6732 -0.7330 -0.7330 0.4355 0.4355 0.6771 0.6771 1.1132 1.1132 1.5273 1.5273 1.7190 1.7190 2.2234 2.2234 2.3986 2.3986 2.4605 2.4605 2.7350 2.7350 3.2239 3.2239 3.3117 3.3117 3.5858 3.5858 3.9504 3.9504 3.9761 3.9761 4.2181 4.2181 4.4411 4.4411 4.5050 4.5050 4.6453 4.6453 4.8207 4.8207 5.1319 5.1319 5.4826 5.4826 5.5430 5.5430 5.6591 5.6591 10.6986 10.6986 10.9928 10.9928 11.5930 11.5930 11.6702 11.6702 11.9709 11.9709 12.2569 12.2569 k = 0.3416 0.5354 0.3262 ( 5288 PWs) bands (ev): -12.3889 -12.3889 -12.3781 -12.3781 -11.6306 -11.6306 -11.1424 -11.1424 -10.8690 -10.8690 -10.8416 -10.8416 -10.7196 -10.7196 -10.6802 -10.6802 -0.6954 -0.6954 0.4598 0.4598 0.6852 0.6852 1.1298 1.1298 1.5271 1.5271 1.7063 1.7063 2.2079 2.2079 2.3927 2.3927 2.4394 2.4394 2.7299 2.7299 3.2059 3.2059 3.3140 3.3140 3.5755 3.5755 3.9429 3.9429 3.9936 3.9936 4.2025 4.2025 4.4499 4.4499 4.5071 4.5071 4.6142 4.6142 4.8102 4.8102 5.1500 5.1500 5.4690 5.4690 5.5544 5.5544 5.6602 5.6602 10.6739 10.6739 10.9626 10.9626 11.6020 11.6020 11.6797 11.6797 11.9976 11.9976 12.2574 12.2574 k = 0.3365 0.5274 0.3410 ( 5288 PWs) bands (ev): -12.3804 -12.3804 -12.3730 -12.3730 -11.6282 -11.6282 -11.1537 -11.1537 -10.8680 -10.8680 -10.8409 -10.8409 -10.7273 -10.7273 -10.6871 -10.6871 -0.6556 -0.6556 0.4742 0.4742 0.7014 0.7014 1.1486 1.1486 1.5281 1.5281 1.6903 1.6903 2.1937 2.1937 2.3866 2.3866 2.4188 2.4188 2.7224 2.7224 3.1889 3.1889 3.3151 3.3151 3.5687 3.5687 3.9342 3.9342 4.0133 4.0133 4.1865 4.1865 4.4570 4.4570 4.5095 4.5095 4.5870 4.5870 4.8008 4.8008 5.1667 5.1667 5.4546 5.4546 5.5550 5.5550 5.6659 5.6659 10.6503 10.6503 10.9325 10.9325 11.6123 11.6123 11.6902 11.6902 12.0242 12.0242 12.2570 12.2570 k = 0.3314 0.5194 0.3559 ( 5286 PWs) bands (ev): -12.3725 -12.3725 -12.3672 -12.3672 -11.6248 -11.6248 -11.1668 -11.1668 -10.8666 -10.8666 -10.8402 -10.8402 -10.7346 -10.7346 -10.6940 -10.6940 -0.6139 -0.6139 0.4789 0.4789 0.7249 0.7249 1.1693 1.1693 1.5308 1.5308 1.6716 1.6716 2.1807 2.1807 2.3792 2.3792 2.3992 2.3992 2.7122 2.7122 3.1738 3.1738 3.3151 3.3151 3.5651 3.5651 3.9236 3.9236 4.0350 4.0350 4.1704 4.1704 4.4616 4.4616 4.5096 4.5096 4.5673 4.5673 4.7927 4.7927 5.1809 5.1809 5.4403 5.4403 5.5454 5.5454 5.6755 5.6755 10.6281 10.6281 10.9028 10.9028 11.6237 11.6237 11.7016 11.7016 12.0502 12.0502 12.2560 12.2560 k = 0.3263 0.5115 0.3707 ( 5294 PWs) bands (ev): -12.3662 -12.3662 -12.3598 -12.3598 -11.6206 -11.6206 -11.1817 -11.1817 -10.8648 -10.8648 -10.8396 -10.8396 -10.7413 -10.7413 -10.7008 -10.7008 -0.5703 -0.5703 0.4759 0.4759 0.7535 0.7535 1.1918 1.1918 1.5357 1.5357 1.6508 1.6508 2.1685 2.1685 2.3687 2.3687 2.3818 2.3818 2.6989 2.6989 3.1613 3.1613 3.3144 3.3144 3.5644 3.5644 3.9106 3.9106 4.0584 4.0584 4.1548 4.1548 4.4621 4.4621 4.5045 4.5045 4.5605 4.5605 4.7860 4.7860 5.1915 5.1915 5.4274 5.4274 5.5279 5.5279 5.6868 5.6868 10.6075 10.6075 10.8734 10.8734 11.6360 11.6360 11.7138 11.7138 12.0754 12.0754 12.2545 12.2545 k = 0.3212 0.5035 0.3855 ( 5292 PWs) bands (ev): -12.3610 -12.3610 -12.3514 -12.3514 -11.6154 -11.6154 -11.1981 -11.1981 -10.8627 -10.8627 -10.8390 -10.8390 -10.7475 -10.7475 -10.7075 -10.7075 -0.5250 -0.5250 0.4672 0.4672 0.7848 0.7848 1.2156 1.2156 1.5432 1.5432 1.6287 1.6287 2.1571 2.1571 2.3540 2.3540 2.3675 2.3675 2.6822 2.6822 3.1521 3.1521 3.3136 3.3136 3.5655 3.5655 3.8950 3.8950 4.0833 4.0833 4.1404 4.1404 4.4544 4.4544 4.4991 4.4991 4.5653 4.5653 4.7807 4.7807 5.1971 5.1971 5.4176 5.4176 5.5046 5.5046 5.6975 5.6975 10.5887 10.5887 10.8445 10.8445 11.6492 11.6492 11.7267 11.7267 12.0992 12.0992 12.2527 12.2527 k = 0.3161 0.4955 0.4003 ( 5294 PWs) bands (ev): -12.3561 -12.3561 -12.3428 -12.3428 -11.6094 -11.6094 -11.2160 -11.2160 -10.8603 -10.8603 -10.8384 -10.8384 -10.7531 -10.7531 -10.7139 -10.7139 -0.4782 -0.4782 0.4543 0.4543 0.8169 0.8169 1.2400 1.2400 1.5535 1.5535 1.6065 1.6065 2.1461 2.1461 2.3373 2.3373 2.3535 2.3535 2.6622 2.6622 3.1467 3.1467 3.3136 3.3136 3.5675 3.5675 3.8765 3.8765 4.1087 4.1087 4.1285 4.1285 4.4390 4.4390 4.4984 4.4984 4.5767 4.5767 4.7769 4.7769 5.1962 5.1962 5.4124 5.4124 5.4768 5.4768 5.7065 5.7065 10.5718 10.5718 10.8164 10.8164 11.6630 11.6630 11.7403 11.7403 12.1212 12.1212 12.2510 12.2510 k = 0.3111 0.4875 0.4152 ( 5294 PWs) bands (ev): -12.3515 -12.3515 -12.3344 -12.3344 -11.6025 -11.6025 -11.2350 -11.2350 -10.8577 -10.8577 -10.8379 -10.8379 -10.7582 -10.7582 -10.7202 -10.7202 -0.4300 -0.4300 0.4382 0.4382 0.8487 0.8487 1.2639 1.2639 1.5667 1.5667 1.5857 1.5857 2.1354 2.1354 2.3205 2.3205 2.3375 2.3375 2.6387 2.6387 3.1454 3.1454 3.3150 3.3150 3.5695 3.5695 3.8554 3.8554 4.1138 4.1138 4.1400 4.1400 4.4203 4.4203 4.5002 4.5002 4.5920 4.5920 4.7746 4.7746 5.1881 5.1881 5.4128 5.4128 5.4453 5.4453 5.7131 5.7131 10.5570 10.5570 10.7890 10.7890 11.6772 11.6772 11.7543 11.7543 12.1407 12.1407 12.2498 12.2498 k = 0.3060 0.4796 0.4300 ( 5290 PWs) bands (ev): -12.3468 -12.3468 -12.3261 -12.3261 -11.5949 -11.5949 -11.2549 -11.2549 -10.8550 -10.8550 -10.8374 -10.8374 -10.7628 -10.7628 -10.7263 -10.7263 -0.3806 -0.3806 0.4196 0.4196 0.8794 0.8794 1.2854 1.2854 1.5676 1.5676 1.5840 1.5840 2.1249 2.1249 2.3034 2.3034 2.3199 2.3199 2.6120 2.6120 3.1483 3.1483 3.3181 3.3181 3.5707 3.5707 3.8318 3.8318 4.1058 4.1058 4.1682 4.1682 4.4011 4.4011 4.5023 4.5023 4.6102 4.6102 4.7740 4.7740 5.1733 5.1733 5.4098 5.4098 5.4193 5.4193 5.7170 5.7170 10.5444 10.5444 10.7624 10.7624 11.6917 11.6917 11.7686 11.7686 12.1568 12.1568 12.2497 12.2497 k = 0.3009 0.4716 0.4448 ( 5286 PWs) bands (ev): -12.3422 -12.3422 -12.3183 -12.3183 -11.5864 -11.5864 -11.2756 -11.2756 -10.8523 -10.8523 -10.8369 -10.8369 -10.7668 -10.7668 -10.7322 -10.7322 -0.3304 -0.3304 0.3989 0.3989 0.9087 0.9087 1.3014 1.3014 1.5571 1.5571 1.6033 1.6033 2.1142 2.1142 2.2836 2.2836 2.3029 2.3029 2.5825 2.5825 3.1553 3.1553 3.3234 3.3234 3.5703 3.5703 3.8061 3.8061 4.0998 4.0998 4.1979 4.1979 4.3823 4.3823 4.5040 4.5040 4.6308 4.6308 4.7753 4.7753 5.1532 5.1532 5.3727 5.3727 5.4290 5.4290 5.7179 5.7179 10.5340 10.5340 10.7369 10.7369 11.7061 11.7061 11.7830 11.7830 12.1689 12.1689 12.2513 12.2513 k = 0.2958 0.4636 0.4597 ( 5279 PWs) bands (ev): -12.3376 -12.3376 -12.3109 -12.3109 -11.5773 -11.5773 -11.2968 -11.2968 -10.8497 -10.8497 -10.8366 -10.8366 -10.7702 -10.7702 -10.7378 -10.7378 -0.2795 -0.2795 0.3764 0.3764 0.9364 0.9364 1.3086 1.3086 1.5570 1.5570 1.6256 1.6256 2.1032 2.1032 2.2584 2.2584 2.2892 2.2892 2.5507 2.5507 3.1662 3.1662 3.3308 3.3308 3.5680 3.5680 3.7787 3.7787 4.0967 4.0967 4.2281 4.2281 4.3640 4.3640 4.5049 4.5049 4.6534 4.6534 4.7784 4.7784 5.1293 5.1293 5.3328 5.3328 5.4423 5.4423 5.7161 5.7161 10.5260 10.5260 10.7124 10.7124 11.7204 11.7204 11.7971 11.7971 12.1767 12.1767 12.2548 12.2548 k = 0.2907 0.4556 0.4745 ( 5268 PWs) bands (ev): -12.3330 -12.3330 -12.3043 -12.3043 -11.5674 -11.5674 -11.3182 -11.3182 -10.8472 -10.8472 -10.8362 -10.8362 -10.7729 -10.7729 -10.7431 -10.7431 -0.2283 -0.2283 0.3524 0.3524 0.9625 0.9625 1.3048 1.3048 1.5695 1.5695 1.6503 1.6503 2.0917 2.0917 2.2284 2.2284 2.2787 2.2787 2.5173 2.5173 3.1809 3.1809 3.3403 3.3403 3.5633 3.5633 3.7499 3.7499 4.0967 4.0967 4.2583 4.2583 4.3463 4.3463 4.5049 4.5049 4.6775 4.6775 4.7838 4.7838 5.1029 5.1029 5.2908 5.2908 5.4577 5.4577 5.7113 5.7113 10.5203 10.5203 10.6891 10.6891 11.7343 11.7343 11.8106 11.8106 12.1808 12.1808 12.2596 12.2596 k = 0.2856 0.4477 0.4893 ( 5277 PWs) bands (ev): -12.3284 -12.3284 -12.2984 -12.2984 -11.5570 -11.5570 -11.3397 -11.3397 -10.8450 -10.8450 -10.8360 -10.8360 -10.7751 -10.7751 -10.7481 -10.7481 -0.1772 -0.1772 0.3271 0.3271 0.9871 0.9871 1.2912 1.2912 1.5941 1.5941 1.6771 1.6771 2.0793 2.0793 2.1945 2.1945 2.2707 2.2707 2.4828 2.4828 3.1990 3.1990 3.3516 3.3516 3.5563 3.5563 3.7202 3.7202 4.0999 4.0999 4.2883 4.2883 4.3289 4.3289 4.5038 4.5038 4.7029 4.7029 4.7914 4.7914 5.0753 5.0753 5.2471 5.2471 5.4744 5.4744 5.7039 5.7039 10.5169 10.5169 10.6670 10.6670 11.7478 11.7478 11.8231 11.8231 12.1826 12.1826 12.2644 12.2644 k = 0.2805 0.4397 0.5041 ( 5279 PWs) bands (ev): -12.3237 -12.3237 -12.2934 -12.2934 -11.5459 -11.5459 -11.3609 -11.3609 -10.8430 -10.8430 -10.8358 -10.8358 -10.7766 -10.7766 -10.7527 -10.7527 -0.1266 -0.1266 0.3008 0.3008 1.0101 1.0101 1.2707 1.2707 1.6279 1.6279 1.7054 1.7054 2.0656 2.0656 2.1573 2.1573 2.2651 2.2651 2.4481 2.4481 3.2203 3.2203 3.3643 3.3643 3.5470 3.5470 3.6898 3.6898 4.1061 4.1061 4.3115 4.3115 4.3176 4.3176 4.5015 4.5015 4.7292 4.7292 4.8016 4.8016 5.0474 5.0474 5.2023 5.2023 5.4920 5.4920 5.6941 5.6941 10.5158 10.5158 10.6462 10.6462 11.7607 11.7607 11.8340 11.8340 12.1836 12.1836 12.2681 12.2681 k = 0.2754 0.4317 0.5190 ( 5274 PWs) bands (ev): -12.3190 -12.3190 -12.2896 -12.2896 -11.5343 -11.5343 -11.3816 -11.3816 -10.8413 -10.8413 -10.8357 -10.8357 -10.7775 -10.7775 -10.7571 -10.7571 -0.0772 -0.0772 0.2736 0.2736 1.0318 1.0318 1.2464 1.2464 1.6682 1.6682 1.7347 1.7347 2.0504 2.0504 2.1175 2.1175 2.2619 2.2619 2.4141 2.4141 3.2444 3.2444 3.3778 3.3778 3.5360 3.5360 3.6591 3.6591 4.1153 4.1153 4.2944 4.2944 4.3453 4.3453 4.4978 4.4978 4.7562 4.7562 4.8146 4.8146 5.0198 5.0198 5.1566 5.1566 5.5101 5.5101 5.6820 5.6820 10.5170 10.5170 10.6269 10.6269 11.7730 11.7730 11.8428 11.8428 12.1849 12.1849 12.2699 12.2699 k = 0.2704 0.4237 0.5338 ( 5281 PWs) bands (ev): -12.3143 -12.3143 -12.2870 -12.2870 -11.5222 -11.5222 -11.4015 -11.4015 -10.8399 -10.8399 -10.8356 -10.8356 -10.7777 -10.7777 -10.7610 -10.7610 -0.0295 -0.0295 0.2459 0.2459 1.0521 1.0521 1.2205 1.2205 1.7131 1.7131 1.7646 1.7646 2.0328 2.0328 2.0754 2.0754 2.2612 2.2612 2.3817 2.3817 3.2710 3.2710 3.3907 3.3907 3.5241 3.5241 3.6286 3.6286 4.1273 4.1273 4.2768 4.2768 4.3715 4.3715 4.4927 4.4927 4.7835 4.7835 4.8302 4.8302 4.9935 4.9935 5.1108 5.1108 5.5284 5.5284 5.6681 5.6681 10.5202 10.5202 10.6089 10.6089 11.7845 11.7845 11.8490 11.8490 12.1873 12.1873 12.2694 12.2694 k = 0.2653 0.4158 0.5486 ( 5282 PWs) bands (ev): -12.3095 -12.3095 -12.2857 -12.2857 -11.5098 -11.5098 -11.4204 -11.4204 -10.8389 -10.8389 -10.8357 -10.8357 -10.7774 -10.7774 -10.7645 -10.7645 0.0155 0.0155 0.2179 0.2179 1.0709 1.0709 1.1950 1.1950 1.7613 1.7613 1.7947 1.7947 2.0124 2.0124 2.0317 2.0317 2.2632 2.2632 2.3519 2.3519 3.2995 3.2995 3.4011 3.4011 3.5135 3.5135 3.5984 3.5984 4.1419 4.1419 4.2587 4.2587 4.3955 4.3955 4.4859 4.4859 4.8107 4.8107 4.8481 4.8481 4.9694 4.9694 5.0654 5.0654 5.5467 5.5467 5.6526 5.6526 10.5254 10.5254 10.5925 10.5925 11.7951 11.7951 11.8524 11.8524 12.1912 12.1912 12.2666 12.2666 k = 0.2602 0.4078 0.5634 ( 5282 PWs) bands (ev): -12.3048 -12.3048 -12.2860 -12.2860 -11.4970 -11.4970 -11.4379 -11.4379 -10.8381 -10.8381 -10.8358 -10.8358 -10.7765 -10.7765 -10.7676 -10.7676 0.0567 0.0567 0.1901 0.1901 1.0877 1.0877 1.1718 1.1718 1.8113 1.8113 1.8246 1.8246 1.9867 1.9867 1.9889 1.9889 2.2680 2.2680 2.3259 2.3259 3.3291 3.3291 3.4051 3.4051 3.5078 3.5078 3.5695 3.5695 4.1587 4.1587 4.2398 4.2398 4.4171 4.4171 4.4772 4.4772 4.8373 4.8373 4.8670 4.8670 4.9497 4.9497 5.0215 5.0215 5.5650 5.5650 5.6360 5.6360 10.5324 10.5324 10.5776 10.5776 11.8043 11.8043 11.8531 11.8531 12.1965 12.1965 12.2620 12.2620 k = 0.2551 0.3998 0.5783 ( 5274 PWs) bands (ev): -12.3004 -12.3004 -12.2876 -12.2876 -11.4843 -11.4843 -11.4535 -11.4535 -10.8377 -10.8377 -10.8359 -10.8359 -10.7753 -10.7753 -10.7700 -10.7700 0.0915 0.0915 0.1640 0.1640 1.1011 1.1011 1.1538 1.1538 1.8528 1.8528 1.8617 1.8617 1.9434 1.9434 1.9611 1.9611 2.2760 2.2760 2.3044 2.3044 3.3581 3.3581 3.3989 3.3989 3.5110 3.5110 3.5431 3.5431 4.1776 4.1776 4.2201 4.2201 4.4361 4.4361 4.4662 4.4662 4.8613 4.8613 4.8815 4.8815 4.9401 4.9401 4.9810 4.9810 5.5831 5.5831 5.6187 5.6187 10.5408 10.5408 10.5645 10.5645 11.8114 11.8114 11.8519 11.8519 12.2021 12.2021 12.2568 12.2568 k = 0.2500 0.3918 0.5931 ( 5276 PWs) bands (ev): -12.2979 -12.2979 -12.2892 -12.2892 -11.4756 -11.4756 -11.4633 -11.4633 -10.8375 -10.8375 -10.8359 -10.8359 -10.7745 -10.7745 -10.7712 -10.7712 0.1097 0.1097 0.1490 0.1490 1.1065 1.1065 1.1465 1.1465 1.8784 1.8784 1.8834 1.8834 1.9291 1.9291 1.9307 1.9307 2.2859 2.2859 2.2898 2.2898 3.3825 3.3825 3.3829 3.3829 3.5226 3.5226 3.5228 3.5228 4.1957 4.1957 4.2019 4.2019 4.4509 4.4509 4.4542 4.4542 4.8737 4.8737 4.8853 4.8853 4.9493 4.9493 4.9516 4.9516 5.5995 5.5995 5.6024 5.6024 10.5479 10.5479 10.5560 10.5560 11.8143 11.8143 11.8509 11.8509 12.2049 12.2049 12.2541 12.2541 k = 0.2500 0.3918 0.5931 ( 5276 PWs) bands (ev): -12.2979 -12.2979 -12.2892 -12.2892 -11.4756 -11.4756 -11.4633 -11.4633 -10.8375 -10.8375 -10.8359 -10.8359 -10.7745 -10.7745 -10.7712 -10.7712 0.1097 0.1097 0.1490 0.1490 1.1065 1.1065 1.1465 1.1465 1.8784 1.8784 1.8834 1.8834 1.9291 1.9291 1.9307 1.9307 2.2859 2.2859 2.2898 2.2898 3.3825 3.3825 3.3829 3.3829 3.5226 3.5226 3.5228 3.5228 4.1957 4.1957 4.2019 4.2019 4.4509 4.4509 4.4542 4.4542 4.8737 4.8737 4.8853 4.8853 4.9493 4.9493 4.9516 4.9516 5.5995 5.5995 5.6024 5.6024 10.5479 10.5479 10.5560 10.5560 11.8143 11.8143 11.8509 11.8509 12.2049 12.2049 12.2541 12.2541 k = 0.2396 0.3985 0.5807 ( 5276 PWs) bands (ev): -12.3014 -12.3014 -12.2864 -12.2864 -11.4865 -11.4865 -11.4519 -11.4519 -10.8377 -10.8377 -10.8358 -10.8358 -10.7755 -10.7755 -10.7696 -10.7696 0.0879 0.0879 0.1663 0.1663 1.1003 1.1003 1.1546 1.1546 1.8353 1.8353 1.8988 1.8988 1.9078 1.9078 1.9816 1.9816 2.2729 2.2729 2.3053 2.3053 3.3529 3.3529 3.3998 3.3998 3.5110 3.5110 3.5473 3.5473 4.1732 4.1732 4.2247 4.2247 4.4325 4.4325 4.4682 4.4682 4.8580 4.8580 4.8794 4.8794 4.9415 4.9415 4.9854 4.9854 5.5800 5.5800 5.6217 5.6217 10.5393 10.5393 10.5666 10.5666 11.8103 11.8103 11.8529 11.8529 12.2011 12.2011 12.2594 12.2594 k = 0.2292 0.4051 0.5684 ( 5282 PWs) bands (ev): -12.3077 -12.3077 -12.2820 -12.2820 -11.5012 -11.5012 -11.4358 -11.4358 -10.8382 -10.8382 -10.8356 -10.8356 -10.7766 -10.7766 -10.7663 -10.7663 0.0501 0.0501 0.1906 0.1906 1.0889 1.0889 1.1711 1.1711 1.7795 1.7795 1.8993 1.8993 1.9067 1.9067 2.0432 2.0432 2.2619 2.2619 2.3247 2.3247 3.3142 3.3142 3.4056 3.4056 3.5085 3.5085 3.5830 3.5830 4.1484 4.1484 4.2506 4.2506 4.4078 4.4078 4.4798 4.4798 4.8270 4.8270 4.8678 4.8678 4.9495 4.9495 5.0331 5.0331 5.5593 5.5593 5.6420 5.6420 10.5299 10.5299 10.5823 10.5823 11.8003 11.8003 11.8570 11.8570 12.1927 12.1927 12.2722 12.2722 k = 0.2188 0.4118 0.5560 ( 5282 PWs) bands (ev): -12.3150 -12.3150 -12.2781 -12.2781 -11.5155 -11.5155 -11.4191 -11.4191 -10.8390 -10.8390 -10.8353 -10.8353 -10.7772 -10.7772 -10.7622 -10.7622 0.0071 0.0071 0.2118 0.2118 1.0780 1.0780 1.1890 1.1890 1.7264 1.7264 1.8939 1.8939 1.9122 1.9122 2.1021 2.1021 2.2582 2.2582 2.3460 2.3460 3.2715 3.2715 3.4046 3.4046 3.5109 3.5109 3.6250 3.6250 4.1241 4.1241 4.2764 4.2764 4.3778 4.3778 4.4882 4.4882 4.7968 4.7968 4.8544 4.8544 4.9622 4.9622 5.0855 5.0855 5.5389 5.5389 5.6617 5.6617 10.5225 10.5225 10.6000 10.6000 11.7874 11.7874 11.8604 11.8604 12.1827 12.1827 12.2891 12.2891 k = 0.2083 0.4184 0.5437 ( 5280 PWs) bands (ev): -12.3228 -12.3228 -12.2749 -12.2749 -11.5289 -11.5289 -11.4025 -11.4025 -10.8400 -10.8400 -10.8347 -10.8347 -10.7773 -10.7773 -10.7574 -10.7574 -0.0393 -0.0393 0.2286 0.2286 1.0691 1.0691 1.2046 1.2046 1.6798 1.6798 1.8892 1.8892 1.9172 1.9172 2.1464 2.1464 2.2718 2.2718 2.3692 2.3692 3.2276 3.2276 3.4002 3.4002 3.5155 3.5155 3.6693 3.6693 4.1006 4.1006 4.3018 4.3018 4.3429 4.3429 4.4938 4.4938 4.7717 4.7717 4.8405 4.8405 4.9764 4.9764 5.1398 5.1398 5.5195 5.5195 5.6806 5.6806 10.5175 10.5175 10.6192 10.6192 11.7731 11.7731 11.8620 11.8620 12.1725 12.1725 12.3083 12.3083 k = 0.1979 0.4251 0.5313 ( 5278 PWs) bands (ev): -12.3309 -12.3309 -12.2726 -12.2726 -11.5414 -11.5414 -11.3861 -11.3861 -10.8411 -10.8411 -10.8337 -10.8337 -10.7769 -10.7769 -10.7521 -10.7521 -0.0881 -0.0881 0.2411 0.2411 1.0624 1.0624 1.2147 1.2147 1.6430 1.6430 1.8850 1.8850 1.9220 1.9220 2.1646 2.1646 2.3129 2.3129 2.3941 2.3941 3.1839 3.1839 3.3943 3.3943 3.5212 3.5212 3.7139 3.7139 4.0779 4.0779 4.3029 4.3029 4.3270 4.3270 4.4968 4.4968 4.7528 4.7528 4.8267 4.8267 4.9910 4.9910 5.1942 5.1942 5.5017 5.5017 5.6986 5.6986 10.5149 10.5149 10.6397 10.6397 11.7583 11.7583 11.8615 11.8615 12.1623 12.1623 12.3291 12.3291 k = 0.1875 0.4317 0.5190 ( 5284 PWs) bands (ev): -12.3392 -12.3392 -12.2711 -12.2711 -11.5527 -11.5527 -11.3702 -11.3702 -10.8424 -10.8424 -10.8323 -10.8323 -10.7762 -10.7762 -10.7463 -10.7463 -0.1387 -0.1387 0.2495 0.2495 1.0578 1.0578 1.2161 1.2161 1.6187 1.6187 1.8811 1.8811 1.9267 1.9267 2.1654 2.1654 2.3720 2.3720 2.4209 2.4209 3.1416 3.1416 3.3877 3.3877 3.5273 3.5273 3.7573 3.7573 4.0559 4.0559 4.2599 4.2599 4.3505 4.3505 4.4978 4.4978 4.7401 4.7401 4.8134 4.8134 5.0058 5.0058 5.2465 5.2465 5.4869 5.4869 5.7155 5.7155 10.5147 10.5147 10.6613 10.6613 11.7438 11.7438 11.8589 11.8589 12.1520 12.1520 12.3507 12.3507 k = 0.1771 0.4384 0.5066 ( 5284 PWs) bands (ev): -12.3477 -12.3477 -12.2706 -12.2706 -11.5629 -11.5629 -11.3548 -11.3548 -10.8437 -10.8437 -10.8304 -10.8304 -10.7752 -10.7752 -10.7402 -10.7402 -0.1902 -0.1902 0.2540 0.2540 1.0551 1.0551 1.2071 1.2071 1.6083 1.6083 1.8774 1.8774 1.9313 1.9313 2.1600 2.1600 2.4357 2.4357 2.4507 2.4507 3.1015 3.1015 3.3812 3.3812 3.5335 3.5335 3.7984 3.7984 4.0348 4.0348 4.2141 4.2141 4.3725 4.3725 4.4971 4.4971 4.7335 4.7335 4.8008 4.8008 5.0204 5.0204 5.2937 5.2937 5.4776 5.4776 5.7312 5.7312 10.5169 10.5169 10.6837 10.6837 11.7299 11.7299 11.8542 11.8542 12.1415 12.1415 12.3727 12.3727 k = 0.1667 0.4450 0.4942 ( 5284 PWs) bands (ev): -12.3561 -12.3561 -12.2709 -12.2709 -11.5719 -11.5719 -11.3403 -11.3403 -10.8452 -10.8452 -10.8278 -10.8278 -10.7740 -10.7740 -10.7338 -10.7338 -0.2420 -0.2420 0.2551 0.2551 1.0541 1.0541 1.1882 1.1882 1.6105 1.6105 1.8739 1.8739 1.9359 1.9359 2.1525 2.1525 2.4773 2.4773 2.5052 2.5052 3.0644 3.0644 3.3749 3.3749 3.5396 3.5396 3.8365 3.8365 4.0143 4.0143 4.1669 4.1669 4.3920 4.3920 4.4955 4.4955 4.7325 4.7325 4.7892 4.7892 5.0348 5.0348 5.3299 5.3299 5.4796 5.4796 5.7457 5.7457 10.5214 10.5214 10.7066 10.7066 11.7172 11.7172 11.8477 11.8477 12.1307 12.1307 12.3944 12.3944 k = 0.1562 0.4517 0.4819 ( 5284 PWs) bands (ev): -12.3645 -12.3645 -12.2720 -12.2720 -11.5798 -11.5798 -11.3266 -11.3266 -10.8466 -10.8466 -10.8245 -10.8245 -10.7727 -10.7727 -10.7273 -10.7273 -0.2935 -0.2935 0.2532 0.2532 1.0544 1.0544 1.1623 1.1623 1.6225 1.6225 1.8706 1.8706 1.9404 1.9404 2.1443 2.1443 2.5091 2.5091 2.5691 2.5691 3.0315 3.0315 3.3693 3.3693 3.5454 3.5454 3.8709 3.8709 3.9943 3.9943 4.1192 4.1192 4.4077 4.4077 4.4940 4.4940 4.7368 4.7368 4.7789 4.7789 5.0488 5.0488 5.3482 5.3482 5.4990 5.4990 5.7590 5.7590 10.5280 10.5280 10.7298 10.7298 11.7058 11.7058 11.8397 11.8397 12.1196 12.1196 12.4154 12.4155 k = 0.1458 0.4583 0.4695 ( 5278 PWs) bands (ev): -12.3728 -12.3728 -12.2738 -12.2738 -11.5866 -11.5866 -11.3139 -11.3139 -10.8481 -10.8481 -10.8206 -10.8206 -10.7712 -10.7712 -10.7207 -10.7207 -0.3440 -0.3440 0.2487 0.2487 1.0556 1.0556 1.1325 1.1325 1.6408 1.6408 1.8674 1.8674 1.9450 1.9450 2.1360 2.1360 2.5420 2.5420 2.6292 2.6292 3.0044 3.0044 3.3643 3.3643 3.5508 3.5508 3.9008 3.9008 3.9748 3.9748 4.0723 4.0723 4.4182 4.4182 4.4941 4.4941 4.7458 4.7458 4.7700 4.7700 5.0625 5.0625 5.3503 5.3503 5.5338 5.5338 5.7710 5.7710 10.5366 10.5366 10.7529 10.7529 11.6960 11.6960 11.8304 11.8304 12.1079 12.1079 12.4352 12.4352 k = 0.1354 0.4649 0.4572 ( 5288 PWs) bands (ev): -12.3808 -12.3808 -12.2762 -12.2762 -11.5923 -11.5923 -11.3023 -11.3023 -10.8496 -10.8496 -10.8162 -10.8162 -10.7698 -10.7698 -10.7142 -10.7142 -0.3931 -0.3931 0.2419 0.2419 1.0569 1.0569 1.1019 1.1019 1.6624 1.6624 1.8645 1.8645 1.9496 1.9496 2.1276 2.1276 2.5760 2.5760 2.6816 2.6816 2.9862 2.9862 3.3599 3.3599 3.5557 3.5557 3.9243 3.9243 3.9565 3.9565 4.0276 4.0276 4.4221 4.4221 4.4969 4.4969 4.7582 4.7582 4.7637 4.7637 5.0757 5.0757 5.3441 5.3441 5.5761 5.5761 5.7818 5.7818 10.5469 10.5469 10.7758 10.7758 11.6879 11.6879 11.8202 11.8202 12.0958 12.0958 12.4532 12.4532 k = 0.1250 0.4716 0.4448 ( 5290 PWs) bands (ev): -12.3885 -12.3885 -12.2792 -12.2792 -11.5970 -11.5970 -11.2918 -11.2918 -10.8510 -10.8510 -10.8112 -10.8112 -10.7683 -10.7683 -10.7078 -10.7078 -0.4402 -0.4402 0.2332 0.2332 1.0537 1.0537 1.0768 1.0768 1.6852 1.6852 1.8617 1.8617 1.9543 1.9543 2.1194 2.1194 2.6110 2.6110 2.7214 2.7214 2.9815 2.9815 3.3562 3.3562 3.5601 3.5601 3.9240 3.9240 3.9546 3.9546 3.9879 3.9879 4.4199 4.4199 4.5019 4.5019 4.7567 4.7567 4.7771 4.7771 5.0883 5.0883 5.3347 5.3347 5.6204 5.6204 5.7913 5.7913 10.5587 10.5587 10.7981 10.7981 11.6815 11.6815 11.8094 11.8094 12.0833 12.0833 12.4691 12.4691 k = 0.1146 0.4782 0.4325 ( 5292 PWs) bands (ev): -12.3958 -12.3958 -12.2825 -12.2825 -11.6008 -11.6008 -11.2825 -11.2825 -10.8523 -10.8523 -10.8057 -10.8057 -10.7668 -10.7668 -10.7016 -10.7016 -0.4850 -0.4850 0.2232 0.2232 1.0330 1.0330 1.0710 1.0710 1.7080 1.7080 1.8591 1.8591 1.9590 1.9590 2.1112 2.1112 2.6468 2.6468 2.7439 2.7439 2.9945 2.9945 3.3529 3.3529 3.5639 3.5639 3.8986 3.8986 3.9516 3.9516 3.9728 3.9728 4.4135 4.4135 4.5072 4.5072 4.7534 4.7534 4.7972 4.7972 5.1004 5.1004 5.3243 5.3243 5.6641 5.6641 5.7996 5.7996 10.5717 10.5717 10.8197 10.8197 11.6767 11.6767 11.7984 11.7984 12.0704 12.0704 12.4825 12.4825 k = 0.1042 0.4849 0.4201 ( 5300 PWs) bands (ev): -12.4027 -12.4027 -12.2861 -12.2861 -11.6039 -11.6039 -11.2742 -11.2742 -10.8536 -10.8536 -10.8001 -10.8001 -10.7654 -10.7654 -10.6956 -10.6956 -0.5271 -0.5271 0.2121 0.2121 1.0066 1.0066 1.0734 1.0734 1.7297 1.7297 1.8567 1.8567 1.9637 1.9637 2.1030 2.1030 2.6830 2.6830 2.7497 2.7497 3.0242 3.0242 3.3496 3.3496 3.5670 3.5670 3.8663 3.8663 3.9278 3.9278 3.9847 3.9847 4.4047 4.4047 4.5113 4.5113 4.7519 4.7519 4.8198 4.8198 5.1117 5.1117 5.3140 5.3140 5.7058 5.7058 5.8069 5.8069 10.5856 10.5856 10.8403 10.8403 11.6732 11.6732 11.7877 11.7877 12.0572 12.0572 12.4931 12.4931 k = 0.0938 0.4915 0.4078 ( 5296 PWs) bands (ev): -12.4091 -12.4091 -12.2898 -12.2898 -11.6062 -11.6062 -11.2670 -11.2670 -10.8548 -10.8548 -10.7943 -10.7943 -10.7641 -10.7641 -10.6900 -10.6900 -0.5662 -0.5662 0.2004 0.2004 0.9816 0.9816 1.0771 1.0771 1.7498 1.7498 1.8546 1.8546 1.9686 1.9686 2.0948 2.0948 2.7194 2.7194 2.7447 2.7447 3.0644 3.0644 3.3458 3.3458 3.5693 3.5693 3.8326 3.8326 3.9077 3.9077 3.9947 3.9947 4.3948 4.3948 4.5132 4.5132 4.7524 4.7524 4.8437 4.8437 5.1223 5.1223 5.3043 5.3043 5.7448 5.7448 5.8131 5.8131 10.6000 10.6000 10.8596 10.8596 11.6708 11.6708 11.7778 11.7778 12.0440 12.0440 12.5009 12.5009 k = 0.0833 0.4982 0.3954 ( 5296 PWs) bands (ev): -12.4150 -12.4150 -12.2934 -12.2934 -11.6080 -11.6080 -11.2608 -11.2608 -10.8559 -10.8559 -10.7885 -10.7885 -10.7629 -10.7629 -10.6848 -10.6848 -0.6018 -0.6018 0.1886 0.1886 0.9590 0.9590 1.0811 1.0811 1.7680 1.7680 1.8526 1.8526 1.9736 1.9736 2.0867 2.0867 2.7343 2.7343 2.7561 2.7561 3.1089 3.1089 3.3409 3.3409 3.5708 3.5708 3.8010 3.8010 3.8899 3.8899 4.0021 4.0021 4.3846 4.3846 4.5129 4.5129 4.7545 4.7545 4.8680 4.8680 5.1321 5.1321 5.2954 5.2954 5.7807 5.7807 5.8183 5.8183 10.6144 10.6144 10.8775 10.8775 11.6689 11.6689 11.7692 11.7692 12.0309 12.0309 12.5059 12.5059 k = 0.0729 0.5048 0.3830 ( 5296 PWs) bands (ev): -12.4203 -12.4203 -12.2970 -12.2970 -11.6094 -11.6094 -11.2555 -11.2555 -10.8568 -10.8568 -10.7829 -10.7829 -10.7618 -10.7618 -10.6800 -10.6800 -0.6339 -0.6339 0.1771 0.1771 0.9391 0.9391 1.0851 1.0851 1.7841 1.7841 1.8509 1.8509 1.9787 1.9787 2.0786 2.0786 2.7227 2.7227 2.7918 2.7918 3.1538 3.1538 3.3344 3.3344 3.5713 3.5713 3.7734 3.7734 3.8733 3.8733 4.0073 4.0073 4.3747 4.3747 4.5104 4.5104 4.7578 4.7578 4.8918 4.8918 5.1409 5.1409 5.2874 5.2874 5.8129 5.8129 5.8227 5.8227 10.6286 10.6286 10.8938 10.8938 11.6670 11.6670 11.7625 11.7625 12.0181 12.0181 12.5083 12.5083 k = 0.0625 0.5115 0.3707 ( 5302 PWs) bands (ev): -12.4249 -12.4249 -12.3003 -12.3003 -11.6103 -11.6103 -11.2511 -11.2511 -10.8577 -10.8577 -10.7777 -10.7777 -10.7608 -10.7608 -10.6758 -10.6758 -0.6622 -0.6622 0.1662 0.1662 0.9220 0.9220 1.0889 1.0889 1.7979 1.7979 1.8493 1.8493 1.9840 1.9840 2.0706 2.0706 2.7112 2.7112 2.8266 2.8266 3.1966 3.1966 3.3257 3.3257 3.5709 3.5709 3.7508 3.7508 3.8576 3.8576 4.0108 4.0108 4.3655 4.3655 4.5064 4.5064 4.7619 4.7619 4.9143 4.9143 5.1488 5.1488 5.2805 5.2805 5.8262 5.8262 5.8414 5.8414 10.6420 10.6420 10.9083 10.9083 11.6647 11.6647 11.7579 11.7579 12.0059 12.0059 12.5086 12.5086 k = 0.0521 0.5181 0.3583 ( 5292 PWs) bands (ev): -12.4289 -12.4289 -12.3033 -12.3033 -11.6110 -11.6110 -11.2476 -11.2476 -10.8584 -10.8584 -10.7730 -10.7730 -10.7600 -10.7600 -10.6721 -10.6721 -0.6864 -0.6864 0.1563 0.1563 0.9077 0.9077 1.0923 1.0923 1.8095 1.8095 1.8480 1.8480 1.9895 1.9895 2.0627 2.0627 2.7008 2.7008 2.8597 2.8597 3.2358 3.2358 3.3147 3.3147 3.5695 3.5695 3.7339 3.7339 3.8428 3.8428 4.0129 4.0129 4.3574 4.3574 4.5015 4.5015 4.7661 4.7661 4.9347 4.9347 5.1555 5.1555 5.2747 5.2747 5.8291 5.8291 5.8658 5.8658 10.6543 10.6543 10.9209 10.9209 11.6619 11.6619 11.7556 11.7556 11.9946 11.9946 12.5072 12.5072 k = 0.0417 0.5248 0.3460 ( 5300 PWs) bands (ev): -12.4322 -12.4322 -12.3058 -12.3058 -11.6114 -11.6114 -11.2447 -11.2447 -10.8590 -10.8590 -10.7689 -10.7689 -10.7594 -10.7594 -10.6690 -10.6690 -0.7064 -0.7064 0.1477 0.1477 0.8962 0.8962 1.0952 1.0952 1.8189 1.8189 1.8470 1.8470 1.9950 1.9950 2.0549 2.0549 2.6919 2.6919 2.8902 2.8902 3.2701 3.2701 3.3020 3.3020 3.5674 3.5674 3.7224 3.7224 3.8290 3.8290 4.0140 4.0140 4.3505 4.3505 4.4963 4.4963 4.7701 4.7701 4.9523 4.9523 5.1612 5.1612 5.2700 5.2700 5.8314 5.8314 5.8860 5.8860 10.6649 10.6649 10.9314 10.9314 11.6587 11.6587 11.7551 11.7551 11.9846 11.9846 12.5049 12.5049 k = 0.0312 0.5314 0.3336 ( 5296 PWs) bands (ev): -12.4348 -12.4348 -12.3079 -12.3079 -11.6117 -11.6117 -11.2426 -11.2426 -10.8595 -10.8595 -10.7655 -10.7655 -10.7589 -10.7589 -10.6666 -10.6666 -0.7221 -0.7221 0.1408 0.1408 0.8873 0.8873 1.0976 1.0976 1.8262 1.8262 1.8461 1.8461 2.0007 2.0007 2.0475 2.0475 2.6849 2.6849 2.9171 2.9171 3.2875 3.2875 3.2997 3.2997 3.5648 3.5648 3.7157 3.7157 3.8168 3.8168 4.0146 4.0146 4.3451 4.3451 4.4914 4.4914 4.7736 4.7736 4.9666 4.9666 5.1657 5.1657 5.2663 5.2663 5.8331 5.8331 5.9018 5.9018 10.6737 10.6737 10.9397 10.9397 11.6555 11.6555 11.7559 11.7559 11.9762 11.9762 12.5023 12.5023 k = 0.0208 0.5381 0.3213 ( 5292 PWs) bands (ev): -12.4366 -12.4366 -12.3094 -12.3094 -11.6118 -11.6118 -11.2411 -11.2411 -10.8599 -10.8599 -10.7629 -10.7629 -10.7587 -10.7587 -10.6649 -10.6649 -0.7334 -0.7334 0.1357 0.1357 0.8810 0.8810 1.0993 1.0993 1.8314 1.8314 1.8454 1.8454 2.0063 2.0063 2.0406 2.0406 2.6798 2.6798 2.9385 2.9385 3.2757 3.2757 3.3208 3.3208 3.5622 3.5622 3.7126 3.7126 3.8070 3.8070 4.0149 4.0149 4.3411 4.3411 4.4875 4.4875 4.7763 4.7763 4.9771 4.9771 5.1689 5.1689 5.2636 5.2636 5.8342 5.8342 5.9132 5.9132 10.6802 10.6802 10.9457 10.9457 11.6528 11.6528 11.7572 11.7572 11.9698 11.9698 12.4999 12.4999 k = 0.0104 0.5447 0.3089 ( 5288 PWs) bands (ev): -12.4378 -12.4378 -12.3103 -12.3103 -11.6119 -11.6119 -11.2402 -11.2402 -10.8601 -10.8601 -10.7611 -10.7611 -10.7588 -10.7588 -10.6638 -10.6638 -0.7402 -0.7402 0.1325 0.1325 0.8772 0.8772 1.1004 1.1004 1.8345 1.8345 1.8450 1.8450 2.0111 2.0111 2.0350 2.0350 2.6767 2.6767 2.9526 2.9526 3.2670 3.2670 3.3343 3.3343 3.5602 3.5602 3.7117 3.7117 3.8004 3.8004 4.0150 4.0150 4.3388 4.3388 4.4849 4.4849 4.7780 4.7780 4.9836 4.9836 5.1708 5.1708 5.2621 5.2621 5.8349 5.8349 5.9200 5.9200 10.6842 10.6842 10.9493 10.9493 11.6510 11.6510 11.7582 11.7582 11.9659 11.9659 12.4983 12.4983 k = 0.0000 0.5513 0.2965 ( 5286 PWs) bands (ev): -12.4381 -12.4381 -12.3106 -12.3106 -11.6119 -11.6119 -11.2399 -11.2399 -10.8601 -10.8601 -10.7603 -10.7603 -10.7590 -10.7590 -10.6635 -10.6635 -0.7425 -0.7425 0.1315 0.1315 0.8759 0.8759 1.1007 1.1007 1.8355 1.8355 1.8448 1.8448 2.0134 2.0134 2.0324 2.0324 2.6757 2.6757 2.9575 2.9575 3.2638 3.2638 3.3389 3.3389 3.5594 3.5594 3.7115 3.7115 3.7981 3.7981 4.0150 4.0150 4.3380 4.3380 4.4841 4.4841 4.7785 4.7785 4.9857 4.9857 5.1715 5.1715 5.2615 5.2615 5.8352 5.8352 5.9223 5.9223 10.6855 10.6855 10.9505 10.9505 11.6504 11.6504 11.7586 11.7586 11.9645 11.9645 12.4977 12.4977 k = 0.0000 0.5513 0.2965 ( 5286 PWs) bands (ev): -12.4381 -12.4381 -12.3106 -12.3106 -11.6119 -11.6119 -11.2399 -11.2399 -10.8601 -10.8601 -10.7603 -10.7603 -10.7590 -10.7590 -10.6635 -10.6635 -0.7425 -0.7425 0.1315 0.1315 0.8759 0.8759 1.1007 1.1007 1.8355 1.8355 1.8448 1.8448 2.0134 2.0134 2.0324 2.0324 2.6757 2.6757 2.9575 2.9575 3.2638 3.2638 3.3389 3.3389 3.5594 3.5594 3.7115 3.7115 3.7981 3.7981 4.0150 4.0150 4.3380 4.3380 4.4841 4.4841 4.7785 4.7785 4.9857 4.9857 5.1715 5.1715 5.2615 5.2615 5.8352 5.8352 5.9223 5.9223 10.6855 10.6855 10.9505 10.9505 11.6504 11.6504 11.7586 11.7586 11.9645 11.9645 12.4977 12.4977 k =-0.0142 0.5464 0.3058 ( 5288 PWs) bands (ev): -12.4383 -12.4383 -12.3107 -12.3107 -11.6130 -11.6130 -11.2385 -11.2385 -10.8603 -10.8603 -10.7607 -10.7607 -10.7586 -10.7586 -10.6631 -10.6631 -0.7443 -0.7443 0.1334 0.1334 0.8717 0.8717 1.1046 1.1046 1.8309 1.8309 1.8358 1.8358 2.0172 2.0172 2.0415 2.0415 2.6770 2.6770 2.9578 2.9578 3.2640 3.2640 3.3364 3.3364 3.5600 3.5600 3.7144 3.7144 3.7983 3.7983 4.0143 4.0143 4.3374 4.3374 4.4841 4.4841 4.7773 4.7773 4.9860 4.9860 5.1752 5.1752 5.2604 5.2604 5.8335 5.8335 5.9220 5.9220 10.6861 10.6861 10.9520 10.9520 11.6496 11.6496 11.7578 11.7578 11.9648 11.9648 12.4933 12.4933 k =-0.0283 0.5414 0.3151 ( 5289 PWs) bands (ev): -12.4387 -12.4387 -12.3110 -12.3110 -11.6162 -11.6162 -11.2345 -11.2345 -10.8609 -10.8609 -10.7619 -10.7619 -10.7573 -10.7573 -10.6620 -10.6620 -0.7497 -0.7497 0.1392 0.1392 0.8598 0.8598 1.1152 1.1152 1.8072 1.8072 1.8239 1.8239 2.0285 2.0285 2.0637 2.0637 2.6808 2.6808 2.9586 2.9586 3.2648 3.2648 3.3291 3.3291 3.5617 3.5617 3.7228 3.7228 3.7989 3.7989 4.0123 4.0123 4.3355 4.3355 4.4841 4.4841 4.7738 4.7738 4.9868 4.9868 5.1860 5.1860 5.2570 5.2570 5.8287 5.8287 5.9210 5.9210 10.6878 10.6878 10.9563 10.9563 11.6470 11.6470 11.7555 11.7555 11.9654 11.9654 12.4808 12.4808 k =-0.0425 0.5364 0.3244 ( 5293 PWs) bands (ev): -12.4393 -12.4393 -12.3116 -12.3116 -11.6213 -11.6213 -11.2280 -11.2280 -10.8618 -10.8618 -10.7637 -10.7637 -10.7553 -10.7553 -10.6602 -10.6602 -0.7584 -0.7584 0.1486 0.1486 0.8420 0.8420 1.1302 1.1302 1.7732 1.7732 1.8102 1.8102 2.0455 2.0455 2.0913 2.0913 2.6864 2.6864 2.9604 2.9604 3.2661 3.2661 3.3175 3.3175 3.5646 3.5646 3.7358 3.7358 3.7999 3.7999 4.0094 4.0094 4.3325 4.3325 4.4842 4.4842 4.7687 4.7687 4.9881 4.9881 5.2028 5.2028 5.2514 5.2514 5.8207 5.8207 5.9191 5.9191 10.6906 10.6906 10.9635 10.9635 11.6429 11.6429 11.7518 11.7518 11.9662 11.9662 12.4623 12.4623 k =-0.0567 0.5314 0.3336 ( 5293 PWs) bands (ev): -12.4402 -12.4402 -12.3124 -12.3124 -11.6277 -11.6277 -11.2196 -11.2196 -10.8631 -10.8631 -10.7661 -10.7661 -10.7525 -10.7525 -10.6578 -10.6578 -0.7701 -0.7701 0.1613 0.1613 0.8204 0.8204 1.1471 1.1471 1.7366 1.7366 1.7942 1.7942 2.0665 2.0665 2.1201 2.1201 2.6928 2.6928 2.9640 2.9640 3.2679 3.2679 3.3024 3.3024 3.5686 3.5686 3.7524 3.7524 3.8012 3.8012 4.0059 4.0059 4.3287 4.3287 4.4844 4.4844 4.7629 4.7629 4.9898 4.9898 5.2243 5.2243 5.2440 5.2440 5.8098 5.8098 5.9163 5.9163 10.6948 10.6948 10.9733 10.9733 11.6375 11.6375 11.7469 11.7469 11.9667 11.9667 12.4400 12.4400 k =-0.0709 0.5264 0.3429 ( 5292 PWs) bands (ev): -12.4413 -12.4413 -12.3136 -12.3136 -11.6352 -11.6352 -11.2096 -11.2096 -10.8645 -10.8645 -10.7691 -10.7691 -10.7490 -10.7490 -10.6548 -10.6548 -0.7844 -0.7844 0.1767 0.1767 0.7960 0.7960 1.1636 1.1636 1.7010 1.7010 1.7768 1.7768 2.0903 2.0903 2.1481 2.1481 2.6987 2.6987 2.9701 2.9701 3.2698 3.2698 3.2849 3.2849 3.5738 3.5738 3.7708 3.7708 3.8028 3.8028 4.0029 4.0029 4.3244 4.3244 4.4848 4.4848 4.7573 4.7573 4.9917 4.9917 5.2330 5.2330 5.2511 5.2511 5.7959 5.7959 5.9125 5.9125 10.7002 10.7002 10.9855 10.9855 11.6309 11.6309 11.7410 11.7410 11.9663 11.9663 12.4158 12.4158 k =-0.0850 0.5214 0.3522 ( 5288 PWs) bands (ev): -12.4426 -12.4426 -12.3152 -12.3152 -11.6432 -11.6432 -11.1986 -11.1986 -10.8660 -10.8660 -10.7725 -10.7725 -10.7449 -10.7449 -10.6515 -10.6515 -0.8008 -0.8008 0.1945 0.1945 0.7699 0.7699 1.1777 1.1777 1.6692 1.6692 1.7589 1.7589 2.1160 2.1160 2.1743 2.1743 2.7029 2.7029 2.9798 2.9798 3.2619 3.2619 3.2757 3.2757 3.5800 3.5800 3.7889 3.7889 3.8050 3.8050 4.0017 4.0017 4.3199 4.3199 4.4855 4.4855 4.7525 4.7525 4.9938 4.9938 5.2221 5.2221 5.2784 5.2784 5.7794 5.7794 5.9074 5.9074 10.7071 10.7071 10.9999 10.9999 11.6234 11.6234 11.7343 11.7343 11.9644 11.9644 12.3915 12.3915 k =-0.0992 0.5165 0.3614 ( 5303 PWs) bands (ev): -12.4441 -12.4441 -12.3173 -12.3173 -11.6512 -11.6512 -11.1870 -11.1870 -10.8676 -10.8676 -10.7762 -10.7762 -10.7400 -10.7400 -10.6479 -10.6479 -0.8188 -0.8188 0.2139 0.2139 0.7425 0.7425 1.1872 1.1872 1.6435 1.6435 1.7408 1.7408 2.1431 2.1431 2.1984 2.1984 2.7042 2.7042 2.9933 2.9933 3.2409 3.2409 3.2789 3.2789 3.5874 3.5874 3.8016 3.8016 3.8101 3.8101 4.0042 4.0042 4.3154 4.3154 4.4866 4.4866 4.7490 4.7490 4.9958 4.9958 5.2094 5.2094 5.3074 5.3074 5.7602 5.7602 5.9011 5.9011 10.7154 10.7154 11.0162 11.0162 11.6154 11.6154 11.7271 11.7271 11.9604 11.9604 12.3683 12.3683 k =-0.1134 0.5115 0.3707 ( 5303 PWs) bands (ev): -12.4458 -12.4458 -12.3200 -12.3200 -11.6589 -11.6589 -11.1753 -11.1753 -10.8691 -10.8691 -10.7802 -10.7802 -10.7346 -10.7346 -10.6440 -10.6440 -0.8380 -0.8380 0.2344 0.2344 0.7141 0.7141 1.1908 1.1908 1.6260 1.6260 1.7227 1.7227 2.1712 2.1712 2.2203 2.2203 2.7022 2.7022 3.0104 3.0104 3.2184 3.2184 3.2837 3.2837 3.5959 3.5959 3.8057 3.8057 3.8194 3.8194 4.0123 4.0123 4.3114 4.3114 4.4881 4.4881 4.7469 4.7469 4.9975 4.9975 5.1957 5.1957 5.3368 5.3368 5.7385 5.7385 5.8934 5.8934 10.7252 10.7252 11.0342 11.0342 11.6071 11.6071 11.7195 11.7195 11.9539 11.9539 12.3473 12.3473 k =-0.1276 0.5065 0.3800 ( 5303 PWs) bands (ev): -12.4476 -12.4476 -12.3233 -12.3233 -11.6659 -11.6659 -11.1638 -11.1638 -10.8704 -10.8704 -10.7843 -10.7843 -10.7286 -10.7286 -10.6399 -10.6399 -0.8578 -0.8578 0.2552 0.2552 0.6852 0.6852 1.1878 1.1878 1.6173 1.6173 1.7049 1.7049 2.2000 2.2000 2.2404 2.2404 2.6971 2.6971 3.0294 3.0294 3.1966 3.1966 3.2894 3.2894 3.6053 3.6053 3.8080 3.8080 3.8247 3.8247 4.0270 4.0270 4.3080 4.3080 4.4902 4.4902 4.7466 4.7466 4.9984 4.9984 5.1814 5.1814 5.3659 5.3659 5.7143 5.7143 5.8842 5.8842 10.7365 10.7365 11.0537 11.0537 11.5989 11.5989 11.7116 11.7116 11.9445 11.9445 12.3290 12.3290 k =-0.1417 0.5015 0.3892 ( 5294 PWs) bands (ev): -12.4495 -12.4495 -12.3273 -12.3273 -11.6719 -11.6719 -11.1530 -11.1530 -10.8716 -10.8716 -10.7885 -10.7885 -10.7221 -10.7221 -10.6358 -10.6358 -0.8780 -0.8780 0.2752 0.2752 0.6564 0.6564 1.1787 1.1787 1.6171 1.6171 1.6874 1.6874 2.2290 2.2290 2.2588 2.2588 2.6897 2.6897 3.0467 3.0467 3.1785 3.1785 3.2962 3.2962 3.6155 3.6155 3.8102 3.8102 3.8249 3.8249 4.0475 4.0475 4.3055 4.3055 4.4929 4.4929 4.7482 4.7482 4.9980 4.9980 5.1671 5.1671 5.3939 5.3939 5.6878 5.6878 5.8735 5.8735 10.7494 10.7494 11.0743 11.0743 11.5910 11.5910 11.7036 11.7036 11.9321 11.9321 12.3138 12.3138 k =-0.1559 0.4965 0.3985 ( 5290 PWs) bands (ev): -12.4516 -12.4516 -12.3320 -12.3320 -11.6767 -11.6767 -11.1431 -11.1431 -10.8724 -10.8724 -10.7929 -10.7929 -10.7150 -10.7150 -10.6315 -10.6315 -0.8980 -0.8980 0.2930 0.2930 0.6287 0.6287 1.1652 1.1652 1.6237 1.6237 1.6704 1.6704 2.2570 2.2570 2.2769 2.2769 2.6809 2.6809 3.0551 3.0551 3.1705 3.1705 3.3040 3.3040 3.6261 3.6261 3.8128 3.8128 3.8217 3.8217 4.0717 4.0717 4.3039 4.3039 4.4961 4.4961 4.7519 4.7519 4.9960 4.9960 5.1536 5.1536 5.4204 5.4204 5.6590 5.6590 5.8613 5.8613 10.7636 10.7636 11.0958 11.0958 11.5837 11.5837 11.6956 11.6956 11.9169 11.9169 12.3016 12.3016 k =-0.1701 0.4915 0.4078 ( 5291 PWs) bands (ev): -12.4537 -12.4537 -12.3375 -12.3375 -11.6800 -11.6800 -11.1344 -11.1344 -10.8729 -10.8729 -10.7972 -10.7972 -10.7074 -10.7074 -10.6272 -10.6272 -0.9177 -0.9177 0.3066 0.3066 0.6038 0.6038 1.1493 1.1493 1.6342 1.6342 1.6545 1.6545 2.2800 2.2800 2.2987 2.2987 2.6717 2.6717 3.0480 3.0480 3.1785 3.1785 3.3129 3.3129 3.6368 3.6368 3.8141 3.8141 3.8191 3.8191 4.0972 4.0972 4.3033 4.3033 4.5000 4.5000 4.7580 4.7580 4.9914 4.9914 5.1416 5.1416 5.4448 5.4448 5.6281 5.6281 5.8476 5.8476 10.7793 10.7793 11.1179 11.1179 11.5773 11.5773 11.6877 11.6877 11.8994 11.8994 12.2920 12.2920 k =-0.1842 0.4865 0.4170 ( 5286 PWs) bands (ev): -12.4559 -12.4559 -12.3437 -12.3437 -11.6817 -11.6817 -11.1271 -11.1271 -10.8729 -10.8729 -10.8016 -10.8016 -10.6994 -10.6994 -10.6230 -10.6230 -0.9365 -0.9365 0.3132 0.3132 0.5843 0.5843 1.1327 1.1327 1.6345 1.6345 1.6515 1.6515 2.2963 2.2963 2.3264 2.3264 2.6629 2.6629 3.0280 3.0280 3.1989 3.1989 3.3228 3.3228 3.6468 3.6468 3.8102 3.8102 3.8235 3.8235 4.1221 4.1221 4.3037 4.3037 4.5044 4.5044 4.7667 4.7667 4.9839 4.9839 5.1318 5.1318 5.4669 5.4669 5.5952 5.5952 5.8323 5.8323 10.7962 10.7962 11.1404 11.1404 11.5718 11.5718 11.6800 11.6800 11.8800 11.8800 12.2845 12.2845 k =-0.1984 0.4816 0.4263 ( 5290 PWs) bands (ev): -12.4582 -12.4582 -12.3506 -12.3506 -11.6819 -11.6819 -11.1213 -11.1213 -10.8726 -10.8726 -10.8059 -10.8059 -10.6910 -10.6910 -10.6188 -10.6188 -0.9544 -0.9544 0.3096 0.3096 0.5735 0.5735 1.1171 1.1171 1.6198 1.6198 1.6641 1.6641 2.3098 2.3098 2.3564 2.3564 2.6553 2.6553 3.0013 3.0013 3.2247 3.2247 3.3338 3.3338 3.6557 3.6557 3.8070 3.8070 3.8315 3.8315 4.1447 4.1447 4.3048 4.3048 4.5093 4.5093 4.7784 4.7784 4.9732 4.9732 5.1247 5.1247 5.4862 5.4862 5.5604 5.5604 5.8155 5.8155 10.8143 10.8143 11.1631 11.1631 11.5674 11.5674 11.6725 11.6725 11.8596 11.8596 12.2782 12.2782 k =-0.2126 0.4766 0.4356 ( 5300 PWs) bands (ev): -12.4606 -12.4606 -12.3581 -12.3581 -11.6803 -11.6803 -11.1170 -11.1170 -10.8719 -10.8719 -10.8102 -10.8102 -10.6823 -10.6823 -10.6146 -10.6146 -0.9710 -0.9710 0.2941 0.2941 0.5729 0.5729 1.1034 1.1034 1.6043 1.6043 1.6761 1.6761 2.3227 2.3227 2.3869 2.3869 2.6492 2.6492 2.9714 2.9714 3.2515 3.2515 3.3456 3.3456 3.6628 3.6628 3.8066 3.8066 3.8430 3.8430 4.1640 4.1640 4.3064 4.3064 4.5146 4.5146 4.7934 4.7934 4.9595 4.9595 5.1201 5.1201 5.5024 5.5024 5.5240 5.5240 5.7971 5.7971 10.8334 10.8334 11.1858 11.1858 11.5643 11.5643 11.6654 11.6654 11.8387 11.8387 12.2725 12.2725 k =-0.2268 0.4716 0.4448 ( 5293 PWs) bands (ev): -12.4631 -12.4631 -12.3662 -12.3662 -11.6770 -11.6770 -11.1144 -11.1144 -10.8708 -10.8708 -10.8143 -10.8143 -10.6733 -10.6733 -10.6105 -10.6105 -0.9861 -0.9861 0.2676 0.2676 0.5820 0.5820 1.0921 1.0921 1.5890 1.5890 1.6850 1.6850 2.3363 2.3363 2.4177 2.4177 2.6450 2.6450 2.9399 2.9399 3.2772 3.2772 3.3582 3.3582 3.6679 3.6679 3.8102 3.8102 3.8585 3.8585 4.1797 4.1797 4.3077 4.3077 4.5200 4.5200 4.8117 4.8117 4.9432 4.9432 5.1178 5.1178 5.4854 5.4854 5.5161 5.5161 5.7771 5.7771 10.8534 10.8534 11.2081 11.2081 11.5624 11.5624 11.6586 11.6586 11.8179 11.8179 12.2664 12.2664 k =-0.2409 0.4666 0.4541 ( 5300 PWs) bands (ev): -12.4657 -12.4657 -12.3747 -12.3747 -11.6721 -11.6721 -11.1134 -11.1134 -10.8695 -10.8695 -10.8184 -10.8184 -10.6642 -10.6642 -10.6066 -10.6066 -0.9995 -0.9995 0.2327 0.2327 0.5983 0.5983 1.0837 1.0837 1.5740 1.5740 1.6896 1.6896 2.3515 2.3515 2.4484 2.4484 2.6425 2.6425 2.9075 2.9075 3.3002 3.3002 3.3712 3.3712 3.6712 3.6712 3.8187 3.8187 3.8780 3.8780 4.1918 4.1918 4.3081 4.3081 4.5256 4.5256 4.8333 4.8333 4.9252 4.9252 5.1172 5.1172 5.4460 5.4460 5.5259 5.5259 5.7557 5.7557 10.8741 10.8741 11.2299 11.2299 11.5618 11.5618 11.6523 11.6523 11.7978 11.7978 12.2592 12.2592 k =-0.2551 0.4616 0.4634 ( 5297 PWs) bands (ev): -12.4683 -12.4683 -12.3836 -12.3836 -11.6656 -11.6656 -11.1138 -11.1138 -10.8679 -10.8679 -10.8223 -10.8223 -10.6549 -10.6549 -10.6028 -10.6028 -1.0110 -1.0110 0.1921 0.1921 0.6196 0.6196 1.0781 1.0781 1.5593 1.5593 1.6890 1.6890 2.3689 2.3689 2.4790 2.4790 2.6415 2.6415 2.8750 2.8750 3.3197 3.3197 3.3840 3.3840 3.6733 3.6733 3.8327 3.8327 3.9015 3.9015 4.2008 4.2008 4.3069 4.3069 4.5310 4.5310 4.8578 4.8578 4.9060 4.9060 5.1177 5.1177 5.4053 5.4053 5.5326 5.5326 5.7329 5.7329 10.8953 10.8953 11.2509 11.2509 11.5625 11.5625 11.6464 11.6464 11.7789 11.7789 12.2502 12.2502 k =-0.2693 0.4566 0.4726 ( 5299 PWs) bands (ev): -12.4711 -12.4711 -12.3926 -12.3926 -11.6575 -11.6575 -11.1157 -11.1157 -10.8663 -10.8663 -10.8261 -10.8261 -10.6457 -10.6457 -10.5991 -10.5991 -1.0205 -1.0205 0.1478 0.1478 0.6440 0.6440 1.0754 1.0754 1.5448 1.5448 1.6830 1.6830 2.3889 2.3889 2.5093 2.5093 2.6418 2.6418 2.8426 2.8426 3.3354 3.3354 3.3959 3.3959 3.6753 3.6753 3.8522 3.8522 3.9287 3.9287 4.2074 4.2074 4.3035 4.3035 4.5361 4.5361 4.8835 4.8835 4.8872 4.8872 5.1189 5.1189 5.3635 5.3635 5.5359 5.5359 5.7088 5.7088 10.9169 10.9169 11.2709 11.2709 11.5643 11.5643 11.6408 11.6408 11.7616 11.7616 12.2386 12.2386 k =-0.2835 0.4517 0.4819 ( 5301 PWs) bands (ev): -12.4739 -12.4739 -12.4016 -12.4016 -11.6481 -11.6481 -11.1189 -11.1189 -10.8645 -10.8645 -10.8298 -10.8298 -10.6367 -10.6367 -10.5955 -10.5955 -1.0279 -1.0279 0.1011 0.1011 0.6706 0.6706 1.0755 1.0755 1.5306 1.5306 1.6716 1.6716 2.4115 2.4115 2.5393 2.5393 2.6429 2.6429 2.8107 2.8107 3.3472 3.3472 3.4062 3.4062 3.6785 3.6785 3.8770 3.8770 3.9591 3.9591 4.2120 4.2120 4.2981 4.2981 4.5407 4.5407 4.8661 4.8661 4.9130 4.9130 5.1206 5.1206 5.3210 5.3210 5.5359 5.5359 5.6834 5.6834 10.9387 10.9387 11.2896 11.2896 11.5672 11.5672 11.6356 11.6356 11.7463 11.7463 12.2243 12.2243 k =-0.2976 0.4467 0.4912 ( 5295 PWs) bands (ev): -12.4769 -12.4769 -12.4106 -12.4106 -11.6373 -11.6373 -11.1233 -11.1233 -10.8628 -10.8628 -10.8332 -10.8332 -10.6278 -10.6278 -10.5921 -10.5921 -1.0329 -1.0329 0.0531 0.0531 0.6986 0.6986 1.0781 1.0781 1.5166 1.5166 1.6553 1.6553 2.4360 2.4360 2.5689 2.5689 2.6447 2.6447 2.7799 2.7799 3.3555 3.3555 3.4137 3.4137 3.6841 3.6841 3.9063 3.9063 3.9926 3.9926 4.2150 4.2150 4.2909 4.2909 4.5445 4.5445 4.8464 4.8464 4.9420 4.9420 5.1223 5.1223 5.2780 5.2780 5.5327 5.5327 5.6570 5.6570 10.9606 10.9606 11.3068 11.3068 11.5710 11.5710 11.6306 11.6306 11.7334 11.7334 12.2068 12.2068 k =-0.3118 0.4417 0.5004 ( 5291 PWs) bands (ev): -12.4800 -12.4800 -12.4194 -12.4194 -11.6253 -11.6253 -11.1288 -11.1288 -10.8612 -10.8612 -10.8365 -10.8365 -10.6193 -10.6193 -10.5889 -10.5889 -1.0356 -1.0356 0.0045 0.0045 0.7277 0.7277 1.0830 1.0830 1.5029 1.5029 1.6347 1.6347 2.4614 2.4614 2.5978 2.5978 2.6473 2.6473 2.7508 2.7508 3.3605 3.3605 3.4177 3.4177 3.6933 3.6933 3.9391 3.9391 4.0287 4.0287 4.2164 4.2164 4.2830 4.2830 4.5474 4.5474 4.8273 4.8273 4.9708 4.9708 5.1240 5.1240 5.2346 5.2346 5.5265 5.5265 5.6297 5.6297 10.9823 10.9823 11.3223 11.3223 11.5757 11.5757 11.6259 11.6259 11.7229 11.7229 12.1864 12.1864 k =-0.3260 0.4367 0.5097 ( 5291 PWs) bands (ev): -12.4832 -12.4832 -12.4279 -12.4279 -11.6122 -11.6122 -11.1352 -11.1352 -10.8598 -10.8598 -10.8396 -10.8396 -10.6112 -10.6112 -10.5859 -10.5859 -1.0357 -1.0357 -0.0443 -0.0443 0.7575 0.7575 1.0901 1.0901 1.4894 1.4894 1.6107 1.6107 2.4861 2.4861 2.6247 2.6247 2.6510 2.6510 2.7250 2.7250 3.3627 3.3627 3.4175 3.4175 3.7070 3.7070 3.9742 3.9742 4.0671 4.0671 4.2157 4.2157 4.2760 4.2760 4.5491 4.5491 4.8088 4.8088 4.9986 4.9986 5.1254 5.1254 5.1911 5.1911 5.5174 5.5174 5.6017 5.6017 11.0039 11.0039 11.3358 11.3358 11.5809 11.5809 11.6215 11.6215 11.7151 11.7151 12.1634 12.1634 k =-0.3401 0.4317 0.5190 ( 5284 PWs) bands (ev): -12.4865 -12.4865 -12.4360 -12.4360 -11.5981 -11.5981 -11.1426 -11.1426 -10.8585 -10.8585 -10.8424 -10.8424 -10.6036 -10.6036 -10.5830 -10.5830 -1.0333 -1.0333 -0.0928 -0.0928 0.7878 0.7878 1.0989 1.0989 1.4761 1.4761 1.5840 1.5840 2.5080 2.5080 2.6395 2.6395 2.6632 2.6632 2.7068 2.7068 3.3623 3.3623 3.4130 3.4130 3.7256 3.7256 4.0103 4.0103 4.1076 4.1076 4.2120 4.2120 4.2722 4.2722 4.5495 4.5495 4.7912 4.7912 5.0247 5.0247 5.1262 5.1262 5.1481 5.1481 5.5057 5.5057 5.5732 5.5732 11.0250 11.0250 11.3471 11.3471 11.5866 11.5866 11.6177 11.6177 11.7098 11.7098 12.1384 12.1384 k =-0.3543 0.4267 0.5282 ( 5284 PWs) bands (ev): -12.4899 -12.4899 -12.4436 -12.4436 -11.5831 -11.5831 -11.1508 -11.1508 -10.8575 -10.8575 -10.8451 -10.8451 -10.5967 -10.5967 -10.5804 -10.5804 -1.0283 -1.0283 -0.1407 -0.1407 0.8186 0.8186 1.1093 1.1093 1.4630 1.4630 1.5556 1.5556 2.5250 2.5250 2.6323 2.6323 2.6873 2.6873 2.7041 2.7041 3.3593 3.3593 3.4045 3.4045 3.7488 3.7488 4.0455 4.0455 4.1498 4.1498 4.2049 4.2049 4.2738 4.2738 4.5484 4.5484 4.7745 4.7745 5.0484 5.0484 5.1043 5.1043 5.1276 5.1276 5.4916 5.4916 5.5447 5.5447 11.0457 11.0457 11.3560 11.3560 11.5924 11.5924 11.6147 11.6147 11.7068 11.7068 12.1119 12.1119 k =-0.3685 0.4217 0.5375 ( 5289 PWs) bands (ev): -12.4933 -12.4933 -12.4507 -12.4507 -11.5673 -11.5673 -11.1597 -11.1597 -10.8567 -10.8567 -10.8475 -10.8475 -10.5904 -10.5904 -10.5779 -10.5779 -1.0206 -1.0206 -0.1878 -0.1878 0.8497 0.8497 1.1209 1.1209 1.4501 1.4501 1.5261 1.5261 2.5356 2.5356 2.6142 2.6142 2.7101 2.7101 2.7201 2.7201 3.3537 3.3537 3.3925 3.3925 3.7762 3.7762 4.0777 4.0777 4.1928 4.1928 4.1959 4.1959 4.2823 4.2823 4.5457 4.5457 4.7587 4.7587 5.0623 5.0623 5.0691 5.0691 5.1273 5.1273 5.4756 5.4756 5.5164 5.5164 11.0658 11.0658 11.3624 11.3624 11.5978 11.5978 11.6131 11.6131 11.7059 11.7059 12.0846 12.0846 k =-0.3827 0.4168 0.5468 ( 5282 PWs) bands (ev): -12.4966 -12.4966 -12.4573 -12.4573 -11.5507 -11.5507 -11.1693 -11.1693 -10.8561 -10.8561 -10.8497 -10.8497 -10.5849 -10.5849 -10.5756 -10.5756 -1.0102 -1.0102 -0.2338 -0.2338 0.8809 0.8809 1.1333 1.1333 1.4375 1.4375 1.4964 1.4964 2.5397 2.5397 2.5929 2.5929 2.7322 2.7322 2.7459 2.7459 3.3453 3.3453 3.3779 3.3779 3.8074 3.8074 4.1049 4.1049 4.1845 4.1845 4.2384 4.2384 4.2984 4.2984 4.5413 4.5413 4.7439 4.7439 5.0213 5.0213 5.0861 5.0861 5.1264 5.1264 5.4579 5.4579 5.4887 5.4887 11.0851 11.0851 11.3662 11.3662 11.6020 11.6020 11.6137 11.6137 11.7068 11.7068 12.0572 12.0572 k =-0.3968 0.4118 0.5560 ( 5282 PWs) bands (ev): -12.4998 -12.4998 -12.4634 -12.4634 -11.5336 -11.5336 -11.1795 -11.1795 -10.8559 -10.8559 -10.8517 -10.8517 -10.5802 -10.5802 -10.5735 -10.5735 -0.9971 -0.9971 -0.2786 -0.2786 0.9120 0.9120 1.1462 1.1462 1.4251 1.4251 1.4671 1.4671 2.5385 2.5385 2.5714 2.5714 2.7574 2.7574 2.7731 2.7731 3.3337 3.3337 3.3612 3.3612 3.8418 3.8418 4.1256 4.1256 4.1744 4.1744 4.2838 4.2838 4.3223 4.3223 4.5350 4.5350 4.7300 4.7300 4.9814 4.9814 5.0992 5.0992 5.1246 5.1246 5.4389 5.4389 5.4621 5.4621 11.1036 11.1036 11.3673 11.3673 11.6046 11.6046 11.6170 11.6170 11.7091 11.7091 12.0301 12.0301 k =-0.4110 0.4068 0.5653 ( 5287 PWs) bands (ev): -12.5028 -12.5028 -12.4691 -12.4691 -11.5160 -11.5160 -11.1903 -11.1903 -10.8559 -10.8559 -10.8534 -10.8534 -10.5763 -10.5763 -10.5716 -10.5716 -0.9811 -0.9811 -0.3221 -0.3221 0.9428 0.9428 1.1590 1.1590 1.4130 1.4130 1.4394 1.4394 2.5331 2.5331 2.5510 2.5510 2.7843 2.7843 2.8005 2.8005 3.3187 3.3187 3.3428 3.3428 3.8789 3.8789 4.1397 4.1397 4.1660 4.1660 4.3293 4.3293 4.3533 4.3533 4.5269 4.5269 4.7173 4.7173 4.9431 4.9431 5.1079 5.1079 5.1219 5.1219 5.4192 5.4192 5.4371 5.4371 11.1211 11.1211 11.3658 11.3658 11.6068 11.6068 11.6217 11.6217 11.7127 11.7127 12.0039 12.0039 k =-0.4252 0.4018 0.5746 ( 5283 PWs) bands (ev): -12.5054 -12.5054 -12.4743 -12.4743 -11.4979 -11.4979 -11.2015 -11.2015 -10.8561 -10.8561 -10.8549 -10.8549 -10.5734 -10.5734 -10.5698 -10.5698 -0.9625 -0.9625 -0.3640 -0.3640 0.9730 0.9730 1.1708 1.1708 1.4011 1.4011 1.4143 1.4143 2.5244 2.5244 2.5323 2.5323 2.8113 2.8113 2.8276 2.8276 3.3004 3.3004 3.3228 3.3228 3.9184 3.9184 4.1480 4.1480 4.1604 4.1604 4.3740 4.3740 4.3897 4.3897 4.5166 4.5166 4.7060 4.7060 4.9066 4.9066 5.1122 5.1122 5.1182 5.1182 5.3991 5.3991 5.4138 5.4138 11.1376 11.1376 11.3617 11.3617 11.6095 11.6095 11.6264 11.6264 11.7172 11.7172 11.9788 11.9788 k =-0.4394 0.3968 0.5838 ( 5276 PWs) bands (ev): -12.5076 -12.5076 -12.4792 -12.4792 -11.4795 -11.4795 -11.2132 -11.2132 -10.8567 -10.8567 -10.8560 -10.8560 -10.5713 -10.5713 -10.5683 -10.5683 -0.9411 -0.9411 -0.4043 -0.4043 1.0021 1.0021 1.1807 1.1807 1.3893 1.3893 1.3935 1.3935 2.5124 2.5124 2.5167 2.5167 2.8375 2.8375 2.8540 2.8540 3.2793 3.2793 3.3011 3.3011 3.9598 3.9598 4.1516 4.1516 4.1588 4.1588 4.4167 4.4167 4.4292 4.4292 4.5042 4.5042 4.6968 4.6968 4.8723 4.8723 5.1119 5.1119 5.1134 5.1134 5.3795 5.3795 5.3924 5.3924 11.1529 11.1529 11.3551 11.3551 11.6131 11.6131 11.6307 11.6307 11.7227 11.7227 11.9552 11.9552 k =-0.4535 0.3918 0.5931 ( 5280 PWs) bands (ev): -12.5092 -12.5092 -12.4838 -12.4838 -11.4608 -11.4608 -11.2254 -11.2254 -10.8576 -10.8576 -10.8570 -10.8570 -10.5699 -10.5699 -10.5673 -10.5673 -0.9170 -0.9170 -0.4430 -0.4430 1.0296 1.0296 1.1871 1.1871 1.3774 1.3774 1.3793 1.3793 2.4980 2.4980 2.5037 2.5037 2.8623 2.8623 2.8791 2.8791 3.2560 3.2560 3.2774 3.2774 4.0029 4.0029 4.1532 4.1532 4.1598 4.1598 4.4563 4.4563 4.4688 4.4688 4.4903 4.4903 4.6910 4.6910 4.8404 4.8404 5.1072 5.1072 5.1080 5.1080 5.3611 5.3611 5.3726 5.3726 11.1669 11.1669 11.3460 11.3460 11.6175 11.6175 11.6344 11.6344 11.7292 11.7292 11.9332 11.9332 k =-0.4535 0.3918 0.5931 ( 5280 PWs) bands (ev): -12.5092 -12.5092 -12.4838 -12.4838 -11.4608 -11.4608 -11.2254 -11.2254 -10.8576 -10.8576 -10.8570 -10.8570 -10.5699 -10.5699 -10.5673 -10.5673 -0.9170 -0.9170 -0.4430 -0.4430 1.0296 1.0296 1.1871 1.1871 1.3774 1.3774 1.3793 1.3793 2.4980 2.4980 2.5037 2.5037 2.8623 2.8623 2.8791 2.8791 3.2560 3.2560 3.2774 3.2774 4.0029 4.0029 4.1532 4.1532 4.1598 4.1598 4.4563 4.4563 4.4688 4.4688 4.4903 4.4903 4.6910 4.6910 4.8404 4.8404 5.1072 5.1072 5.1080 5.1080 5.3611 5.3611 5.3726 5.3726 11.1669 11.1669 11.3460 11.3460 11.6175 11.6175 11.6344 11.6344 11.7292 11.7292 11.9332 11.9332 k =-0.4628 0.3773 0.5931 ( 5280 PWs) bands (ev): -12.5107 -12.5107 -12.4900 -12.4900 -11.4335 -11.4335 -11.2441 -11.2441 -10.8587 -10.8587 -10.8582 -10.8582 -10.5684 -10.5684 -10.5663 -10.5663 -0.8786 -0.8786 -0.4976 -0.4976 1.0662 1.0662 1.1913 1.1913 1.3630 1.3630 1.3645 1.3645 2.4794 2.4794 2.4863 2.4863 2.8971 2.8971 2.9140 2.9140 3.2212 3.2212 3.2418 3.2418 4.0663 4.0663 4.1558 4.1558 4.1615 4.1615 4.4632 4.4632 4.5126 4.5126 4.5219 4.5219 4.6868 4.6868 4.7986 4.7986 5.0962 5.0962 5.0980 5.0980 5.3376 5.3376 5.3469 5.3469 11.1863 11.1863 11.3306 11.3306 11.6242 11.6242 11.6388 11.6388 11.7401 11.7401 11.9031 11.9031 k =-0.4721 0.3627 0.5931 ( 5280 PWs) bands (ev): -12.5113 -12.5113 -12.4955 -12.4955 -11.4067 -11.4067 -11.2640 -11.2640 -10.8595 -10.8595 -10.8591 -10.8591 -10.5672 -10.5672 -10.5656 -10.5656 -0.8379 -0.8379 -0.5511 -0.5511 1.0984 1.0984 1.1917 1.1917 1.3517 1.3517 1.3528 1.3528 2.4651 2.4651 2.4718 2.4718 2.9307 2.9307 2.9472 2.9472 3.1880 3.1880 3.2073 3.2073 4.1284 4.1284 4.1581 4.1581 4.1625 4.1625 4.4330 4.4330 4.5597 4.5597 4.5680 4.5680 4.6851 4.6851 4.7632 4.7632 5.0831 5.0831 5.0855 5.0855 5.3193 5.3193 5.3262 5.3262 11.2057 11.2057 11.3145 11.3145 11.6306 11.6306 11.6420 11.6420 11.7526 11.7526 11.8749 11.8749 k =-0.4814 0.3481 0.5931 ( 5268 PWs) bands (ev): -12.5109 -12.5109 -12.5002 -12.5002 -11.3806 -11.3806 -11.2852 -11.2852 -10.8601 -10.8601 -10.8598 -10.8598 -10.5663 -10.5663 -10.5652 -10.5652 -0.7949 -0.7949 -0.6032 -0.6032 1.1260 1.1260 1.1880 1.1880 1.3438 1.3438 1.3445 1.3445 2.4554 2.4554 2.4605 2.4605 2.9621 2.9621 2.9769 2.9769 3.1584 3.1584 3.1750 3.1750 4.1595 4.1595 4.1629 4.1629 4.1892 4.1892 4.3956 4.3956 4.5982 4.5982 4.6044 4.6044 4.6862 4.6862 4.7350 4.7350 5.0699 5.0699 5.0723 5.0723 5.3067 5.3067 5.3112 5.3112 11.2248 11.2248 11.2976 11.2976 11.6361 11.6361 11.6439 11.6439 11.7672 11.7672 11.8488 11.8488 k =-0.4907 0.3336 0.5931 ( 5268 PWs) bands (ev): -12.5096 -12.5096 -12.5042 -12.5042 -11.3553 -11.3553 -11.3075 -11.3075 -10.8604 -10.8604 -10.8603 -10.8603 -10.5656 -10.5656 -10.5651 -10.5651 -0.7497 -0.7497 -0.6538 -0.6538 1.1488 1.1488 1.1797 1.1797 1.3390 1.3390 1.3394 1.3394 2.4502 2.4502 2.4530 2.4530 2.9886 2.9886 2.9986 2.9986 3.1370 3.1370 3.1479 3.1479 4.1610 4.1610 4.1627 4.1627 4.2471 4.2471 4.3515 4.3515 4.6243 4.6243 4.6277 4.6277 4.6908 4.6908 4.7142 4.7142 5.0601 5.0601 5.0617 5.0617 5.2997 5.2997 5.3019 5.3019 11.2436 11.2436 11.2801 11.2801 11.6404 11.6404 11.6443 11.6443 11.7840 11.7840 11.8248 11.8248 k =-0.5000 0.3190 0.5931 ( 5256 PWs) bands (ev): -12.5074 -12.5074 -12.5074 -12.5074 -11.3309 -11.3309 -11.3309 -11.3309 -10.8605 -10.8605 -10.8605 -10.8605 -10.5652 -10.5652 -10.5652 -10.5652 -0.7027 -0.7027 -0.7027 -0.7027 1.1667 1.1667 1.1667 1.1667 1.3376 1.3376 1.3376 1.3376 2.4495 2.4495 2.4495 2.4495 3.0035 3.0035 3.0035 3.0035 3.1325 3.1325 3.1325 3.1325 4.1621 4.1621 4.1621 4.1621 4.3016 4.3016 4.3016 4.3016 4.6347 4.6347 4.6347 4.6347 4.6998 4.6998 4.6998 4.6998 5.0570 5.0570 5.0570 5.0570 5.2981 5.2981 5.2981 5.2981 11.2621 11.2621 11.2621 11.2621 11.6431 11.6431 11.6431 11.6431 11.8032 11.8032 11.8032 11.8032 k = 0.0000 0.0000 0.5931 ( 5288 PWs) bands (ev): -12.4744 -12.4744 -12.4743 -12.4743 -11.1431 -11.1431 -11.1431 -11.1431 -10.8830 -10.8830 -10.8830 -10.8830 -10.8347 -10.8347 -10.8347 -10.8347 0.0862 0.0862 0.0863 0.0863 1.2286 1.2286 1.2286 1.2286 1.3489 1.3489 1.3489 1.3489 1.6973 1.6973 1.6973 1.6973 2.6694 2.6694 2.6694 2.6694 3.2925 3.2925 3.2925 3.2925 3.5652 3.5652 3.5653 3.5653 4.1282 4.1282 4.1282 4.1282 4.7454 4.7454 4.7454 4.7454 5.1656 5.1656 5.1657 5.1657 5.1976 5.1976 5.1977 5.1977 5.5422 5.5422 5.5422 5.5422 10.5791 10.5791 10.5791 10.5791 11.5838 11.5838 11.5838 11.5838 11.6592 11.6592 11.6592 11.6592 k = 0.0093 0.0145 0.5931 ( 5292 PWs) bands (ev): -12.4740 -12.4740 -12.4737 -12.4737 -11.1449 -11.1449 -11.1440 -11.1440 -10.8827 -10.8827 -10.8819 -10.8819 -10.8348 -10.8348 -10.8345 -10.8345 0.0855 0.0855 0.0874 0.0874 1.2280 1.2280 1.2281 1.2281 1.3512 1.3512 1.3521 1.3521 1.6931 1.6931 1.6975 1.6975 2.6706 2.6706 2.6718 2.6718 3.2915 3.2915 3.2921 3.2921 3.5651 3.5651 3.5654 3.5654 4.1281 4.1281 4.1286 4.1286 4.7432 4.7432 4.7446 4.7446 5.1618 5.1618 5.1637 5.1637 5.1983 5.1983 5.1995 5.1995 5.5424 5.5424 5.5426 5.5426 10.5788 10.5788 10.5788 10.5788 11.5817 11.5817 11.5885 11.5885 11.6575 11.6575 11.6643 11.6643 k = 0.0185 0.0290 0.5931 ( 5304 PWs) bands (ev): -12.4727 -12.4727 -12.4721 -12.4721 -11.1494 -11.1494 -11.1476 -11.1476 -10.8809 -10.8809 -10.8794 -10.8794 -10.8350 -10.8350 -10.8344 -10.8344 0.0850 0.0850 0.0888 0.0888 1.2266 1.2266 1.2269 1.2269 1.3587 1.3587 1.3606 1.3606 1.6851 1.6851 1.6938 1.6938 2.6753 2.6753 2.6775 2.6775 3.2891 3.2891 3.2903 3.2903 3.5650 3.5650 3.5655 3.5655 4.1284 4.1284 4.1293 4.1293 4.7382 4.7382 4.7409 4.7409 5.1539 5.1539 5.1567 5.1567 5.2006 5.2006 5.2022 5.2022 5.5432 5.5432 5.5436 5.5436 10.5779 10.5779 10.5780 10.5780 11.5824 11.5824 11.5955 11.5955 11.6595 11.6595 11.6724 11.6724 k = 0.0278 0.0435 0.5931 ( 5296 PWs) bands (ev): -12.4704 -12.4704 -12.4694 -12.4694 -11.1563 -11.1563 -11.1538 -11.1538 -10.8778 -10.8778 -10.8757 -10.8757 -10.8351 -10.8351 -10.8342 -10.8342 0.0849 0.0849 0.0906 0.0906 1.2252 1.2252 1.2255 1.2255 1.3705 1.3705 1.3733 1.3733 1.6736 1.6736 1.6866 1.6866 2.6830 2.6830 2.6861 2.6861 3.2856 3.2856 3.2874 3.2874 3.5648 3.5648 3.5656 3.5656 4.1291 4.1291 4.1304 4.1304 4.7303 4.7303 4.7343 4.7343 5.1433 5.1433 5.1467 5.1467 5.2027 5.2027 5.2043 5.2043 5.5446 5.5446 5.5452 5.5452 10.5764 10.5764 10.5767 10.5767 11.5861 11.5861 11.6039 11.6039 11.6659 11.6659 11.6834 11.6834 k = 0.0370 0.0581 0.5931 ( 5296 PWs) bands (ev): -12.4671 -12.4671 -12.4659 -12.4659 -11.1655 -11.1655 -11.1622 -11.1622 -10.8737 -10.8737 -10.8709 -10.8709 -10.8352 -10.8352 -10.8339 -10.8339 0.0851 0.0851 0.0927 0.0927 1.2243 1.2243 1.2249 1.2249 1.3855 1.3855 1.3894 1.3894 1.6595 1.6595 1.6766 1.6766 2.6929 2.6929 2.6968 2.6968 3.2812 3.2812 3.2835 3.2835 3.5645 3.5645 3.5655 3.5655 4.1301 4.1301 4.1318 4.1318 4.7200 4.7200 4.7251 4.7251 5.1310 5.1310 5.1345 5.1345 5.2035 5.2035 5.2049 5.2049 5.5466 5.5466 5.5474 5.5474 10.5745 10.5745 10.5749 10.5749 11.5926 11.5926 11.6129 11.6129 11.6770 11.6770 11.6972 11.6972 k = 0.0463 0.0726 0.5931 ( 5296 PWs) bands (ev): -12.4629 -12.4629 -12.4613 -12.4613 -11.1766 -11.1766 -11.1727 -11.1727 -10.8688 -10.8688 -10.8654 -10.8654 -10.8353 -10.8353 -10.8336 -10.8336 0.0856 0.0856 0.0951 0.0951 1.2247 1.2247 1.2253 1.2253 1.4028 1.4028 1.4077 1.4077 1.6438 1.6438 1.6648 1.6648 2.7042 2.7042 2.7087 2.7087 3.2763 3.2763 3.2792 3.2792 3.5641 3.5641 3.5653 3.5653 4.1315 4.1315 4.1336 4.1336 4.7075 4.7075 4.7136 4.7136 5.1173 5.1173 5.1206 5.1206 5.2024 5.2024 5.2036 5.2036 5.5493 5.5493 5.5503 5.5503 10.5722 10.5722 10.5729 10.5729 11.6015 11.6015 11.6222 11.6222 11.6931 11.6931 11.7136 11.7136 k = 0.0556 0.0871 0.5931 ( 5294 PWs) bands (ev): -12.4578 -12.4578 -12.4559 -12.4559 -11.1894 -11.1894 -11.1849 -11.1849 -10.8634 -10.8634 -10.8593 -10.8593 -10.8353 -10.8353 -10.8331 -10.8331 0.0864 0.0864 0.0977 0.0977 1.2266 1.2266 1.2273 1.2273 1.4210 1.4210 1.4269 1.4269 1.6279 1.6279 1.6525 1.6525 2.7157 2.7157 2.7205 2.7205 3.2716 3.2716 3.2749 3.2749 3.5635 3.5635 3.5648 3.5648 4.1333 4.1333 4.1358 4.1358 4.6933 4.6933 4.7000 4.7000 5.1023 5.1023 5.1054 5.1054 5.1994 5.1994 5.2002 5.2002 5.5526 5.5526 5.5538 5.5538 10.5697 10.5697 10.5706 10.5706 11.6126 11.6126 11.6317 11.6317 11.7137 11.7137 11.7325 11.7325 k = 0.0648 0.1016 0.5931 ( 5290 PWs) bands (ev): -12.4519 -12.4519 -12.4496 -12.4496 -11.2036 -11.2036 -11.1986 -11.1986 -10.8578 -10.8578 -10.8530 -10.8530 -10.8353 -10.8353 -10.8325 -10.8325 0.0873 0.0873 0.1005 0.1005 1.2302 1.2302 1.2309 1.2309 1.4388 1.4388 1.4453 1.4453 1.6141 1.6141 1.6416 1.6416 2.7261 2.7261 2.7312 2.7312 3.2675 3.2675 3.2712 3.2712 3.5626 3.5626 3.5641 3.5641 4.1354 4.1354 4.1383 4.1383 4.6775 4.6775 4.6849 4.6849 5.0863 5.0863 5.0890 5.0890 5.1943 5.1943 5.1949 5.1949 5.5564 5.5564 5.5579 5.5579 10.5669 10.5669 10.5682 10.5682 11.6256 11.6256 11.6415 11.6415 11.7382 11.7382 11.7539 11.7539 k = 0.0741 0.1161 0.5931 ( 5290 PWs) bands (ev): -12.4451 -12.4451 -12.4425 -12.4425 -11.2191 -11.2191 -11.2135 -11.2135 -10.8522 -10.8522 -10.8466 -10.8466 -10.8351 -10.8351 -10.8316 -10.8316 0.0884 0.0884 0.1035 0.1035 1.2354 1.2354 1.2359 1.2359 1.4541 1.4541 1.4600 1.4600 1.6055 1.6055 1.6344 1.6344 2.7342 2.7342 2.7392 2.7392 3.2648 3.2648 3.2690 3.2690 3.5615 3.5615 3.5630 3.5630 4.1379 4.1379 4.1411 4.1411 4.6607 4.6607 4.6685 4.6685 5.0693 5.0693 5.0715 5.0715 5.1872 5.1872 5.1877 5.1877 5.5607 5.5607 5.5624 5.5624 10.5641 10.5641 10.5658 10.5658 11.6399 11.6399 11.6518 11.6518 11.7658 11.7658 11.7774 11.7774 k = 0.0833 0.1306 0.5931 ( 5304 PWs) bands (ev): -12.4376 -12.4376 -12.4346 -12.4346 -11.2354 -11.2354 -11.2294 -11.2294 -10.8472 -10.8472 -10.8410 -10.8410 -10.8341 -10.8341 -10.8300 -10.8300 0.0897 0.0897 0.1066 0.1066 1.2418 1.2418 1.2419 1.2419 1.4650 1.4650 1.4679 1.4679 1.6062 1.6062 1.6337 1.6337 2.7386 2.7386 2.7436 2.7436 3.2643 3.2643 3.2687 3.2687 3.5599 3.5599 3.5615 3.5615 4.1407 4.1407 4.1442 4.1442 4.6432 4.6432 4.6512 4.6512 5.0515 5.0515 5.0531 5.0531 5.1784 5.1784 5.1787 5.1787 5.5652 5.5652 5.5672 5.5672 10.5613 10.5613 10.5635 10.5635 11.6553 11.6553 11.6626 11.6626 11.7960 11.7960 11.8029 11.8029 k = 0.0926 0.1451 0.5931 ( 5308 PWs) bands (ev): -12.4294 -12.4294 -12.4261 -12.4261 -11.2526 -11.2526 -11.2460 -11.2460 -10.8432 -10.8432 -10.8379 -10.8379 -10.8306 -10.8306 -10.8274 -10.8274 0.0911 0.0911 0.1099 0.1099 1.2481 1.2481 1.2489 1.2489 1.4683 1.4683 1.4704 1.4704 1.6178 1.6178 1.6414 1.6414 2.7384 2.7384 2.7431 2.7431 3.2663 3.2663 3.2710 3.2710 3.5579 3.5579 3.5596 3.5596 4.1439 4.1439 4.1477 4.1477 4.6254 4.6254 4.6335 4.6335 5.0332 5.0332 5.0341 5.0341 5.1680 5.1680 5.1683 5.1683 5.5699 5.5699 5.5721 5.5721 10.5587 10.5587 10.5613 10.5613 11.6714 11.6714 11.6740 11.6740 11.8281 11.8281 11.8302 11.8302 k = 0.1019 0.1596 0.5931 ( 5304 PWs) bands (ev): -12.4206 -12.4206 -12.4169 -12.4169 -11.2702 -11.2702 -11.2632 -11.2632 -10.8405 -10.8405 -10.8372 -10.8372 -10.8249 -10.8249 -10.8236 -10.8236 0.0926 0.0926 0.1132 0.1132 1.2532 1.2532 1.2556 1.2556 1.4647 1.4647 1.4716 1.4716 1.6384 1.6384 1.6573 1.6573 2.7327 2.7327 2.7372 2.7372 3.2713 3.2713 3.2762 3.2762 3.5554 3.5554 3.5571 3.5571 4.1473 4.1473 4.1514 4.1514 4.6075 4.6075 4.6156 4.6156 5.0145 5.0145 5.0147 5.0147 5.1563 5.1563 5.1565 5.1565 5.5746 5.5746 5.5769 5.5769 10.5562 10.5562 10.5594 10.5594 11.6858 11.6858 11.6878 11.6878 11.8589 11.8589 11.8617 11.8617 k = 0.1111 0.1742 0.5931 ( 5304 PWs) bands (ev): -12.4113 -12.4113 -12.4072 -12.4072 -11.2883 -11.2883 -11.2808 -11.2808 -10.8389 -10.8389 -10.8370 -10.8370 -10.8190 -10.8190 -10.8189 -10.8189 0.0941 0.0941 0.1165 0.1165 1.2558 1.2558 1.2606 1.2606 1.4620 1.4620 1.4720 1.4720 1.6645 1.6645 1.6795 1.6795 2.7211 2.7211 2.7255 2.7255 3.2792 3.2792 3.2841 3.2841 3.5525 3.5525 3.5542 3.5542 4.1510 4.1510 4.1553 4.1553 4.5898 4.5898 4.5978 4.5978 4.9953 4.9953 4.9957 4.9957 5.1435 5.1435 5.1437 5.1437 5.5790 5.5790 5.5815 5.5815 10.5540 10.5540 10.5577 10.5577 11.6978 11.6978 11.7044 11.7044 11.8887 11.8887 11.8963 11.8963 k = 0.1204 0.1887 0.5931 ( 5300 PWs) bands (ev): -12.4015 -12.4015 -12.3970 -12.3970 -11.3065 -11.3065 -11.2986 -11.2986 -10.8380 -10.8380 -10.8370 -10.8370 -10.8141 -10.8141 -10.8131 -10.8131 0.0956 0.0956 0.1198 0.1198 1.2542 1.2542 1.2626 1.2626 1.4640 1.4640 1.4751 1.4751 1.6938 1.6938 1.7058 1.7058 2.7039 2.7039 2.7081 2.7081 3.2896 3.2896 3.2944 3.2944 3.5490 3.5490 3.5508 3.5508 4.1549 4.1549 4.1595 4.1595 4.5727 4.5727 4.5804 4.5804 4.9761 4.9761 4.9773 4.9773 5.1298 5.1298 5.1300 5.1300 5.5831 5.5831 5.5858 5.5858 10.5522 10.5522 10.5564 10.5564 11.7099 11.7099 11.7207 11.7207 11.9192 11.9192 11.9315 11.9315 k = 0.1296 0.2032 0.5931 ( 5296 PWs) bands (ev): -12.3914 -12.3914 -12.3866 -12.3866 -11.3247 -11.3247 -11.3165 -11.3165 -10.8374 -10.8374 -10.8370 -10.8370 -10.8091 -10.8091 -10.8075 -10.8075 0.0972 0.0972 0.1231 0.1231 1.2479 1.2479 1.2606 1.2606 1.4729 1.4729 1.4834 1.4834 1.7248 1.7248 1.7345 1.7345 2.6813 2.6813 2.6853 2.6853 3.3019 3.3019 3.3066 3.3066 3.5452 3.5452 3.5470 3.5470 4.1590 4.1590 4.1638 4.1638 4.5563 4.5563 4.5637 4.5637 4.9576 4.9576 4.9596 4.9596 5.1154 5.1154 5.1157 5.1157 5.5868 5.5868 5.5896 5.5896 10.5506 10.5506 10.5553 10.5553 11.7220 11.7220 11.7367 11.7367 11.9500 11.9500 11.9667 11.9667 k = 0.1389 0.2177 0.5931 ( 5284 PWs) bands (ev): -12.3811 -12.3811 -12.3759 -12.3759 -11.3428 -11.3428 -11.3341 -11.3341 -10.8370 -10.8370 -10.8370 -10.8370 -10.8042 -10.8042 -10.8022 -10.8022 0.0987 0.0987 0.1263 0.1263 1.2372 1.2372 1.2544 1.2544 1.4889 1.4889 1.4980 1.4980 1.7565 1.7565 1.7644 1.7644 2.6538 2.6538 2.6578 2.6578 3.3153 3.3153 3.3197 3.3197 3.5410 3.5410 3.5428 3.5428 4.1631 4.1631 4.1681 4.1681 4.5408 4.5408 4.5478 4.5478 4.9402 4.9402 4.9429 4.9429 5.1004 5.1004 5.1007 5.1007 5.5901 5.5901 5.5929 5.5929 10.5493 10.5493 10.5545 10.5545 11.7339 11.7339 11.7520 11.7520 11.9807 11.9807 12.0016 12.0016 k = 0.1481 0.2322 0.5931 ( 5272 PWs) bands (ev): -12.3708 -12.3708 -12.3652 -12.3652 -11.3605 -11.3605 -11.3514 -11.3514 -10.8371 -10.8371 -10.8367 -10.8367 -10.7996 -10.7996 -10.7973 -10.7973 0.1002 0.1002 0.1294 0.1294 1.2234 1.2234 1.2448 1.2448 1.5111 1.5111 1.5187 1.5187 1.7881 1.7881 1.7946 1.7946 2.6223 2.6223 2.6262 2.6262 3.3289 3.3289 3.3330 3.3330 3.5367 3.5367 3.5385 3.5385 4.1673 4.1673 4.1725 4.1725 4.5263 4.5263 4.5330 4.5330 4.9242 4.9242 4.9276 4.9276 5.0850 5.0850 5.0854 5.0854 5.5928 5.5928 5.5957 5.5957 10.5484 10.5484 10.5540 10.5540 11.7454 11.7454 11.7667 11.7667 12.0109 12.0109 12.0358 12.0358 k = 0.1574 0.2467 0.5931 ( 5272 PWs) bands (ev): -12.3605 -12.3605 -12.3545 -12.3545 -11.3777 -11.3777 -11.3681 -11.3681 -10.8372 -10.8372 -10.8365 -10.8365 -10.7954 -10.7954 -10.7928 -10.7928 0.1016 0.1016 0.1324 0.1324 1.2079 1.2079 1.2329 1.2329 1.5385 1.5385 1.5447 1.5447 1.8189 1.8189 1.8244 1.8244 2.5875 2.5875 2.5913 2.5913 3.3420 3.3420 3.3458 3.3458 3.5324 3.5324 3.5342 3.5342 4.1714 4.1714 4.1768 4.1768 4.5130 4.5130 4.5193 4.5193 4.9099 4.9099 4.9141 4.9141 5.0694 5.0694 5.0698 5.0698 5.5950 5.5950 5.5979 5.5979 10.5477 10.5477 10.5538 10.5538 11.7563 11.7563 11.7805 11.7805 12.0402 12.0402 12.0688 12.0688 k = 0.1667 0.2612 0.5931 ( 5276 PWs) bands (ev): -12.3505 -12.3505 -12.3441 -12.3441 -11.3941 -11.3941 -11.3841 -11.3841 -10.8372 -10.8372 -10.8364 -10.8364 -10.7915 -10.7915 -10.7888 -10.7888 0.1030 0.1030 0.1352 0.1352 1.1918 1.1918 1.2199 1.2199 1.5698 1.5698 1.5750 1.5750 1.8484 1.8484 1.8529 1.8529 2.5501 2.5501 2.5539 2.5539 3.3539 3.3539 3.3572 3.3572 3.5284 3.5284 3.5302 3.5302 4.1754 4.1754 4.1809 4.1809 4.5010 4.5010 4.5068 4.5068 4.8977 4.8977 4.9026 4.9026 5.0536 5.0536 5.0541 5.0541 5.5967 5.5967 5.5996 5.5996 10.5473 10.5473 10.5537 10.5537 11.7666 11.7666 11.7932 11.7932 12.0681 12.0681 12.1003 12.1003 k = 0.1759 0.2757 0.5931 ( 5266 PWs) bands (ev): -12.3409 -12.3409 -12.3341 -12.3341 -11.4095 -11.4095 -11.3991 -11.3991 -10.8373 -10.8373 -10.8362 -10.8362 -10.7879 -10.7879 -10.7851 -10.7851 0.1043 0.1043 0.1378 0.1378 1.1760 1.1760 1.2068 1.2068 1.6044 1.6044 1.6088 1.6088 1.8758 1.8758 1.8796 1.8796 2.5111 2.5111 2.5148 2.5148 3.3641 3.3641 3.3669 3.3669 3.5250 3.5250 3.5267 3.5267 4.1793 4.1793 4.1849 4.1849 4.4903 4.4903 4.4956 4.4956 4.8876 4.8876 4.8933 4.8933 5.0379 5.0379 5.0385 5.0385 5.5979 5.5979 5.6009 5.6009 10.5471 10.5471 10.5539 10.5539 11.7761 11.7761 11.8049 11.8049 12.0944 12.0944 12.1298 12.1298 k = 0.1852 0.2903 0.5931 ( 5282 PWs) bands (ev): -12.3318 -12.3318 -12.3246 -12.3246 -11.4238 -11.4238 -11.4131 -11.4131 -10.8373 -10.8373 -10.8361 -10.8361 -10.7848 -10.7848 -10.7818 -10.7818 0.1054 0.1054 0.1403 0.1403 1.1610 1.1610 1.1940 1.1940 1.6414 1.6414 1.6451 1.6451 1.9004 1.9004 1.9035 1.9035 2.4712 2.4712 2.4750 2.4750 3.3720 3.3720 3.3743 3.3743 3.5225 3.5225 3.5240 3.5240 4.1828 4.1828 4.1886 4.1886 4.4808 4.4808 4.4858 4.4858 4.8799 4.8799 4.8863 4.8863 5.0225 5.0225 5.0230 5.0230 5.5988 5.5988 5.6017 5.6017 10.5470 10.5470 10.5541 10.5541 11.7847 11.7847 11.8154 11.8154 12.1186 12.1186 12.1570 12.1570 k = 0.1944 0.3048 0.5931 ( 5284 PWs) bands (ev): -12.3235 -12.3235 -12.3160 -12.3160 -11.4368 -11.4368 -11.4256 -11.4256 -10.8374 -10.8374 -10.8361 -10.8361 -10.7821 -10.7821 -10.7790 -10.7790 0.1065 0.1065 0.1425 0.1425 1.1473 1.1473 1.1822 1.1822 1.6800 1.6800 1.6833 1.6833 1.9213 1.9213 1.9239 1.9239 2.4317 2.4317 2.4354 2.4354 3.3777 3.3777 3.3794 3.3794 3.5210 3.5210 3.5222 3.5222 4.1860 4.1860 4.1919 4.1919 4.4728 4.4728 4.4773 4.4773 4.8746 4.8746 4.8817 4.8817 5.0076 5.0076 5.0079 5.0079 5.5993 5.5993 5.6023 5.6023 10.5471 10.5471 10.5545 10.5545 11.7923 11.7923 11.8246 11.8246 12.1404 12.1404 12.1814 12.1814 k = 0.2037 0.3193 0.5931 ( 5286 PWs) bands (ev): -12.3161 -12.3161 -12.3082 -12.3082 -11.4482 -11.4482 -11.4367 -11.4367 -10.8374 -10.8374 -10.8360 -10.8360 -10.7798 -10.7798 -10.7767 -10.7767 0.1074 0.1074 0.1444 0.1444 1.1353 1.1353 1.1718 1.1718 1.7197 1.7197 1.7226 1.7226 1.9376 1.9376 1.9397 1.9397 2.3936 2.3936 2.3974 2.3974 3.3812 3.3812 3.3823 3.3823 3.5204 3.5204 3.5214 3.5214 4.1889 4.1889 4.1948 4.1948 4.4660 4.4660 4.4702 4.4702 4.8714 4.8714 4.8793 4.8793 4.9934 4.9934 4.9935 4.9935 5.5996 5.5996 5.6025 5.6025 10.5472 10.5472 10.5548 10.5548 11.7989 11.7989 11.8326 11.8326 12.1594 12.1594 12.2029 12.2029 k = 0.2130 0.3338 0.5931 ( 5274 PWs) bands (ev): -12.3098 -12.3098 -12.3016 -12.3016 -11.4578 -11.4578 -11.4460 -11.4460 -10.8375 -10.8375 -10.8360 -10.8360 -10.7779 -10.7779 -10.7747 -10.7747 0.1082 0.1082 0.1460 0.1460 1.1252 1.1252 1.1629 1.1629 1.7594 1.7594 1.7621 1.7621 1.9481 1.9481 1.9497 1.9497 2.3587 2.3587 2.3625 2.3625 3.3829 3.3829 3.3836 3.3836 3.5206 3.5206 3.5213 3.5213 4.1913 4.1913 4.1973 4.1973 4.4605 4.4605 4.4644 4.4644 4.8703 4.8703 4.8790 4.8790 4.9801 4.9801 4.9804 4.9804 5.5997 5.5997 5.6026 5.6026 10.5474 10.5474 10.5552 10.5552 11.8044 11.8044 11.8391 11.8391 12.1754 12.1754 12.2209 12.2209 k = 0.2222 0.3483 0.5931 ( 5268 PWs) bands (ev): -12.3047 -12.3047 -12.2963 -12.2963 -11.4654 -11.4654 -11.4534 -11.4534 -10.8375 -10.8375 -10.8359 -10.8359 -10.7764 -10.7764 -10.7732 -10.7732 0.1089 0.1089 0.1473 0.1473 1.1171 1.1171 1.1558 1.1558 1.7981 1.7981 1.8009 1.8009 1.9517 1.9517 1.9529 1.9529 2.3287 2.3287 2.3325 2.3325 3.3835 3.3835 3.3837 3.3837 3.5212 3.5212 3.5217 3.5217 4.1932 4.1932 4.1993 4.1993 4.4563 4.4563 4.4599 4.4599 4.8706 4.8706 4.8802 4.8802 4.9682 4.9682 4.9689 4.9689 5.5996 5.5996 5.6026 5.6026 10.5476 10.5476 10.5555 10.5555 11.8087 11.8087 11.8442 11.8442 12.1881 12.1881 12.2352 12.2352 k = 0.2315 0.3628 0.5931 ( 5272 PWs) bands (ev): -12.3009 -12.3009 -12.2924 -12.2924 -11.4711 -11.4711 -11.4589 -11.4589 -10.8375 -10.8375 -10.8359 -10.8359 -10.7754 -10.7754 -10.7721 -10.7721 0.1093 0.1093 0.1482 0.1482 1.1113 1.1113 1.1507 1.1507 1.8342 1.8342 1.8372 1.8372 1.9479 1.9479 1.9485 1.9485 2.3055 2.3055 2.3094 2.3094 3.3832 3.3832 3.3834 3.3834 3.5219 3.5219 3.5222 3.5222 4.1945 4.1945 4.2007 4.2007 4.4533 4.4533 4.4567 4.4567 4.8719 4.8719 4.8823 4.8823 4.9584 4.9584 4.9598 4.9598 5.5996 5.5996 5.6025 5.6025 10.5477 10.5477 10.5558 10.5558 11.8118 11.8118 11.8479 11.8479 12.1974 12.1974 12.2457 12.2457 k = 0.2407 0.3773 0.5931 ( 5272 PWs) bands (ev): -12.2987 -12.2987 -12.2900 -12.2900 -11.4745 -11.4745 -11.4622 -11.4622 -10.8375 -10.8375 -10.8359 -10.8359 -10.7747 -10.7747 -10.7715 -10.7715 0.1096 0.1096 0.1488 0.1488 1.1077 1.1077 1.1475 1.1475 1.8642 1.8642 1.8681 1.8681 1.9376 1.9376 1.9381 1.9381 2.2909 2.2909 2.2948 2.2948 3.3827 3.3827 3.3831 3.3831 3.5224 3.5224 3.5227 3.5227 4.1954 4.1954 4.2016 4.2016 4.4515 4.4515 4.4548 4.4548 4.8732 4.8732 4.8844 4.8844 4.9517 4.9517 4.9537 4.9537 5.5995 5.5995 5.6025 5.6025 10.5478 10.5478 10.5560 10.5560 11.8137 11.8137 11.8501 11.8501 12.2030 12.2030 12.2520 12.2520 k = 0.2500 0.3918 0.5931 ( 5276 PWs) bands (ev): -12.2979 -12.2979 -12.2892 -12.2892 -11.4756 -11.4756 -11.4633 -11.4633 -10.8375 -10.8375 -10.8359 -10.8359 -10.7745 -10.7745 -10.7712 -10.7712 0.1097 0.1097 0.1490 0.1490 1.1065 1.1065 1.1465 1.1465 1.8784 1.8784 1.8834 1.8834 1.9291 1.9291 1.9307 1.9307 2.2859 2.2859 2.2898 2.2898 3.3825 3.3825 3.3829 3.3829 3.5226 3.5226 3.5228 3.5228 4.1957 4.1957 4.2019 4.2019 4.4509 4.4509 4.4542 4.4542 4.8737 4.8737 4.8853 4.8853 4.9493 4.9493 4.9516 4.9516 5.5995 5.5995 5.6024 5.6024 10.5479 10.5479 10.5560 10.5560 11.8143 11.8143 11.8509 11.8509 12.2049 12.2049 12.2541 12.2541 Writing output data file ZrSiO4.save init_run : 0.24s CPU 0.37s WALL ( 1 calls) electrons : 362.07s CPU 366.49s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 362.06s CPU 366.48s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.10s WALL ( 301 calls) cegterg : 336.71s CPU 340.33s WALL ( 644 calls) Called by sum_band: Called by *egterg: h_psi : 193.32s CPU 196.15s WALL ( 9420 calls) s_psi : 11.56s CPU 11.77s WALL ( 9420 calls) g_psi : 0.57s CPU 0.52s WALL ( 8475 calls) cdiaghg : 109.34s CPU 110.33s WALL ( 8776 calls) cegterg:over : 16.60s CPU 16.69s WALL ( 8475 calls) cegterg:upda : 13.08s CPU 13.36s WALL ( 8475 calls) cegterg:last : 7.68s CPU 7.54s WALL ( 1547 calls) cdiaghg:chol : 6.54s CPU 6.43s WALL ( 8776 calls) cdiaghg:inve : 4.59s CPU 4.63s WALL ( 8776 calls) cdiaghg:para : 7.73s CPU 7.90s WALL ( 17552 calls) Called by h_psi: h_psi:vloc : 162.14s CPU 164.76s WALL ( 9420 calls) h_psi:vnl : 30.50s CPU 30.71s WALL ( 9420 calls) add_vuspsi : 14.86s CPU 14.91s WALL ( 9420 calls) General routines calbec : 15.61s CPU 15.78s WALL ( 9420 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 150.76s CPU 153.27s WALL ( 1447032 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.26s CPU 0.35s WALL ( 602 calls) Parallel routines fft_scatter : 51.60s CPU 53.05s WALL ( 1447055 calls) PWSCF : 6m25.04s CPU 6m46.99s WALL This run was terminated on: 21: 8:11 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=