Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:52:18 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Zr3xSiCux4.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 91 77 22 1901 1462 226 Max 92 78 23 1903 1483 228 Sum 3303 2789 805 68467 52965 8159 bravais-lattice index = 14 lattice parameter (alat) = 14.2576 a.u. unit-cell volume = 1110.8239 (a.u.)^3 number of atoms/cell = 11 number of atomic types = 3 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 237.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.257569 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.864061 celldm(5)= -0.641007 celldm(6)= 0.505067 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.505067 0.863080 0.000000 ) a(3) = ( -0.641007 -0.626024 0.444076 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.585192 0.618503 ) b(2) = ( 0.000000 1.158641 1.633362 ) b(3) = ( 0.000000 0.000000 2.251864 ) 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 Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients 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) Cu 11.00 63.54600 Cu( 1.00) Si 4.00 28.08550 Si( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 335 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 2) = ( -0.0061950 0.0108031 0.0202374), wk = 0.0029851 k( 3) = ( -0.0123900 0.0216061 0.0404747), wk = 0.0029851 k( 4) = ( -0.0185850 0.0324092 0.0607121), wk = 0.0029851 k( 5) = ( -0.0247800 0.0432122 0.0809495), wk = 0.0029851 k( 6) = ( -0.0309750 0.0540153 0.1011869), wk = 0.0029851 k( 7) = ( -0.0371700 0.0648184 0.1214242), wk = 0.0029851 k( 8) = ( -0.0433651 0.0756214 0.1416616), wk = 0.0029851 k( 9) = ( -0.0495601 0.0864245 0.1618990), wk = 0.0029851 k( 10) = ( -0.0557551 0.0972275 0.1821364), wk = 0.0029851 k( 11) = ( -0.0619501 0.1080306 0.2023737), wk = 0.0029851 k( 12) = ( -0.0681451 0.1188337 0.2226111), wk = 0.0029851 k( 13) = ( -0.0743401 0.1296367 0.2428485), wk = 0.0029851 k( 14) = ( -0.0805351 0.1404398 0.2630858), wk = 0.0029851 k( 15) = ( -0.0867301 0.1512428 0.2833232), wk = 0.0029851 k( 16) = ( -0.0929251 0.1620459 0.3035606), wk = 0.0029851 k( 17) = ( -0.0991201 0.1728489 0.3237979), wk = 0.0029851 k( 18) = ( -0.1053151 0.1836520 0.3440353), wk = 0.0029851 k( 19) = ( -0.1115101 0.1944551 0.3642727), wk = 0.0029851 k( 20) = ( -0.1177051 0.2052581 0.3845101), wk = 0.0029851 k( 21) = ( -0.1239001 0.2160612 0.4047474), wk = 0.0029851 k( 22) = ( -0.1300951 0.2268643 0.4249848), wk = 0.0029851 k( 23) = ( -0.1362901 0.2376673 0.4452222), wk = 0.0029851 k( 24) = ( -0.1424852 0.2484704 0.4654596), wk = 0.0029851 k( 25) = ( -0.1486802 0.2592734 0.4856970), wk = 0.0029851 k( 26) = ( -0.1548752 0.2700765 0.5059343), wk = 0.0029851 k( 27) = ( -0.1610702 0.2808795 0.5261717), wk = 0.0029851 k( 28) = ( -0.1672652 0.2916826 0.5464091), wk = 0.0029851 k( 29) = ( -0.1734602 0.3024857 0.5666464), wk = 0.0029851 k( 30) = ( -0.1796552 0.3132887 0.5868838), wk = 0.0029851 k( 31) = ( -0.1858502 0.3240918 0.6071212), wk = 0.0029851 k( 32) = ( -0.1920452 0.3348948 0.6273585), wk = 0.0029851 k( 33) = ( -0.1982402 0.3456979 0.6475959), wk = 0.0029851 k( 34) = ( -0.2044352 0.3565010 0.6678333), wk = 0.0029851 k( 35) = ( -0.2106302 0.3673040 0.6880707), wk = 0.0029851 k( 36) = ( -0.2168252 0.3781071 0.7083080), wk = 0.0029851 k( 37) = ( -0.2230202 0.3889101 0.7285454), wk = 0.0029851 k( 38) = ( -0.2292152 0.3997132 0.7487828), wk = 0.0029851 k( 39) = ( -0.2354102 0.4105163 0.7690202), wk = 0.0029851 k( 40) = ( -0.2416052 0.4213193 0.7892575), wk = 0.0029851 k( 41) = ( -0.2478003 0.4321224 0.8094949), wk = 0.0029851 k( 42) = ( -0.2539953 0.4429254 0.8297323), wk = 0.0029851 k( 43) = ( -0.2601903 0.4537285 0.8499696), wk = 0.0029851 k( 44) = ( -0.2663853 0.4645316 0.8702070), wk = 0.0029851 k( 45) = ( -0.2725803 0.4753346 0.8904444), wk = 0.0029851 k( 46) = ( -0.2725803 0.4753346 0.8904444), wk = 0.0029851 k( 47) = ( -0.2625609 0.4578624 0.9028385), wk = 0.0029851 k( 48) = ( -0.2525414 0.4403902 0.9152326), wk = 0.0029851 k( 49) = ( -0.2425220 0.4229179 0.9276267), wk = 0.0029851 k( 50) = ( -0.2325025 0.4054457 0.9400208), wk = 0.0029851 k( 51) = ( -0.2224831 0.3879735 0.9524149), wk = 0.0029851 k( 52) = ( -0.2124637 0.3705013 0.9648090), wk = 0.0029851 k( 53) = ( -0.2024442 0.3530290 0.9772031), wk = 0.0029851 k( 54) = ( -0.1924248 0.3355568 0.9895972), wk = 0.0029851 k( 55) = ( -0.1824054 0.3180846 1.0019913), wk = 0.0029851 k( 56) = ( -0.1723859 0.3006123 1.0143854), wk = 0.0029851 k( 57) = ( -0.1623665 0.2831401 1.0267795), wk = 0.0029851 k( 58) = ( -0.1523471 0.2656679 1.0391736), wk = 0.0029851 k( 59) = ( -0.1423276 0.2481957 1.0515676), wk = 0.0029851 k( 60) = ( -0.1323082 0.2307234 1.0639617), wk = 0.0029851 k( 61) = ( -0.1222888 0.2132512 1.0763558), wk = 0.0029851 k( 62) = ( -0.1122693 0.1957790 1.0887499), wk = 0.0029851 k( 63) = ( -0.1022499 0.1783068 1.1011441), wk = 0.0029851 k( 64) = ( -0.0922305 0.1608345 1.1135381), wk = 0.0029851 k( 65) = ( -0.0822110 0.1433623 1.1259322), wk = 0.0029851 k( 66) = ( -0.0822110 0.1433623 1.1259322), wk = 0.0029851 k( 67) = ( -0.0704666 0.1228820 1.1259322), wk = 0.0029851 k( 68) = ( -0.0587222 0.1024016 1.1259322), wk = 0.0029851 k( 69) = ( -0.0469777 0.0819213 1.1259322), wk = 0.0029851 k( 70) = ( -0.0352333 0.0614410 1.1259322), wk = 0.0029851 k( 71) = ( -0.0234889 0.0409607 1.1259322), wk = 0.0029851 k( 72) = ( -0.0117444 0.0204803 1.1259322), wk = 0.0029851 k( 73) = ( 0.0000000 0.0000000 1.1259322), wk = 0.0029851 k( 74) = ( 0.0000000 0.0000000 1.1259322), wk = 0.0029851 k( 75) = ( 0.0208333 0.0119469 1.1259322), wk = 0.0029851 k( 76) = ( 0.0416667 0.0238937 1.1259322), wk = 0.0029851 k( 77) = ( 0.0625000 0.0358406 1.1259322), wk = 0.0029851 k( 78) = ( 0.0833333 0.0477874 1.1259322), wk = 0.0029851 k( 79) = ( 0.1041667 0.0597343 1.1259322), wk = 0.0029851 k( 80) = ( 0.1250000 0.0716812 1.1259322), wk = 0.0029851 k( 81) = ( 0.1458333 0.0836280 1.1259322), wk = 0.0029851 k( 82) = ( 0.1666667 0.0955749 1.1259322), wk = 0.0029851 k( 83) = ( 0.1875000 0.1075217 1.1259322), wk = 0.0029851 k( 84) = ( 0.2083333 0.1194686 1.1259322), wk = 0.0029851 k( 85) = ( 0.2291667 0.1314155 1.1259322), wk = 0.0029851 k( 86) = ( 0.2500000 0.1433623 1.1259322), wk = 0.0029851 k( 87) = ( 0.2500000 0.1433623 1.1259322), wk = 0.0029851 k( 88) = ( 0.2400000 0.1608007 1.1135622), wk = 0.0029851 k( 89) = ( 0.2300000 0.1782390 1.1011921), wk = 0.0029851 k( 90) = ( 0.2200000 0.1956773 1.0888221), wk = 0.0029851 k( 91) = ( 0.2100000 0.2131157 1.0764520), wk = 0.0029851 k( 92) = ( 0.2000000 0.2305540 1.0640820), wk = 0.0029851 k( 93) = ( 0.1900000 0.2479923 1.0517119), wk = 0.0029851 k( 94) = ( 0.1800000 0.2654307 1.0393418), wk = 0.0029851 k( 95) = ( 0.1700000 0.2828690 1.0269718), wk = 0.0029851 k( 96) = ( 0.1600000 0.3003073 1.0146017), wk = 0.0029851 k( 97) = ( 0.1500000 0.3177457 1.0022317), wk = 0.0029851 k( 98) = ( 0.1400000 0.3351840 0.9898616), wk = 0.0029851 k( 99) = ( 0.1300000 0.3526223 0.9774916), wk = 0.0029851 k( 100) = ( 0.1200000 0.3700607 0.9651215), wk = 0.0029851 k( 101) = ( 0.1100000 0.3874990 0.9527515), wk = 0.0029851 k( 102) = ( 0.1000000 0.4049373 0.9403814), wk = 0.0029851 k( 103) = ( 0.0900000 0.4223757 0.9280113), wk = 0.0029851 k( 104) = ( 0.0800000 0.4398140 0.9156413), wk = 0.0029851 k( 105) = ( 0.0700000 0.4572523 0.9032712), wk = 0.0029851 k( 106) = ( 0.0600000 0.4746907 0.8909012), wk = 0.0029851 k( 107) = ( 0.0500000 0.4921290 0.8785311), wk = 0.0029851 k( 108) = ( 0.0400000 0.5095673 0.8661611), wk = 0.0029851 k( 109) = ( 0.0300000 0.5270057 0.8537910), wk = 0.0029851 k( 110) = ( 0.0200000 0.5444440 0.8414210), wk = 0.0029851 k( 111) = ( 0.0100000 0.5618823 0.8290509), wk = 0.0029851 k( 112) = ( 0.0000000 0.5793207 0.8166808), wk = 0.0029851 k( 113) = ( 0.0000000 0.5793207 0.8166808), wk = 0.0029851 k( 114) = ( 0.0209677 0.5873196 0.8110067), wk = 0.0029851 k( 115) = ( 0.0419354 0.5953185 0.8053326), wk = 0.0029851 k( 116) = ( 0.0629031 0.6033175 0.7996585), wk = 0.0029851 k( 117) = ( 0.0838709 0.6113164 0.7939844), wk = 0.0029851 k( 118) = ( 0.1048386 0.6193153 0.7883102), wk = 0.0029851 k( 119) = ( 0.1258063 0.6273142 0.7826361), wk = 0.0029851 k( 120) = ( 0.1467740 0.6353132 0.7769620), wk = 0.0029851 k( 121) = ( 0.1677417 0.6433121 0.7712879), wk = 0.0029851 k( 122) = ( 0.1887094 0.6513110 0.7656138), wk = 0.0029851 k( 123) = ( 0.2096771 0.6593099 0.7599397), wk = 0.0029851 k( 124) = ( 0.2306449 0.6673089 0.7542655), wk = 0.0029851 k( 125) = ( 0.2516126 0.6753078 0.7485914), wk = 0.0029851 k( 126) = ( 0.2725803 0.6833067 0.7429173), wk = 0.0029851 k( 127) = ( 0.2725803 0.6833067 0.7429173), wk = 0.0029851 k( 128) = ( 0.2787268 0.6725883 0.7228385), wk = 0.0029851 k( 129) = ( 0.2848732 0.6618699 0.7027596), wk = 0.0029851 k( 130) = ( 0.2910197 0.6511514 0.6826808), wk = 0.0029851 k( 131) = ( 0.2971662 0.6404330 0.6626019), wk = 0.0029851 k( 132) = ( 0.3033127 0.6297146 0.6425231), wk = 0.0029851 k( 133) = ( 0.3094592 0.6189961 0.6224442), wk = 0.0029851 k( 134) = ( 0.3156056 0.6082777 0.6023654), wk = 0.0029851 k( 135) = ( 0.3217521 0.5975592 0.5822865), wk = 0.0029851 k( 136) = ( 0.3278986 0.5868408 0.5622077), wk = 0.0029851 k( 137) = ( 0.3340451 0.5761224 0.5421288), wk = 0.0029851 k( 138) = ( 0.3401916 0.5654040 0.5220500), wk = 0.0029851 k( 139) = ( 0.3463380 0.5546855 0.5019711), wk = 0.0029851 k( 140) = ( 0.3524845 0.5439671 0.4818923), wk = 0.0029851 k( 141) = ( 0.3586310 0.5332486 0.4618134), wk = 0.0029851 k( 142) = ( 0.3647775 0.5225302 0.4417346), wk = 0.0029851 k( 143) = ( 0.3709240 0.5118118 0.4216557), wk = 0.0029851 k( 144) = ( 0.3770704 0.5010933 0.4015769), wk = 0.0029851 k( 145) = ( 0.3832169 0.4903749 0.3814981), wk = 0.0029851 k( 146) = ( 0.3893634 0.4796565 0.3614192), wk = 0.0029851 k( 147) = ( 0.3955099 0.4689380 0.3413404), wk = 0.0029851 k( 148) = ( 0.4016563 0.4582196 0.3212615), wk = 0.0029851 k( 149) = ( 0.4078028 0.4475012 0.3011827), wk = 0.0029851 k( 150) = ( 0.4139493 0.4367827 0.2811038), wk = 0.0029851 k( 151) = ( 0.4200958 0.4260643 0.2610250), wk = 0.0029851 k( 152) = ( 0.4262422 0.4153459 0.2409462), wk = 0.0029851 k( 153) = ( 0.4323887 0.4046274 0.2208673), wk = 0.0029851 k( 154) = ( 0.4385352 0.3939090 0.2007885), wk = 0.0029851 k( 155) = ( 0.4446817 0.3831906 0.1807096), wk = 0.0029851 k( 156) = ( 0.4508282 0.3724721 0.1606308), wk = 0.0029851 k( 157) = ( 0.4569746 0.3617537 0.1405519), wk = 0.0029851 k( 158) = ( 0.4631211 0.3510352 0.1204731), wk = 0.0029851 k( 159) = ( 0.4692676 0.3403168 0.1003942), wk = 0.0029851 k( 160) = ( 0.4754141 0.3295984 0.0803154), wk = 0.0029851 k( 161) = ( 0.4815606 0.3188799 0.0602365), wk = 0.0029851 k( 162) = ( 0.4877070 0.3081615 0.0401577), wk = 0.0029851 k( 163) = ( 0.4938535 0.2974431 0.0200788), wk = 0.0029851 k( 164) = ( 0.5000000 0.2867246 0.0000000), wk = 0.0029851 k( 165) = ( 0.5000000 0.2867246 0.0000000), wk = 0.0029851 k( 166) = ( 0.4791667 0.2747778 0.0000000), wk = 0.0029851 k( 167) = ( 0.4583333 0.2628309 0.0000000), wk = 0.0029851 k( 168) = ( 0.4375000 0.2508841 0.0000000), wk = 0.0029851 k( 169) = ( 0.4166667 0.2389372 0.0000000), wk = 0.0029851 k( 170) = ( 0.3958333 0.2269903 0.0000000), wk = 0.0029851 k( 171) = ( 0.3750000 0.2150435 0.0000000), wk = 0.0029851 k( 172) = ( 0.3541667 0.2030966 0.0000000), wk = 0.0029851 k( 173) = ( 0.3333333 0.1911498 0.0000000), wk = 0.0029851 k( 174) = ( 0.3125000 0.1792029 0.0000000), wk = 0.0029851 k( 175) = ( 0.2916667 0.1672560 0.0000000), wk = 0.0029851 k( 176) = ( 0.2708333 0.1553092 0.0000000), wk = 0.0029851 k( 177) = ( 0.2500000 0.1433623 0.0000000), wk = 0.0029851 k( 178) = ( 0.2291667 0.1314155 0.0000000), wk = 0.0029851 k( 179) = ( 0.2083333 0.1194686 0.0000000), wk = 0.0029851 k( 180) = ( 0.1875000 0.1075217 0.0000000), wk = 0.0029851 k( 181) = ( 0.1666667 0.0955749 0.0000000), wk = 0.0029851 k( 182) = ( 0.1458333 0.0836280 0.0000000), wk = 0.0029851 k( 183) = ( 0.1250000 0.0716812 0.0000000), wk = 0.0029851 k( 184) = ( 0.1041667 0.0597343 -0.0000000), wk = 0.0029851 k( 185) = ( 0.0833333 0.0477874 0.0000000), wk = 0.0029851 k( 186) = ( 0.0625000 0.0358406 0.0000000), wk = 0.0029851 k( 187) = ( 0.0416667 0.0238937 0.0000000), wk = 0.0029851 k( 188) = ( 0.0208333 0.0119469 0.0000000), wk = 0.0029851 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 190) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 191) = ( 0.0099881 -0.0174176 0.0123553), wk = 0.0029851 k( 192) = ( 0.0199762 -0.0348351 0.0247106), wk = 0.0029851 k( 193) = ( 0.0299643 -0.0522527 0.0370660), wk = 0.0029851 k( 194) = ( 0.0399523 -0.0696702 0.0494213), wk = 0.0029851 k( 195) = ( 0.0499404 -0.0870878 0.0617766), wk = 0.0029851 k( 196) = ( 0.0599285 -0.1045054 0.0741319), wk = 0.0029851 k( 197) = ( 0.0699166 -0.1219229 0.0864872), wk = 0.0029851 k( 198) = ( 0.0799047 -0.1393405 0.0988426), wk = 0.0029851 k( 199) = ( 0.0898928 -0.1567581 0.1111979), wk = 0.0029851 k( 200) = ( 0.0998809 -0.1741756 0.1235532), wk = 0.0029851 k( 201) = ( 0.1098690 -0.1915932 0.1359085), wk = 0.0029851 k( 202) = ( 0.1198571 -0.2090107 0.1482639), wk = 0.0029851 k( 203) = ( 0.1298451 -0.2264283 0.1606192), wk = 0.0029851 k( 204) = ( 0.1398332 -0.2438459 0.1729745), wk = 0.0029851 k( 205) = ( 0.1498213 -0.2612634 0.1853298), wk = 0.0029851 k( 206) = ( 0.1598094 -0.2786810 0.1976851), wk = 0.0029851 k( 207) = ( 0.1697975 -0.2960986 0.2100405), wk = 0.0029851 k( 208) = ( 0.1797856 -0.3135161 0.2223958), wk = 0.0029851 k( 209) = ( 0.1897737 -0.3309337 0.2347511), wk = 0.0029851 k( 210) = ( 0.1997618 -0.3483512 0.2471064), wk = 0.0029851 k( 211) = ( 0.2097498 -0.3657688 0.2594617), wk = 0.0029851 k( 212) = ( 0.2197379 -0.3831864 0.2718171), wk = 0.0029851 k( 213) = ( 0.2297260 -0.4006039 0.2841724), wk = 0.0029851 k( 214) = ( 0.2397141 -0.4180215 0.2965277), wk = 0.0029851 k( 215) = ( 0.2497022 -0.4354390 0.3088830), wk = 0.0029851 k( 216) = ( 0.2596903 -0.4528566 0.3212383), wk = 0.0029851 k( 217) = ( 0.2696784 -0.4702742 0.3335937), wk = 0.0029851 k( 218) = ( 0.2796665 -0.4876917 0.3459490), wk = 0.0029851 k( 219) = ( 0.2896546 -0.5051093 0.3583043), wk = 0.0029851 k( 220) = ( 0.2996426 -0.5225269 0.3706596), wk = 0.0029851 k( 221) = ( 0.3096307 -0.5399444 0.3830149), wk = 0.0029851 k( 222) = ( 0.3096307 -0.5399444 0.3830149), wk = 0.0029851 k( 223) = ( 0.3232285 -0.5222767 0.3777461), wk = 0.0029851 k( 224) = ( 0.3368263 -0.5046089 0.3724773), wk = 0.0029851 k( 225) = ( 0.3504241 -0.4869412 0.3672085), wk = 0.0029851 k( 226) = ( 0.3640219 -0.4692735 0.3619396), wk = 0.0029851 k( 227) = ( 0.3776197 -0.4516057 0.3566708), wk = 0.0029851 k( 228) = ( 0.3912176 -0.4339380 0.3514020), wk = 0.0029851 k( 229) = ( 0.4048154 -0.4162702 0.3461332), wk = 0.0029851 k( 230) = ( 0.4184132 -0.3986025 0.3408643), wk = 0.0029851 k( 231) = ( 0.4320110 -0.3809347 0.3355955), wk = 0.0029851 k( 232) = ( 0.4456088 -0.3632670 0.3303267), wk = 0.0029851 k( 233) = ( 0.4592066 -0.3455993 0.3250579), wk = 0.0029851 k( 234) = ( 0.4728044 -0.3279315 0.3197890), wk = 0.0029851 k( 235) = ( 0.4864022 -0.3102638 0.3145202), wk = 0.0029851 k( 236) = ( 0.5000000 -0.2925960 0.3092514), wk = 0.0029851 k( 237) = ( 0.5000000 -0.2925960 0.3092514), wk = 0.0029851 k( 238) = ( 0.4937500 -0.2816971 0.3296684), wk = 0.0029851 k( 239) = ( 0.4875000 -0.2707981 0.3500854), wk = 0.0029851 k( 240) = ( 0.4812500 -0.2598992 0.3705025), wk = 0.0029851 k( 241) = ( 0.4750000 -0.2490002 0.3909195), wk = 0.0029851 k( 242) = ( 0.4687500 -0.2381012 0.4113365), wk = 0.0029851 k( 243) = ( 0.4625000 -0.2272023 0.4317535), wk = 0.0029851 k( 244) = ( 0.4562500 -0.2163033 0.4521705), wk = 0.0029851 k( 245) = ( 0.4500000 -0.2054044 0.4725876), wk = 0.0029851 k( 246) = ( 0.4437500 -0.1945054 0.4930046), wk = 0.0029851 k( 247) = ( 0.4375000 -0.1836065 0.5134216), wk = 0.0029851 k( 248) = ( 0.4312500 -0.1727075 0.5338386), wk = 0.0029851 k( 249) = ( 0.4250000 -0.1618085 0.5542556), wk = 0.0029851 k( 250) = ( 0.4187500 -0.1509096 0.5746727), wk = 0.0029851 k( 251) = ( 0.4125000 -0.1400106 0.5950897), wk = 0.0029851 k( 252) = ( 0.4062500 -0.1291117 0.6155067), wk = 0.0029851 k( 253) = ( 0.4000000 -0.1182127 0.6359237), wk = 0.0029851 k( 254) = ( 0.3937500 -0.1073137 0.6563408), wk = 0.0029851 k( 255) = ( 0.3875000 -0.0964148 0.6767578), wk = 0.0029851 k( 256) = ( 0.3812500 -0.0855158 0.6971748), wk = 0.0029851 k( 257) = ( 0.3750000 -0.0746169 0.7175918), wk = 0.0029851 k( 258) = ( 0.3687500 -0.0637179 0.7380088), wk = 0.0029851 k( 259) = ( 0.3625000 -0.0528189 0.7584259), wk = 0.0029851 k( 260) = ( 0.3562500 -0.0419200 0.7788429), wk = 0.0029851 k( 261) = ( 0.3500000 -0.0310210 0.7992599), wk = 0.0029851 k( 262) = ( 0.3437500 -0.0201221 0.8196769), wk = 0.0029851 k( 263) = ( 0.3375000 -0.0092231 0.8400939), wk = 0.0029851 k( 264) = ( 0.3312500 0.0016759 0.8605110), wk = 0.0029851 k( 265) = ( 0.3250000 0.0125748 0.8809280), wk = 0.0029851 k( 266) = ( 0.3187500 0.0234738 0.9013450), wk = 0.0029851 k( 267) = ( 0.3125000 0.0343727 0.9217620), wk = 0.0029851 k( 268) = ( 0.3062500 0.0452717 0.9421790), wk = 0.0029851 k( 269) = ( 0.3000000 0.0561706 0.9625961), wk = 0.0029851 k( 270) = ( 0.2937500 0.0670696 0.9830131), wk = 0.0029851 k( 271) = ( 0.2875000 0.0779686 1.0034301), wk = 0.0029851 k( 272) = ( 0.2812500 0.0888675 1.0238471), wk = 0.0029851 k( 273) = ( 0.2750000 0.0997665 1.0442642), wk = 0.0029851 k( 274) = ( 0.2687500 0.1106654 1.0646812), wk = 0.0029851 k( 275) = ( 0.2625000 0.1215644 1.0850982), wk = 0.0029851 k( 276) = ( 0.2562500 0.1324634 1.1055152), wk = 0.0029851 k( 277) = ( 0.2500000 0.1433623 1.1259322), wk = 0.0029851 k( 278) = ( 0.0822110 -0.1433623 1.1259322), wk = 0.0029851 k( 279) = ( 0.0883575 -0.1540807 1.1058534), wk = 0.0029851 k( 280) = ( 0.0945040 -0.1647992 1.0857746), wk = 0.0029851 k( 281) = ( 0.1006505 -0.1755176 1.0656957), wk = 0.0029851 k( 282) = ( 0.1067969 -0.1862361 1.0456169), wk = 0.0029851 k( 283) = ( 0.1129434 -0.1969545 1.0255380), wk = 0.0029851 k( 284) = ( 0.1190899 -0.2076729 1.0054592), wk = 0.0029851 k( 285) = ( 0.1252364 -0.2183914 0.9853803), wk = 0.0029851 k( 286) = ( 0.1313828 -0.2291098 0.9653015), wk = 0.0029851 k( 287) = ( 0.1375293 -0.2398282 0.9452226), wk = 0.0029851 k( 288) = ( 0.1436758 -0.2505467 0.9251438), wk = 0.0029851 k( 289) = ( 0.1498223 -0.2612651 0.9050649), wk = 0.0029851 k( 290) = ( 0.1559688 -0.2719835 0.8849861), wk = 0.0029851 k( 291) = ( 0.1621152 -0.2827020 0.8649072), wk = 0.0029851 k( 292) = ( 0.1682617 -0.2934204 0.8448284), wk = 0.0029851 k( 293) = ( 0.1744082 -0.3041388 0.8247495), wk = 0.0029851 k( 294) = ( 0.1805547 -0.3148573 0.8046707), wk = 0.0029851 k( 295) = ( 0.1867012 -0.3255757 0.7845919), wk = 0.0029851 k( 296) = ( 0.1928476 -0.3362941 0.7645130), wk = 0.0029851 k( 297) = ( 0.1989941 -0.3470126 0.7444342), wk = 0.0029851 k( 298) = ( 0.2051406 -0.3577310 0.7243553), wk = 0.0029851 k( 299) = ( 0.2112871 -0.3684495 0.7042765), wk = 0.0029851 k( 300) = ( 0.2174336 -0.3791679 0.6841976), wk = 0.0029851 k( 301) = ( 0.2235800 -0.3898863 0.6641188), wk = 0.0029851 k( 302) = ( 0.2297265 -0.4006048 0.6440399), wk = 0.0029851 k( 303) = ( 0.2358730 -0.4113232 0.6239611), wk = 0.0029851 k( 304) = ( 0.2420195 -0.4220416 0.6038823), wk = 0.0029851 k( 305) = ( 0.2481659 -0.4327601 0.5838034), wk = 0.0029851 k( 306) = ( 0.2543124 -0.4434785 0.5637246), wk = 0.0029851 k( 307) = ( 0.2604589 -0.4541969 0.5436457), wk = 0.0029851 k( 308) = ( 0.2666054 -0.4649154 0.5235669), wk = 0.0029851 k( 309) = ( 0.2727519 -0.4756338 0.5034880), wk = 0.0029851 k( 310) = ( 0.2788983 -0.4863522 0.4834092), wk = 0.0029851 k( 311) = ( 0.2850448 -0.4970707 0.4633303), wk = 0.0029851 k( 312) = ( 0.2911913 -0.5077891 0.4432515), wk = 0.0029851 k( 313) = ( 0.2973378 -0.5185075 0.4231726), wk = 0.0029851 k( 314) = ( 0.3034843 -0.5292260 0.4030938), wk = 0.0029851 k( 315) = ( 0.3096307 -0.5399444 0.3830149), wk = 0.0029851 k( 316) = ( 0.6903693 -0.0452477 0.2354878), wk = 0.0029851 k( 317) = ( 0.6803498 -0.0277754 0.2230937), wk = 0.0029851 k( 318) = ( 0.6703304 -0.0103032 0.2106997), wk = 0.0029851 k( 319) = ( 0.6603110 0.0071690 0.1983056), wk = 0.0029851 k( 320) = ( 0.6502915 0.0246412 0.1859115), wk = 0.0029851 k( 321) = ( 0.6402721 0.0421135 0.1735174), wk = 0.0029851 k( 322) = ( 0.6302527 0.0595857 0.1611233), wk = 0.0029851 k( 323) = ( 0.6202332 0.0770579 0.1487292), wk = 0.0029851 k( 324) = ( 0.6102138 0.0945301 0.1363351), wk = 0.0029851 k( 325) = ( 0.6001943 0.1120024 0.1239410), wk = 0.0029851 k( 326) = ( 0.5901749 0.1294746 0.1115469), wk = 0.0029851 k( 327) = ( 0.5801555 0.1469468 0.0991528), wk = 0.0029851 k( 328) = ( 0.5701361 0.1644190 0.0867587), wk = 0.0029851 k( 329) = ( 0.5601166 0.1818913 0.0743646), wk = 0.0029851 k( 330) = ( 0.5500972 0.1993635 0.0619705), wk = 0.0029851 k( 331) = ( 0.5400777 0.2168357 0.0495764), wk = 0.0029851 k( 332) = ( 0.5300583 0.2343079 0.0371823), wk = 0.0029851 k( 333) = ( 0.5200389 0.2517802 0.0247882), wk = 0.0029851 k( 334) = ( 0.5100194 0.2692524 0.0123941), wk = 0.0029851 k( 335) = ( 0.5000000 0.2867246 0.0000000), wk = 0.0029851 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 2) = ( -0.0061950 0.0061950 0.0061950), wk = 0.0029851 k( 3) = ( -0.0123900 0.0123900 0.0123900), wk = 0.0029851 k( 4) = ( -0.0185850 0.0185850 0.0185850), wk = 0.0029851 k( 5) = ( -0.0247800 0.0247800 0.0247800), wk = 0.0029851 k( 6) = ( -0.0309750 0.0309750 0.0309750), wk = 0.0029851 k( 7) = ( -0.0371700 0.0371700 0.0371700), wk = 0.0029851 k( 8) = ( -0.0433651 0.0433650 0.0433651), wk = 0.0029851 k( 9) = ( -0.0495601 0.0495600 0.0495601), wk = 0.0029851 k( 10) = ( -0.0557551 0.0557551 0.0557551), wk = 0.0029851 k( 11) = ( -0.0619501 0.0619501 0.0619501), wk = 0.0029851 k( 12) = ( -0.0681451 0.0681451 0.0681451), wk = 0.0029851 k( 13) = ( -0.0743401 0.0743401 0.0743401), wk = 0.0029851 k( 14) = ( -0.0805351 0.0805351 0.0805351), wk = 0.0029851 k( 15) = ( -0.0867301 0.0867301 0.0867301), wk = 0.0029851 k( 16) = ( -0.0929251 0.0929251 0.0929251), wk = 0.0029851 k( 17) = ( -0.0991201 0.0991201 0.0991201), wk = 0.0029851 k( 18) = ( -0.1053151 0.1053151 0.1053151), wk = 0.0029851 k( 19) = ( -0.1115101 0.1115101 0.1115101), wk = 0.0029851 k( 20) = ( -0.1177051 0.1177051 0.1177051), wk = 0.0029851 k( 21) = ( -0.1239001 0.1239001 0.1239001), wk = 0.0029851 k( 22) = ( -0.1300951 0.1300951 0.1300951), wk = 0.0029851 k( 23) = ( -0.1362901 0.1362901 0.1362901), wk = 0.0029851 k( 24) = ( -0.1424852 0.1424852 0.1424851), wk = 0.0029851 k( 25) = ( -0.1486802 0.1486802 0.1486802), wk = 0.0029851 k( 26) = ( -0.1548752 0.1548752 0.1548752), wk = 0.0029851 k( 27) = ( -0.1610702 0.1610702 0.1610702), wk = 0.0029851 k( 28) = ( -0.1672652 0.1672652 0.1672652), wk = 0.0029851 k( 29) = ( -0.1734602 0.1734602 0.1734602), wk = 0.0029851 k( 30) = ( -0.1796552 0.1796552 0.1796552), wk = 0.0029851 k( 31) = ( -0.1858502 0.1858502 0.1858502), wk = 0.0029851 k( 32) = ( -0.1920452 0.1920452 0.1920452), wk = 0.0029851 k( 33) = ( -0.1982402 0.1982402 0.1982402), wk = 0.0029851 k( 34) = ( -0.2044352 0.2044352 0.2044352), wk = 0.0029851 k( 35) = ( -0.2106302 0.2106302 0.2106302), wk = 0.0029851 k( 36) = ( -0.2168252 0.2168252 0.2168252), wk = 0.0029851 k( 37) = ( -0.2230202 0.2230202 0.2230202), wk = 0.0029851 k( 38) = ( -0.2292152 0.2292152 0.2292152), wk = 0.0029851 k( 39) = ( -0.2354102 0.2354102 0.2354102), wk = 0.0029851 k( 40) = ( -0.2416052 0.2416052 0.2416052), wk = 0.0029851 k( 41) = ( -0.2478003 0.2478003 0.2478003), wk = 0.0029851 k( 42) = ( -0.2539953 0.2539953 0.2539953), wk = 0.0029851 k( 43) = ( -0.2601903 0.2601903 0.2601903), wk = 0.0029851 k( 44) = ( -0.2663853 0.2663853 0.2663853), wk = 0.0029851 k( 45) = ( -0.2725803 0.2725803 0.2725803), wk = 0.0029851 k( 46) = ( -0.2725803 0.2725803 0.2725803), wk = 0.0029851 k( 47) = ( -0.2625609 0.2625609 0.2825997), wk = 0.0029851 k( 48) = ( -0.2525414 0.2525414 0.2926192), wk = 0.0029851 k( 49) = ( -0.2425220 0.2425220 0.3026386), wk = 0.0029851 k( 50) = ( -0.2325025 0.2325025 0.3126580), wk = 0.0029851 k( 51) = ( -0.2224831 0.2224831 0.3226775), wk = 0.0029851 k( 52) = ( -0.2124637 0.2124637 0.3326969), wk = 0.0029851 k( 53) = ( -0.2024442 0.2024442 0.3427163), wk = 0.0029851 k( 54) = ( -0.1924248 0.1924248 0.3527358), wk = 0.0029851 k( 55) = ( -0.1824054 0.1824054 0.3627552), wk = 0.0029851 k( 56) = ( -0.1723859 0.1723859 0.3727746), wk = 0.0029851 k( 57) = ( -0.1623665 0.1623665 0.3827941), wk = 0.0029851 k( 58) = ( -0.1523471 0.1523471 0.3928135), wk = 0.0029851 k( 59) = ( -0.1423276 0.1423276 0.4028329), wk = 0.0029851 k( 60) = ( -0.1323082 0.1323082 0.4128524), wk = 0.0029851 k( 61) = ( -0.1222888 0.1222888 0.4228718), wk = 0.0029851 k( 62) = ( -0.1122693 0.1122693 0.4328912), wk = 0.0029851 k( 63) = ( -0.1022499 0.1022499 0.4429107), wk = 0.0029851 k( 64) = ( -0.0922305 0.0922305 0.4529301), wk = 0.0029851 k( 65) = ( -0.0822110 0.0822110 0.4629496), wk = 0.0029851 k( 66) = ( -0.0822110 0.0822110 0.4629496), wk = 0.0029851 k( 67) = ( -0.0704666 0.0704666 0.4682425), wk = 0.0029851 k( 68) = ( -0.0587222 0.0587221 0.4735354), wk = 0.0029851 k( 69) = ( -0.0469777 0.0469777 0.4788283), wk = 0.0029851 k( 70) = ( -0.0352333 0.0352333 0.4841212), wk = 0.0029851 k( 71) = ( -0.0234889 0.0234889 0.4894142), wk = 0.0029851 k( 72) = ( -0.0117444 0.0117444 0.4947071), wk = 0.0029851 k( 73) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029851 k( 74) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029851 k( 75) = ( 0.0208333 0.0208333 0.4791667), wk = 0.0029851 k( 76) = ( 0.0416667 0.0416667 0.4583333), wk = 0.0029851 k( 77) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0029851 k( 78) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0029851 k( 79) = ( 0.1041667 0.1041667 0.3958333), wk = 0.0029851 k( 80) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0029851 k( 81) = ( 0.1458333 0.1458333 0.3541667), wk = 0.0029851 k( 82) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0029851 k( 83) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0029851 k( 84) = ( 0.2083333 0.2083333 0.2916667), wk = 0.0029851 k( 85) = ( 0.2291667 0.2291667 0.2708333), wk = 0.0029851 k( 86) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029851 k( 87) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029851 k( 88) = ( 0.2400000 0.2600000 0.2400000), wk = 0.0029851 k( 89) = ( 0.2300000 0.2700000 0.2300000), wk = 0.0029851 k( 90) = ( 0.2200000 0.2800000 0.2200000), wk = 0.0029851 k( 91) = ( 0.2100000 0.2900000 0.2100000), wk = 0.0029851 k( 92) = ( 0.2000000 0.3000000 0.2000000), wk = 0.0029851 k( 93) = ( 0.1900000 0.3100000 0.1900000), wk = 0.0029851 k( 94) = ( 0.1800000 0.3200000 0.1800000), wk = 0.0029851 k( 95) = ( 0.1700000 0.3300000 0.1700000), wk = 0.0029851 k( 96) = ( 0.1600000 0.3400000 0.1600000), wk = 0.0029851 k( 97) = ( 0.1500000 0.3500000 0.1500000), wk = 0.0029851 k( 98) = ( 0.1400000 0.3600000 0.1400000), wk = 0.0029851 k( 99) = ( 0.1300000 0.3700000 0.1300000), wk = 0.0029851 k( 100) = ( 0.1200000 0.3800000 0.1200000), wk = 0.0029851 k( 101) = ( 0.1100000 0.3900000 0.1100000), wk = 0.0029851 k( 102) = ( 0.1000000 0.4000000 0.1000000), wk = 0.0029851 k( 103) = ( 0.0900000 0.4100000 0.0900000), wk = 0.0029851 k( 104) = ( 0.0800000 0.4200000 0.0800000), wk = 0.0029851 k( 105) = ( 0.0700000 0.4300000 0.0700000), wk = 0.0029851 k( 106) = ( 0.0600000 0.4400000 0.0600000), wk = 0.0029851 k( 107) = ( 0.0500000 0.4500000 0.0500000), wk = 0.0029851 k( 108) = ( 0.0400000 0.4600000 0.0400000), wk = 0.0029851 k( 109) = ( 0.0300000 0.4700000 0.0300000), wk = 0.0029851 k( 110) = ( 0.0200000 0.4800000 0.0200000), wk = 0.0029851 k( 111) = ( 0.0100000 0.4900000 0.0100000), wk = 0.0029851 k( 112) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029851 k( 113) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0029851 k( 114) = ( 0.0209677 0.5174938 -0.0209677), wk = 0.0029851 k( 115) = ( 0.0419354 0.5349877 -0.0419354), wk = 0.0029851 k( 116) = ( 0.0629031 0.5524815 -0.0629031), wk = 0.0029851 k( 117) = ( 0.0838709 0.5699753 -0.0838709), wk = 0.0029851 k( 118) = ( 0.1048386 0.5874691 -0.1048386), wk = 0.0029851 k( 119) = ( 0.1258063 0.6049629 -0.1258063), wk = 0.0029851 k( 120) = ( 0.1467740 0.6224568 -0.1467740), wk = 0.0029851 k( 121) = ( 0.1677417 0.6399506 -0.1677417), wk = 0.0029851 k( 122) = ( 0.1887094 0.6574444 -0.1887094), wk = 0.0029851 k( 123) = ( 0.2096771 0.6749382 -0.2096771), wk = 0.0029851 k( 124) = ( 0.2306449 0.6924321 -0.2306449), wk = 0.0029851 k( 125) = ( 0.2516126 0.7099259 -0.2516126), wk = 0.0029851 k( 126) = ( 0.2725803 0.7274197 -0.2725803), wk = 0.0029851 k( 127) = ( 0.2725803 0.7274197 -0.2725803), wk = 0.0029851 k( 128) = ( 0.2787268 0.7212732 -0.2787268), wk = 0.0029851 k( 129) = ( 0.2848732 0.7151268 -0.2848732), wk = 0.0029851 k( 130) = ( 0.2910197 0.7089803 -0.2910197), wk = 0.0029851 k( 131) = ( 0.2971662 0.7028338 -0.2971662), wk = 0.0029851 k( 132) = ( 0.3033127 0.6966873 -0.3033127), wk = 0.0029851 k( 133) = ( 0.3094592 0.6905408 -0.3094592), wk = 0.0029851 k( 134) = ( 0.3156056 0.6843944 -0.3156056), wk = 0.0029851 k( 135) = ( 0.3217521 0.6782479 -0.3217521), wk = 0.0029851 k( 136) = ( 0.3278986 0.6721014 -0.3278986), wk = 0.0029851 k( 137) = ( 0.3340451 0.6659549 -0.3340451), wk = 0.0029851 k( 138) = ( 0.3401916 0.6598084 -0.3401916), wk = 0.0029851 k( 139) = ( 0.3463380 0.6536620 -0.3463380), wk = 0.0029851 k( 140) = ( 0.3524845 0.6475155 -0.3524845), wk = 0.0029851 k( 141) = ( 0.3586310 0.6413690 -0.3586310), wk = 0.0029851 k( 142) = ( 0.3647775 0.6352225 -0.3647775), wk = 0.0029851 k( 143) = ( 0.3709240 0.6290760 -0.3709239), wk = 0.0029851 k( 144) = ( 0.3770704 0.6229296 -0.3770704), wk = 0.0029851 k( 145) = ( 0.3832169 0.6167831 -0.3832169), wk = 0.0029851 k( 146) = ( 0.3893634 0.6106366 -0.3893634), wk = 0.0029851 k( 147) = ( 0.3955099 0.6044901 -0.3955099), wk = 0.0029851 k( 148) = ( 0.4016563 0.5983437 -0.4016563), wk = 0.0029851 k( 149) = ( 0.4078028 0.5921972 -0.4078028), wk = 0.0029851 k( 150) = ( 0.4139493 0.5860507 -0.4139493), wk = 0.0029851 k( 151) = ( 0.4200958 0.5799042 -0.4200958), wk = 0.0029851 k( 152) = ( 0.4262422 0.5737577 -0.4262422), wk = 0.0029851 k( 153) = ( 0.4323887 0.5676113 -0.4323887), wk = 0.0029851 k( 154) = ( 0.4385352 0.5614648 -0.4385352), wk = 0.0029851 k( 155) = ( 0.4446817 0.5553183 -0.4446817), wk = 0.0029851 k( 156) = ( 0.4508282 0.5491718 -0.4508282), wk = 0.0029851 k( 157) = ( 0.4569746 0.5430253 -0.4569746), wk = 0.0029851 k( 158) = ( 0.4631211 0.5368789 -0.4631211), wk = 0.0029851 k( 159) = ( 0.4692676 0.5307324 -0.4692676), wk = 0.0029851 k( 160) = ( 0.4754141 0.5245859 -0.4754141), wk = 0.0029851 k( 161) = ( 0.4815606 0.5184394 -0.4815606), wk = 0.0029851 k( 162) = ( 0.4877070 0.5122930 -0.4877070), wk = 0.0029851 k( 163) = ( 0.4938535 0.5061465 -0.4938535), wk = 0.0029851 k( 164) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029851 k( 165) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029851 k( 166) = ( 0.4791667 0.4791667 -0.4791667), wk = 0.0029851 k( 167) = ( 0.4583333 0.4583333 -0.4583333), wk = 0.0029851 k( 168) = ( 0.4375000 0.4375000 -0.4375000), wk = 0.0029851 k( 169) = ( 0.4166667 0.4166667 -0.4166667), wk = 0.0029851 k( 170) = ( 0.3958333 0.3958333 -0.3958333), wk = 0.0029851 k( 171) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0029851 k( 172) = ( 0.3541667 0.3541667 -0.3541667), wk = 0.0029851 k( 173) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0029851 k( 174) = ( 0.3125000 0.3125000 -0.3125000), wk = 0.0029851 k( 175) = ( 0.2916667 0.2916667 -0.2916667), wk = 0.0029851 k( 176) = ( 0.2708333 0.2708333 -0.2708333), wk = 0.0029851 k( 177) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0029851 k( 178) = ( 0.2291667 0.2291667 -0.2291667), wk = 0.0029851 k( 179) = ( 0.2083333 0.2083333 -0.2083333), wk = 0.0029851 k( 180) = ( 0.1875000 0.1875000 -0.1875000), wk = 0.0029851 k( 181) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0029851 k( 182) = ( 0.1458333 0.1458333 -0.1458333), wk = 0.0029851 k( 183) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0029851 k( 184) = ( 0.1041667 0.1041667 -0.1041667), wk = 0.0029851 k( 185) = ( 0.0833333 0.0833333 -0.0833333), wk = 0.0029851 k( 186) = ( 0.0625000 0.0625000 -0.0625000), wk = 0.0029851 k( 187) = ( 0.0416667 0.0416667 -0.0416667), wk = 0.0029851 k( 188) = ( 0.0208333 0.0208333 -0.0208333), wk = 0.0029851 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 190) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029851 k( 191) = ( 0.0099881 -0.0099881 0.0099881), wk = 0.0029851 k( 192) = ( 0.0199762 -0.0199762 0.0199762), wk = 0.0029851 k( 193) = ( 0.0299643 -0.0299643 0.0299643), wk = 0.0029851 k( 194) = ( 0.0399523 -0.0399523 0.0399523), wk = 0.0029851 k( 195) = ( 0.0499404 -0.0499404 0.0499404), wk = 0.0029851 k( 196) = ( 0.0599285 -0.0599285 0.0599285), wk = 0.0029851 k( 197) = ( 0.0699166 -0.0699166 0.0699166), wk = 0.0029851 k( 198) = ( 0.0799047 -0.0799047 0.0799047), wk = 0.0029851 k( 199) = ( 0.0898928 -0.0898928 0.0898928), wk = 0.0029851 k( 200) = ( 0.0998809 -0.0998809 0.0998809), wk = 0.0029851 k( 201) = ( 0.1098690 -0.1098690 0.1098690), wk = 0.0029851 k( 202) = ( 0.1198571 -0.1198571 0.1198571), wk = 0.0029851 k( 203) = ( 0.1298451 -0.1298451 0.1298451), wk = 0.0029851 k( 204) = ( 0.1398332 -0.1398332 0.1398332), wk = 0.0029851 k( 205) = ( 0.1498213 -0.1498213 0.1498213), wk = 0.0029851 k( 206) = ( 0.1598094 -0.1598094 0.1598094), wk = 0.0029851 k( 207) = ( 0.1697975 -0.1697975 0.1697975), wk = 0.0029851 k( 208) = ( 0.1797856 -0.1797856 0.1797856), wk = 0.0029851 k( 209) = ( 0.1897737 -0.1897737 0.1897737), wk = 0.0029851 k( 210) = ( 0.1997618 -0.1997618 0.1997618), wk = 0.0029851 k( 211) = ( 0.2097498 -0.2097498 0.2097498), wk = 0.0029851 k( 212) = ( 0.2197379 -0.2197379 0.2197379), wk = 0.0029851 k( 213) = ( 0.2297260 -0.2297260 0.2297260), wk = 0.0029851 k( 214) = ( 0.2397141 -0.2397141 0.2397141), wk = 0.0029851 k( 215) = ( 0.2497022 -0.2497022 0.2497022), wk = 0.0029851 k( 216) = ( 0.2596903 -0.2596903 0.2596903), wk = 0.0029851 k( 217) = ( 0.2696784 -0.2696784 0.2696784), wk = 0.0029851 k( 218) = ( 0.2796665 -0.2796665 0.2796665), wk = 0.0029851 k( 219) = ( 0.2896546 -0.2896546 0.2896546), wk = 0.0029851 k( 220) = ( 0.2996426 -0.2996426 0.2996426), wk = 0.0029851 k( 221) = ( 0.3096307 -0.3096307 0.3096307), wk = 0.0029851 k( 222) = ( 0.3096307 -0.3096307 0.3096307), wk = 0.0029851 k( 223) = ( 0.3232285 -0.2875143 0.2875143), wk = 0.0029851 k( 224) = ( 0.3368263 -0.2653978 0.2653978), wk = 0.0029851 k( 225) = ( 0.3504241 -0.2432813 0.2432813), wk = 0.0029851 k( 226) = ( 0.3640219 -0.2211648 0.2211648), wk = 0.0029851 k( 227) = ( 0.3776197 -0.1990483 0.1990483), wk = 0.0029851 k( 228) = ( 0.3912176 -0.1769318 0.1769318), wk = 0.0029851 k( 229) = ( 0.4048154 -0.1548154 0.1548154), wk = 0.0029851 k( 230) = ( 0.4184132 -0.1326989 0.1326989), wk = 0.0029851 k( 231) = ( 0.4320110 -0.1105824 0.1105824), wk = 0.0029851 k( 232) = ( 0.4456088 -0.0884659 0.0884659), wk = 0.0029851 k( 233) = ( 0.4592066 -0.0663494 0.0663494), wk = 0.0029851 k( 234) = ( 0.4728044 -0.0442330 0.0442330), wk = 0.0029851 k( 235) = ( 0.4864022 -0.0221165 0.0221165), wk = 0.0029851 k( 236) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0029851 k( 237) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0029851 k( 238) = ( 0.4937500 0.0062500 0.0062500), wk = 0.0029851 k( 239) = ( 0.4875000 0.0125000 0.0125000), wk = 0.0029851 k( 240) = ( 0.4812500 0.0187500 0.0187500), wk = 0.0029851 k( 241) = ( 0.4750000 0.0250000 0.0250000), wk = 0.0029851 k( 242) = ( 0.4687500 0.0312500 0.0312500), wk = 0.0029851 k( 243) = ( 0.4625000 0.0375000 0.0375000), wk = 0.0029851 k( 244) = ( 0.4562500 0.0437500 0.0437500), wk = 0.0029851 k( 245) = ( 0.4500000 0.0500000 0.0500000), wk = 0.0029851 k( 246) = ( 0.4437500 0.0562500 0.0562500), wk = 0.0029851 k( 247) = ( 0.4375000 0.0625000 0.0625000), wk = 0.0029851 k( 248) = ( 0.4312500 0.0687500 0.0687500), wk = 0.0029851 k( 249) = ( 0.4250000 0.0750000 0.0750000), wk = 0.0029851 k( 250) = ( 0.4187500 0.0812500 0.0812500), wk = 0.0029851 k( 251) = ( 0.4125000 0.0875000 0.0875000), wk = 0.0029851 k( 252) = ( 0.4062500 0.0937500 0.0937500), wk = 0.0029851 k( 253) = ( 0.4000000 0.1000000 0.1000000), wk = 0.0029851 k( 254) = ( 0.3937500 0.1062500 0.1062500), wk = 0.0029851 k( 255) = ( 0.3875000 0.1125000 0.1125000), wk = 0.0029851 k( 256) = ( 0.3812500 0.1187500 0.1187500), wk = 0.0029851 k( 257) = ( 0.3750000 0.1250000 0.1250000), wk = 0.0029851 k( 258) = ( 0.3687500 0.1312500 0.1312500), wk = 0.0029851 k( 259) = ( 0.3625000 0.1375000 0.1375000), wk = 0.0029851 k( 260) = ( 0.3562500 0.1437500 0.1437500), wk = 0.0029851 k( 261) = ( 0.3500000 0.1500000 0.1500000), wk = 0.0029851 k( 262) = ( 0.3437500 0.1562500 0.1562500), wk = 0.0029851 k( 263) = ( 0.3375000 0.1625000 0.1625000), wk = 0.0029851 k( 264) = ( 0.3312500 0.1687500 0.1687500), wk = 0.0029851 k( 265) = ( 0.3250000 0.1750000 0.1750000), wk = 0.0029851 k( 266) = ( 0.3187500 0.1812500 0.1812500), wk = 0.0029851 k( 267) = ( 0.3125000 0.1875000 0.1875000), wk = 0.0029851 k( 268) = ( 0.3062500 0.1937500 0.1937500), wk = 0.0029851 k( 269) = ( 0.3000000 0.2000000 0.2000000), wk = 0.0029851 k( 270) = ( 0.2937500 0.2062500 0.2062500), wk = 0.0029851 k( 271) = ( 0.2875000 0.2125000 0.2125000), wk = 0.0029851 k( 272) = ( 0.2812500 0.2187500 0.2187500), wk = 0.0029851 k( 273) = ( 0.2750000 0.2250000 0.2250000), wk = 0.0029851 k( 274) = ( 0.2687500 0.2312500 0.2312500), wk = 0.0029851 k( 275) = ( 0.2625000 0.2375000 0.2375000), wk = 0.0029851 k( 276) = ( 0.2562500 0.2437500 0.2437500), wk = 0.0029851 k( 277) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029851 k( 278) = ( 0.0822110 -0.0822110 0.5370504), wk = 0.0029851 k( 279) = ( 0.0883575 -0.0883575 0.5309040), wk = 0.0029851 k( 280) = ( 0.0945040 -0.0945040 0.5247575), wk = 0.0029851 k( 281) = ( 0.1006505 -0.1006505 0.5186110), wk = 0.0029851 k( 282) = ( 0.1067969 -0.1067969 0.5124645), wk = 0.0029851 k( 283) = ( 0.1129434 -0.1129434 0.5063180), wk = 0.0029851 k( 284) = ( 0.1190899 -0.1190899 0.5001716), wk = 0.0029851 k( 285) = ( 0.1252364 -0.1252364 0.4940251), wk = 0.0029851 k( 286) = ( 0.1313828 -0.1313828 0.4878786), wk = 0.0029851 k( 287) = ( 0.1375293 -0.1375293 0.4817321), wk = 0.0029851 k( 288) = ( 0.1436758 -0.1436758 0.4755857), wk = 0.0029851 k( 289) = ( 0.1498223 -0.1498223 0.4694392), wk = 0.0029851 k( 290) = ( 0.1559688 -0.1559688 0.4632927), wk = 0.0029851 k( 291) = ( 0.1621152 -0.1621152 0.4571462), wk = 0.0029851 k( 292) = ( 0.1682617 -0.1682617 0.4509997), wk = 0.0029851 k( 293) = ( 0.1744082 -0.1744082 0.4448533), wk = 0.0029851 k( 294) = ( 0.1805547 -0.1805547 0.4387068), wk = 0.0029851 k( 295) = ( 0.1867012 -0.1867011 0.4325603), wk = 0.0029851 k( 296) = ( 0.1928476 -0.1928476 0.4264138), wk = 0.0029851 k( 297) = ( 0.1989941 -0.1989941 0.4202674), wk = 0.0029851 k( 298) = ( 0.2051406 -0.2051406 0.4141209), wk = 0.0029851 k( 299) = ( 0.2112871 -0.2112871 0.4079744), wk = 0.0029851 k( 300) = ( 0.2174336 -0.2174335 0.4018279), wk = 0.0029851 k( 301) = ( 0.2235800 -0.2235800 0.3956814), wk = 0.0029851 k( 302) = ( 0.2297265 -0.2297265 0.3895349), wk = 0.0029851 k( 303) = ( 0.2358730 -0.2358730 0.3833885), wk = 0.0029851 k( 304) = ( 0.2420195 -0.2420195 0.3772420), wk = 0.0029851 k( 305) = ( 0.2481659 -0.2481659 0.3710955), wk = 0.0029851 k( 306) = ( 0.2543124 -0.2543124 0.3649490), wk = 0.0029851 k( 307) = ( 0.2604589 -0.2604589 0.3588026), wk = 0.0029851 k( 308) = ( 0.2666054 -0.2666054 0.3526561), wk = 0.0029851 k( 309) = ( 0.2727519 -0.2727519 0.3465096), wk = 0.0029851 k( 310) = ( 0.2788983 -0.2788983 0.3403631), wk = 0.0029851 k( 311) = ( 0.2850448 -0.2850448 0.3342166), wk = 0.0029851 k( 312) = ( 0.2911913 -0.2911913 0.3280702), wk = 0.0029851 k( 313) = ( 0.2973378 -0.2973378 0.3219237), wk = 0.0029851 k( 314) = ( 0.3034843 -0.3034843 0.3157772), wk = 0.0029851 k( 315) = ( 0.3096307 -0.3096307 0.3096307), wk = 0.0029851 k( 316) = ( 0.6903693 0.3096307 -0.3096307), wk = 0.0029851 k( 317) = ( 0.6803498 0.3196502 -0.3196502), wk = 0.0029851 k( 318) = ( 0.6703304 0.3296696 -0.3296696), wk = 0.0029851 k( 319) = ( 0.6603110 0.3396890 -0.3396890), wk = 0.0029851 k( 320) = ( 0.6502915 0.3497085 -0.3497085), wk = 0.0029851 k( 321) = ( 0.6402721 0.3597279 -0.3597279), wk = 0.0029851 k( 322) = ( 0.6302527 0.3697473 -0.3697473), wk = 0.0029851 k( 323) = ( 0.6202332 0.3797668 -0.3797668), wk = 0.0029851 k( 324) = ( 0.6102138 0.3897862 -0.3897862), wk = 0.0029851 k( 325) = ( 0.6001943 0.3998057 -0.3998056), wk = 0.0029851 k( 326) = ( 0.5901749 0.4098251 -0.4098251), wk = 0.0029851 k( 327) = ( 0.5801555 0.4198445 -0.4198445), wk = 0.0029851 k( 328) = ( 0.5701361 0.4298639 -0.4298639), wk = 0.0029851 k( 329) = ( 0.5601166 0.4398834 -0.4398834), wk = 0.0029851 k( 330) = ( 0.5500972 0.4499028 -0.4499028), wk = 0.0029851 k( 331) = ( 0.5400777 0.4599223 -0.4599223), wk = 0.0029851 k( 332) = ( 0.5300583 0.4699417 -0.4699417), wk = 0.0029851 k( 333) = ( 0.5200389 0.4799611 -0.4799611), wk = 0.0029851 k( 334) = ( 0.5100194 0.4899806 -0.4899806), wk = 0.0029851 k( 335) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029851 Dense grid: 68467 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 52965 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.51 Mb ( 392, 86) NL pseudopotentials 0.96 Mb ( 196, 320) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1902) G-vector shells 0.01 Mb ( 1796) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.06 Mb ( 392, 344) Each subspace H/S matrix 0.11 Mb ( 86, 86) Each matrix 0.84 Mb ( 320, 2, 86) The potential is recalculated from file : ./Zr3xSiCux4.save/charge-density.dat Starting wfc are 158 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 7.5 secs Computing kpt #: 2 total cpu time spent up to now is 10.9 secs Computing kpt #: 3 total cpu time spent up to now is 13.3 secs Computing kpt #: 4 total cpu time spent up to now is 15.8 secs Computing kpt #: 5 total cpu time spent up to now is 18.1 secs Computing kpt #: 6 total cpu time spent up to now is 20.6 secs Computing kpt #: 7 total cpu time spent up to now is 23.0 secs Computing kpt #: 8 total cpu time spent up to now is 25.3 secs Computing kpt #: 9 total cpu time spent up to now is 27.6 secs Computing kpt #: 10 total cpu time spent up to now is 30.1 secs Computing kpt #: 11 total cpu time spent up to now is 33.7 secs Computing kpt #: 12 total cpu time spent up to now is 36.9 secs Computing kpt #: 13 total cpu time spent up to now is 39.8 secs Computing kpt #: 14 total cpu time spent up to now is 42.3 secs Computing kpt #: 15 total cpu time spent up to now is 44.9 secs Computing kpt #: 16 total cpu time spent up to now is 47.4 secs Computing kpt #: 17 total cpu time spent up to now is 50.3 secs Computing kpt #: 18 total cpu time spent up to now is 53.0 secs Computing kpt #: 19 total cpu time spent up to now is 55.9 secs Computing kpt #: 20 total cpu time spent up to now is 59.4 secs Computing kpt #: 21 total cpu time spent up to now is 62.9 secs Computing kpt #: 22 total cpu time spent up to now is 66.7 secs Computing kpt #: 23 total cpu time spent up to now is 71.1 secs Computing kpt #: 24 total cpu time spent up to now is 75.7 secs Computing kpt #: 25 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 80.5 secs Computing kpt #: 26 total cpu time spent up to now is 85.1 secs Computing kpt #: 27 total cpu time spent up to now is 89.5 secs Computing kpt #: 28 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 94.2 secs Computing kpt #: 29 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 98.9 secs Computing kpt #: 30 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 103.7 secs Computing kpt #: 31 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 108.5 secs Computing kpt #: 32 total cpu time spent up to now is 112.1 secs Computing kpt #: 33 total cpu time spent up to now is 115.0 secs Computing kpt #: 34 total cpu time spent up to now is 117.4 secs Computing kpt #: 35 total cpu time spent up to now is 119.8 secs Computing kpt #: 36 total cpu time spent up to now is 122.2 secs Computing kpt #: 37 total cpu time spent up to now is 124.5 secs Computing kpt #: 38 total cpu time spent up to now is 127.0 secs Computing kpt #: 39 total cpu time spent up to now is 129.4 secs Computing kpt #: 40 total cpu time spent up to now is 132.2 secs Computing kpt #: 41 total cpu time spent up to now is 134.9 secs Computing kpt #: 42 total cpu time spent up to now is 137.7 secs Computing kpt #: 43 total cpu time spent up to now is 140.4 secs Computing kpt #: 44 total cpu time spent up to now is 142.8 secs Computing kpt #: 45 total cpu time spent up to now is 145.3 secs Computing kpt #: 46 total cpu time spent up to now is 147.7 secs Computing kpt #: 47 total cpu time spent up to now is 150.1 secs Computing kpt #: 48 total cpu time spent up to now is 152.5 secs Computing kpt #: 49 total cpu time spent up to now is 154.9 secs Computing kpt #: 50 total cpu time spent up to now is 157.3 secs Computing kpt #: 51 total cpu time spent up to now is 159.8 secs Computing kpt #: 52 total cpu time spent up to now is 162.3 secs Computing kpt #: 53 total cpu time spent up to now is 164.8 secs Computing kpt #: 54 total cpu time spent up to now is 167.3 secs Computing kpt #: 55 total cpu time spent up to now is 170.1 secs Computing kpt #: 56 total cpu time spent up to now is 172.6 secs Computing kpt #: 57 total cpu time spent up to now is 175.5 secs Computing kpt #: 58 total cpu time spent up to now is 178.4 secs Computing kpt #: 59 total cpu time spent up to now is 181.8 secs Computing kpt #: 60 total cpu time spent up to now is 184.3 secs Computing kpt #: 61 total cpu time spent up to now is 186.7 secs Computing kpt #: 62 total cpu time spent up to now is 189.2 secs Computing kpt #: 63 total cpu time spent up to now is 191.7 secs Computing kpt #: 64 total cpu time spent up to now is 194.2 secs Computing kpt #: 65 total cpu time spent up to now is 196.8 secs Computing kpt #: 66 total cpu time spent up to now is 199.3 secs Computing kpt #: 67 total cpu time spent up to now is 201.8 secs Computing kpt #: 68 total cpu time spent up to now is 204.3 secs Computing kpt #: 69 total cpu time spent up to now is 206.6 secs Computing kpt #: 70 total cpu time spent up to now is 209.1 secs Computing kpt #: 71 total cpu time spent up to now is 211.4 secs Computing kpt #: 72 total cpu time spent up to now is 214.3 secs Computing kpt #: 73 total cpu time spent up to now is 217.2 secs Computing kpt #: 74 total cpu time spent up to now is 219.5 secs Computing kpt #: 75 total cpu time spent up to now is 221.9 secs Computing kpt #: 76 total cpu time spent up to now is 225.4 secs Computing kpt #: 77 total cpu time spent up to now is 228.3 secs Computing kpt #: 78 total cpu time spent up to now is 230.7 secs Computing kpt #: 79 total cpu time spent up to now is 233.0 secs Computing kpt #: 80 total cpu time spent up to now is 235.3 secs Computing kpt #: 81 total cpu time spent up to now is 237.7 secs Computing kpt #: 82 total cpu time spent up to now is 240.6 secs Computing kpt #: 83 total cpu time spent up to now is 242.9 secs Computing kpt #: 84 total cpu time spent up to now is 245.3 secs Computing kpt #: 85 total cpu time spent up to now is 247.5 secs Computing kpt #: 86 total cpu time spent up to now is 249.8 secs Computing kpt #: 87 total cpu time spent up to now is 252.1 secs Computing kpt #: 88 total cpu time spent up to now is 254.4 secs Computing kpt #: 89 total cpu time spent up to now is 256.7 secs Computing kpt #: 90 total cpu time spent up to now is 259.0 secs Computing kpt #: 91 total cpu time spent up to now is 261.2 secs Computing kpt #: 92 total cpu time spent up to now is 263.5 secs Computing kpt #: 93 total cpu time spent up to now is 265.9 secs Computing kpt #: 94 total cpu time spent up to now is 268.1 secs Computing kpt #: 95 total cpu time spent up to now is 270.4 secs Computing kpt #: 96 total cpu time spent up to now is 272.7 secs Computing kpt #: 97 total cpu time spent up to now is 275.6 secs Computing kpt #: 98 total cpu time spent up to now is 279.5 secs Computing kpt #: 99 total cpu time spent up to now is 283.0 secs Computing kpt #: 100 total cpu time spent up to now is 286.5 secs Computing kpt #: 101 total cpu time spent up to now is 289.9 secs Computing kpt #: 102 total cpu time spent up to now is 292.8 secs Computing kpt #: 103 total cpu time spent up to now is 295.6 secs Computing kpt #: 104 total cpu time spent up to now is 298.4 secs Computing kpt #: 105 total cpu time spent up to now is 301.2 secs Computing kpt #: 106 total cpu time spent up to now is 303.6 secs Computing kpt #: 107 total cpu time spent up to now is 306.4 secs Computing kpt #: 108 total cpu time spent up to now is 308.9 secs Computing kpt #: 109 total cpu time spent up to now is 311.4 secs Computing kpt #: 110 total cpu time spent up to now is 313.8 secs Computing kpt #: 111 total cpu time spent up to now is 316.2 secs Computing kpt #: 112 total cpu time spent up to now is 318.6 secs Computing kpt #: 113 total cpu time spent up to now is 320.9 secs Computing kpt #: 114 total cpu time spent up to now is 323.4 secs Computing kpt #: 115 total cpu time spent up to now is 326.1 secs Computing kpt #: 116 total cpu time spent up to now is 328.6 secs Computing kpt #: 117 total cpu time spent up to now is 331.4 secs Computing kpt #: 118 total cpu time spent up to now is 333.7 secs Computing kpt #: 119 total cpu time spent up to now is 336.2 secs Computing kpt #: 120 total cpu time spent up to now is 338.6 secs Computing kpt #: 121 total cpu time spent up to now is 341.1 secs Computing kpt #: 122 total cpu time spent up to now is 343.4 secs Computing kpt #: 123 total cpu time spent up to now is 345.8 secs Computing kpt #: 124 total cpu time spent up to now is 348.2 secs Computing kpt #: 125 total cpu time spent up to now is 350.6 secs Computing kpt #: 126 total cpu time spent up to now is 352.9 secs Computing kpt #: 127 total cpu time spent up to now is 355.4 secs Computing kpt #: 128 total cpu time spent up to now is 358.2 secs Computing kpt #: 129 total cpu time spent up to now is 360.7 secs Computing kpt #: 130 total cpu time spent up to now is 363.4 secs Computing kpt #: 131 total cpu time spent up to now is 365.9 secs Computing kpt #: 132 total cpu time spent up to now is 368.4 secs Computing kpt #: 133 total cpu time spent up to now is 371.0 secs Computing kpt #: 134 total cpu time spent up to now is 373.5 secs Computing kpt #: 135 total cpu time spent up to now is 376.0 secs Computing kpt #: 136 total cpu time spent up to now is 378.5 secs Computing kpt #: 137 total cpu time spent up to now is 381.5 secs Computing kpt #: 138 total cpu time spent up to now is 384.9 secs Computing kpt #: 139 total cpu time spent up to now is 388.8 secs Computing kpt #: 140 total cpu time spent up to now is 393.0 secs Computing kpt #: 141 total cpu time spent up to now is 397.7 secs Computing kpt #: 142 total cpu time spent up to now is 402.3 secs Computing kpt #: 143 total cpu time spent up to now is 406.9 secs Computing kpt #: 144 total cpu time spent up to now is 411.5 secs Computing kpt #: 145 total cpu time spent up to now is 416.1 secs Computing kpt #: 146 total cpu time spent up to now is 420.3 secs Computing kpt #: 147 total cpu time spent up to now is 423.8 secs Computing kpt #: 148 total cpu time spent up to now is 427.3 secs Computing kpt #: 149 total cpu time spent up to now is 430.7 secs Computing kpt #: 150 total cpu time spent up to now is 433.7 secs Computing kpt #: 151 total cpu time spent up to now is 437.1 secs Computing kpt #: 152 total cpu time spent up to now is 440.0 secs Computing kpt #: 153 total cpu time spent up to now is 443.5 secs Computing kpt #: 154 total cpu time spent up to now is 447.5 secs Computing kpt #: 155 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 452.4 secs Computing kpt #: 156 total cpu time spent up to now is 456.0 secs Computing kpt #: 157 total cpu time spent up to now is 459.3 secs Computing kpt #: 158 total cpu time spent up to now is 462.8 secs Computing kpt #: 159 total cpu time spent up to now is 466.3 secs Computing kpt #: 160 total cpu time spent up to now is 470.4 secs Computing kpt #: 161 total cpu time spent up to now is 474.3 secs Computing kpt #: 162 total cpu time spent up to now is 478.9 secs Computing kpt #: 163 total cpu time spent up to now is 482.9 secs Computing kpt #: 164 total cpu time spent up to now is 486.9 secs Computing kpt #: 165 total cpu time spent up to now is 491.0 secs Computing kpt #: 166 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 495.7 secs Computing kpt #: 167 total cpu time spent up to now is 499.8 secs Computing kpt #: 168 total cpu time spent up to now is 503.2 secs Computing kpt #: 169 total cpu time spent up to now is 506.0 secs Computing kpt #: 170 total cpu time spent up to now is 508.2 secs Computing kpt #: 171 total cpu time spent up to now is 510.4 secs Computing kpt #: 172 total cpu time spent up to now is 512.7 secs Computing kpt #: 173 total cpu time spent up to now is 514.9 secs Computing kpt #: 174 total cpu time spent up to now is 517.2 secs Computing kpt #: 175 total cpu time spent up to now is 519.4 secs Computing kpt #: 176 total cpu time spent up to now is 521.7 secs Computing kpt #: 177 total cpu time spent up to now is 523.9 secs Computing kpt #: 178 total cpu time spent up to now is 526.2 secs Computing kpt #: 179 total cpu time spent up to now is 528.5 secs Computing kpt #: 180 total cpu time spent up to now is 530.8 secs Computing kpt #: 181 total cpu time spent up to now is 533.0 secs Computing kpt #: 182 total cpu time spent up to now is 535.4 secs Computing kpt #: 183 total cpu time spent up to now is 537.7 secs Computing kpt #: 184 total cpu time spent up to now is 540.6 secs Computing kpt #: 185 total cpu time spent up to now is 542.9 secs Computing kpt #: 186 total cpu time spent up to now is 545.8 secs Computing kpt #: 187 total cpu time spent up to now is 549.3 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 554.1 secs Computing kpt #: 189 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 558.9 secs Computing kpt #: 190 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 563.6 secs Computing kpt #: 191 total cpu time spent up to now is 566.1 secs Computing kpt #: 192 total cpu time spent up to now is 568.4 secs Computing kpt #: 193 total cpu time spent up to now is 570.7 secs Computing kpt #: 194 total cpu time spent up to now is 573.0 secs Computing kpt #: 195 total cpu time spent up to now is 575.4 secs Computing kpt #: 196 total cpu time spent up to now is 577.7 secs Computing kpt #: 197 total cpu time spent up to now is 579.7 secs Computing kpt #: 198 total cpu time spent up to now is 582.0 secs Computing kpt #: 199 total cpu time spent up to now is 584.1 secs Computing kpt #: 200 total cpu time spent up to now is 586.1 secs Computing kpt #: 201 total cpu time spent up to now is 588.5 secs Computing kpt #: 202 total cpu time spent up to now is 590.8 secs Computing kpt #: 203 total cpu time spent up to now is 593.1 secs Computing kpt #: 204 total cpu time spent up to now is 595.4 secs Computing kpt #: 205 total cpu time spent up to now is 597.7 secs Computing kpt #: 206 total cpu time spent up to now is 600.1 secs Computing kpt #: 207 total cpu time spent up to now is 602.5 secs Computing kpt #: 208 total cpu time spent up to now is 604.8 secs Computing kpt #: 209 total cpu time spent up to now is 607.2 secs Computing kpt #: 210 total cpu time spent up to now is 609.5 secs Computing kpt #: 211 total cpu time spent up to now is 611.9 secs Computing kpt #: 212 total cpu time spent up to now is 614.2 secs Computing kpt #: 213 total cpu time spent up to now is 616.5 secs Computing kpt #: 214 total cpu time spent up to now is 618.8 secs Computing kpt #: 215 total cpu time spent up to now is 621.1 secs Computing kpt #: 216 total cpu time spent up to now is 623.5 secs Computing kpt #: 217 total cpu time spent up to now is 625.9 secs Computing kpt #: 218 total cpu time spent up to now is 628.2 secs Computing kpt #: 219 total cpu time spent up to now is 630.6 secs Computing kpt #: 220 total cpu time spent up to now is 632.9 secs Computing kpt #: 221 total cpu time spent up to now is 635.2 secs Computing kpt #: 222 total cpu time spent up to now is 637.5 secs Computing kpt #: 223 total cpu time spent up to now is 639.9 secs Computing kpt #: 224 total cpu time spent up to now is 642.2 secs Computing kpt #: 225 total cpu time spent up to now is 644.5 secs Computing kpt #: 226 total cpu time spent up to now is 646.9 secs Computing kpt #: 227 total cpu time spent up to now is 649.3 secs Computing kpt #: 228 total cpu time spent up to now is 651.7 secs Computing kpt #: 229 total cpu time spent up to now is 654.3 secs Computing kpt #: 230 total cpu time spent up to now is 657.3 secs Computing kpt #: 231 total cpu time spent up to now is 660.4 secs Computing kpt #: 232 total cpu time spent up to now is 663.5 secs Computing kpt #: 233 total cpu time spent up to now is 667.0 secs Computing kpt #: 234 total cpu time spent up to now is 670.5 secs Computing kpt #: 235 total cpu time spent up to now is 674.5 secs Computing kpt #: 236 total cpu time spent up to now is 677.9 secs Computing kpt #: 237 total cpu time spent up to now is 681.4 secs Computing kpt #: 238 total cpu time spent up to now is 685.0 secs Computing kpt #: 239 total cpu time spent up to now is 688.5 secs Computing kpt #: 240 total cpu time spent up to now is 692.6 secs Computing kpt #: 241 total cpu time spent up to now is 696.0 secs Computing kpt #: 242 total cpu time spent up to now is 699.6 secs Computing kpt #: 243 total cpu time spent up to now is 703.1 secs Computing kpt #: 244 total cpu time spent up to now is 706.7 secs Computing kpt #: 245 total cpu time spent up to now is 710.4 secs Computing kpt #: 246 total cpu time spent up to now is 715.2 secs Computing kpt #: 247 total cpu time spent up to now is 717.7 secs Computing kpt #: 248 total cpu time spent up to now is 720.2 secs Computing kpt #: 249 total cpu time spent up to now is 723.2 secs Computing kpt #: 250 total cpu time spent up to now is 726.1 secs Computing kpt #: 251 total cpu time spent up to now is 729.6 secs Computing kpt #: 252 total cpu time spent up to now is 733.8 secs Computing kpt #: 253 total cpu time spent up to now is 737.8 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 742.6 secs Computing kpt #: 255 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 747.5 secs Computing kpt #: 256 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 752.3 secs Computing kpt #: 257 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 757.2 secs Computing kpt #: 258 total cpu time spent up to now is 761.4 secs Computing kpt #: 259 total cpu time spent up to now is 763.9 secs Computing kpt #: 260 total cpu time spent up to now is 766.4 secs Computing kpt #: 261 total cpu time spent up to now is 769.3 secs Computing kpt #: 262 total cpu time spent up to now is 771.9 secs Computing kpt #: 263 total cpu time spent up to now is 774.4 secs Computing kpt #: 264 total cpu time spent up to now is 777.3 secs Computing kpt #: 265 total cpu time spent up to now is 780.2 secs Computing kpt #: 266 total cpu time spent up to now is 783.1 secs Computing kpt #: 267 total cpu time spent up to now is 785.6 secs Computing kpt #: 268 total cpu time spent up to now is 788.1 secs Computing kpt #: 269 total cpu time spent up to now is 790.6 secs Computing kpt #: 270 total cpu time spent up to now is 793.0 secs Computing kpt #: 271 total cpu time spent up to now is 795.4 secs Computing kpt #: 272 total cpu time spent up to now is 797.7 secs Computing kpt #: 273 total cpu time spent up to now is 800.0 secs Computing kpt #: 274 total cpu time spent up to now is 802.3 secs Computing kpt #: 275 total cpu time spent up to now is 804.6 secs Computing kpt #: 276 total cpu time spent up to now is 806.8 secs Computing kpt #: 277 total cpu time spent up to now is 809.2 secs Computing kpt #: 278 total cpu time spent up to now is 811.7 secs Computing kpt #: 279 total cpu time spent up to now is 814.2 secs Computing kpt #: 280 total cpu time spent up to now is 816.6 secs Computing kpt #: 281 total cpu time spent up to now is 819.0 secs Computing kpt #: 282 total cpu time spent up to now is 821.4 secs Computing kpt #: 283 total cpu time spent up to now is 823.8 secs Computing kpt #: 284 total cpu time spent up to now is 826.1 secs Computing kpt #: 285 total cpu time spent up to now is 828.5 secs Computing kpt #: 286 total cpu time spent up to now is 830.8 secs Computing kpt #: 287 total cpu time spent up to now is 833.1 secs Computing kpt #: 288 total cpu time spent up to now is 835.4 secs Computing kpt #: 289 total cpu time spent up to now is 837.6 secs Computing kpt #: 290 total cpu time spent up to now is 840.5 secs Computing kpt #: 291 total cpu time spent up to now is 842.8 secs Computing kpt #: 292 total cpu time spent up to now is 845.0 secs Computing kpt #: 293 total cpu time spent up to now is 847.3 secs Computing kpt #: 294 total cpu time spent up to now is 849.9 secs Computing kpt #: 295 total cpu time spent up to now is 852.6 secs Computing kpt #: 296 total cpu time spent up to now is 854.9 secs Computing kpt #: 297 total cpu time spent up to now is 857.7 secs Computing kpt #: 298 total cpu time spent up to now is 860.3 secs Computing kpt #: 299 total cpu time spent up to now is 862.6 secs Computing kpt #: 300 total cpu time spent up to now is 865.0 secs Computing kpt #: 301 total cpu time spent up to now is 867.3 secs Computing kpt #: 302 total cpu time spent up to now is 869.6 secs Computing kpt #: 303 total cpu time spent up to now is 871.9 secs Computing kpt #: 304 total cpu time spent up to now is 874.3 secs Computing kpt #: 305 total cpu time spent up to now is 876.6 secs Computing kpt #: 306 total cpu time spent up to now is 878.9 secs Computing kpt #: 307 total cpu time spent up to now is 881.3 secs Computing kpt #: 308 total cpu time spent up to now is 883.6 secs Computing kpt #: 309 total cpu time spent up to now is 886.0 secs Computing kpt #: 310 total cpu time spent up to now is 888.3 secs Computing kpt #: 311 total cpu time spent up to now is 890.6 secs Computing kpt #: 312 total cpu time spent up to now is 893.0 secs Computing kpt #: 313 total cpu time spent up to now is 895.3 secs Computing kpt #: 314 total cpu time spent up to now is 897.6 secs Computing kpt #: 315 total cpu time spent up to now is 899.9 secs Computing kpt #: 316 total cpu time spent up to now is 902.2 secs Computing kpt #: 317 total cpu time spent up to now is 904.5 secs Computing kpt #: 318 total cpu time spent up to now is 906.8 secs Computing kpt #: 319 total cpu time spent up to now is 909.1 secs Computing kpt #: 320 total cpu time spent up to now is 911.4 secs Computing kpt #: 321 total cpu time spent up to now is 913.7 secs Computing kpt #: 322 total cpu time spent up to now is 916.0 secs Computing kpt #: 323 total cpu time spent up to now is 918.3 secs Computing kpt #: 324 total cpu time spent up to now is 920.6 secs Computing kpt #: 325 total cpu time spent up to now is 923.0 secs Computing kpt #: 326 total cpu time spent up to now is 925.4 secs Computing kpt #: 327 total cpu time spent up to now is 927.7 secs Computing kpt #: 328 total cpu time spent up to now is 930.1 secs Computing kpt #: 329 total cpu time spent up to now is 932.5 secs Computing kpt #: 330 total cpu time spent up to now is 935.0 secs Computing kpt #: 331 total cpu time spent up to now is 937.6 secs Computing kpt #: 332 total cpu time spent up to now is 940.0 secs Computing kpt #: 333 total cpu time spent up to now is 942.4 secs Computing kpt #: 334 total cpu time spent up to now is 945.4 secs Computing kpt #: 335 total cpu time spent up to now is 949.5 secs ethr = 1.39E-08, avg # of iterations = 44.8 total cpu time spent up to now is 949.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6595 PWs) bands (ev): -0.2386 -0.2386 1.8487 1.8487 2.3205 2.3205 3.7655 3.7655 4.6321 4.6321 4.7000 4.7000 5.3840 5.3840 6.0988 6.0988 6.3033 6.3033 6.3266 6.3266 6.5436 6.5436 6.6759 6.6759 6.8464 6.8464 6.9049 6.9049 6.9940 6.9940 7.0796 7.0796 7.1637 7.1637 7.2504 7.2504 7.2760 7.2760 7.3030 7.3030 7.4540 7.4540 7.5168 7.5168 7.7114 7.7114 7.7408 7.7408 7.9089 7.9089 7.9824 7.9824 8.2211 8.2211 9.0456 9.0456 9.0888 9.0888 9.4600 9.4600 9.5104 9.5104 9.5494 9.5494 9.8831 9.8831 10.5412 10.5412 11.5075 11.5075 11.6734 11.6734 12.3250 12.3250 12.3581 12.3581 12.4732 12.4732 12.6409 12.6409 12.9055 12.9055 13.1822 13.1822 13.2657 13.2778 k =-0.0062 0.0108 0.0202 ( 6597 PWs) bands (ev): -0.2371 -0.2371 1.8490 1.8490 2.3213 2.3213 3.7654 3.7654 4.6332 4.6332 4.7006 4.7006 5.3853 5.3853 6.0983 6.0983 6.3028 6.3028 6.3273 6.3273 6.5441 6.5441 6.6761 6.6761 6.8461 6.8461 6.9050 6.9050 6.9938 6.9938 7.0791 7.0791 7.1635 7.1635 7.2504 7.2504 7.2744 7.2744 7.3036 7.3036 7.4541 7.4541 7.5176 7.5176 7.7110 7.7110 7.7407 7.7407 7.9086 7.9086 7.9821 7.9821 8.2210 8.2210 9.0367 9.0367 9.0903 9.0903 9.4530 9.4530 9.5097 9.5097 9.5488 9.5488 9.8872 9.8872 10.5436 10.5436 11.5091 11.5091 11.6753 11.6753 12.3154 12.3154 12.3205 12.3205 12.5149 12.5149 12.6278 12.6278 12.8979 12.8979 13.1871 13.1871 13.2678 13.2678 k =-0.0124 0.0216 0.0405 ( 6591 PWs) bands (ev): -0.2326 -0.2326 1.8499 1.8499 2.3237 2.3237 3.7650 3.7650 4.6365 4.6365 4.7021 4.7021 5.3893 5.3893 6.0970 6.0970 6.3014 6.3014 6.3295 6.3295 6.5457 6.5457 6.6767 6.6767 6.8455 6.8455 6.9055 6.9055 6.9935 6.9935 7.0773 7.0773 7.1629 7.1629 7.2504 7.2504 7.2704 7.2704 7.3052 7.3052 7.4546 7.4546 7.5197 7.5197 7.7097 7.7097 7.7405 7.7405 7.9080 7.9080 7.9811 7.9811 8.2210 8.2210 9.0127 9.0127 9.0929 9.0929 9.4325 9.4325 9.5067 9.5067 9.5480 9.5480 9.8983 9.8983 10.5509 10.5509 11.5138 11.5138 11.6808 11.6808 12.2452 12.2452 12.3010 12.3010 12.5887 12.5887 12.5909 12.5909 12.8757 12.8757 13.2004 13.2004 13.2739 13.2739 k =-0.0186 0.0324 0.0607 ( 6595 PWs) bands (ev): -0.2251 -0.2251 1.8513 1.8513 2.3276 2.3276 3.7643 3.7643 4.6419 4.6419 4.7046 4.7046 5.3959 5.3959 6.0948 6.0948 6.2996 6.2996 6.3327 6.3327 6.5484 6.5484 6.6778 6.6778 6.8445 6.8445 6.9062 6.9062 6.9929 6.9929 7.0744 7.0744 7.1620 7.1620 7.2502 7.2502 7.2650 7.2650 7.3069 7.3069 7.4554 7.4554 7.5229 7.5229 7.7077 7.7077 7.7401 7.7401 7.9069 7.9069 7.9794 7.9794 8.2208 8.2208 8.9771 8.9771 9.0951 9.0951 9.3990 9.3990 9.4995 9.4995 9.5491 9.5491 9.9143 9.9143 10.5635 10.5635 11.5209 11.5209 11.6891 11.6891 12.1677 12.1677 12.2718 12.2718 12.5345 12.5345 12.6708 12.6708 12.8405 12.8405 13.2192 13.2192 13.2824 13.2824 k =-0.0248 0.0432 0.0809 ( 6589 PWs) bands (ev): -0.2146 -0.2146 1.8534 1.8534 2.3332 2.3332 3.7633 3.7633 4.6495 4.6495 4.7080 4.7080 5.4051 5.4051 6.0917 6.0917 6.2977 6.2977 6.3367 6.3367 6.5522 6.5522 6.6793 6.6793 6.8431 6.8431 6.9071 6.9071 6.9921 6.9921 7.0703 7.0703 7.1606 7.1606 7.2490 7.2490 7.2597 7.2597 7.3086 7.3086 7.4566 7.4566 7.5268 7.5268 7.7049 7.7049 7.7395 7.7395 7.9054 7.9054 7.9772 7.9772 8.2206 8.2206 8.9326 8.9326 9.0967 9.0967 9.3539 9.3539 9.4869 9.4869 9.5536 9.5536 9.9318 9.9318 10.5820 10.5820 11.5295 11.5295 11.6994 11.6994 12.0880 12.0880 12.2330 12.2330 12.4650 12.4650 12.7573 12.7573 12.7950 12.7950 13.2408 13.2408 13.2866 13.2866 k =-0.0310 0.0540 0.1012 ( 6593 PWs) bands (ev): -0.2012 -0.2012 1.8560 1.8560 2.3402 2.3402 3.7621 3.7621 4.6592 4.6592 4.7121 4.7121 5.4168 5.4168 6.0877 6.0877 6.2958 6.2958 6.3412 6.3412 6.5570 6.5570 6.6811 6.6811 6.8414 6.8414 6.9082 6.9082 6.9910 6.9910 7.0648 7.0648 7.1589 7.1589 7.2449 7.2449 7.2570 7.2570 7.3100 7.3100 7.4581 7.4581 7.5310 7.5310 7.7015 7.7015 7.7386 7.7386 7.9034 7.9034 7.9743 7.9743 8.2201 8.2201 8.8814 8.8814 9.0978 9.0978 9.2986 9.2986 9.4693 9.4693 9.5614 9.5614 9.9476 9.9476 10.6070 10.6070 11.5382 11.5382 11.7100 11.7100 12.0077 12.0077 12.1860 12.1860 12.3873 12.3873 12.7418 12.7418 12.8474 12.8474 13.2631 13.2631 13.2941 13.2941 k =-0.0372 0.0648 0.1214 ( 6599 PWs) bands (ev): -0.1848 -0.1848 1.8591 1.8591 2.3488 2.3488 3.7606 3.7606 4.6710 4.6710 4.7169 4.7169 5.4310 5.4310 6.0828 6.0828 6.2941 6.2941 6.3464 6.3464 6.5629 6.5629 6.6833 6.6833 6.8395 6.8395 6.9094 6.9094 6.9895 6.9895 7.0581 7.0581 7.1567 7.1567 7.2384 7.2384 7.2568 7.2568 7.3111 7.3111 7.4600 7.4600 7.5351 7.5351 7.6974 7.6974 7.7375 7.7375 7.9010 7.9010 7.9709 7.9709 8.2195 8.2195 8.8258 8.8258 9.0987 9.0987 9.2349 9.2349 9.4476 9.4476 9.5720 9.5720 9.9589 9.9589 10.6390 10.6390 11.5447 11.5447 11.7181 11.7181 11.9292 11.9292 12.1325 12.1325 12.3060 12.3060 12.6841 12.6841 12.9388 12.9388 13.2841 13.2841 13.3083 13.3083 k =-0.0434 0.0756 0.1417 ( 6601 PWs) bands (ev): -0.1654 -0.1654 1.8628 1.8628 2.3587 2.3587 3.7588 3.7588 4.6847 4.6847 4.7223 4.7223 5.4474 5.4474 6.0770 6.0770 6.2928 6.2928 6.3520 6.3520 6.5697 6.5697 6.6858 6.6858 6.8373 6.8373 6.9108 6.9108 6.9875 6.9875 7.0501 7.0501 7.1543 7.1543 7.2314 7.2314 7.2576 7.2576 7.3121 7.3121 7.4621 7.4621 7.5385 7.5385 7.6927 7.6927 7.7361 7.7361 7.8983 7.8983 7.9669 7.9669 8.2185 8.2185 8.7675 8.7675 9.0989 9.0989 9.1647 9.1647 9.4226 9.4226 9.5849 9.5849 9.9636 9.9636 10.6779 10.6779 11.5463 11.5463 11.7162 11.7162 11.8600 11.8600 12.0737 12.0737 12.2256 12.2256 12.6245 12.6245 13.0266 13.0266 13.3062 13.3062 13.3318 13.3318 k =-0.0496 0.0864 0.1619 ( 6605 PWs) bands (ev): -0.1432 -0.1432 1.8670 1.8670 2.3701 2.3701 3.7568 3.7568 4.7001 4.7001 4.7283 4.7283 5.4661 5.4661 6.0703 6.0703 6.2919 6.2919 6.3583 6.3583 6.5775 6.5775 6.6886 6.6886 6.8350 6.8350 6.9123 6.9123 6.9849 6.9849 7.0411 7.0411 7.1514 7.1514 7.2247 7.2247 7.2589 7.2589 7.3129 7.3129 7.4645 7.4645 7.5408 7.5408 7.6875 7.6875 7.7344 7.7344 7.8952 7.8952 7.9625 7.9625 8.2171 8.2171 8.7082 8.7082 9.0840 9.0840 9.1042 9.1042 9.3950 9.3950 9.5998 9.5998 9.9605 9.9605 10.7234 10.7234 11.5391 11.5391 11.6850 11.6850 11.8191 11.8191 12.0111 12.0111 12.1508 12.1508 12.5657 12.5657 13.1009 13.1009 13.3379 13.3379 13.3652 13.3652 k =-0.0558 0.0972 0.1821 ( 6605 PWs) bands (ev): -0.1180 -0.1180 1.8716 1.8716 2.3827 2.3827 3.7544 3.7544 4.7159 4.7159 4.7357 4.7357 5.4869 5.4869 6.0627 6.0627 6.2916 6.2916 6.3653 6.3653 6.5862 6.5862 6.6915 6.6915 6.8325 6.8325 6.9137 6.9137 6.9813 6.9813 7.0314 7.0314 7.1483 7.1483 7.2186 7.2186 7.2605 7.2605 7.3137 7.3137 7.4672 7.4672 7.5414 7.5414 7.6819 7.6819 7.7324 7.7324 7.8917 7.8917 7.9576 7.9576 8.2154 8.2154 8.6493 8.6493 9.0075 9.0075 9.1012 9.1012 9.3652 9.3652 9.6167 9.6167 9.9491 9.9491 10.7746 10.7746 11.5184 11.5184 11.6197 11.6197 11.8113 11.8113 11.9460 11.9460 12.0866 12.0866 12.5098 12.5098 13.1502 13.1502 13.3729 13.3729 13.3989 13.3989 k =-0.0620 0.1080 0.2024 ( 6621 PWs) bands (ev): -0.0901 -0.0901 1.8767 1.8767 2.3966 2.3966 3.7518 3.7518 4.7284 4.7284 4.7481 4.7481 5.5094 5.5094 6.0541 6.0541 6.2920 6.2920 6.3730 6.3730 6.5957 6.5957 6.6945 6.6945 6.8300 6.8300 6.9152 6.9152 6.9761 6.9761 7.0217 7.0217 7.1449 7.1449 7.2132 7.2132 7.2623 7.2623 7.3144 7.3144 7.4701 7.4701 7.5400 7.5400 7.6759 7.6759 7.7301 7.7301 7.8879 7.8879 7.9522 7.9522 8.2130 8.2130 8.5920 8.5920 8.9257 8.9257 9.1007 9.1007 9.3339 9.3339 9.6351 9.6351 9.9292 9.9292 10.8305 10.8305 11.4805 11.4805 11.5404 11.5404 11.8155 11.8155 11.8806 11.8806 12.0369 12.0369 12.4586 12.4586 13.1755 13.1755 13.3839 13.3839 13.4233 13.4233 k =-0.0681 0.1188 0.2226 ( 6625 PWs) bands (ev): -0.0593 -0.0593 1.8822 1.8822 2.4116 2.4116 3.7490 3.7490 4.7352 4.7352 4.7676 4.7676 5.5336 5.5336 6.0447 6.0447 6.2931 6.2931 6.3815 6.3815 6.6060 6.6060 6.6975 6.6975 6.8274 6.8274 6.9166 6.9166 6.9687 6.9687 7.0130 7.0130 7.1414 7.1414 7.2084 7.2084 7.2645 7.2645 7.3153 7.3153 7.4731 7.4731 7.5361 7.5361 7.6697 7.6697 7.7274 7.7274 7.8838 7.8838 7.9464 7.9464 8.2101 8.2101 8.5372 8.5372 8.8426 8.8426 9.1000 9.1000 9.3014 9.3014 9.6550 9.6550 9.9014 9.9014 10.8901 10.8901 11.4240 11.4240 11.4570 11.4570 11.8000 11.8000 11.8377 11.8377 12.0028 12.0028 12.4135 12.4135 13.1867 13.1867 13.3683 13.3683 13.4603 13.4603 k =-0.0743 0.1296 0.2428 ( 6625 PWs) bands (ev): -0.0257 -0.0257 1.8881 1.8881 2.4275 2.4275 3.7459 3.7459 4.7390 4.7390 4.7911 4.7911 5.5591 5.5591 6.0344 6.0344 6.2950 6.2950 6.3911 6.3911 6.6170 6.6170 6.7003 6.7003 6.8248 6.8248 6.9177 6.9177 6.9588 6.9588 7.0061 7.0061 7.1378 7.1378 7.2043 7.2043 7.2669 7.2669 7.3163 7.3163 7.4760 7.4760 7.5296 7.5296 7.6632 7.6632 7.7245 7.7245 7.8794 7.8794 7.9402 7.9402 8.2065 8.2065 8.4858 8.4858 8.7595 8.7595 9.0988 9.0988 9.2681 9.2681 9.6762 9.6762 9.8662 9.8662 10.9522 10.9522 11.3515 11.3515 11.3723 11.3723 11.7367 11.7367 11.8432 11.8432 11.9823 11.9823 12.3756 12.3756 13.1908 13.1908 13.3440 13.3440 13.5024 13.5024 k =-0.0805 0.1404 0.2631 ( 6621 PWs) bands (ev): 0.0106 0.0106 1.8944 1.8944 2.4444 2.4444 3.7425 3.7425 4.7408 4.7408 4.8171 4.8171 5.5855 5.5855 6.0235 6.0235 6.2978 6.2978 6.4018 6.4018 6.6285 6.6285 6.7027 6.7027 6.8220 6.8220 6.9179 6.9179 6.9472 6.9472 7.0011 7.0011 7.1342 7.1342 7.2008 7.2008 7.2696 7.2696 7.3176 7.3176 7.4780 7.4780 7.5208 7.5208 7.6567 7.6567 7.7213 7.7213 7.8747 7.8747 7.9334 7.9334 8.2022 8.2022 8.4386 8.4386 8.6773 8.6773 9.0971 9.0971 9.2343 9.2343 9.6984 9.6984 9.8243 9.8243 11.0160 11.0160 11.2676 11.2676 11.2870 11.2870 11.6687 11.6687 11.8535 11.8535 11.9709 11.9709 12.3456 12.3456 13.1911 13.1911 13.3176 13.3176 13.5486 13.5486 k =-0.0867 0.1512 0.2833 ( 6617 PWs) bands (ev): 0.0496 0.0496 1.9009 1.9009 2.4620 2.4620 3.7389 3.7389 4.7407 4.7407 4.8453 4.8453 5.6123 5.6123 6.0122 6.0122 6.3014 6.3014 6.4138 6.4138 6.6404 6.6404 6.7042 6.7042 6.8191 6.8191 6.9152 6.9152 6.9371 6.9371 6.9975 6.9975 7.1305 7.1305 7.1978 7.1978 7.2726 7.2726 7.3192 7.3192 7.4772 7.4772 7.5114 7.5114 7.6502 7.6502 7.7180 7.7180 7.8698 7.8698 7.9262 7.9262 8.1971 8.1971 8.3958 8.3958 8.5973 8.5973 9.0946 9.0946 9.2003 9.2003 9.7213 9.7213 9.7767 9.7767 11.0797 11.0797 11.1767 11.1767 11.2022 11.2022 11.6009 11.6009 11.8638 11.8638 11.9649 11.9649 12.3240 12.3240 13.1894 13.1894 13.2918 13.2918 13.5989 13.5989 k =-0.0929 0.1620 0.3036 ( 6619 PWs) bands (ev): 0.0912 0.0912 1.9077 1.9077 2.4801 2.4801 3.7350 3.7350 4.7386 4.7386 4.8756 4.8756 5.6388 5.6388 6.0007 6.0007 6.3057 6.3057 6.4273 6.4273 6.6525 6.6525 6.7045 6.7045 6.8158 6.8158 6.9065 6.9065 6.9327 6.9327 6.9950 6.9950 7.1268 7.1268 7.1952 7.1952 7.2759 7.2759 7.3211 7.3211 7.4693 7.4693 7.5060 7.5060 7.6437 7.6437 7.7144 7.7144 7.8646 7.8646 7.9185 7.9185 8.1909 8.1909 8.3574 8.3574 8.5208 8.5208 9.0914 9.0914 9.1664 9.1664 9.7242 9.7242 9.7446 9.7446 11.0751 11.0751 11.1180 11.1180 11.1499 11.1499 11.5342 11.5342 11.8735 11.8735 11.9610 11.9610 12.3108 12.3108 13.1864 13.1864 13.2679 13.2679 13.6529 13.6529 k =-0.0991 0.1728 0.3238 ( 6617 PWs) bands (ev): 0.1354 0.1354 1.9147 1.9147 2.4985 2.4985 3.7309 3.7309 4.7343 4.7343 4.9077 4.9077 5.6641 5.6641 5.9897 5.9897 6.3109 6.3109 6.4424 6.4424 6.6646 6.6646 6.7029 6.7029 6.8119 6.8119 6.8943 6.8943 6.9327 6.9327 6.9934 6.9934 7.1232 7.1232 7.1931 7.1931 7.2794 7.2794 7.3233 7.3233 7.4529 7.4529 7.5061 7.5061 7.6373 7.6373 7.7107 7.7107 7.8592 7.8592 7.9103 7.9103 8.1834 8.1834 8.3226 8.3226 8.4494 8.4494 9.0871 9.0871 9.1329 9.1329 9.6681 9.6681 9.7680 9.7680 10.9763 10.9763 11.0366 11.0366 11.2125 11.2125 11.4694 11.4694 11.8823 11.8823 11.9572 11.9572 12.3061 12.3061 13.1826 13.1826 13.2468 13.2468 13.7105 13.7105 k =-0.1053 0.1837 0.3440 ( 6609 PWs) bands (ev): 0.1821 0.1821 1.9218 1.9218 2.5171 2.5171 3.7266 3.7266 4.7278 4.7278 4.9418 4.9418 5.6868 5.6868 5.9801 5.9801 6.3166 6.3166 6.4592 6.4592 6.6764 6.6764 6.6984 6.6984 6.8073 6.8073 6.8829 6.8829 6.9344 6.9344 6.9928 6.9928 7.1197 7.1197 7.1912 7.1912 7.2831 7.2831 7.3260 7.3260 7.4311 7.4311 7.5092 7.5092 7.6312 7.6312 7.7068 7.7068 7.8536 7.8536 7.9016 7.9016 8.1738 8.1738 8.2893 8.2893 8.3863 8.3863 9.0806 9.0806 9.1010 9.1010 9.6094 9.6094 9.7912 9.7912 10.8745 10.8745 10.9565 10.9565 11.2753 11.2753 11.4075 11.4075 11.8900 11.8900 11.9523 11.9523 12.3097 12.3097 13.1782 13.1782 13.2291 13.2291 13.7709 13.7709 k =-0.1115 0.1945 0.3643 ( 6613 PWs) bands (ev): 0.2312 0.2312 1.9291 1.9291 2.5356 2.5356 3.7220 3.7220 4.7189 4.7189 4.9775 4.9775 5.7054 5.7054 5.9731 5.9731 6.3229 6.3229 6.4776 6.4776 6.6874 6.6874 6.6904 6.6904 6.8018 6.8018 6.8743 6.8743 6.9368 6.9368 6.9929 6.9929 7.1162 7.1162 7.1897 7.1897 7.2870 7.2870 7.3290 7.3290 7.4067 7.4067 7.5135 7.5135 7.6253 7.6253 7.7028 7.7028 7.8478 7.8478 7.8925 7.8925 8.1605 8.1605 8.2547 8.2547 8.3360 8.3360 9.0611 9.0611 9.0817 9.0817 9.5494 9.5494 9.8136 9.8136 10.7722 10.7722 10.8783 10.8783 11.3254 11.3254 11.3601 11.3601 11.8963 11.8963 11.9456 11.9456 12.3211 12.3211 13.1731 13.1731 13.2154 13.2154 13.8335 13.8335 k =-0.1177 0.2053 0.3845 ( 6625 PWs) bands (ev): 0.2826 0.2826 1.9365 1.9365 2.5536 2.5536 3.7173 3.7173 4.7078 4.7078 5.0150 5.0150 5.7177 5.7177 5.9701 5.9701 6.3297 6.3297 6.4975 6.4975 6.6777 6.6777 6.6981 6.6981 6.7963 6.7963 6.8692 6.8692 6.9399 6.9399 6.9941 6.9941 7.1128 7.1128 7.1884 7.1884 7.2910 7.2910 7.3320 7.3320 7.3816 7.3816 7.5183 7.5183 7.6197 7.6197 7.6987 7.6987 7.8416 7.8416 7.8829 7.8829 8.1395 8.1395 8.2201 8.2201 8.3009 8.3009 9.0297 9.0297 9.0737 9.0737 9.4894 9.4894 9.8347 9.8347 10.6702 10.6702 10.8021 10.8021 11.2857 11.2857 11.4044 11.4044 11.9009 11.9009 11.9369 11.9369 12.3401 12.3401 13.1678 13.1678 13.2058 13.2058 13.8969 13.8969 k =-0.1239 0.2161 0.4047 ( 6631 PWs) bands (ev): 0.3363 0.3363 1.9438 1.9438 2.5709 2.5709 3.7124 3.7124 4.6945 4.6945 5.0541 5.0541 5.7219 5.7219 5.9723 5.9723 6.3368 6.3368 6.5180 6.5180 6.6614 6.6614 6.7071 6.7071 6.7914 6.7914 6.8673 6.8673 6.9436 6.9436 6.9966 6.9966 7.1095 7.1095 7.1873 7.1873 7.2945 7.2945 7.3332 7.3332 7.3594 7.3594 7.5233 7.5233 7.6144 7.6144 7.6945 7.6945 7.8351 7.8351 7.8731 7.8731 8.1068 8.1068 8.1933 8.1933 8.2769 8.2769 8.9973 8.9973 9.0664 9.0664 9.4306 9.4306 9.8539 9.8539 10.5692 10.5692 10.7280 10.7280 11.2342 11.2342 11.4623 11.4623 11.9028 11.9028 11.9269 11.9269 12.3662 12.3662 13.1629 13.1629 13.1997 13.1997 13.9594 13.9594 k =-0.1301 0.2269 0.4250 ( 6635 PWs) bands (ev): 0.3920 0.3920 1.9512 1.9512 2.5872 2.5872 3.7074 3.7074 4.6793 4.6793 5.0947 5.0947 5.7174 5.7174 5.9799 5.9799 6.3442 6.3442 6.5369 6.5369 6.6441 6.6441 6.7146 6.7146 6.7877 6.7877 6.8679 6.8679 6.9479 6.9479 7.0005 7.0005 7.1063 7.1063 7.1863 7.1863 7.2956 7.2956 7.3250 7.3250 7.3504 7.3504 7.5285 7.5285 7.6096 7.6096 7.6901 7.6901 7.8280 7.8280 7.8630 7.8630 8.0663 8.0663 8.1754 8.1754 8.2590 8.2590 8.9649 8.9649 9.0588 9.0588 9.3743 9.3743 9.8707 9.8707 10.4698 10.4698 10.6560 10.6560 11.1866 11.1866 11.5186 11.5186 11.8990 11.8990 11.9187 11.9187 12.3989 12.3989 13.1594 13.1594 13.1965 13.1965 14.0184 14.0184 k =-0.1363 0.2377 0.4452 ( 6631 PWs) bands (ev): 0.4498 0.4498 1.9585 1.9585 2.6020 2.6020 3.7022 3.7022 4.6626 4.6626 5.1367 5.1367 5.7048 5.7048 5.9912 5.9912 6.3518 6.3518 6.5483 6.5483 6.6329 6.6329 6.7203 6.7203 6.7852 6.7852 6.8703 6.8703 6.9529 6.9529 7.0060 7.0060 7.1031 7.1031 7.1852 7.1852 7.2875 7.2875 7.3169 7.3169 7.3531 7.3531 7.5335 7.5335 7.6053 7.6053 7.6857 7.6857 7.8201 7.8201 7.8531 7.8531 8.0253 8.0253 8.1618 8.1618 8.2438 8.2438 8.9325 8.9325 9.0506 9.0506 9.3218 9.3218 9.8844 9.8844 10.3723 10.3723 10.5863 10.5863 11.1443 11.1443 11.5720 11.5720 11.8868 11.8868 11.9151 11.9151 12.4378 12.4378 13.1581 13.1581 13.1953 13.1953 14.0700 14.0701 k =-0.1425 0.2485 0.4655 ( 6623 PWs) bands (ev): 0.5095 0.5095 1.9657 1.9657 2.6149 2.6149 3.6968 3.6968 4.6448 4.6448 5.1802 5.1802 5.6852 5.6852 6.0041 6.0041 6.3595 6.3595 6.5432 6.5432 6.6379 6.6379 6.7238 6.7238 6.7834 6.7834 6.8741 6.8741 6.9586 6.9586 7.0133 7.0133 7.1001 7.1001 7.1838 7.1838 7.2709 7.2709 7.3179 7.3179 7.3584 7.3584 7.5383 7.5383 7.6017 7.6017 7.6810 7.6810 7.8110 7.8110 7.8437 7.8437 7.9879 7.9879 8.1500 8.1500 8.2296 8.2296 8.9002 8.9002 9.0422 9.0422 9.2742 9.2742 9.8942 9.8942 10.2773 10.2773 10.5188 10.5188 11.1081 11.1081 11.6221 11.6221 11.8697 11.8697 11.9127 11.9127 12.4824 12.4824 13.1593 13.1593 13.1958 13.1958 14.1095 14.1095 k =-0.1487 0.2593 0.4857 ( 6629 PWs) bands (ev): 0.5709 0.5709 1.9727 1.9727 2.6255 2.6255 3.6914 3.6914 4.6264 4.6264 5.2249 5.2249 5.6601 5.6601 6.0157 6.0157 6.3674 6.3674 6.5251 6.5251 6.6570 6.6570 6.7253 6.7253 6.7821 6.7821 6.8786 6.8786 6.9650 6.9650 7.0222 7.0222 7.0971 7.0971 7.1813 7.1813 7.2545 7.2545 7.3215 7.3215 7.3647 7.3647 7.5428 7.5428 7.5986 7.5986 7.6761 7.6761 7.8005 7.8005 7.8354 7.8354 7.9559 7.9559 8.1388 8.1388 8.2152 8.2152 8.8678 8.8678 9.0335 9.0335 9.2324 9.2324 9.8996 9.8996 10.1850 10.1850 10.4537 10.4537 11.0786 11.0786 11.6682 11.6682 11.8504 11.8504 11.9096 11.9096 12.5322 12.5322 13.1633 13.1633 13.1977 13.1977 14.1335 14.1336 k =-0.1549 0.2701 0.5059 ( 6641 PWs) bands (ev): 0.6339 0.6339 1.9796 1.9796 2.6333 2.6333 3.6859 3.6859 4.6082 4.6082 5.2708 5.2708 5.6306 5.6306 6.0236 6.0236 6.3754 6.3754 6.5038 6.5038 6.6818 6.6818 6.7247 6.7247 6.7811 6.7811 6.8837 6.8837 6.9722 6.9722 7.0324 7.0324 7.0942 7.0942 7.1774 7.1774 7.2420 7.2420 7.3254 7.3254 7.3716 7.3716 7.5469 7.5469 7.5962 7.5962 7.6710 7.6710 7.7892 7.7892 7.8284 7.8284 7.9302 7.9302 8.1279 8.1279 8.1998 8.1998 8.8353 8.8353 9.0248 9.0248 9.1974 9.1974 9.9000 9.9000 10.0959 10.0959 10.3909 10.3909 11.0565 11.0565 11.7097 11.7097 11.8298 11.8298 11.9051 11.9051 12.5867 12.5867 13.1699 13.1699 13.2009 13.2009 14.1444 14.1444 k =-0.1611 0.2809 0.5262 ( 6637 PWs) bands (ev): 0.6982 0.6982 1.9863 1.9863 2.6378 2.6378 3.6804 3.6804 4.5906 4.5906 5.3177 5.3177 5.5976 5.5976 6.0255 6.0255 6.3836 6.3836 6.4844 6.4844 6.7065 6.7065 6.7239 6.7239 6.7805 6.7805 6.8891 6.8891 6.9800 6.9800 7.0432 7.0432 7.0913 7.0913 7.1722 7.1722 7.2344 7.2344 7.3286 7.3286 7.3791 7.3791 7.5505 7.5505 7.5946 7.5946 7.6656 7.6656 7.7785 7.7785 7.8226 7.8226 7.9105 7.9105 8.1169 8.1169 8.1830 8.1830 8.8026 8.8026 9.0164 9.0164 9.1697 9.1697 9.8950 9.8950 10.0104 10.0104 10.3305 10.3305 11.0420 11.0420 11.7450 11.7450 11.8098 11.8098 11.8991 11.8991 12.6452 12.6452 13.1790 13.1790 13.2055 13.2055 14.1476 14.1476 k =-0.1673 0.2917 0.5464 ( 6631 PWs) bands (ev): 0.7637 0.7637 1.9928 1.9928 2.6386 2.6386 3.6749 3.6749 4.5745 4.5745 5.3655 5.3655 5.5615 5.5615 6.0198 6.0198 6.3919 6.3919 6.4697 6.4697 6.7130 6.7130 6.7389 6.7389 6.7806 6.7806 6.8947 6.8947 6.9887 6.9887 7.0536 7.0536 7.0885 7.0885 7.1673 7.1673 7.2310 7.2310 7.3304 7.3304 7.3872 7.3872 7.5537 7.5537 7.5936 7.5936 7.6601 7.6601 7.7695 7.7695 7.8179 7.8179 7.8966 7.8966 8.1059 8.1059 8.1646 8.1646 8.7695 8.7695 9.0081 9.0081 9.1497 9.1497 9.8846 9.8846 9.9289 9.9289 10.2725 10.2725 11.0352 11.0352 11.7653 11.7653 11.7992 11.7992 11.8915 11.8915 12.7073 12.7073 13.1897 13.1897 13.2119 13.2119 14.1475 14.1475 k =-0.1735 0.3025 0.5666 ( 6617 PWs) bands (ev): 0.8301 0.8301 1.9991 1.9991 2.6353 2.6353 3.6693 3.6693 4.5604 4.5604 5.4140 5.4140 5.5230 5.5230 6.0058 6.0058 6.4005 6.4005 6.4607 6.4607 6.7067 6.7067 6.7608 6.7608 6.7838 6.7838 6.9002 6.9002 6.9981 6.9981 7.0620 7.0620 7.0856 7.0856 7.1653 7.1653 7.2305 7.2305 7.3307 7.3307 7.3959 7.3959 7.5566 7.5566 7.5929 7.5929 7.6545 7.6545 7.7629 7.7629 7.8141 7.8141 7.8882 7.8882 8.0948 8.0948 8.1450 8.1450 8.7360 8.7360 9.0000 9.0000 9.1378 9.1378 9.8502 9.8502 9.8703 9.8703 10.2169 10.2169 11.0361 11.0361 11.7538 11.7538 11.8147 11.8147 11.8826 11.8826 12.7721 12.7721 13.2005 13.2005 13.2218 13.2218 14.1470 14.1470 k =-0.1797 0.3133 0.5869 ( 6609 PWs) bands (ev): 0.8970 0.8970 2.0054 2.0054 2.6273 2.6273 3.6638 3.6638 4.5490 4.5490 5.4617 5.4617 5.4839 5.4839 5.9839 5.9839 6.4093 6.4093 6.4573 6.4573 6.6975 6.6975 6.7708 6.7708 6.7985 6.7985 6.9055 6.9055 7.0082 7.0082 7.0670 7.0670 7.0825 7.0825 7.1686 7.1686 7.2317 7.2317 7.3294 7.3294 7.4054 7.4054 7.5591 7.5591 7.5923 7.5923 7.6492 7.6492 7.7588 7.7588 7.8112 7.8112 7.8854 7.8854 8.0837 8.0837 8.1246 8.1246 8.7021 8.7021 8.9917 8.9917 9.1339 9.1339 9.7776 9.7776 9.8495 9.8495 10.1638 10.1638 11.0442 11.0442 11.7331 11.7331 11.8331 11.8331 11.8729 11.8729 12.8385 12.8385 13.2095 13.2095 13.2370 13.2370 14.1472 14.1477 k =-0.1859 0.3241 0.6071 ( 6620 PWs) bands (ev): 0.9642 0.9642 2.0115 2.0115 2.6144 2.6144 3.6584 3.6584 4.5409 4.5409 5.4386 5.4386 5.5143 5.5143 5.9554 5.9554 6.4184 6.4184 6.4584 6.4584 6.6862 6.6862 6.7723 6.7723 6.8196 6.8196 6.9107 6.9107 7.0186 7.0186 7.0686 7.0686 7.0790 7.0790 7.1775 7.1775 7.2338 7.2338 7.3269 7.3269 7.4155 7.4155 7.5612 7.5612 7.5912 7.5912 7.6445 7.6445 7.7564 7.7564 7.8093 7.8093 7.8883 7.8883 8.0728 8.0728 8.1043 8.1043 8.6678 8.6678 8.9833 8.9833 9.1379 9.1379 9.7092 9.7092 9.8250 9.8250 10.1130 10.1130 11.0588 11.0588 11.7116 11.7116 11.8426 11.8426 11.8664 11.8664 12.9052 12.9052 13.2167 13.2167 13.2577 13.2577 14.1368 14.1368 k =-0.1920 0.3349 0.6274 ( 6620 PWs) bands (ev): 1.0312 1.0312 2.0178 2.0178 2.5964 2.5964 3.6530 3.6530 4.5365 4.5365 5.3948 5.3948 5.5642 5.5642 5.9220 5.9220 6.4277 6.4277 6.4627 6.4627 6.6730 6.6730 6.7722 6.7722 6.8398 6.8398 6.9158 6.9158 7.0290 7.0290 7.0681 7.0681 7.0753 7.0753 7.1904 7.1904 7.2364 7.2364 7.3242 7.3242 7.4261 7.4261 7.5627 7.5627 7.5896 7.5896 7.6406 7.6406 7.7550 7.7550 7.8087 7.8087 7.8966 7.8966 8.0627 8.0627 8.0851 8.0851 8.6331 8.6331 8.9747 8.9747 9.1491 9.1491 9.6456 9.6456 9.7971 9.7971 10.0646 10.0646 11.0794 11.0794 11.6906 11.6906 11.8360 11.8360 11.8691 11.8691 12.9701 12.9701 13.2230 13.2230 13.2838 13.2838 14.1006 14.1006 k =-0.1982 0.3457 0.6476 ( 6624 PWs) bands (ev): 1.0974 1.0974 2.0244 2.0244 2.5732 2.5732 3.6478 3.6478 4.5361 4.5361 5.3496 5.3496 5.6147 5.6147 5.8854 5.8854 6.4371 6.4371 6.4688 6.4688 6.6579 6.6579 6.7718 6.7718 6.8566 6.8566 6.9213 6.9213 7.0382 7.0382 7.0670 7.0670 7.0724 7.0724 7.2047 7.2047 7.2405 7.2405 7.3219 7.3219 7.4367 7.4367 7.5635 7.5635 7.5871 7.5871 7.6374 7.6374 7.7543 7.7543 7.8094 7.8094 7.9092 7.9092 8.0541 8.0541 8.0681 8.0681 8.5983 8.5983 8.9662 8.9662 9.1667 9.1667 9.5869 9.5869 9.7666 9.7666 10.0187 10.0187 11.1052 11.1052 11.6706 11.6706 11.8214 11.8214 11.8730 11.8730 13.0305 13.0305 13.2287 13.2287 13.3165 13.3165 14.0600 14.0600 k =-0.2044 0.3565 0.6678 ( 6626 PWs) bands (ev): 1.1624 1.1624 2.0316 2.0316 2.5447 2.5447 3.6427 3.6427 4.5399 4.5399 5.3036 5.3036 5.6651 5.6651 5.8471 5.8471 6.4466 6.4466 6.4756 6.4756 6.6412 6.6412 6.7713 6.7713 6.8688 6.8688 6.9283 6.9283 7.0445 7.0445 7.0659 7.0659 7.0720 7.0720 7.2161 7.2161 7.2489 7.2489 7.3207 7.3207 7.4469 7.4469 7.5635 7.5635 7.5835 7.5835 7.6351 7.6351 7.7547 7.7547 7.8115 7.8115 7.9233 7.9233 8.0476 8.0476 8.0557 8.0557 8.5635 8.5635 8.9579 8.9579 9.1898 9.1898 9.5332 9.5332 9.7340 9.7340 9.9752 9.9752 11.1354 11.1354 11.6519 11.6519 11.8038 11.8038 11.8731 11.8731 13.0830 13.0830 13.2340 13.2340 13.3577 13.3577 14.0174 14.0175 k =-0.2106 0.3673 0.6881 ( 6626 PWs) bands (ev): 1.2254 1.2254 2.0396 2.0396 2.5111 2.5111 3.6377 3.6377 4.5481 4.5481 5.2571 5.2571 5.7154 5.7154 5.8083 5.8083 6.4560 6.4560 6.4822 6.4822 6.6229 6.6229 6.7706 6.7706 6.8751 6.8751 6.9374 6.9374 7.0467 7.0467 7.0644 7.0644 7.0755 7.0755 7.2226 7.2226 7.2638 7.2638 7.3206 7.3206 7.4561 7.4561 7.5628 7.5628 7.5790 7.5790 7.6335 7.6335 7.7567 7.7567 7.8147 7.8147 7.9347 7.9347 8.0381 8.0381 8.0571 8.0571 8.5291 8.5291 8.9501 8.9501 9.2174 9.2174 9.4843 9.4843 9.7002 9.7002 9.9342 9.9342 11.1695 11.1695 11.6348 11.6348 11.7841 11.7841 11.8690 11.8690 13.1246 13.1246 13.2387 13.2387 13.4088 13.4088 13.9741 13.9741 k =-0.2168 0.3781 0.7083 ( 6638 PWs) bands (ev): 1.2855 1.2855 2.0491 2.0491 2.4727 2.4727 3.6329 3.6329 4.5605 4.5605 5.2106 5.2106 5.7601 5.7601 5.7753 5.7753 6.4652 6.4652 6.4880 6.4880 6.6034 6.6034 6.7699 6.7699 6.8758 6.8758 6.9485 6.9485 7.0457 7.0457 7.0637 7.0637 7.0803 7.0803 7.2273 7.2273 7.2825 7.2825 7.3213 7.3213 7.4630 7.4630 7.5617 7.5617 7.5738 7.5738 7.6323 7.6323 7.7612 7.7612 7.8191 7.8191 7.9400 7.9400 8.0282 8.0282 8.0723 8.0723 8.4954 8.4954 8.9429 8.9429 9.2487 9.2487 9.4403 9.4403 9.6658 9.6658 9.8956 9.8956 11.2068 11.2068 11.6196 11.6196 11.7626 11.7626 11.8610 11.8610 13.1541 13.1541 13.2427 13.2427 13.4695 13.4695 13.9311 13.9311 k =-0.2230 0.3889 0.7285 ( 6634 PWs) bands (ev): 1.3418 1.3418 2.0606 2.0606 2.4296 2.4296 3.6283 3.6283 4.5770 4.5770 5.1644 5.1644 5.7310 5.7310 5.8167 5.8167 6.4737 6.4737 6.4924 6.4924 6.5833 6.5833 6.7692 6.7692 6.8723 6.8723 6.9603 6.9603 7.0429 7.0429 7.0644 7.0644 7.0838 7.0838 7.2337 7.2337 7.3024 7.3024 7.3224 7.3224 7.4667 7.4667 7.5601 7.5601 7.5693 7.5693 7.6313 7.6313 7.7688 7.7688 7.8246 7.8246 7.9397 7.9397 8.0202 8.0202 8.0978 8.0978 8.4629 8.4629 8.9364 8.9364 9.2827 9.2827 9.4008 9.4008 9.6314 9.6314 9.8595 9.8595 11.2467 11.2467 11.6064 11.6064 11.7395 11.7395 11.8496 11.8496 13.1724 13.1724 13.2459 13.2459 13.5375 13.5375 13.8895 13.8895 k =-0.2292 0.3997 0.7488 ( 6644 PWs) bands (ev): 1.3932 1.3932 2.0748 2.0748 2.3824 2.3824 3.6240 3.6240 4.5973 4.5973 5.1189 5.1189 5.6957 5.6957 5.8656 5.8656 6.4801 6.4801 6.4950 6.4950 6.5642 6.5642 6.7683 6.7683 6.8657 6.8657 6.9716 6.9716 7.0391 7.0391 7.0666 7.0666 7.0846 7.0846 7.2432 7.2432 7.3206 7.3206 7.3252 7.3252 7.4656 7.4656 7.5568 7.5568 7.5680 7.5680 7.6305 7.6305 7.7798 7.7798 7.8311 7.8311 7.9364 7.9364 8.0148 8.0148 8.1299 8.1299 8.4319 8.4319 8.9307 8.9307 9.3186 9.3186 9.3657 9.3657 9.5975 9.5975 9.8259 9.8259 11.2889 11.2889 11.5953 11.5953 11.7150 11.7150 11.8355 11.8355 13.1808 13.1808 13.2480 13.2480 13.6096 13.6096 13.8505 13.8505 k =-0.2354 0.4105 0.7690 ( 6640 PWs) bands (ev): 1.4385 1.4385 2.0923 2.0923 2.3314 2.3314 3.6198 3.6198 4.6211 4.6211 5.0746 5.0746 5.6626 5.6626 5.9140 5.9140 6.4794 6.4794 6.4973 6.4973 6.5497 6.5497 6.7674 6.7674 6.8569 6.8569 6.9816 6.9816 7.0348 7.0348 7.0698 7.0698 7.0832 7.0832 7.2563 7.2563 7.3236 7.3236 7.3422 7.3422 7.4594 7.4594 7.5516 7.5516 7.5708 7.5708 7.6301 7.6301 7.7941 7.7941 7.8388 7.8388 7.9319 7.9319 8.0125 8.0125 8.1651 8.1651 8.4029 8.4029 8.9260 8.9260 9.3347 9.3347 9.3553 9.3553 9.5648 9.5648 9.7948 9.7948 11.3329 11.3329 11.5865 11.5865 11.6892 11.6892 11.8194 11.8194 13.1804 13.1804 13.2488 13.2488 13.6829 13.6829 13.8152 13.8152 k =-0.2416 0.4213 0.7893 ( 6640 PWs) bands (ev): 1.4767 1.4767 2.1138 2.1138 2.2770 2.2770 3.6160 3.6160 4.6482 4.6482 5.0319 5.0319 5.6322 5.6322 5.9614 5.9614 6.4659 6.4659 6.5008 6.5008 6.5434 6.5434 6.7663 6.7663 6.8464 6.8464 6.9890 6.9890 7.0310 7.0310 7.0725 7.0725 7.0814 7.0814 7.2720 7.2720 7.3247 7.3247 7.3600 7.3600 7.4485 7.4485 7.5461 7.5461 7.5761 7.5761 7.6303 7.6303 7.8114 7.8114 7.8476 7.8476 7.9271 7.9271 8.0137 8.0137 8.2014 8.2014 8.3764 8.3764 8.9222 8.9222 9.3076 9.3076 9.3916 9.3916 9.5339 9.5339 9.7662 9.7662 11.3782 11.3782 11.5802 11.5802 11.6626 11.6626 11.8023 11.8023 13.1720 13.1720 13.2479 13.2479 13.7547 13.7547 13.7848 13.7848 k =-0.2478 0.4321 0.8095 ( 6648 PWs) bands (ev): 1.5071 1.5071 2.1395 2.1395 2.2198 2.2198 3.6123 3.6123 4.6781 4.6781 4.9912 4.9912 5.6051 5.6051 6.0078 6.0078 6.4427 6.4427 6.5032 6.5032 6.5452 6.5452 6.7650 6.7650 6.8347 6.8347 6.9926 6.9926 7.0284 7.0284 7.0702 7.0702 7.0844 7.0844 7.2879 7.2879 7.3272 7.3272 7.3762 7.3762 7.4340 7.4340 7.5407 7.5407 7.5826 7.5826 7.6318 7.6318 7.8308 7.8308 7.8573 7.8573 7.9232 7.9232 8.0186 8.0186 8.2368 8.2368 8.3529 8.3529 8.9194 8.9194 9.2841 9.2841 9.4251 9.4251 9.5069 9.5069 9.7403 9.7403 11.4246 11.4246 11.5762 11.5762 11.6355 11.6355 11.7849 11.7849 13.1561 13.1561 13.2451 13.2451 13.7605 13.7605 13.8219 13.8219 k =-0.2540 0.4429 0.8297 ( 6632 PWs) bands (ev): 1.5294 1.5294 2.1602 2.1602 2.1693 2.1693 3.6090 3.6090 4.7104 4.7104 4.9531 4.9531 5.5816 5.5816 6.0529 6.0529 6.4137 6.4137 6.5037 6.5037 6.5516 6.5516 6.7635 6.7635 6.8221 6.8221 6.9917 6.9917 7.0276 7.0276 7.0644 7.0644 7.0913 7.0913 7.2990 7.2990 7.3352 7.3352 7.3905 7.3905 7.4174 7.4174 7.5361 7.5361 7.5896 7.5896 7.6351 7.6351 7.8505 7.8505 7.8671 7.8671 7.9228 7.9228 8.0269 8.0269 8.2687 8.2687 8.3341 8.3341 8.9177 8.9177 9.2641 9.2641 9.4455 9.4455 9.4936 9.4936 9.7171 9.7171 11.4715 11.4715 11.5745 11.5745 11.6090 11.6090 11.7682 11.7682 13.1331 13.1331 13.2396 13.2396 13.7432 13.7432 13.8806 13.8806 k =-0.2602 0.4537 0.8500 ( 6632 PWs) bands (ev): 1.5436 1.5436 2.0986 2.0986 2.2024 2.2024 3.6059 3.6059 4.7448 4.7448 4.9180 4.9180 5.5620 5.5620 6.0965 6.0965 6.3811 6.3811 6.5024 6.5024 6.5603 6.5603 6.7618 6.7618 6.8089 6.8089 6.9872 6.9872 7.0276 7.0276 7.0576 7.0576 7.0998 7.0998 7.3019 7.3019 7.3486 7.3486 7.4007 7.4007 7.4041 7.4041 7.5324 7.5324 7.5964 7.5964 7.6405 7.6405 7.8662 7.8662 7.8758 7.8758 7.9309 7.9309 8.0382 8.0382 8.2879 8.2879 8.3283 8.3283 8.9171 8.9171 9.2473 9.2473 9.4354 9.4354 9.5108 9.5108 9.6965 9.6965 11.5176 11.5176 11.5708 11.5708 11.5884 11.5884 11.7530 11.7530 13.1039 13.1039 13.2312 13.2312 13.7340 13.7340 13.9255 13.9255 k =-0.2664 0.4645 0.8702 ( 6624 PWs) bands (ev): 1.5504 1.5504 2.0354 2.0354 2.2379 2.2379 3.6030 3.6030 4.7809 4.7809 4.8864 4.8864 5.5465 5.5465 6.1386 6.1386 6.3460 6.3460 6.4996 6.4996 6.5702 6.5702 6.7596 6.7596 6.7952 6.7952 6.9807 6.9807 7.0273 7.0273 7.0505 7.0505 7.1095 7.1095 7.2995 7.2995 7.3562 7.3562 7.3894 7.3894 7.4199 7.4199 7.5301 7.5301 7.6034 7.6034 7.6480 7.6480 7.8699 7.8699 7.8886 7.8886 7.9504 7.9504 8.0521 8.0521 8.2834 8.2834 8.3460 8.3460 8.9175 8.9175 9.2335 9.2335 9.4154 9.4154 9.5377 9.5377 9.6786 9.6786 11.5452 11.5452 11.5649 11.5649 11.5920 11.5920 11.7405 11.7405 13.0688 13.0688 13.2196 13.2196 13.7333 13.7333 13.9518 13.9518 k =-0.2726 0.4753 0.8904 ( 6632 PWs) bands (ev): 1.5504 1.5504 1.9710 1.9710 2.2746 2.2746 3.6005 3.6005 4.8183 4.8183 4.8588 4.8588 5.5355 5.5355 6.1786 6.1786 6.3091 6.3091 6.4955 6.4955 6.5807 6.5807 6.7570 6.7570 6.7812 6.7812 6.9730 6.9730 7.0258 7.0258 7.0432 7.0432 7.1198 7.1198 7.2934 7.2934 7.3485 7.3485 7.3873 7.3873 7.4421 7.4421 7.5294 7.5294 7.6109 7.6109 7.6571 7.6571 7.8666 7.8666 7.9033 7.9033 7.9778 7.9778 8.0683 8.0683 8.2720 8.2720 8.3694 8.3694 8.9191 8.9191 9.2226 9.2226 9.3959 9.3959 9.5631 9.5631 9.6636 9.6636 11.5236 11.5236 11.5833 11.5833 11.6233 11.6233 11.7320 11.7320 13.0288 13.0288 13.2047 13.2047 13.7415 13.7415 13.9585 13.9585 k =-0.2726 0.4753 0.8904 ( 6632 PWs) bands (ev): 1.5504 1.5504 1.9710 1.9710 2.2746 2.2746 3.6005 3.6005 4.8183 4.8183 4.8588 4.8588 5.5355 5.5355 6.1786 6.1786 6.3091 6.3091 6.4955 6.4955 6.5807 6.5807 6.7570 6.7570 6.7812 6.7812 6.9730 6.9730 7.0258 7.0258 7.0432 7.0432 7.1198 7.1198 7.2934 7.2934 7.3485 7.3485 7.3873 7.3873 7.4421 7.4421 7.5294 7.5294 7.6109 7.6109 7.6571 7.6571 7.8666 7.8666 7.9033 7.9033 7.9778 7.9778 8.0683 8.0683 8.2720 8.2720 8.3694 8.3694 8.9191 8.9191 9.2226 9.2226 9.3959 9.3959 9.5631 9.5631 9.6636 9.6636 11.5236 11.5236 11.5833 11.5833 11.6233 11.6233 11.7320 11.7320 13.0288 13.0288 13.2047 13.2047 13.7415 13.7415 13.9585 13.9585 k =-0.2626 0.4579 0.9028 ( 6637 PWs) bands (ev): 1.5506 1.5506 1.9718 1.9718 2.2748 2.2748 3.5980 3.5980 4.8164 4.8164 4.8612 4.8612 5.5358 5.5358 6.1788 6.1788 6.3097 6.3097 6.4958 6.4958 6.5811 6.5811 6.7569 6.7569 6.7814 6.7814 6.9717 6.9717 7.0257 7.0257 7.0432 7.0432 7.1209 7.1209 7.2930 7.2930 7.3485 7.3485 7.3869 7.3869 7.4418 7.4418 7.5299 7.5299 7.6107 7.6107 7.6569 7.6569 7.8653 7.8653 7.9030 7.9030 7.9786 7.9786 8.0677 8.0677 8.2731 8.2731 8.3725 8.3725 8.9198 8.9198 9.2202 9.2202 9.3919 9.3919 9.5629 9.5629 9.6654 9.6654 11.5188 11.5188 11.5760 11.5760 11.6303 11.6303 11.7388 11.7388 13.0295 13.0295 13.2078 13.2078 13.7417 13.7417 13.9580 13.9580 k =-0.2525 0.4404 0.9152 ( 6631 PWs) bands (ev): 1.5511 1.5511 1.9742 1.9742 2.2753 2.2753 3.5907 3.5907 4.8107 4.8107 4.8682 4.8682 5.5369 5.5369 6.1796 6.1796 6.3114 6.3114 6.4967 6.4967 6.5823 6.5823 6.7564 6.7564 6.7820 6.7820 6.9679 6.9679 7.0254 7.0254 7.0434 7.0434 7.1241 7.1241 7.2919 7.2919 7.3486 7.3486 7.3856 7.3856 7.4411 7.4411 7.5314 7.5314 7.6103 7.6103 7.6562 7.6562 7.8615 7.8615 7.9022 7.9022 7.9809 7.9809 8.0660 8.0660 8.2765 8.2765 8.3816 8.3816 8.9218 8.9218 9.2130 9.2130 9.3800 9.3800 9.5625 9.5625 9.6705 9.6705 11.5071 11.5071 11.5580 11.5580 11.6475 11.6475 11.7567 11.7567 13.0314 13.0314 13.2170 13.2170 13.7427 13.7427 13.9565 13.9565 k =-0.2425 0.4229 0.9276 ( 6637 PWs) bands (ev): 1.5519 1.5519 1.9781 1.9781 2.2762 2.2762 3.5787 3.5787 4.8013 4.8013 4.8797 4.8797 5.5387 5.5387 6.1809 6.1809 6.3142 6.3142 6.4981 6.4981 6.5841 6.5841 6.7555 6.7555 6.7829 6.7829 6.9618 6.9618 7.0252 7.0252 7.0437 7.0437 7.1285 7.1285 7.2900 7.2900 7.3486 7.3486 7.3838 7.3838 7.4399 7.4399 7.5337 7.5337 7.6095 7.6095 7.6552 7.6552 7.8553 7.8553 7.9009 7.9009 7.9848 7.9848 8.0633 8.0633 8.2820 8.2820 8.3964 8.3964 8.9249 8.9249 9.2014 9.2014 9.3607 9.3607 9.5619 9.5619 9.6788 9.6788 11.4917 11.4917 11.5343 11.5343 11.6707 11.6707 11.7810 11.7810 13.0347 13.0347 13.2321 13.2321 13.7444 13.7444 13.9539 13.9539 k =-0.2325 0.4054 0.9400 ( 6641 PWs) bands (ev): 1.5530 1.5530 1.9836 1.9836 2.2775 2.2775 3.5627 3.5627 4.7883 4.7883 4.8950 4.8950 5.5415 5.5415 6.1827 6.1827 6.3180 6.3180 6.5001 6.5001 6.5867 6.5867 6.7540 6.7540 6.7842 6.7842 6.9540 6.9540 7.0252 7.0252 7.0444 7.0444 7.1334 7.1334 7.2871 7.2871 7.3484 7.3484 7.3818 7.3818 7.4384 7.4384 7.5367 7.5367 7.6083 7.6083 7.6541 7.6541 7.8470 7.8470 7.8992 7.8992 7.9905 7.9905 8.0598 8.0598 8.2895 8.2895 8.4162 8.4162 8.9287 8.9287 9.1858 9.1858 9.3347 9.3347 9.5611 9.5611 9.6898 9.6898 11.4745 11.4745 11.5081 11.5081 11.6978 11.6978 11.8085 11.8085 13.0394 13.0394 13.2527 13.2527 13.7473 13.7473 13.9502 13.9502 k =-0.2225 0.3880 0.9524 ( 6637 PWs) bands (ev): 1.5545 1.5545 1.9905 1.9905 2.2789 2.2789 3.5430 3.5430 4.7720 4.7720 4.9137 4.9137 5.5456 5.5456 6.1852 6.1852 6.3227 6.3227 6.5025 6.5025 6.5901 6.5901 6.7519 6.7519 6.7860 6.7860 6.9448 6.9448 7.0254 7.0254 7.0454 7.0454 7.1383 7.1383 7.2830 7.2830 7.3476 7.3476 7.3804 7.3804 7.4368 7.4368 7.5402 7.5402 7.6067 7.6067 7.6530 7.6530 7.8369 7.8369 7.8972 7.8972 7.9977 7.9977 8.0559 8.0559 8.2991 8.2991 8.4404 8.4404 8.9328 8.9328 9.1669 9.1669 9.3027 9.3027 9.5603 9.5603 9.7035 9.7035 11.4562 11.4562 11.4809 11.4809 11.7275 11.7275 11.8375 11.8375 13.0453 13.0453 13.2780 13.2780 13.7520 13.7520 13.9452 13.9452 k =-0.2125 0.3705 0.9648 ( 6645 PWs) bands (ev): 1.5561 1.5561 1.9990 1.9990 2.2806 2.2806 3.5202 3.5202 4.7525 4.7525 4.9349 4.9349 5.5510 5.5510 6.1881 6.1881 6.3281 6.3281 6.5053 6.5053 6.5940 6.5940 6.7488 6.7488 6.7882 6.7882 6.9350 6.9350 7.0258 7.0258 7.0468 7.0468 7.1425 7.1425 7.2776 7.2776 7.3457 7.3457 7.3804 7.3804 7.4351 7.4351 7.5438 7.5438 7.6046 7.6046 7.6524 7.6524 7.8255 7.8255 7.8950 7.8950 8.0058 8.0058 8.0521 8.0521 8.3106 8.3106 8.4680 8.4680 8.9364 8.9364 9.1453 9.1453 9.2656 9.2656 9.5596 9.5596 9.7195 9.7195 11.4366 11.4366 11.4539 11.4539 11.7591 11.7591 11.8669 11.8669 13.0526 13.0526 13.3071 13.3071 13.7591 13.7591 13.9390 13.9390 k =-0.2024 0.3530 0.9772 ( 6639 PWs) bands (ev): 1.5580 1.5580 2.0089 2.0089 2.2824 2.2824 3.4951 3.4951 4.7301 4.7301 4.9579 4.9579 5.5582 5.5582 6.1917 6.1917 6.3341 6.3341 6.5086 6.5086 6.5986 6.5986 6.7447 6.7447 6.7909 6.7909 6.9250 6.9250 7.0261 7.0261 7.0485 7.0485 7.1458 7.1458 7.2706 7.2706 7.3426 7.3426 7.3822 7.3822 7.4337 7.4337 7.5475 7.5475 7.6021 7.6021 7.6526 7.6526 7.8132 7.8132 7.8930 7.8930 8.0132 8.0132 8.0500 8.0500 8.3239 8.3239 8.4984 8.4984 8.9386 8.9386 9.1219 9.1219 9.2244 9.2244 9.5591 9.5591 9.7378 9.7378 11.4147 11.4147 11.4287 11.4287 11.7917 11.7917 11.8963 11.8963 13.0611 13.0611 13.3384 13.3384 13.7698 13.7698 13.9314 13.9314 k =-0.1924 0.3356 0.9896 ( 6641 PWs) bands (ev): 1.5601 1.5601 2.0202 2.0202 2.2842 2.2842 3.4683 3.4683 4.7053 4.7053 4.9820 4.9820 5.5675 5.5675 6.1959 6.1959 6.3406 6.3406 6.5121 6.5121 6.6038 6.6038 6.7394 6.7394 6.7941 6.7941 6.9152 6.9152 7.0259 7.0259 7.0506 7.0506 7.1478 7.1478 7.2617 7.2617 7.3386 7.3386 7.3858 7.3858 7.4325 7.4325 7.5510 7.5510 7.5991 7.5991 7.6538 7.6538 7.8003 7.8003 7.8914 7.8914 8.0164 8.0164 8.0529 8.0529 8.3391 8.3391 8.5309 8.5309 8.9384 8.9384 9.0976 9.0976 9.1801 9.1801 9.5590 9.5590 9.7582 9.7582 11.3899 11.3899 11.4064 11.4064 11.8247 11.8247 11.9251 11.9251 13.0709 13.0709 13.3701 13.3701 13.7855 13.7855 13.9226 13.9226 k =-0.1824 0.3181 1.0020 ( 6646 PWs) bands (ev): 1.5624 1.5624 2.0328 2.0328 2.2860 2.2860 3.4404 3.4404 4.6782 4.6782 5.0064 5.0064 5.5791 5.5791 6.2007 6.2007 6.3473 6.3473 6.5158 6.5158 6.6094 6.6094 6.7327 6.7327 6.7978 6.7978 6.9059 6.9059 7.0249 7.0249 7.0533 7.0533 7.1485 7.1485 7.2512 7.2512 7.3342 7.3342 7.3907 7.3907 7.4317 7.4317 7.5540 7.5540 7.5958 7.5958 7.6562 7.6562 7.7873 7.7873 7.8903 7.8903 8.0136 8.0136 8.0623 8.0623 8.3560 8.3560 8.5647 8.5647 8.9343 8.9343 9.0732 9.0732 9.1338 9.1338 9.5596 9.5596 9.7807 9.7807 11.3635 11.3635 11.3859 11.3859 11.8576 11.8576 11.9533 11.9533 13.0819 13.0819 13.3997 13.3997 13.8079 13.8079 13.9127 13.9127 k =-0.1724 0.3006 1.0144 ( 6642 PWs) bands (ev): 1.5647 1.5647 2.0466 2.0466 2.2875 2.2875 3.4119 3.4119 4.6493 4.6493 5.0306 5.0306 5.5932 5.5932 6.2060 6.2060 6.3541 6.3541 6.5196 6.5196 6.6153 6.6153 6.7247 6.7247 6.8018 6.8018 6.8974 6.8974 7.0227 7.0227 7.0566 7.0566 7.1477 7.1477 7.2394 7.2394 7.3297 7.3297 7.3963 7.3963 7.4314 7.4314 7.5562 7.5562 7.5928 7.5928 7.6599 7.6599 7.7744 7.7744 7.8902 7.8902 8.0070 8.0070 8.0758 8.0758 8.3745 8.3745 8.5991 8.5991 8.9251 8.9251 9.0492 9.0492 9.0873 9.0873 9.5611 9.5611 9.8050 9.8050 11.3370 11.3370 11.3662 11.3662 11.8896 11.8896 11.9805 11.9805 13.0940 13.0940 13.4250 13.4250 13.8376 13.8376 13.9023 13.9023 k =-0.1624 0.2831 1.0268 ( 6640 PWs) bands (ev): 1.5672 1.5672 2.0616 2.0616 2.2886 2.2886 3.3836 3.3836 4.6190 4.6190 5.0540 5.0540 5.6100 5.6100 6.2117 6.2117 6.3609 6.3609 6.5234 6.5234 6.6215 6.6215 6.7155 6.7155 6.8060 6.8060 6.8900 6.8900 7.0189 7.0189 7.0604 7.0604 7.1453 7.1453 7.2271 7.2271 7.3253 7.3253 7.4018 7.4018 7.4321 7.4321 7.5572 7.5572 7.5905 7.5905 7.6650 7.6650 7.7619 7.7619 7.8912 7.8912 7.9985 7.9985 8.0916 8.0916 8.3943 8.3943 8.6333 8.6333 8.9094 8.9094 9.0218 9.0218 9.0465 9.0465 9.5637 9.5637 9.8309 9.8309 11.3111 11.3111 11.3470 11.3470 11.9202 11.9202 12.0067 12.0067 13.1070 13.1070 13.4445 13.4445 13.8723 13.8723 13.8936 13.8936 k =-0.1523 0.2657 1.0392 ( 6632 PWs) bands (ev): 1.5696 1.5696 2.0777 2.0777 2.2892 2.2892 3.3558 3.3558 4.5875 4.5875 5.0762 5.0762 5.6295 5.6295 6.2179 6.2179 6.3675 6.3675 6.5271 6.5271 6.6277 6.6277 6.7055 6.7055 6.8102 6.8102 6.8837 6.8837 7.0131 7.0131 7.0648 7.0648 7.1410 7.1410 7.2155 7.2155 7.3211 7.3211 7.4061 7.4061 7.4342 7.4342 7.5569 7.5569 7.5892 7.5892 7.6715 7.6715 7.7499 7.7499 7.8938 7.8938 7.9890 7.9890 8.1084 8.1084 8.4153 8.4153 8.6663 8.6663 8.8872 8.8872 8.9823 8.9823 9.0212 9.0212 9.5675 9.5675 9.8583 9.8583 11.2862 11.2862 11.3283 11.3283 11.9489 11.9489 12.0319 12.0319 13.1208 13.1208 13.4576 13.4576 13.8761 13.8761 13.9185 13.9185 k =-0.1423 0.2482 1.0516 ( 6630 PWs) bands (ev): 1.5720 1.5720 2.0947 2.0947 2.2891 2.2891 3.3292 3.3292 4.5554 4.5554 5.0969 5.0969 5.6517 5.6517 6.2244 6.2244 6.3737 6.3737 6.5306 6.5306 6.6334 6.6334 6.6951 6.6951 6.8137 6.8137 6.8791 6.8791 7.0050 7.0050 7.0696 7.0696 7.1347 7.1347 7.2059 7.2059 7.3168 7.3168 7.4085 7.4085 7.4379 7.4379 7.5554 7.5554 7.5891 7.5891 7.6792 7.6792 7.7386 7.7386 7.8981 7.8981 7.9788 7.9788 8.1257 8.1257 8.4372 8.4372 8.6966 8.6966 8.8593 8.8593 8.9398 8.9398 9.0035 9.0035 9.5726 9.5726 9.8868 9.8868 11.2625 11.2625 11.3103 11.3103 11.9752 11.9752 12.0560 12.0560 13.1352 13.1352 13.4648 13.4648 13.8651 13.8651 13.9489 13.9489 k =-0.1323 0.2307 1.0640 ( 6628 PWs) bands (ev): 1.5742 1.5742 2.1126 2.1126 2.2882 2.2882 3.3041 3.3041 4.5230 4.5230 5.1159 5.1159 5.6764 5.6764 6.2311 6.2311 6.3794 6.3794 6.5338 6.5338 6.6375 6.6375 6.6858 6.6858 6.8158 6.8158 6.8767 6.8767 6.9944 6.9944 7.0746 7.0746 7.1265 7.1265 7.1988 7.1988 7.3124 7.3124 7.4090 7.4090 7.4428 7.4428 7.5532 7.5532 7.5899 7.5899 7.6879 7.6879 7.7282 7.7282 7.9045 7.9045 7.9684 7.9684 8.1430 8.1430 8.4598 8.4598 8.7215 8.7215 8.8273 8.8273 8.9020 8.9020 8.9873 8.9873 9.5787 9.5787 9.9162 9.9162 11.2402 11.2402 11.2930 11.2930 11.9988 11.9988 12.0790 12.0790 13.1499 13.1499 13.4673 13.4673 13.8535 13.8535 13.9521 13.9521 k =-0.1223 0.2133 1.0764 ( 6624 PWs) bands (ev): 1.5763 1.5763 2.1313 2.1313 2.2863 2.2863 3.2811 3.2811 4.4906 4.4906 5.1333 5.1333 5.7033 5.7033 6.2378 6.2378 6.3845 6.3845 6.5367 6.5367 6.6380 6.6380 6.6797 6.6797 6.8158 6.8158 6.8770 6.8770 6.9815 6.9815 7.0793 7.0793 7.1175 7.1175 7.1946 7.1946 7.3080 7.3080 7.4081 7.4081 7.4479 7.4479 7.5507 7.5507 7.5913 7.5913 7.6967 7.6967 7.7194 7.7194 7.9128 7.9128 7.9582 7.9582 8.1596 8.1596 8.4827 8.4827 8.7345 8.7345 8.7943 8.7943 8.8746 8.8746 8.9712 8.9712 9.5856 9.5856 9.9460 9.9460 11.2196 11.2196 11.2767 11.2767 12.0194 12.0194 12.1012 12.1012 13.1646 13.1646 13.4665 13.4665 13.8422 13.8422 13.9318 13.9318 k =-0.1123 0.1958 1.0887 ( 6613 PWs) bands (ev): 1.5781 1.5781 2.1505 2.1505 2.2832 2.2832 3.2604 3.2604 4.4587 4.4587 5.1491 5.1491 5.7319 5.7319 6.2443 6.2443 6.3888 6.3888 6.5391 6.5391 6.6328 6.6328 6.6791 6.6791 6.8132 6.8132 6.8802 6.8802 6.9664 6.9664 7.0827 7.0827 7.1094 7.1094 7.1926 7.1926 7.3033 7.3033 7.4062 7.4062 7.4526 7.4526 7.5486 7.5486 7.5931 7.5931 7.7016 7.7016 7.7161 7.7161 7.9219 7.9219 7.9502 7.9502 8.1748 8.1748 8.5055 8.5055 8.7247 8.7247 8.7657 8.7657 8.8647 8.8647 8.9547 8.9547 9.5929 9.5929 9.9759 9.9759 11.2007 11.2007 11.2613 11.2613 12.0368 12.0368 12.1225 12.1225 13.1791 13.1791 13.4640 13.4640 13.8312 13.8312 13.9030 13.9030 k =-0.1022 0.1783 1.1011 ( 6607 PWs) bands (ev): 1.5797 1.5797 2.1701 2.1701 2.2789 2.2789 3.2425 3.2425 4.4275 4.4275 5.1633 5.1633 5.7619 5.7619 6.2504 6.2504 6.3921 6.3921 6.5411 6.5411 6.6232 6.6232 6.6829 6.6829 6.8083 6.8083 6.8856 6.8856 6.9502 6.9502 7.0823 7.0823 7.1052 7.1052 7.1927 7.1927 7.2985 7.2985 7.4037 7.4037 7.4563 7.4563 7.5468 7.5468 7.5953 7.5953 7.6971 7.6971 7.7232 7.7232 7.9245 7.9245 7.9520 7.9520 8.1879 8.1879 8.5277 8.5277 8.6965 8.6965 8.7391 8.7391 8.8717 8.8717 8.9381 8.9381 9.6003 9.6003 10.0054 10.0054 11.1838 11.1838 11.2469 11.2469 12.0508 12.0508 12.1431 12.1431 13.1932 13.1932 13.4610 13.4610 13.8208 13.8208 13.8731 13.8731 k =-0.0922 0.1608 1.1135 ( 6604 PWs) bands (ev): 1.5808 1.5808 2.1901 2.1901 2.2732 2.2732 3.2276 3.2276 4.3975 4.3975 5.1762 5.1762 5.7926 5.7926 6.2557 6.2557 6.3943 6.3943 6.5425 6.5425 6.6117 6.6117 6.6890 6.6890 6.8016 6.8016 6.8919 6.8919 6.9344 6.9344 7.0766 7.0766 7.1062 7.1062 7.1943 7.1943 7.2936 7.2936 7.4008 7.4008 7.4589 7.4589 7.5453 7.5453 7.5977 7.5977 7.6905 7.6905 7.7334 7.7334 7.9173 7.9173 7.9669 7.9669 8.1976 8.1976 8.5485 8.5485 8.6643 8.6643 8.7109 8.7109 8.8862 8.8862 8.9221 8.9221 9.6072 9.6072 10.0341 10.0341 11.1687 11.1687 11.2332 11.2332 12.0616 12.0616 12.1632 12.1632 13.2065 13.2065 13.4588 13.4588 13.8106 13.8106 13.8447 13.8447 k =-0.0822 0.1434 1.1259 ( 6605 PWs) bands (ev): 1.5814 1.5814 2.2101 2.2101 2.2662 2.2662 3.2159 3.2159 4.3689 4.3689 5.1877 5.1877 5.8236 5.8236 6.2600 6.2600 6.3953 6.3953 6.5435 6.5435 6.5998 6.5998 6.6959 6.6959 6.7937 6.7937 6.8951 6.8951 6.9232 6.9232 7.0685 7.0685 7.1097 7.1097 7.1973 7.1973 7.2886 7.2886 7.3977 7.3977 7.4604 7.4604 7.5440 7.5440 7.6004 7.6004 7.6842 7.6842 7.7438 7.7438 7.9074 7.9074 7.9881 7.9881 8.2026 8.2026 8.5666 8.5666 8.6334 8.6334 8.6840 8.6840 8.9002 8.9002 8.9092 8.9092 9.6134 9.6134 10.0616 10.0616 11.1555 11.1555 11.2202 11.2202 12.0693 12.0693 12.1828 12.1828 13.2189 13.2189 13.4584 13.4584 13.7996 13.7996 13.8195 13.8195 k =-0.0822 0.1434 1.1259 ( 6605 PWs) bands (ev): 1.5814 1.5814 2.2101 2.2101 2.2662 2.2662 3.2159 3.2159 4.3689 4.3689 5.1877 5.1877 5.8236 5.8236 6.2600 6.2600 6.3953 6.3953 6.5435 6.5435 6.5998 6.5998 6.6959 6.6959 6.7937 6.7937 6.8951 6.8951 6.9232 6.9232 7.0685 7.0685 7.1097 7.1097 7.1973 7.1973 7.2886 7.2886 7.3977 7.3977 7.4604 7.4604 7.5440 7.5440 7.6004 7.6004 7.6842 7.6842 7.7438 7.7438 7.9074 7.9074 7.9881 7.9881 8.2026 8.2026 8.5666 8.5666 8.6334 8.6334 8.6840 8.6840 8.9002 8.9002 8.9092 8.9092 9.6134 9.6134 10.0616 10.0616 11.1555 11.1555 11.2202 11.2202 12.0693 12.0693 12.1828 12.1828 13.2189 13.2189 13.4584 13.4584 13.7996 13.7996 13.8195 13.8195 k =-0.0705 0.1229 1.1259 ( 6614 PWs) bands (ev): 1.5838 1.5838 2.2477 2.2477 2.2629 2.2629 3.2046 3.2046 4.3250 4.3250 5.1989 5.1989 5.8530 5.8530 6.2634 6.2634 6.3965 6.3965 6.5455 6.5455 6.5918 6.5918 6.7005 6.7005 6.7864 6.7864 6.8870 6.8870 6.9278 6.9278 7.0633 7.0633 7.1174 7.1174 7.2021 7.2021 7.2847 7.2847 7.3995 7.3995 7.4609 7.4609 7.5435 7.5435 7.6051 7.6051 7.6754 7.6754 7.7510 7.7510 7.8962 7.8962 8.0161 8.0161 8.1762 8.1762 8.5626 8.5626 8.6113 8.6113 8.6700 8.6700 8.8922 8.8922 8.9029 8.9029 9.6154 9.6154 10.0874 10.0874 11.1450 11.1450 11.2048 11.2048 12.0707 12.0707 12.2153 12.2153 13.2427 13.2427 13.4680 13.4680 13.7845 13.7845 13.8020 13.8020 k =-0.0587 0.1024 1.1259 ( 6616 PWs) bands (ev): 1.5856 1.5856 2.2600 2.2600 2.2815 2.2815 3.1950 3.1950 4.2858 4.2858 5.2092 5.2092 5.8801 5.8801 6.2668 6.2668 6.3951 6.3951 6.5475 6.5475 6.5846 6.5846 6.7053 6.7053 6.7790 6.7790 6.8745 6.8745 6.9383 6.9383 7.0565 7.0565 7.1239 7.1239 7.2086 7.2086 7.2808 7.2808 7.4010 7.4010 7.4600 7.4600 7.5423 7.5423 7.6105 7.6105 7.6690 7.6690 7.7582 7.7582 7.8855 7.8855 8.0467 8.0467 8.1518 8.1518 8.5556 8.5556 8.5851 8.5851 8.6606 8.6606 8.8844 8.8844 8.9012 8.9012 9.6167 9.6167 10.1106 10.1106 11.1366 11.1366 11.1905 11.1905 12.0717 12.0717 12.2448 12.2448 13.2651 13.2651 13.4776 13.4776 13.7671 13.7671 13.7862 13.7862 k =-0.0470 0.0819 1.1259 ( 6611 PWs) bands (ev): 1.5869 1.5869 2.2580 2.2580 2.3103 2.3103 3.1870 3.1870 4.2523 4.2523 5.2183 5.2183 5.9042 5.9042 6.2698 6.2698 6.3918 6.3918 6.5495 6.5495 6.5782 6.5782 6.7102 6.7102 6.7719 6.7719 6.8627 6.8627 6.9500 6.9500 7.0485 7.0485 7.1289 7.1289 7.2166 7.2166 7.2769 7.2769 7.4021 7.4021 7.4586 7.4586 7.5402 7.5402 7.6154 7.6154 7.6657 7.6657 7.7649 7.7649 7.8755 7.8755 8.0778 8.0778 8.1313 8.1313 8.5391 8.5391 8.5645 8.5645 8.6542 8.6542 8.8798 8.8798 8.9002 8.9002 9.6174 9.6174 10.1308 10.1308 11.1302 11.1302 11.1779 11.1779 12.0724 12.0724 12.2705 12.2705 13.2855 13.2855 13.4867 13.4867 13.7502 13.7502 13.7701 13.7701 k =-0.0352 0.0614 1.1259 ( 6615 PWs) bands (ev): 1.5878 1.5878 2.2564 2.2564 2.3335 2.3335 3.1808 3.1808 4.2252 4.2252 5.2257 5.2257 5.9245 5.9245 6.2722 6.2722 6.3876 6.3876 6.5514 6.5514 6.5727 6.5727 6.7150 6.7150 6.7652 6.7652 6.8531 6.8531 6.9617 6.9617 7.0398 7.0398 7.1324 7.1324 7.2254 7.2254 7.2725 7.2725 7.4024 7.4024 7.4574 7.4574 7.5375 7.5375 7.6190 7.6190 7.6652 7.6652 7.7710 7.7710 7.8666 7.8666 8.0978 8.0978 8.1251 8.1251 8.5108 8.5108 8.5557 8.5557 8.6499 8.6499 8.8775 8.8775 8.8995 8.8995 9.6177 9.6177 10.1472 10.1472 11.1254 11.1254 11.1673 11.1673 12.0730 12.0730 12.2914 12.2914 13.3035 13.3035 13.4946 13.4946 13.7334 13.7334 13.7555 13.7555 k =-0.0235 0.0410 1.1259 ( 6609 PWs) bands (ev): 1.5884 1.5884 2.2553 2.2553 2.3507 2.3507 3.1764 3.1764 4.2053 4.2053 5.2313 5.2313 5.9400 5.9400 6.2737 6.2737 6.3836 6.3836 6.5531 6.5531 6.5686 6.5686 6.7194 6.7194 6.7595 6.7595 6.8460 6.8460 6.9726 6.9726 7.0310 7.0310 7.1347 7.1347 7.2343 7.2343 7.2677 7.2677 7.4023 7.4023 7.4568 7.4568 7.5347 7.5347 7.6209 7.6209 7.6666 7.6666 7.7762 7.7762 7.8593 7.8593 8.0912 8.0912 8.1466 8.1466 8.4823 8.4823 8.5509 8.5509 8.6471 8.6471 8.8768 8.8768 8.8989 8.8989 9.6177 9.6177 10.1594 10.1594 11.1222 11.1222 11.1593 11.1593 12.0734 12.0734 12.3070 12.3070 13.3178 13.3178 13.5006 13.5006 13.7175 13.7175 13.7449 13.7449 k =-0.0117 0.0205 1.1259 ( 6614 PWs) bands (ev): 1.5888 1.5888 2.2547 2.2547 2.3612 2.3612 3.1737 3.1737 4.1931 4.1931 5.2347 5.2347 5.9498 5.9498 6.2746 6.2746 6.3807 6.3807 6.5544 6.5544 6.5657 6.5657 6.7228 6.7228 6.7553 6.7553 6.8417 6.8417 6.9815 6.9815 7.0233 7.0233 7.1359 7.1359 7.2422 7.2422 7.2625 7.2625 7.4020 7.4020 7.4566 7.4566 7.5327 7.5327 7.6218 7.6218 7.6682 7.6682 7.7797 7.7797 7.8544 7.8544 8.0836 8.0836 8.1666 8.1666 8.4611 8.4611 8.5482 8.5482 8.6455 8.6455 8.8766 8.8766 8.8985 8.8985 9.6177 9.6177 10.1669 10.1669 11.1204 11.1204 11.1544 11.1544 12.0736 12.0736 12.3165 12.3165 13.3272 13.3272 13.5044 13.5044 13.7058 13.7058 13.7390 13.7390 k = 0.0000 0.0000 1.1259 ( 6608 PWs) bands (ev): 1.5889 1.5889 2.2545 2.2545 2.3647 2.3647 3.1728 3.1728 4.1890 4.1890 5.2359 5.2359 5.9531 5.9531 6.2748 6.2748 6.3797 6.3797 6.5550 6.5550 6.5647 6.5647 6.7241 6.7241 6.7536 6.7536 6.8402 6.8402 6.9854 6.9854 7.0199 7.0199 7.1363 7.1363 7.2463 7.2463 7.2594 7.2594 7.4018 7.4018 7.4565 7.4565 7.5320 7.5320 7.6220 7.6220 7.6690 7.6690 7.7810 7.7810 7.8527 7.8527 8.0808 8.0808 8.1743 8.1743 8.4531 8.4531 8.5473 8.5473 8.6450 8.6450 8.8766 8.8766 8.8984 8.8984 9.6176 9.6176 10.1694 10.1694 11.1198 11.1198 11.1527 11.1527 12.0736 12.0736 12.3197 12.3197 13.3305 13.3305 13.5057 13.5057 13.7014 13.7014 13.7371 13.7371 k = 0.0000 0.0000 1.1259 ( 6608 PWs) bands (ev): 1.5889 1.5889 2.2545 2.2545 2.3647 2.3647 3.1728 3.1728 4.1890 4.1890 5.2359 5.2359 5.9531 5.9531 6.2748 6.2748 6.3797 6.3797 6.5550 6.5550 6.5647 6.5647 6.7241 6.7241 6.7536 6.7536 6.8402 6.8402 6.9854 6.9854 7.0199 7.0199 7.1363 7.1363 7.2463 7.2463 7.2594 7.2594 7.4018 7.4018 7.4565 7.4565 7.5320 7.5320 7.6220 7.6220 7.6690 7.6690 7.7810 7.7810 7.8527 7.8527 8.0808 8.0808 8.1743 8.1743 8.4531 8.4531 8.5473 8.5473 8.6450 8.6450 8.8766 8.8766 8.8984 8.8984 9.6176 9.6176 10.1694 10.1694 11.1198 11.1198 11.1527 11.1527 12.0736 12.0736 12.3197 12.3197 13.3305 13.3305 13.5057 13.5057 13.7014 13.7014 13.7371 13.7371 k = 0.0208 0.0119 1.1259 ( 6616 PWs) bands (ev): 1.5889 1.5889 2.2541 2.2541 2.3650 2.3650 3.1730 3.1730 4.1878 4.1878 5.2381 5.2381 5.9520 5.9520 6.2768 6.2768 6.3791 6.3791 6.5545 6.5545 6.5652 6.5652 6.7206 6.7206 6.7551 6.7551 6.8422 6.8422 6.9839 6.9839 7.0203 7.0203 7.1362 7.1362 7.2459 7.2459 7.2594 7.2594 7.4015 7.4015 7.4563 7.4563 7.5318 7.5318 7.6219 7.6219 7.6689 7.6689 7.7811 7.7811 7.8529 7.8529 8.0764 8.0764 8.1751 8.1751 8.4567 8.4567 8.5472 8.5472 8.6437 8.6437 8.8732 8.8732 8.9051 8.9051 9.6201 9.6201 10.1670 10.1670 11.0994 11.0994 11.1714 11.1714 12.0735 12.0735 12.3198 12.3198 13.3306 13.3306 13.5045 13.5045 13.7025 13.7025 13.7322 13.7322 k = 0.0417 0.0239 1.1259 ( 6614 PWs) bands (ev): 1.5890 1.5890 2.2532 2.2532 2.3660 2.3660 3.1737 3.1737 4.1844 4.1844 5.2446 5.2446 5.9488 5.9488 6.2825 6.2825 6.3774 6.3774 6.5534 6.5534 6.5663 6.5663 6.7115 6.7115 6.7584 6.7584 6.8478 6.8478 6.9797 6.9797 7.0214 7.0214 7.1357 7.1357 7.2449 7.2449 7.2593 7.2593 7.4004 7.4004 7.4555 7.4555 7.5310 7.5310 7.6216 7.6216 7.6689 7.6689 7.7813 7.7813 7.8539 7.8539 8.0641 8.0641 8.1776 8.1776 8.4665 8.4665 8.5469 8.5469 8.6399 8.6399 8.8676 8.8676 8.9201 8.9201 9.6274 9.6274 10.1597 10.1597 11.0673 11.0673 11.1988 11.1988 12.0730 12.0730 12.3202 12.3202 13.3307 13.3307 13.5010 13.5010 13.7047 13.7047 13.7232 13.7232 k = 0.0625 0.0358 1.1259 ( 6612 PWs) bands (ev): 1.5891 1.5891 2.2516 2.2516 2.3675 2.3675 3.1746 3.1746 4.1789 4.1789 5.2549 5.2549 5.9439 5.9439 6.2913 6.2913 6.3749 6.3749 6.5519 6.5519 6.5679 6.5679 6.6988 6.6988 6.7628 6.7628 6.8558 6.8558 6.9731 6.9731 7.0227 7.0227 7.1350 7.1350 7.2434 7.2434 7.2591 7.2591 7.3988 7.3988 7.4544 7.4544 7.5297 7.5297 7.6214 7.6214 7.6687 7.6687 7.7815 7.7815 7.8552 7.8552 8.0464 8.0464 8.1818 8.1818 8.4800 8.4800 8.5464 8.5464 8.6339 8.6339 8.8628 8.8628 8.9402 8.9402 9.6393 9.6393 10.1478 10.1478 11.0332 11.0332 11.2252 11.2252 12.0722 12.0722 12.3208 12.3208 13.3310 13.3310 13.4954 13.4954 13.7012 13.7012 13.7209 13.7209 k = 0.0833 0.0478 1.1259 ( 6614 PWs) bands (ev): 1.5892 1.5892 2.2497 2.2497 2.3694 2.3694 3.1759 3.1759 4.1719 4.1719 5.2683 5.2683 5.9377 5.9377 6.3022 6.3022 6.3723 6.3723 6.5501 6.5501 6.5696 6.5696 6.6839 6.6839 6.7682 6.7682 6.8650 6.8650 6.9646 6.9646 7.0237 7.0237 7.1340 7.1340 7.2416 7.2416 7.2587 7.2587 7.3967 7.3967 7.4529 7.4529 7.5279 7.5279 7.6214 7.6214 7.6683 7.6683 7.7819 7.7819 7.8568 7.8568 8.0259 8.0259 8.1874 8.1874 8.4949 8.4949 8.5458 8.5458 8.6260 8.6260 8.8592 8.8592 8.9642 8.9642 9.6557 9.6557 10.1314 10.1314 10.9987 10.9987 11.2496 11.2496 12.0712 12.0712 12.3215 12.3215 13.3312 13.3312 13.4881 13.4881 13.6910 13.6910 13.7279 13.7279 k = 0.1042 0.0597 1.1259 ( 6614 PWs) bands (ev): 1.5894 1.5894 2.2475 2.2475 2.3715 2.3715 3.1774 3.1774 4.1639 4.1639 5.2841 5.2841 5.9310 5.9310 6.3133 6.3133 6.3709 6.3709 6.5481 6.5481 6.5712 6.5712 6.6676 6.6676 6.7745 6.7745 6.8748 6.8748 6.9545 6.9545 7.0243 7.0243 7.1330 7.1330 7.2396 7.2396 7.2582 7.2582 7.3942 7.3942 7.4513 7.4513 7.5256 7.5256 7.6219 7.6219 7.6677 7.6677 7.7823 7.7823 7.8582 7.8582 8.0051 8.0051 8.1944 8.1944 8.5087 8.5087 8.5451 8.5451 8.6171 8.6171 8.8564 8.8564 8.9912 8.9912 9.6760 9.6760 10.1110 10.1110 10.9647 10.9647 11.2715 11.2715 12.0702 12.0702 12.3222 12.3222 13.3316 13.3316 13.4796 13.4796 13.6800 13.6800 13.7381 13.7381 k = 0.1250 0.0717 1.1259 ( 6614 PWs) bands (ev): 1.5896 1.5896 2.2453 2.2453 2.3737 2.3737 3.1791 3.1791 4.1555 4.1555 5.3010 5.3010 5.9240 5.9240 6.3219 6.3219 6.3735 6.3735 6.5457 6.5457 6.5727 6.5727 6.6507 6.6507 6.7819 6.7819 6.8844 6.8844 6.9430 6.9430 7.0244 7.0244 7.1319 7.1319 7.2376 7.2376 7.2576 7.2576 7.3916 7.3916 7.4496 7.4496 7.5228 7.5228 7.6229 7.6229 7.6667 7.6667 7.7829 7.7829 7.8593 7.8593 7.9858 7.9858 8.2023 8.2023 8.5198 8.5198 8.5447 8.5447 8.6078 8.6078 8.8542 8.8542 9.0199 9.0199 9.6999 9.6999 10.0869 10.0869 10.9321 10.9321 11.2908 11.2908 12.0691 12.0691 12.3230 12.3230 13.3320 13.3320 13.4705 13.4705 13.6700 13.6700 13.7496 13.7496 k = 0.1458 0.0836 1.1259 ( 6614 PWs) bands (ev): 1.5898 1.5898 2.2431 2.2431 2.3758 2.3758 3.1807 3.1807 4.1472 4.1472 5.3181 5.3181 5.9175 5.9175 6.3251 6.3251 6.3824 6.3824 6.5427 6.5427 6.5740 6.5740 6.6339 6.6339 6.7904 6.7904 6.8931 6.8931 6.9304 6.9304 7.0239 7.0239 7.1310 7.1310 7.2357 7.2357 7.2568 7.2568 7.3890 7.3890 7.4479 7.4479 7.5199 7.5199 7.6244 7.6244 7.6655 7.6655 7.7835 7.7835 7.8597 7.8597 7.9692 7.9692 8.2107 8.2107 8.5261 8.5261 8.5461 8.5461 8.5991 8.5991 8.8526 8.8526 9.0485 9.0485 9.7270 9.7270 10.0597 10.0597 10.9019 10.9019 11.3073 11.3073 12.0682 12.0682 12.3237 12.3237 13.3324 13.3324 13.4613 13.4613 13.6612 13.6612 13.7613 13.7613 k = 0.1667 0.0956 1.1259 ( 6610 PWs) bands (ev): 1.5899 1.5899 2.2411 2.2411 2.3778 2.3778 3.1822 3.1822 4.1395 4.1395 5.3341 5.3341 5.9116 5.9116 6.3238 6.3238 6.3967 6.3967 6.5385 6.5385 6.5749 6.5749 6.6182 6.6182 6.8000 6.8000 6.9001 6.9001 6.9178 6.9178 7.0230 7.0230 7.1302 7.1302 7.2341 7.2341 7.2560 7.2560 7.3866 7.3866 7.4464 7.4464 7.5170 7.5170 7.6264 7.6264 7.6639 7.6639 7.7841 7.7841 7.8593 7.8593 7.9559 7.9559 8.2191 8.2191 8.5269 8.5269 8.5495 8.5495 8.5919 8.5919 8.8513 8.8513 9.0753 9.0753 9.7566 9.7566 10.0297 10.0297 10.8752 10.8752 11.3210 11.3210 12.0673 12.0673 12.3243 12.3243 13.3328 13.3328 13.4528 13.4528 13.6540 13.6540 13.7722 13.7722 k = 0.1875 0.1075 1.1259 ( 6606 PWs) bands (ev): 1.5901 1.5901 2.2395 2.2395 2.3794 2.3794 3.1836 3.1836 4.1331 4.1331 5.3480 5.3480 5.9068 5.9068 6.3206 6.3206 6.4134 6.4134 6.5327 6.5327 6.5754 6.5754 6.6049 6.6049 6.8106 6.8106 6.8984 6.8984 6.9122 6.9122 7.0220 7.0220 7.1295 7.1295 7.2327 7.2327 7.2553 7.2553 7.3845 7.3845 7.4451 7.4451 7.5145 7.5145 7.6285 7.6285 7.6623 7.6623 7.7847 7.7847 7.8583 7.8583 7.9461 7.9461 8.2268 8.2268 8.5246 8.5246 8.5531 8.5531 8.5870 8.5870 8.8504 8.8504 9.0983 9.0983 9.7883 9.7883 9.9978 9.9978 10.8530 10.8530 11.3318 11.3318 12.0667 12.0667 12.3247 12.3247 13.3332 13.3332 13.4454 13.4454 13.6483 13.6483 13.7816 13.7816 k = 0.2083 0.1195 1.1259 ( 6606 PWs) bands (ev): 1.5902 1.5902 2.2382 2.2382 2.3806 2.3806 3.1846 3.1846 4.1282 4.1282 5.3587 5.3587 5.9032 5.9032 6.3174 6.3174 6.4301 6.4301 6.5248 6.5248 6.5752 6.5752 6.5955 6.5955 6.8218 6.8218 6.8862 6.8862 6.9156 6.9156 7.0209 7.0209 7.1291 7.1291 7.2317 7.2317 7.2548 7.2548 7.3829 7.3829 7.4441 7.4441 7.5125 7.5125 7.6305 7.6305 7.6607 7.6607 7.7852 7.7852 7.8569 7.8569 7.9396 7.9396 8.2330 8.2330 8.5213 8.5213 8.5554 8.5554 8.5842 8.5842 8.8498 8.8498 9.1161 9.1161 9.8214 9.8214 9.9644 9.9644 10.8363 10.8363 11.3395 11.3395 12.0662 12.0662 12.3251 12.3251 13.3334 13.3334 13.4397 13.4397 13.6443 13.6443 13.7889 13.7889 k = 0.2292 0.1314 1.1259 ( 6604 PWs) bands (ev): 1.5903 1.5903 2.2375 2.2375 2.3813 2.3813 3.1852 3.1852 4.1251 4.1251 5.3655 5.3655 5.9010 5.9010 6.3151 6.3151 6.4439 6.4439 6.5165 6.5165 6.5745 6.5745 6.5905 6.5905 6.8324 6.8324 6.8741 6.8741 6.9185 6.9185 7.0201 7.0201 7.1288 7.1288 7.2311 7.2311 7.2544 7.2544 7.3819 7.3819 7.4435 7.4435 7.5113 7.5113 7.6320 7.6320 7.6595 7.6595 7.7856 7.7856 7.8559 7.8559 7.9360 7.9360 8.2371 8.2371 8.5187 8.5187 8.5565 8.5565 8.5830 8.5830 8.8494 8.8494 9.1273 9.1273 9.8547 9.8547 9.9309 9.9309 10.8259 10.8259 11.3441 11.3441 12.0659 12.0659 12.3253 12.3253 13.3336 13.3336 13.4361 13.4361 13.6418 13.6418 13.7934 13.7934 k = 0.2500 0.1434 1.1259 ( 6600 PWs) bands (ev): 1.5903 1.5903 2.2372 2.2372 2.3816 2.3816 3.1855 3.1855 4.1241 4.1241 5.3678 5.3678 5.9002 5.9002 6.3143 6.3143 6.4497 6.4497 6.5125 6.5125 6.5741 6.5741 6.5891 6.5891 6.8379 6.8379 6.8681 6.8681 6.9195 6.9195 7.0198 7.0198 7.1287 7.1287 7.2309 7.2309 7.2543 7.2543 7.3816 7.3816 7.4434 7.4434 7.5109 7.5109 7.6326 7.6326 7.6591 7.6591 7.7857 7.7857 7.8554 7.8554 7.9348 7.9348 8.2385 8.2385 8.5177 8.5177 8.5569 8.5569 8.5827 8.5827 8.8493 8.8493 9.1311 9.1311 9.8784 9.8784 9.9072 9.9072 10.8224 10.8224 11.3457 11.3457 12.0659 12.0659 12.3253 12.3253 13.3337 13.3337 13.4348 13.4348 13.6410 13.6410 13.7950 13.7950 k = 0.2500 0.1434 1.1259 ( 6600 PWs) bands (ev): 1.5903 1.5903 2.2372 2.2372 2.3816 2.3816 3.1855 3.1855 4.1241 4.1241 5.3678 5.3678 5.9002 5.9002 6.3143 6.3143 6.4497 6.4497 6.5125 6.5125 6.5741 6.5741 6.5891 6.5891 6.8379 6.8379 6.8681 6.8681 6.9195 6.9195 7.0198 7.0198 7.1287 7.1287 7.2309 7.2309 7.2543 7.2543 7.3816 7.3816 7.4434 7.4434 7.5109 7.5109 7.6326 7.6326 7.6591 7.6591 7.7857 7.7857 7.8554 7.8554 7.9348 7.9348 8.2385 8.2385 8.5177 8.5177 8.5569 8.5569 8.5827 8.5827 8.8493 8.8493 9.1311 9.1311 9.8784 9.8784 9.9072 9.9072 10.8224 10.8224 11.3457 11.3457 12.0659 12.0659 12.3253 12.3253 13.3337 13.3337 13.4348 13.4348 13.6410 13.6410 13.7950 13.7950 k = 0.2400 0.1608 1.1136 ( 6604 PWs) bands (ev): 1.5900 1.5900 2.2364 2.2364 2.3809 2.3809 3.1872 3.1872 4.1260 4.1260 5.3670 5.3670 5.8978 5.8978 6.3130 6.3130 6.4496 6.4496 6.5138 6.5138 6.5731 6.5731 6.5918 6.5918 6.8364 6.8364 6.8645 6.8645 6.9236 6.9236 7.0218 7.0218 7.1284 7.1284 7.2284 7.2284 7.2567 7.2567 7.3823 7.3823 7.4435 7.4435 7.5106 7.5106 7.6323 7.6323 7.6588 7.6588 7.7859 7.7859 7.8531 7.8531 7.9380 7.9380 8.2317 8.2317 8.5193 8.5193 8.5571 8.5571 8.5855 8.5855 8.8491 8.8491 9.1342 9.1342 9.8768 9.8768 9.9063 9.9063 10.8218 10.8218 11.3460 11.3460 12.0651 12.0651 12.3249 12.3249 13.3327 13.3327 13.4367 13.4367 13.6431 13.6431 13.7955 13.7955 k = 0.2300 0.1782 1.1012 ( 6606 PWs) bands (ev): 1.5893 1.5893 2.2341 2.2341 2.3790 2.3790 3.1924 3.1924 4.1314 4.1314 5.3646 5.3646 5.8906 5.8906 6.3094 6.3094 6.4494 6.4494 6.5175 6.5175 6.5713 6.5713 6.5986 6.5986 6.8320 6.8320 6.8559 6.8559 6.9332 6.9332 7.0274 7.0274 7.1276 7.1276 7.2230 7.2230 7.2620 7.2620 7.3845 7.3845 7.4438 7.4438 7.5100 7.5100 7.6313 7.6313 7.6580 7.6580 7.7862 7.7862 7.8469 7.8469 7.9468 7.9468 8.2133 8.2133 8.5227 8.5227 8.5514 8.5514 8.6004 8.6004 8.8481 8.8481 9.1435 9.1435 9.8719 9.8719 9.9038 9.9038 10.8198 10.8198 11.3471 11.3471 12.0630 12.0630 12.3236 12.3236 13.3298 13.3298 13.4420 13.4420 13.6495 13.6495 13.7969 13.7969 k = 0.2200 0.1957 1.0888 ( 6610 PWs) bands (ev): 1.5880 1.5880 2.2302 2.2302 2.3759 2.3759 3.2010 3.2010 4.1402 4.1402 5.3606 5.3606 5.8791 5.8791 6.3035 6.3035 6.4490 6.4490 6.5232 6.5232 6.5700 6.5700 6.6081 6.6081 6.8250 6.8250 6.8460 6.8460 6.9452 6.9452 7.0363 7.0363 7.1262 7.1262 7.2167 7.2167 7.2683 7.2683 7.3878 7.3878 7.4445 7.4445 7.5091 7.5091 7.6296 7.6296 7.6567 7.6567 7.7869 7.7869 7.8387 7.8387 7.9592 7.9592 8.1870 8.1870 8.5202 8.5202 8.5451 8.5451 8.6273 8.6273 8.8451 8.8451 9.1587 9.1587 9.8639 9.8639 9.8997 9.8997 10.8168 10.8168 11.3490 11.3490 12.0595 12.0595 12.3212 12.3212 13.3251 13.3251 13.4499 13.4499 13.6608 13.6608 13.7993 13.7993 k = 0.2100 0.2131 1.0765 ( 6600 PWs) bands (ev): 1.5863 1.5863 2.2250 2.2250 2.3718 2.3718 3.2127 3.2127 4.1525 4.1525 5.3551 5.3551 5.8640 5.8640 6.2954 6.2954 6.4485 6.4485 6.5303 6.5303 6.5697 6.5697 6.6195 6.6195 6.8158 6.8158 6.8363 6.8363 6.9579 6.9579 7.0479 7.0479 7.1243 7.1243 7.2104 7.2104 7.2747 7.2747 7.3917 7.3917 7.4456 7.4456 7.5082 7.5082 7.6273 7.6273 7.6550 7.6550 7.7877 7.7877 7.8298 7.8298 7.9739 7.9739 8.1567 8.1567 8.5015 8.5015 8.5518 8.5518 8.6606 8.6606 8.8393 8.8393 9.1795 9.1795 9.8529 9.8529 9.8940 9.8940 10.8132 10.8132 11.3519 11.3519 12.0546 12.0546 12.3174 12.3174 13.3186 13.3186 13.4592 13.4592 13.6777 13.6777 13.8024 13.8024 k = 0.2000 0.2306 1.0641 ( 6600 PWs) bands (ev): 1.5841 1.5841 2.2185 2.2185 2.3668 2.3668 3.2274 3.2274 4.1678 4.1678 5.3481 5.3481 5.8460 5.8460 6.2853 6.2853 6.4481 6.4481 6.5374 6.5374 6.5708 6.5708 6.6324 6.6324 6.8052 6.8052 6.8275 6.8275 6.9707 6.9707 7.0614 7.0614 7.1221 7.1221 7.2046 7.2046 7.2808 7.2808 7.3955 7.3955 7.4471 7.4471 7.5077 7.5077 7.6241 7.6241 7.6532 7.6532 7.7885 7.7885 7.8211 7.8211 7.9898 7.9898 8.1251 8.1251 8.4748 8.4748 8.5653 8.5653 8.6969 8.6969 8.8299 8.8299 9.2051 9.2051 9.8391 9.8391 9.8867 9.8867 10.8093 10.8093 11.3559 11.3559 12.0484 12.0484 12.3119 12.3119 13.3107 13.3107 13.4684 13.4684 13.7007 13.7007 13.8061 13.8061 k = 0.1900 0.2480 1.0517 ( 6608 PWs) bands (ev): 1.5815 1.5815 2.2108 2.2108 2.3610 2.3610 3.2447 3.2447 4.1861 4.1861 5.3396 5.3396 5.8260 5.8260 6.2735 6.2735 6.4476 6.4476 6.5433 6.5433 6.5740 6.5740 6.6463 6.6463 6.7941 6.7941 6.8195 6.8195 6.9831 6.9831 7.0762 7.0762 7.1197 7.1197 7.1997 7.1997 7.2866 7.2866 7.3983 7.3983 7.4491 7.4491 7.5082 7.5082 7.6201 7.6201 7.6511 7.6511 7.7893 7.7893 7.8130 7.8130 8.0059 8.0059 8.0946 8.0946 8.4446 8.4446 8.5825 8.5825 8.7340 8.7340 8.8168 8.8168 9.2345 9.2345 9.8228 9.8228 9.8780 9.8780 10.8056 10.8056 11.3612 11.3612 12.0411 12.0411 12.3043 12.3043 13.3014 13.3014 13.4763 13.4763 13.7303 13.7303 13.8103 13.8103 k = 0.1800 0.2654 1.0393 ( 6606 PWs) bands (ev): 1.5785 1.5785 2.2022 2.2022 2.3548 2.3548 3.2644 3.2644 4.2070 4.2070 5.3296 5.3296 5.8047 5.8047 6.2603 6.2603 6.4472 6.4472 6.5468 6.5468 6.5797 6.5797 6.6605 6.6605 6.7830 6.7830 6.8127 6.8127 6.9948 6.9948 7.0912 7.0912 7.1173 7.1173 7.1963 7.1963 7.2920 7.2920 7.3996 7.3996 7.4515 7.4515 7.5102 7.5102 7.6154 7.6154 7.6491 7.6491 7.7894 7.7894 7.8064 7.8064 8.0188 8.0188 8.0695 8.0695 8.4124 8.4124 8.6029 8.6029 8.7701 8.7701 8.8007 8.8007 9.2669 9.2669 9.8043 9.8043 9.8681 9.8681 10.8026 10.8026 11.3677 11.3677 12.0327 12.0327 12.2944 12.2944 13.2912 13.2912 13.4818 13.4818 13.7657 13.7657 13.8150 13.8150 k = 0.1700 0.2829 1.0270 ( 6616 PWs) bands (ev): 1.5752 1.5752 2.1928 2.1928 2.3482 2.3482 3.2860 3.2860 4.2303 4.2303 5.3182 5.3182 5.7827 5.7827 6.2458 6.2458 6.4471 6.4471 6.5481 6.5481 6.5871 6.5871 6.6743 6.6743 6.7727 6.7727 6.8074 6.8074 7.0056 7.0056 7.1043 7.1043 7.1162 7.1162 7.1950 7.1950 7.2970 7.2970 7.3989 7.3989 7.4538 7.4538 7.5142 7.5142 7.6099 7.6099 7.6470 7.6470 7.7874 7.7874 7.8028 7.8028 8.0157 8.0157 8.0632 8.0632 8.3790 8.3790 8.6260 8.6260 8.7799 8.7799 8.8062 8.8062 9.3011 9.3011 9.7841 9.7841 9.8570 9.8570 10.8008 10.8008 11.3756 11.3756 12.0234 12.0234 12.2819 12.2819 13.2802 13.2802 13.4843 13.4843 13.8055 13.8055 13.8203 13.8203 k = 0.1600 0.3003 1.0146 ( 6618 PWs) bands (ev): 1.5716 1.5716 2.1828 2.1828 2.3414 2.3414 3.3092 3.3092 4.2555 4.2555 5.3056 5.3056 5.7607 5.7607 6.2303 6.2303 6.4472 6.4472 6.5479 6.5479 6.5950 6.5950 6.6866 6.6866 6.7634 6.7634 6.8043 6.8043 7.0153 7.0153 7.1088 7.1088 7.1219 7.1219 7.1969 7.1969 7.3016 7.3016 7.3964 7.3964 7.4554 7.4554 7.5205 7.5205 7.6039 7.6039 7.6450 7.6450 7.7827 7.7827 7.8028 7.8028 7.9964 7.9964 8.0763 8.0763 8.3453 8.3453 8.6511 8.6511 8.7589 8.7589 8.8379 8.8379 9.3364 9.3364 9.7628 9.7628 9.8452 9.8452 10.8005 10.8005 11.3846 11.3846 12.0133 12.0133 12.2668 12.2668 13.2688 13.2688 13.4833 13.4833 13.8255 13.8255 13.8474 13.8474 k = 0.1500 0.3177 1.0022 ( 6618 PWs) bands (ev): 1.5677 1.5677 2.1724 2.1724 2.3347 2.3347 3.3337 3.3337 4.2823 4.2823 5.2917 5.2917 5.7390 5.7390 6.2140 6.2140 6.4476 6.4476 6.5468 6.5468 6.6026 6.6026 6.6963 6.6963 6.7556 6.7556 6.8041 6.8041 7.0236 7.0236 7.1075 7.1075 7.1302 7.1302 7.2029 7.2029 7.3057 7.3057 7.3923 7.3923 7.4562 7.4562 7.5286 7.5286 7.5974 7.5974 7.6431 7.6431 7.7767 7.7767 7.8053 7.8053 7.9754 7.9754 8.0945 8.0945 8.3115 8.3115 8.6761 8.6761 8.7379 8.7379 8.8667 8.8667 9.3718 9.3718 9.7410 9.7410 9.8330 9.8330 10.8021 10.8021 11.3945 11.3945 12.0026 12.0026 12.2492 12.2492 13.2572 13.2572 13.4782 13.4782 13.8315 13.8315 13.8821 13.8821 k = 0.1400 0.3352 0.9899 ( 6622 PWs) bands (ev): 1.5637 1.5637 2.1617 2.1617 2.3281 2.3281 3.3591 3.3591 4.3103 4.3103 5.2768 5.2768 5.7182 5.7182 6.1971 6.1971 6.4484 6.4484 6.5450 6.5450 6.6092 6.6092 6.7022 6.7022 6.7498 6.7498 6.8076 6.8076 7.0302 7.0302 7.1059 7.1059 7.1353 7.1353 7.2132 7.2132 7.3095 7.3095 7.3873 7.3873 7.4560 7.4560 7.5379 7.5379 7.5907 7.5907 7.6415 7.6415 7.7705 7.7705 7.8091 7.8091 7.9564 7.9564 8.1139 8.1139 8.2784 8.2784 8.6869 8.6869 8.7316 8.7316 8.8918 8.8918 9.4061 9.4061 9.7196 9.7196 9.8206 9.8206 10.8057 10.8057 11.4051 11.4051 11.9916 11.9916 12.2293 12.2293 13.2456 13.2456 13.4684 13.4684 13.8375 13.8375 13.8725 13.8725 k = 0.1300 0.3526 0.9775 ( 6624 PWs) bands (ev): 1.5596 1.5596 2.1509 2.1509 2.3217 2.3217 3.3850 3.3850 4.3391 4.3391 5.2610 5.2610 5.6986 5.6986 6.1796 6.1796 6.4495 6.4495 6.5427 6.5427 6.6146 6.6146 6.7038 6.7038 6.7463 6.7463 6.8149 6.8149 7.0352 7.0352 7.1047 7.1047 7.1375 7.1375 7.2263 7.2263 7.3128 7.3128 7.3817 7.3817 7.4550 7.4550 7.5474 7.5474 7.5841 7.5841 7.6403 7.6403 7.7644 7.7644 7.8142 7.8142 7.9404 7.9404 8.1330 8.1330 8.2465 8.2465 8.6683 8.6683 8.7551 8.7551 8.9129 8.9129 9.4381 9.4381 9.6999 9.6999 9.8086 9.8086 10.8114 10.8114 11.4160 11.4160 11.9803 11.9803 12.2074 12.2074 13.2342 13.2342 13.4535 13.4535 13.8360 13.8360 13.8492 13.8492 k = 0.1200 0.3701 0.9651 ( 6630 PWs) bands (ev): 1.5554 1.5554 2.1403 2.1403 2.3157 2.3157 3.4112 3.4112 4.3683 4.3683 5.2446 5.2446 5.6804 5.6804 6.1617 6.1617 6.4511 6.4511 6.5401 6.5401 6.6186 6.6186 6.7022 6.7022 6.7445 6.7445 6.8256 6.8256 7.0383 7.0383 7.1039 7.1039 7.1379 7.1379 7.2406 7.2406 7.3158 7.3158 7.3764 7.3764 7.4530 7.4530 7.5559 7.5559 7.5780 7.5780 7.6400 7.6400 7.7586 7.7586 7.8205 7.8205 7.9273 7.9273 8.1498 8.1498 8.2179 8.2179 8.6413 8.6413 8.7878 8.7878 8.9297 8.9297 9.4656 9.4656 9.6836 9.6836 9.7973 9.7973 10.8190 10.8190 11.4269 11.4269 11.9691 11.9691 12.1839 12.1839 13.2233 13.2233 13.4334 13.4334 13.8106 13.8106 13.8534 13.8534 k = 0.1100 0.3875 0.9528 ( 6632 PWs) bands (ev): 1.5512 1.5512 2.1299 2.1299 2.3101 2.3101 3.4372 3.4372 4.3974 4.3974 5.2277 5.2277 5.6638 5.6638 6.1436 6.1436 6.4530 6.4530 6.5373 6.5373 6.6213 6.6213 6.6985 6.6985 6.7439 6.7439 6.8387 6.8387 7.0397 7.0397 7.1033 7.1033 7.1374 7.1374 7.2542 7.2542 7.3185 7.3185 7.3718 7.3718 7.4503 7.4503 7.5612 7.5612 7.5740 7.5740 7.6411 7.6411 7.7533 7.7533 7.8280 7.8280 7.9170 7.9170 8.1556 8.1556 8.2014 8.2014 8.6123 8.6123 8.8231 8.8231 8.9423 8.9423 9.4859 9.4859 9.6735 9.6735 9.7870 9.7870 10.8284 10.8284 11.4372 11.4372 11.9580 11.9580 12.1593 12.1593 13.2129 13.2129 13.4087 13.4087 13.7886 13.7886 13.8602 13.8602 k = 0.1000 0.4049 0.9404 ( 6628 PWs) bands (ev): 1.5471 1.5471 2.1199 2.1199 2.3049 2.3049 3.4626 3.4626 4.4259 4.4259 5.2107 5.2107 5.6492 5.6492 6.1255 6.1255 6.4552 6.4552 6.5343 6.5343 6.6228 6.6228 6.6941 6.6941 6.7441 6.7441 6.8534 6.8534 7.0397 7.0397 7.1024 7.1024 7.1368 7.1368 7.2660 7.2660 7.3210 7.3210 7.3688 7.3688 7.4469 7.4469 7.5603 7.5603 7.5746 7.5746 7.6441 7.6441 7.7487 7.7487 7.8366 7.8366 7.9092 7.9092 8.1390 8.1390 8.2082 8.2082 8.5827 8.5827 8.8597 8.8597 8.9509 8.9509 9.4957 9.4957 9.6725 9.6725 9.7782 9.7782 10.8393 10.8393 11.4468 11.4468 11.9472 11.9472 12.1343 12.1343 13.2031 13.2031 13.3804 13.3804 13.7723 13.7723 13.8673 13.8673 k = 0.0900 0.4224 0.9280 ( 6632 PWs) bands (ev): 1.5432 1.5432 2.1105 2.1105 2.3002 2.3002 3.4872 3.4872 4.4534 4.4534 5.1938 5.1938 5.6365 5.6365 6.1075 6.1075 6.4576 6.4576 6.5313 6.5313 6.6233 6.6233 6.6893 6.6893 6.7447 6.7447 6.8691 6.8691 7.0387 7.0387 7.1005 7.1005 7.1366 7.1366 7.2748 7.2748 7.3235 7.3235 7.3679 7.3679 7.4429 7.4429 7.5564 7.5564 7.5765 7.5765 7.6492 7.6492 7.7447 7.7447 7.8461 7.8461 7.9035 7.9035 8.1142 8.1142 8.2243 8.2243 8.5531 8.5531 8.8962 8.8962 8.9563 8.9563 9.4943 9.4943 9.6808 9.6808 9.7712 9.7712 10.8512 10.8512 11.4553 11.4553 11.9370 11.9370 12.1094 12.1094 13.1942 13.1942 13.3501 13.3501 13.7609 13.7609 13.8744 13.8744 k = 0.0800 0.4398 0.9156 ( 6642 PWs) bands (ev): 1.5395 1.5395 2.1017 2.1017 2.2959 2.2959 3.5105 3.5105 4.4795 4.4795 5.1774 5.1774 5.6258 5.6258 6.0899 6.0899 6.4603 6.4603 6.5282 6.5282 6.6231 6.6231 6.6847 6.6847 6.7457 6.7457 6.8854 6.8854 7.0369 7.0369 7.0971 7.0971 7.1369 7.1369 7.2802 7.2802 7.3259 7.3259 7.3693 7.3693 7.4384 7.4384 7.5524 7.5524 7.5770 7.5770 7.6564 7.6564 7.7414 7.7414 7.8557 7.8557 7.8999 7.8999 8.0892 8.0892 8.2416 8.2416 8.5243 8.5243 8.9299 8.9299 8.9612 8.9612 9.4841 9.4841 9.6950 9.6950 9.7669 9.7669 10.8637 10.8637 11.4624 11.4624 11.9274 11.9274 12.0853 12.0853 13.1860 13.1860 13.3193 13.3193 13.7534 13.7534 13.8811 13.8811 k = 0.0700 0.4573 0.9033 ( 6642 PWs) bands (ev): 1.5361 1.5361 2.0937 2.0937 2.2922 2.2922 3.5321 3.5321 4.5037 4.5037 5.1618 5.1618 5.6171 5.6171 6.0731 6.0731 6.4630 6.4630 6.5253 6.5253 6.6225 6.6225 6.6804 6.6804 6.7468 6.7468 6.9020 6.9020 7.0348 7.0348 7.0919 7.0919 7.1379 7.1379 7.2826 7.2826 7.3281 7.3281 7.3726 7.3726 7.4336 7.4336 7.5493 7.5493 7.5760 7.5760 7.6650 7.6650 7.7387 7.7387 7.8642 7.8642 7.8988 7.8988 8.0659 8.0659 8.2585 8.2585 8.4965 8.4965 8.9466 8.9466 8.9799 8.9799 9.4688 9.4688 9.7100 9.7100 9.7664 9.7664 10.8763 10.8763 11.4681 11.4681 11.9187 11.9187 12.0626 12.0626 13.1787 13.1787 13.2895 13.2895 13.7488 13.7488 13.8875 13.8875 k = 0.0600 0.4747 0.8909 ( 6632 PWs) bands (ev): 1.5330 1.5330 2.0866 2.0866 2.2890 2.2890 3.5518 3.5518 4.5256 4.5256 5.1473 5.1473 5.6102 5.6102 6.0572 6.0572 6.4657 6.4657 6.5225 6.5225 6.6218 6.6218 6.6764 6.6764 6.7481 6.7481 6.9187 6.9187 7.0326 7.0326 7.0851 7.0851 7.1393 7.1393 7.2829 7.2829 7.3300 7.3300 7.3771 7.3771 7.4286 7.4286 7.5471 7.5471 7.5741 7.5741 7.6746 7.6746 7.7366 7.7366 7.8691 7.8691 7.9019 7.9019 8.0448 8.0448 8.2743 8.2743 8.4706 8.4706 8.9464 8.9464 9.0123 9.0123 9.4508 9.4508 9.7209 9.7209 9.7719 9.7719 10.8885 10.8885 11.4723 11.4723 11.9108 11.9108 12.0418 12.0418 13.1724 13.1724 13.2617 13.2617 13.7461 13.7461 13.8933 13.8933 k = 0.0500 0.4921 0.8785 ( 6634 PWs) bands (ev): 1.5303 1.5303 2.0805 2.0805 2.2863 2.2863 3.5692 3.5692 4.5448 4.5448 5.1343 5.1343 5.6052 5.6052 6.0427 6.0427 6.4682 6.4682 6.5200 6.5200 6.6209 6.6209 6.6728 6.6728 6.7492 6.7492 6.9353 6.9353 7.0303 7.0303 7.0767 7.0767 7.1408 7.1408 7.2821 7.2821 7.3316 7.3316 7.3818 7.3818 7.4236 7.4236 7.5459 7.5459 7.5718 7.5718 7.6846 7.6846 7.7349 7.7349 7.8692 7.8692 7.9096 7.9096 8.0265 8.0265 8.2884 8.2884 8.4469 8.4469 8.9424 8.9424 9.0452 9.0452 9.4320 9.4320 9.7259 9.7259 9.7830 9.7830 10.8998 10.8998 11.4752 11.4752 11.9039 11.9039 12.0235 12.0235 13.1669 13.1669 13.2369 13.2369 13.7448 13.7448 13.8984 13.8984 k = 0.0400 0.5096 0.8662 ( 6622 PWs) bands (ev): 1.5280 1.5280 2.0754 2.0754 2.2841 2.2841 3.5839 3.5839 4.5610 4.5610 5.1232 5.1232 5.6016 5.6016 6.0301 6.0301 6.4706 6.4706 6.5179 6.5179 6.6202 6.6202 6.6698 6.6698 6.7502 6.7502 6.9518 6.9518 7.0283 7.0283 7.0669 7.0669 7.1422 7.1422 7.2809 7.2809 7.3329 7.3329 7.3863 7.3863 7.4187 7.4187 7.5456 7.5456 7.5694 7.5694 7.6945 7.6945 7.7334 7.7334 7.8661 7.8661 7.9196 7.9196 8.0112 8.0112 8.3005 8.3005 8.4262 8.4262 8.9375 8.9375 9.0759 9.0759 9.4133 9.4133 9.7274 9.7274 9.7963 9.7963 10.9098 10.9098 11.4769 11.4769 11.8981 11.8981 12.0081 12.0081 13.1625 13.1625 13.2158 13.2158 13.7443 13.7443 13.9028 13.9028 k = 0.0300 0.5270 0.8538 ( 6618 PWs) bands (ev): 1.5262 1.5262 2.0713 2.0713 2.2824 2.2824 3.5957 3.5957 4.5739 4.5739 5.1142 5.1142 5.5992 5.5992 6.0196 6.0196 6.4725 6.4725 6.5161 6.5161 6.6196 6.6196 6.6673 6.6673 6.7511 6.7511 6.9680 6.9680 7.0265 7.0265 7.0560 7.0560 7.1435 7.1435 7.2797 7.2797 7.3338 7.3338 7.3904 7.3904 7.4141 7.4141 7.5460 7.5460 7.5671 7.5671 7.7040 7.7040 7.7320 7.7320 7.8615 7.8615 7.9300 7.9300 7.9988 7.9988 8.3102 8.3102 8.4093 8.4093 8.9327 8.9327 9.1028 9.1028 9.3960 9.3960 9.7276 9.7276 9.8085 9.8085 10.9180 10.9180 11.4777 11.4777 11.8935 11.8935 11.9959 11.9959 13.1591 13.1591 13.1989 13.1989 13.7443 13.7443 13.9063 13.9063 k = 0.0200 0.5444 0.8414 ( 6620 PWs) bands (ev): 1.5249 1.5249 2.0684 2.0684 2.2812 2.2812 3.6043 3.6043 4.5833 4.5833 5.1075 5.1075 5.5978 5.5978 6.0118 6.0118 6.4739 6.4739 6.5148 6.5148 6.6192 6.6192 6.6654 6.6654 6.7517 6.7517 6.9837 6.9837 7.0248 7.0248 7.0444 7.0444 7.1445 7.1445 7.2787 7.2787 7.3346 7.3346 7.3940 7.3940 7.4099 7.4099 7.5466 7.5466 7.5652 7.5652 7.7124 7.7124 7.7303 7.7303 7.8568 7.8568 7.9394 7.9394 7.9892 7.9892 8.3173 8.3173 8.3967 8.3967 8.9287 8.9287 9.1244 9.1244 9.3815 9.3815 9.7273 9.7273 9.8180 9.8180 10.9241 10.9241 11.4781 11.4781 11.8902 11.8902 11.9870 11.9870 13.1566 13.1566 13.1865 13.1865 13.7444 13.7444 13.9088 13.9088 k = 0.0100 0.5619 0.8291 ( 6618 PWs) bands (ev): 1.5241 1.5241 2.0666 2.0666 2.2805 2.2805 3.6095 3.6095 4.5890 4.5890 5.1034 5.1034 5.5971 5.5971 6.0070 6.0070 6.4749 6.4749 6.5140 6.5140 6.6189 6.6189 6.6643 6.6643 6.7521 6.7521 6.9985 6.9985 7.0221 7.0221 7.0336 7.0336 7.1451 7.1451 7.2781 7.2781 7.3350 7.3350 7.3971 7.3971 7.4063 7.4063 7.5471 7.5471 7.5640 7.5640 7.7192 7.7192 7.7280 7.7280 7.8533 7.8533 7.9465 7.9465 7.9825 7.9825 8.3215 8.3215 8.3889 8.3889 8.9261 8.9261 9.1388 9.1388 9.3715 9.3715 9.7271 9.7271 9.8240 9.8240 10.9279 10.9279 11.4781 11.4781 11.8881 11.8881 11.9817 11.9817 13.1551 13.1551 13.1789 13.1789 13.7446 13.7446 13.9104 13.9104 k = 0.0000 0.5793 0.8167 ( 6618 PWs) bands (ev): 1.5238 1.5238 2.0661 2.0661 2.2802 2.2802 3.6113 3.6113 4.5909 4.5909 5.1021 5.1021 5.5969 5.5969 6.0054 6.0054 6.4752 6.4752 6.5137 6.5137 6.6188 6.6188 6.6639 6.6639 6.7522 6.7522 7.0094 7.0094 7.0158 7.0158 7.0295 7.0295 7.1453 7.1453 7.2778 7.2778 7.3351 7.3351 7.3988 7.3988 7.4044 7.4044 7.5474 7.5474 7.5635 7.5635 7.7235 7.7235 7.7254 7.7254 7.8520 7.8520 7.9493 7.9493 7.9799 7.9799 8.3229 8.3229 8.3863 8.3863 8.9252 8.9252 9.1438 9.1438 9.3679 9.3679 9.7270 9.7270 9.8260 9.8260 10.9292 10.9292 11.4781 11.4781 11.8875 11.8875 11.9799 11.9799 13.1547 13.1547 13.1764 13.1764 13.7446 13.7446 13.9109 13.9109 k = 0.0000 0.5793 0.8167 ( 6618 PWs) bands (ev): 1.5238 1.5238 2.0661 2.0661 2.2802 2.2802 3.6113 3.6113 4.5909 4.5909 5.1021 5.1021 5.5969 5.5969 6.0054 6.0054 6.4752 6.4752 6.5137 6.5137 6.6188 6.6188 6.6639 6.6639 6.7522 6.7522 7.0094 7.0094 7.0158 7.0158 7.0295 7.0295 7.1453 7.1453 7.2778 7.2778 7.3351 7.3351 7.3988 7.3988 7.4044 7.4044 7.5474 7.5474 7.5635 7.5635 7.7235 7.7235 7.7254 7.7254 7.8520 7.8520 7.9493 7.9493 7.9799 7.9799 8.3229 8.3229 8.3863 8.3863 8.9252 8.9252 9.1438 9.1438 9.3679 9.3679 9.7270 9.7270 9.8260 9.8260 10.9292 10.9292 11.4781 11.4781 11.8875 11.8875 11.9799 11.9799 13.1547 13.1547 13.1764 13.1764 13.7446 13.7446 13.9109 13.9109 k = 0.0210 0.5873 0.8110 ( 6620 PWs) bands (ev): 1.5241 1.5241 2.0660 2.0660 2.2794 2.2794 3.6111 3.6111 4.5925 4.5925 5.1000 5.1000 5.5961 5.5961 6.0067 6.0067 6.4738 6.4738 6.5135 6.5135 6.6161 6.6161 6.6674 6.6674 6.7530 6.7530 7.0085 7.0085 7.0166 7.0166 7.0298 7.0298 7.1441 7.1441 7.2796 7.2796 7.3347 7.3347 7.3984 7.3984 7.4045 7.4045 7.5468 7.5468 7.5644 7.5644 7.7126 7.7126 7.7372 7.7372 7.8524 7.8524 7.9493 7.9493 7.9806 7.9806 8.3226 8.3226 8.3858 8.3858 8.9249 8.9249 9.1444 9.1444 9.3700 9.3700 9.7261 9.7261 9.8201 9.8201 10.9370 10.9370 11.4786 11.4786 11.8857 11.8857 11.9771 11.9771 13.1524 13.1524 13.1782 13.1782 13.7442 13.7442 13.9115 13.9115 k = 0.0419 0.5953 0.8053 ( 6611 PWs) bands (ev): 1.5251 1.5251 2.0659 2.0659 2.2769 2.2769 3.6108 3.6108 4.5975 4.5975 5.0937 5.0937 5.5940 5.5940 6.0107 6.0107 6.4697 6.4697 6.5129 6.5129 6.6100 6.6100 6.6759 6.6759 6.7555 6.7555 7.0065 7.0065 7.0182 7.0182 7.0306 7.0306 7.1409 7.1409 7.2846 7.2846 7.3334 7.3334 7.3975 7.3975 7.4050 7.4050 7.5453 7.5453 7.5667 7.5667 7.7018 7.7018 7.7509 7.7509 7.8537 7.8537 7.9491 7.9491 7.9829 7.9829 8.3217 8.3217 8.3843 8.3843 8.9242 8.9242 9.1462 9.1462 9.3761 9.3761 9.7232 9.7232 9.8031 9.8031 10.9597 10.9597 11.4801 11.4801 11.8804 11.8804 11.9690 11.9690 13.1469 13.1469 13.1825 13.1825 13.7431 13.7431 13.9134 13.9134 k = 0.0629 0.6033 0.7997 ( 6616 PWs) bands (ev): 1.5265 1.5265 2.0656 2.0656 2.2730 2.2730 3.6103 3.6103 4.6056 4.6056 5.0835 5.0835 5.5907 5.5907 6.0172 6.0172 6.4631 6.4631 6.5118 6.5118 6.6028 6.6028 6.6866 6.6866 6.7594 6.7594 7.0039 7.0039 7.0201 7.0201 7.0319 7.0319 7.1362 7.1362 7.2921 7.2921 7.3314 7.3314 7.3961 7.3961 7.4056 7.4056 7.5433 7.5433 7.5700 7.5700 7.6920 7.6920 7.7653 7.7653 7.8557 7.8557 7.9488 7.9488 7.9867 7.9867 8.3202 8.3202 8.3819 8.3819 8.9230 8.9230 9.1493 9.1493 9.3860 9.3860 9.7170 9.7170 9.7782 9.7782 10.9955 10.9955 11.4825 11.4825 11.8716 11.8716 11.9558 11.9558 13.1396 13.1396 13.1876 13.1876 13.7413 13.7413 13.9164 13.9164 k = 0.0839 0.6113 0.7940 ( 6625 PWs) bands (ev): 1.5286 1.5286 2.0646 2.0646 2.2680 2.2680 3.6096 3.6096 4.6170 4.6170 5.0695 5.0695 5.5861 5.5861 6.0263 6.0263 6.4540 6.4540 6.5104 6.5104 6.5960 6.5960 6.6978 6.6978 6.7645 6.7645 7.0010 7.0010 7.0219 7.0219 7.0334 7.0334 7.1309 7.1309 7.3011 7.3011 7.3289 7.3289 7.3944 7.3944 7.4062 7.4062 7.5412 7.5412 7.5739 7.5739 7.6832 7.6832 7.7804 7.7804 7.8582 7.8582 7.9485 7.9485 7.9919 7.9919 8.3179 8.3179 8.3787 8.3787 8.9217 8.9217 9.1537 9.1537 9.3992 9.3992 9.7033 9.7033 9.7519 9.7519 11.0421 11.0421 11.4859 11.4859 11.8593 11.8593 11.9379 11.9379 13.1311 13.1311 13.1929 13.1929 13.7391 13.7391 13.9205 13.9205 k = 0.1048 0.6193 0.7883 ( 6631 PWs) bands (ev): 1.5311 1.5311 2.0627 2.0627 2.2626 2.2626 3.6087 3.6087 4.6313 4.6313 5.0522 5.0522 5.5807 5.5807 6.0378 6.0378 6.4429 6.4429 6.5087 6.5087 6.5900 6.5900 6.7086 6.7086 6.7704 6.7704 6.9979 6.9979 7.0236 7.0236 7.0352 7.0352 7.1257 7.1257 7.3102 7.3102 7.3268 7.3268 7.3926 7.3926 7.4069 7.4069 7.5391 7.5391 7.5783 7.5783 7.6755 7.6755 7.7961 7.7961 7.8611 7.8611 7.9484 7.9484 7.9984 7.9984 8.3148 8.3148 8.3750 8.3750 8.9204 8.9204 9.1593 9.1593 9.4152 9.4152 9.6754 9.6754 9.7335 9.7335 11.0967 11.0967 11.4904 11.4904 11.8435 11.8435 11.9159 11.9159 13.1217 13.1217 13.1981 13.1981 13.7369 13.7369 13.9255 13.9255 k = 0.1258 0.6273 0.7826 ( 6631 PWs) bands (ev): 1.5340 1.5340 2.0594 2.0594 2.2575 2.2575 3.6077 3.6077 4.6484 4.6484 5.0320 5.0320 5.5745 5.5745 6.0515 6.0515 6.4297 6.4297 6.5068 6.5068 6.5851 6.5851 6.7186 6.7186 6.7766 6.7766 6.9945 6.9945 7.0251 7.0251 7.0372 7.0372 7.1211 7.1211 7.3150 7.3150 7.3289 7.3289 7.3908 7.3908 7.4079 7.4079 7.5371 7.5371 7.5829 7.5829 7.6690 7.6690 7.8120 7.8120 7.8642 7.8642 7.9486 7.9486 8.0063 8.0063 8.3109 8.3109 8.3711 8.3711 8.9193 8.9193 9.1664 9.1664 9.4332 9.4332 9.6363 9.6363 9.7225 9.7225 11.1572 11.1572 11.4959 11.4959 11.8241 11.8241 11.8906 11.8906 13.1114 13.1114 13.2029 13.2029 13.7348 13.7348 13.9312 13.9312 k = 0.1468 0.6353 0.7770 ( 6642 PWs) bands (ev): 1.5371 1.5371 2.0540 2.0540 2.2533 2.2533 3.6066 3.6066 4.6682 4.6682 5.0093 5.0093 5.5679 5.5679 6.0674 6.0674 6.4147 6.4147 6.5049 6.5049 6.5812 6.5812 6.7277 6.7277 6.7822 6.7822 6.9909 6.9909 7.0262 7.0262 7.0393 7.0393 7.1176 7.1176 7.3133 7.3133 7.3366 7.3366 7.3891 7.3891 7.4094 7.4094 7.5352 7.5352 7.5877 7.5877 7.6635 7.6635 7.8279 7.8279 7.8675 7.8675 7.9491 7.9491 8.0153 8.0153 8.3062 8.3062 8.3673 8.3673 8.9184 8.9184 9.1748 9.1748 9.4524 9.4524 9.5934 9.5934 9.7135 9.7135 11.2213 11.2213 11.5022 11.5022 11.8013 11.8013 11.8629 11.8629 13.1005 13.1005 13.2070 13.2070 13.7332 13.7332 13.9372 13.9372 k = 0.1677 0.6433 0.7713 ( 6645 PWs) bands (ev): 1.5404 1.5404 2.0461 2.0461 2.2508 2.2508 3.6055 3.6055 4.6905 4.6905 4.9846 4.9846 5.5612 5.5612 6.0851 6.0851 6.3979 6.3979 6.5031 6.5031 6.5784 6.5784 6.7357 6.7357 6.7867 6.7867 6.9873 6.9873 7.0268 7.0268 7.0414 7.0414 7.1152 7.1152 7.3098 7.3098 7.3446 7.3446 7.3878 7.3878 7.4117 7.4117 7.5335 7.5335 7.5925 7.5925 7.6592 7.6592 7.8428 7.8428 7.8709 7.8709 7.9504 7.9504 8.0251 8.0251 8.3007 8.3007 8.3640 8.3640 8.9179 8.9179 9.1843 9.1843 9.4711 9.4711 9.5514 9.5514 9.7048 9.7048 11.2875 11.2875 11.5092 11.5092 11.7751 11.7751 11.8340 11.8340 13.0891 13.0891 13.2101 13.2101 13.7324 13.7324 13.9432 13.9432 k = 0.1887 0.6513 0.7656 ( 6649 PWs) bands (ev): 1.5437 1.5437 2.0354 2.0354 2.2506 2.2506 3.6043 3.6043 4.7149 4.7149 4.9585 4.9585 5.5546 5.5546 6.1043 6.1043 6.3798 6.3798 6.5013 6.5013 6.5768 6.5768 6.7427 6.7427 6.7894 6.7894 6.9838 6.9838 7.0271 7.0271 7.0433 7.0433 7.1141 7.1141 7.3059 7.3059 7.3504 7.3504 7.3871 7.3871 7.4154 7.4154 7.5320 7.5320 7.5971 7.5971 7.6562 7.6562 7.8554 7.8554 7.8754 7.8754 7.9528 7.9528 8.0352 8.0352 8.2946 8.2946 8.3615 8.3615 8.9177 8.9177 9.1948 9.1948 9.4814 9.4814 9.5198 9.5198 9.6959 9.6959 11.3540 11.3540 11.5164 11.5164 11.7458 11.7458 11.8052 11.8052 13.0773 13.0773 13.2120 13.2120 13.7324 13.7324 13.9487 13.9487 k = 0.2097 0.6593 0.7599 ( 6646 PWs) bands (ev): 1.5466 1.5466 2.0220 2.0220 2.2530 2.2530 3.6032 3.6032 4.7412 4.7412 4.9314 4.9314 5.5485 5.5485 6.1245 6.1245 6.3606 6.3606 6.4998 6.4998 6.5762 6.5762 6.7485 6.7485 6.7900 6.7900 6.9806 6.9806 7.0271 7.0271 7.0447 7.0447 7.1141 7.1141 7.3021 7.3021 7.3532 7.3532 7.3870 7.3870 7.4207 7.4207 7.5308 7.5308 7.6014 7.6014 7.6544 7.6544 7.8633 7.8633 7.8823 7.8823 7.9566 7.9566 8.0452 8.0452 8.2882 8.2882 8.3604 8.3604 8.9178 8.9178 9.2055 9.2055 9.4598 9.4598 9.5232 9.5232 9.6866 9.6866 11.4196 11.4196 11.5230 11.5230 11.7139 11.7139 11.7782 11.7782 13.0652 13.0652 13.2124 13.2124 13.7335 13.7335 13.9533 13.9533 k = 0.2306 0.6673 0.7543 ( 6636 PWs) bands (ev): 1.5490 1.5490 2.0063 2.0063 2.2579 2.2579 3.6022 3.6022 4.7688 4.7688 4.9039 4.9039 5.5431 5.5431 6.1449 6.1449 6.3413 6.3413 6.4983 6.4983 6.5767 6.5767 6.7532 6.7532 6.7885 6.7885 6.9778 6.9778 7.0268 7.0268 7.0452 7.0452 7.1152 7.1152 7.2988 7.2988 7.3533 7.3533 7.3872 7.3872 7.4274 7.4274 7.5300 7.5300 7.6052 7.6052 7.6540 7.6540 7.8666 7.8666 7.8908 7.8908 7.9622 7.9622 8.0545 8.0545 8.2819 8.2819 8.3612 8.3612 8.9181 8.9181 9.2152 9.2152 9.4303 9.4303 9.5388 9.5388 9.6774 9.6774 11.4829 11.4829 11.5279 11.5279 11.6799 11.6799 11.7552 11.7552 13.0530 13.0530 13.2113 13.2113 13.7354 13.7354 13.9566 13.9566 k = 0.2516 0.6753 0.7486 ( 6632 PWs) bands (ev): 1.5504 1.5504 1.9891 1.9891 2.2652 2.2652 3.6012 3.6012 4.7968 4.7968 4.8775 4.8775 5.5387 5.5387 6.1640 6.1640 6.3231 6.3231 6.4969 6.4969 6.5782 6.5782 6.7563 6.7563 6.7853 6.7853 6.9753 6.9753 7.0264 7.0264 7.0448 7.0448 7.1171 7.1171 7.2958 7.2958 7.3515 7.3515 7.3874 7.3874 7.4348 7.4348 7.5295 7.5295 7.6084 7.6084 7.6550 7.6550 7.8673 7.8673 7.8981 7.8981 7.9695 7.9695 8.0624 8.0624 8.2762 8.2762 8.3641 8.3641 8.9185 8.9185 9.2218 9.2218 9.4075 9.4075 9.5533 9.5533 9.6693 9.6693 11.5266 11.5266 11.5445 11.5445 11.6449 11.6449 11.7389 11.7389 13.0408 13.0408 13.2087 13.2087 13.7382 13.7382 13.9583 13.9583 k = 0.2726 0.6833 0.7429 ( 6632 PWs) bands (ev): 1.5504 1.5504 1.9710 1.9710 2.2746 2.2746 3.6005 3.6005 4.8183 4.8183 4.8588 4.8588 5.5355 5.5355 6.1786 6.1786 6.3091 6.3091 6.4955 6.4955 6.5807 6.5807 6.7570 6.7570 6.7812 6.7812 6.9730 6.9730 7.0258 7.0258 7.0432 7.0432 7.1198 7.1198 7.2934 7.2934 7.3485 7.3485 7.3873 7.3873 7.4421 7.4421 7.5294 7.5294 7.6109 7.6109 7.6571 7.6571 7.8666 7.8666 7.9033 7.9033 7.9778 7.9778 8.0683 8.0683 8.2720 8.2720 8.3694 8.3694 8.9191 8.9191 9.2226 9.2226 9.3959 9.3959 9.5631 9.5631 9.6636 9.6636 11.5236 11.5236 11.5833 11.5833 11.6233 11.6233 11.7320 11.7320 13.0288 13.0288 13.2047 13.2047 13.7415 13.7415 13.9585 13.9585 k = 0.2726 0.6833 0.7429 ( 6632 PWs) bands (ev): 1.5504 1.5504 1.9710 1.9710 2.2746 2.2746 3.6005 3.6005 4.8183 4.8183 4.8588 4.8588 5.5355 5.5355 6.1786 6.1786 6.3091 6.3091 6.4955 6.4955 6.5807 6.5807 6.7570 6.7570 6.7812 6.7812 6.9730 6.9730 7.0258 7.0258 7.0432 7.0432 7.1198 7.1198 7.2934 7.2934 7.3485 7.3485 7.3873 7.3873 7.4421 7.4421 7.5294 7.5294 7.6109 7.6109 7.6571 7.6571 7.8666 7.8666 7.9033 7.9033 7.9778 7.9778 8.0683 8.0683 8.2720 8.2720 8.3694 8.3694 8.9191 8.9191 9.2226 9.2226 9.3959 9.3959 9.5631 9.5631 9.6636 9.6636 11.5236 11.5236 11.5833 11.5833 11.6233 11.6233 11.7320 11.7320 13.0288 13.0288 13.2047 13.2047 13.7415 13.7415 13.9585 13.9585 k = 0.2787 0.6726 0.7228 ( 6642 PWs) bands (ev): 1.5446 1.5446 1.9063 1.9063 2.3108 2.3108 3.5982 3.5982 4.8347 4.8347 4.8575 4.8575 5.5291 5.5291 6.2145 6.2145 6.2728 6.2728 6.4902 6.4902 6.5913 6.5913 6.7538 6.7538 6.7675 6.7675 6.9650 6.9650 7.0228 7.0228 7.0362 7.0362 7.1305 7.1305 7.2832 7.2832 7.3364 7.3364 7.3860 7.3860 7.4689 7.4689 7.5307 7.5307 7.6191 7.6191 7.6674 7.6674 7.8614 7.8614 7.9179 7.9179 8.0091 8.0091 8.0862 8.0862 8.2612 8.2612 8.3906 8.3906 8.9217 8.9217 9.2146 9.2146 9.3792 9.3792 9.5845 9.5845 9.6518 9.6518 11.5004 11.5004 11.5948 11.5948 11.6626 11.6626 11.7315 11.7315 12.9848 12.9848 13.1869 13.1869 13.7581 13.7581 13.9506 13.9506 k = 0.2849 0.6619 0.7028 ( 6650 PWs) bands (ev): 1.5339 1.5339 1.8410 1.8410 2.3457 2.3457 3.5962 3.5962 4.8165 4.8165 4.8963 4.8963 5.5273 5.5273 6.2200 6.2200 6.2635 6.2635 6.4837 6.4837 6.6019 6.6019 6.7488 6.7488 6.7550 6.7550 6.9569 6.9569 7.0180 7.0180 7.0295 7.0295 7.1413 7.1413 7.2683 7.2683 7.3269 7.3269 7.3824 7.3824 7.4953 7.4953 7.5364 7.5364 7.6285 7.6285 7.6785 7.6785 7.8562 7.8562 7.9327 7.9327 8.0418 8.0418 8.1062 8.1062 8.2520 8.2520 8.4081 8.4081 8.9253 8.9253 9.2093 9.2093 9.3657 9.3657 9.6008 9.6008 9.6436 9.6436 11.4791 11.4791 11.6074 11.6074 11.6881 11.6881 11.7500 11.7500 12.9372 12.9372 13.1665 13.1665 13.7828 13.7828 13.9346 13.9346 k = 0.2910 0.6512 0.6827 ( 6654 PWs) bands (ev): 1.5188 1.5188 1.7755 1.7755 2.3782 2.3782 3.5945 3.5945 4.8028 4.8028 4.9360 4.9360 5.5302 5.5302 6.1827 6.1827 6.2938 6.2938 6.4760 6.4760 6.6122 6.6122 6.7378 6.7378 6.7481 6.7481 6.9489 6.9489 7.0112 7.0112 7.0233 7.0233 7.1521 7.1521 7.2500 7.2500 7.3204 7.3204 7.3776 7.3776 7.5122 7.5122 7.5532 7.5532 7.6391 7.6391 7.6903 7.6903 7.8516 7.8516 7.9474 7.9474 8.0738 8.0738 8.1289 8.1289 8.2445 8.2445 8.4217 8.4217 8.9300 8.9300 9.2066 9.2066 9.3560 9.3560 9.6104 9.6104 9.6402 9.6402 11.4603 11.4603 11.6222 11.6222 11.6967 11.6967 11.7892 11.7892 12.8865 12.8865 13.1439 13.1439 13.8149 13.8149 13.9155 13.9155 k = 0.2972 0.6404 0.6626 ( 6650 PWs) bands (ev): 1.5001 1.5001 1.7100 1.7100 2.4074 2.4074 3.5930 3.5930 4.7942 4.7942 4.9761 4.9761 5.5379 5.5379 6.1406 6.1406 6.3258 6.3258 6.4672 6.4672 6.6220 6.6220 6.7247 6.7247 6.7430 6.7430 6.9413 6.9413 7.0026 7.0026 7.0175 7.0175 7.1626 7.1626 7.2302 7.2302 7.3156 7.3156 7.3732 7.3732 7.5185 7.5185 7.5793 7.5793 7.6519 7.6519 7.7030 7.7030 7.8484 7.8484 7.9621 7.9621 8.1028 8.1028 8.1554 8.1554 8.2387 8.2387 8.4310 8.4310 8.9356 8.9356 9.2065 9.2065 9.3506 9.3506 9.6134 9.6134 9.6415 9.6415 11.4445 11.4445 11.6393 11.6393 11.7014 11.7014 11.8357 11.8357 12.8333 12.8333 13.1195 13.1195 13.8538 13.8538 13.8966 13.8966 k = 0.3033 0.6297 0.6425 ( 6638 PWs) bands (ev): 1.4784 1.4784 1.6448 1.6448 2.4327 2.4327 3.5917 3.5917 4.7909 4.7909 5.0164 5.0164 5.5503 5.5503 6.0970 6.0970 6.3559 6.3559 6.4577 6.4577 6.6310 6.6310 6.7117 6.7117 6.7376 6.7376 6.9341 6.9341 6.9923 6.9923 7.0120 7.0120 7.1725 7.1725 7.2107 7.2107 7.3114 7.3114 7.3703 7.3703 7.5214 7.5214 7.6046 7.6046 7.6678 7.6678 7.7172 7.7172 7.8472 7.8472 7.9765 7.9765 8.1272 8.1272 8.1859 8.1859 8.2345 8.2345 8.4361 8.4361 8.9421 8.9421 9.2090 9.2090 9.3499 9.3499 9.6133 9.6133 9.6440 9.6440 11.4322 11.4322 11.6583 11.6583 11.7070 11.7070 11.8843 11.8843 12.7778 12.7778 13.0938 13.0938 13.8792 13.8792 13.8994 13.8994 k = 0.3095 0.6190 0.6224 ( 6638 PWs) bands (ev): 1.4540 1.4540 1.5800 1.5800 2.4535 2.4535 3.5907 3.5907 4.7928 4.7928 5.0567 5.0567 5.5672 5.5672 6.0525 6.0525 6.3822 6.3822 6.4489 6.4489 6.6388 6.6388 6.6992 6.6992 6.7319 6.7319 6.9272 6.9272 6.9805 6.9805 7.0066 7.0066 7.1803 7.1803 7.1936 7.1936 7.3072 7.3072 7.3703 7.3703 7.5233 7.5233 7.6232 7.6232 7.6867 7.6867 7.7348 7.7348 7.8485 7.8485 7.9906 7.9906 8.1474 8.1474 8.2191 8.2191 8.2318 8.2318 8.4373 8.4373 8.9494 8.9494 9.2140 9.2140 9.3544 9.3544 9.6126 9.6126 9.6455 9.6455 11.4237 11.4237 11.6781 11.6781 11.7154 11.7154 11.9335 11.9335 12.7204 12.7204 13.0670 13.0670 13.8665 13.8665 13.9489 13.9489 k = 0.3156 0.6083 0.6024 ( 6642 PWs) bands (ev): 1.4274 1.4274 1.5160 1.5160 2.4697 2.4697 3.5899 3.5899 4.7997 4.7997 5.0968 5.0968 5.5886 5.5886 6.0076 6.0076 6.3991 6.3991 6.4462 6.4462 6.6447 6.6447 6.6872 6.6872 6.7262 6.7262 6.9202 6.9202 6.9674 6.9674 7.0017 7.0017 7.1726 7.1726 7.1926 7.1926 7.3030 7.3030 7.3736 7.3736 7.5252 7.5252 7.6348 7.6348 7.7051 7.7051 7.7575 7.7575 7.8533 7.8533 8.0043 8.0043 8.1641 8.1641 8.2306 8.2306 8.2532 8.2532 8.4349 8.4349 8.9575 8.9575 9.2216 9.2216 9.3644 9.3644 9.6114 9.6114 9.6467 9.6467 11.4191 11.4191 11.6957 11.6957 11.7291 11.7291 11.9829 11.9829 12.6612 12.6612 13.0395 13.0395 13.8582 13.8582 14.0028 14.0028 k = 0.3218 0.5976 0.5823 ( 6636 PWs) bands (ev): 1.3989 1.3989 1.4528 1.4528 2.4810 2.4810 3.5893 3.5893 4.8115 4.8115 5.1367 5.1367 5.6140 5.6140 5.9624 5.9624 6.3977 6.3977 6.4583 6.4583 6.6482 6.6482 6.6759 6.6759 6.7211 6.7211 6.9120 6.9120 6.9539 6.9539 6.9974 6.9974 7.1583 7.1583 7.1988 7.1988 7.2999 7.2999 7.3806 7.3806 7.5272 7.5272 7.6411 7.6411 7.7201 7.7201 7.7836 7.7836 7.8634 7.8634 8.0175 8.0175 8.1776 8.1776 8.2313 8.2313 8.2863 8.2863 8.4291 8.4291 8.9662 8.9662 9.2317 9.2317 9.3803 9.3803 9.6078 9.6078 9.6500 9.6500 11.4187 11.4187 11.7079 11.7079 11.7509 11.7509 12.0321 12.0321 12.6002 12.6002 13.0115 13.0115 13.8553 13.8553 14.0593 14.0593 k = 0.3279 0.5868 0.5622 ( 6644 PWs) bands (ev): 1.3687 1.3687 1.3910 1.3910 2.4876 2.4876 3.5889 3.5889 4.8279 4.8279 5.1762 5.1762 5.6432 5.6432 5.9172 5.9172 6.3848 6.3848 6.4786 6.4786 6.6485 6.6485 6.6651 6.6651 6.7174 6.7174 6.9007 6.9007 6.9420 6.9420 6.9941 6.9941 7.1457 7.1457 7.2032 7.2032 7.2987 7.2987 7.3911 7.3911 7.5295 7.5295 7.6439 7.6439 7.7325 7.7325 7.8074 7.8074 7.8811 7.8811 8.0302 8.0302 8.1875 8.1875 8.2341 8.2341 8.3176 8.3176 8.4207 8.4207 8.9755 8.9755 9.2444 9.2444 9.4024 9.4024 9.6006 9.6006 9.6576 9.6576 11.4224 11.4224 11.7155 11.7155 11.7790 11.7790 12.0809 12.0809 12.5377 12.5377 12.9831 12.9831 13.8580 13.8580 14.1169 14.1169 k = 0.3340 0.5761 0.5421 ( 6634 PWs) bands (ev): 1.3279 1.3279 1.3397 1.3397 2.4897 2.4897 3.5886 3.5886 4.8484 4.8484 5.2153 5.2153 5.6756 5.6756 5.8723 5.8723 6.3675 6.3675 6.5000 6.5000 6.6455 6.6455 6.6542 6.6542 6.7156 6.7156 6.8849 6.8849 6.9331 6.9331 6.9920 6.9920 7.1354 7.1354 7.2050 7.2050 7.3006 7.3006 7.4054 7.4054 7.5322 7.5322 7.6442 7.6442 7.7434 7.7434 7.8255 7.8255 7.9070 7.9070 8.0423 8.0423 8.1938 8.1938 8.2391 8.2391 8.3459 8.3459 8.4105 8.4105 8.9852 8.9852 9.2595 9.2595 9.4306 9.4306 9.5902 9.5902 9.6703 9.6703 11.4302 11.4302 11.7200 11.7200 11.8111 11.8111 12.1293 12.1293 12.4736 12.4736 12.9545 12.9545 13.8659 13.8659 14.1734 14.1734 k = 0.3402 0.5654 0.5220 ( 6638 PWs) bands (ev): 1.2692 1.2692 1.3067 1.3067 2.4877 2.4877 3.5885 3.5885 4.8727 4.8727 5.2538 5.2538 5.7107 5.7107 5.8278 5.8278 6.3478 6.3478 6.5204 6.5204 6.6399 6.6399 6.6428 6.6428 6.7154 6.7154 6.8648 6.8648 6.9270 6.9270 6.9915 6.9915 7.1271 7.1271 7.2039 7.2039 7.3057 7.3057 7.4236 7.4236 7.5355 7.5355 7.6424 7.6424 7.7536 7.7536 7.8389 7.8389 7.9380 7.9380 8.0540 8.0540 8.1972 8.1972 8.2453 8.2453 8.3689 8.3689 8.4011 8.4011 8.9952 8.9952 9.2771 9.2771 9.4642 9.4642 9.5786 9.5786 9.6879 9.6879 11.4420 11.4420 11.7218 11.7218 11.8464 11.8464 12.1771 12.1771 12.4082 12.4082 12.9258 12.9258 13.8782 13.8782 14.2261 14.2261 k = 0.3463 0.5547 0.5020 ( 6628 PWs) bands (ev): 1.2110 1.2110 1.2739 1.2739 2.4818 2.4818 3.5885 3.5885 4.9002 4.9002 5.2918 5.2918 5.7472 5.7472 5.7846 5.7846 6.3263 6.3263 6.5389 6.5389 6.6295 6.6295 6.6342 6.6342 6.7162 6.7162 6.8421 6.8421 6.9224 6.9224 6.9929 6.9929 7.1206 7.1206 7.2006 7.2006 7.3136 7.3136 7.4458 7.4458 7.5397 7.5397 7.6391 7.6391 7.7632 7.7632 7.8497 7.8497 7.9703 7.9703 8.0652 8.0652 8.1985 8.1985 8.2519 8.2519 8.3739 8.3739 8.4056 8.4056 9.0054 9.0054 9.2969 9.2969 9.4994 9.4994 9.5702 9.5702 9.7105 9.7105 11.4578 11.4578 11.7206 11.7206 11.8843 11.8843 12.2239 12.2239 12.3417 12.3417 12.8972 12.8972 13.8934 13.8934 14.2712 14.2712 k = 0.3525 0.5440 0.4819 ( 6632 PWs) bands (ev): 1.1543 1.1543 1.2408 1.2408 2.4725 2.4725 3.5886 3.5886 4.9305 4.9305 5.3291 5.3291 5.7392 5.7392 5.7880 5.7880 6.3033 6.3033 6.5544 6.5544 6.6165 6.6165 6.6280 6.6280 6.7172 6.7172 6.8177 6.8177 6.9184 6.9184 6.9960 6.9960 7.1159 7.1159 7.1958 7.1958 7.3234 7.3234 7.4719 7.4719 7.5453 7.5453 7.6348 7.6348 7.7724 7.7724 7.8593 7.8593 8.0010 8.0010 8.0760 8.0760 8.1987 8.1987 8.2577 8.2577 8.3629 8.3629 8.4228 8.4228 9.0155 9.0155 9.3190 9.3190 9.5185 9.5185 9.5835 9.5835 9.7382 9.7382 11.4773 11.4773 11.7161 11.7161 11.9245 11.9245 12.2661 12.2661 12.2783 12.2783 12.8687 12.8687 13.9091 13.9091 14.3040 14.3040 k = 0.3586 0.5332 0.4618 ( 6644 PWs) bands (ev): 1.0992 1.0992 1.2075 1.2075 2.4604 2.4604 3.5888 3.5888 4.9633 4.9633 5.3658 5.3658 5.6974 5.6974 5.8268 5.8268 6.2793 6.2793 6.5636 6.5636 6.6051 6.6051 6.6233 6.6233 6.7176 6.7176 6.7928 6.7928 6.9146 6.9146 7.0008 7.0008 7.1126 7.1126 7.1903 7.1903 7.3344 7.3344 7.5005 7.5005 7.5540 7.5540 7.6300 7.6300 7.7811 7.7811 7.8680 7.8680 8.0283 8.0283 8.0866 8.0866 8.1981 8.1981 8.2623 8.2623 8.3496 8.3496 8.4399 8.4399 9.0255 9.0255 9.3432 9.3432 9.5120 9.5120 9.6282 9.6282 9.7712 9.7712 11.5003 11.5003 11.7079 11.7079 11.9667 11.9667 12.2064 12.2064 12.3156 12.3156 12.8404 12.8404 13.9228 13.9228 14.3201 14.3201 k = 0.3648 0.5225 0.4417 ( 6642 PWs) bands (ev): 1.0459 1.0459 1.1742 1.1742 2.4458 2.4458 3.5891 3.5891 4.9980 4.9980 5.4019 5.4019 5.6562 5.6562 5.8660 5.8660 6.2543 6.2543 6.5604 6.5604 6.5991 6.5991 6.6229 6.6229 6.7169 6.7169 6.7683 6.7683 6.9108 6.9108 7.0072 7.0072 7.1105 7.1105 7.1845 7.1845 7.3460 7.3460 7.5257 7.5257 7.5715 7.5715 7.6257 7.6257 7.7895 7.7895 7.8761 7.8761 8.0506 8.0506 8.0970 8.0970 8.1973 8.1973 8.2655 8.2655 8.3370 8.3370 8.4551 8.4551 9.0351 9.0351 9.3694 9.3694 9.4982 9.4982 9.6862 9.6862 9.8097 9.8097 11.5267 11.5267 11.6953 11.6953 12.0101 12.0101 12.1406 12.1406 12.3592 12.3592 12.8123 12.8123 13.9319 13.9319 14.3165 14.3165 k = 0.3709 0.5118 0.4217 ( 6638 PWs) bands (ev): 0.9944 0.9944 1.1412 1.1412 2.4292 2.4292 3.5894 3.5894 5.0344 5.0344 5.4372 5.4372 5.6162 5.6162 5.9045 5.9045 6.2287 6.2287 6.5464 6.5464 6.5947 6.5947 6.6290 6.6290 6.7131 6.7131 6.7463 6.7463 6.9071 6.9071 7.0147 7.0147 7.1097 7.1097 7.1789 7.1789 7.3579 7.3579 7.5407 7.5407 7.5985 7.5985 7.6284 7.6284 7.7975 7.7975 7.8836 7.8836 8.0670 8.0670 8.1065 8.1065 8.1966 8.1966 8.2676 8.2676 8.3263 8.3263 8.4684 8.4684 9.0443 9.0443 9.3974 9.3974 9.4835 9.4835 9.7512 9.7512 9.8538 9.8538 11.5561 11.5561 11.6776 11.6776 12.0445 12.0445 12.0873 12.0873 12.4015 12.4015 12.7846 12.7846 13.9345 13.9345 14.2942 14.2942 k = 0.3771 0.5011 0.4016 ( 6646 PWs) bands (ev): 0.9448 0.9448 1.1085 1.1085 2.4111 2.4111 3.5898 3.5898 5.0721 5.0721 5.4718 5.4718 5.5775 5.5775 5.9416 5.9416 6.2027 6.2027 6.5277 6.5277 6.5884 6.5884 6.6386 6.6386 6.7016 6.7016 6.7320 6.7320 6.9034 6.9034 7.0230 7.0230 7.1098 7.1098 7.1737 7.1737 7.3699 7.3699 7.5497 7.5497 7.6047 7.6047 7.6640 7.6640 7.8054 7.8054 7.8906 7.8906 8.0778 8.0778 8.1134 8.1134 8.1964 8.1964 8.2691 8.2691 8.3180 8.3180 8.4799 8.4799 9.0526 9.0526 9.4269 9.4269 9.4694 9.4694 9.8215 9.8215 9.9034 9.9034 11.5883 11.5883 11.6533 11.6533 12.0049 12.0049 12.1130 12.1130 12.4423 12.4423 12.7572 12.7572 13.9301 13.9301 14.2570 14.2570 k = 0.3832 0.4904 0.3815 ( 6640 PWs) bands (ev): 0.8972 0.8972 1.0764 1.0764 2.3918 2.3918 3.5902 3.5902 5.1109 5.1109 5.5054 5.5054 5.5404 5.5404 5.9768 5.9768 6.1766 6.1766 6.5071 6.5071 6.5811 6.5811 6.6475 6.6475 6.6834 6.6834 6.7260 6.7260 6.8999 6.8999 7.0317 7.0317 7.1109 7.1109 7.1693 7.1693 7.3817 7.3817 7.5568 7.5568 7.6003 7.6003 7.7177 7.7177 7.8138 7.8138 7.8972 7.8972 8.0833 8.0833 8.1170 8.1170 8.1966 8.1966 8.2709 8.2709 8.3123 8.3123 8.4899 8.4899 9.0601 9.0601 9.4567 9.4567 9.4581 9.4581 9.8959 9.8959 9.9588 9.9588 11.6191 11.6191 11.6250 11.6250 11.9497 11.9497 12.1613 12.1613 12.4814 12.4814 12.7301 12.7301 13.9193 13.9193 14.2096 14.2096 k = 0.3894 0.4797 0.3614 ( 6648 PWs) bands (ev): 0.8517 0.8517 1.0451 1.0451 2.3717 2.3717 3.5906 3.5906 5.1503 5.1503 5.5036 5.5036 5.5396 5.5396 6.0097 6.0097 6.1505 6.1505 6.4851 6.4851 6.5728 6.5728 6.6461 6.6461 6.6726 6.6726 6.7228 6.7228 6.8965 6.8965 7.0404 7.0404 7.1128 7.1128 7.1658 7.1658 7.3932 7.3932 7.5634 7.5634 7.5945 7.5945 7.7742 7.7742 7.8265 7.8265 7.9039 7.9039 8.0833 8.0833 8.1182 8.1182 8.1968 8.1968 8.2728 8.2728 8.3092 8.3092 8.4987 8.4987 9.0664 9.0664 9.4463 9.4463 9.4902 9.4902 9.9732 9.9732 10.0203 10.0203 11.5788 11.5788 11.6601 11.6601 11.9005 11.9005 12.2124 12.2124 12.5187 12.5187 12.7034 12.7034 13.9036 13.9036 14.1557 14.1557 k = 0.3955 0.4689 0.3413 ( 6634 PWs) bands (ev): 0.8083 0.8083 1.0146 1.0146 2.3513 2.3513 3.5910 3.5910 5.1903 5.1903 5.4697 5.4697 5.5719 5.5719 6.0397 6.0397 6.1250 6.1250 6.4623 6.4623 6.5640 6.5640 6.6281 6.6281 6.6777 6.6777 6.7203 6.7203 6.8933 6.8933 7.0486 7.0486 7.1152 7.1152 7.1638 7.1638 7.4046 7.4046 7.5697 7.5697 7.5886 7.5886 7.8085 7.8085 7.8629 7.8629 7.9144 7.9144 8.0773 8.0773 8.1193 8.1193 8.1968 8.1968 8.2736 8.2736 8.3093 8.3093 8.5066 8.5066 9.0714 9.0714 9.4383 9.4383 9.5234 9.5234 10.0514 10.0514 10.0888 10.0888 11.5265 11.5265 11.6982 11.6982 11.8597 11.8597 12.2650 12.2650 12.5540 12.5540 12.6770 12.6770 13.8842 13.8842 14.0977 14.0977 k = 0.4017 0.4582 0.3213 ( 6630 PWs) bands (ev): 0.7670 0.7670 0.9852 0.9852 2.3307 2.3307 3.5914 3.5914 5.2304 5.2304 5.4372 5.4372 5.6037 5.6037 6.0652 6.0652 6.1017 6.1017 6.4388 6.4388 6.5545 6.5545 6.6064 6.6064 6.6859 6.6859 6.7180 6.7180 6.8905 6.8905 7.0561 7.0561 7.1178 7.1178 7.1637 7.1637 7.4156 7.4156 7.5750 7.5750 7.5838 7.5838 7.8190 7.8190 7.8976 7.8976 7.9542 7.9542 8.0668 8.0668 8.1211 8.1211 8.1966 8.1966 8.2723 8.2723 8.3124 8.3124 8.5136 8.5136 9.0751 9.0751 9.4330 9.4330 9.5574 9.5574 10.1284 10.1284 10.1657 10.1657 11.4647 11.4647 11.7355 11.7355 11.8292 11.8292 12.3189 12.3189 12.5869 12.5869 12.6512 12.6512 13.8622 13.8622 14.0374 14.0374 k = 0.4078 0.4475 0.3012 ( 6626 PWs) bands (ev): 0.7281 0.7281 0.9569 0.9569 2.3102 2.3102 3.5918 3.5918 5.2705 5.2705 5.4064 5.4064 5.6350 5.6350 6.0676 6.0676 6.0993 6.0993 6.4147 6.4147 6.5444 6.5444 6.5847 6.5847 6.6934 6.6934 6.7163 6.7163 6.8879 6.8879 7.0625 7.0625 7.1200 7.1200 7.1659 7.1659 7.4263 7.4263 7.5741 7.5741 7.5854 7.5854 7.8245 7.8245 7.9063 7.9063 8.0237 8.0237 8.0560 8.0560 8.1246 8.1246 8.1968 8.1968 8.2688 8.2688 8.3176 8.3176 8.5201 8.5201 9.0775 9.0775 9.4306 9.4306 9.5918 9.5918 10.2042 10.2042 10.2499 10.2499 11.3949 11.3949 11.7609 11.7609 11.8182 11.8182 12.3736 12.3736 12.6145 12.6145 12.6287 12.6287 13.8385 13.8385 13.9759 13.9759 k = 0.4139 0.4368 0.2811 ( 6626 PWs) bands (ev): 0.6914 0.6914 0.9299 0.9299 2.2901 2.2901 3.5922 3.5922 5.3099 5.3099 5.3779 5.3779 5.6655 5.6655 6.0463 6.0463 6.1189 6.1189 6.3903 6.3903 6.5337 6.5337 6.5639 6.5639 6.6984 6.6984 6.7162 6.7162 6.8856 6.8856 7.0677 7.0677 7.1218 7.1218 7.1705 7.1705 7.4367 7.4367 7.5691 7.5691 7.5914 7.5914 7.8283 7.8283 7.9101 7.9101 8.0343 8.0343 8.0953 8.0953 8.1425 8.1425 8.1983 8.1983 8.2646 8.2646 8.3236 8.3236 8.5260 8.5260 9.0788 9.0788 9.4311 9.4311 9.6265 9.6265 10.2801 10.2801 10.3388 10.3388 11.3191 11.3191 11.7557 11.7557 11.8437 11.8437 12.4289 12.4289 12.5981 12.5981 12.6482 12.6482 13.8139 13.8139 13.9141 13.9141 k = 0.4201 0.4261 0.2610 ( 6628 PWs) bands (ev): 0.6571 0.6571 0.9043 0.9043 2.2706 2.2706 3.5925 3.5925 5.3416 5.3416 5.3583 5.3583 5.6954 5.6954 6.0235 6.0235 6.1383 6.1383 6.3656 6.3656 6.5223 6.5223 6.5442 6.5442 6.6996 6.6996 6.7193 6.7193 6.8836 6.8836 7.0717 7.0717 7.1232 7.1232 7.1773 7.1773 7.4467 7.4467 7.5637 7.5637 7.5980 7.5980 7.8309 7.8309 7.9122 7.9122 8.0189 8.0189 8.1112 8.1112 8.1876 8.1876 8.2194 8.2194 8.2658 8.2658 8.3296 8.3296 8.5316 8.5316 9.0794 9.0794 9.4344 9.4344 9.6610 9.6610 10.3570 10.3570 10.4306 10.4306 11.2387 11.2387 11.7395 11.7395 11.8844 11.8844 12.4843 12.4843 12.5731 12.5731 12.6741 12.6741 13.7886 13.7886 13.8527 13.8527 k = 0.4262 0.4153 0.2409 ( 6634 PWs) bands (ev): 0.6251 0.6251 0.8802 0.8802 2.2519 2.2519 3.5928 3.5928 5.3231 5.3231 5.3903 5.3903 5.7246 5.7246 6.0015 6.0015 6.1558 6.1558 6.3408 6.3408 6.5102 6.5102 6.5259 6.5259 6.6979 6.6979 6.7243 6.7243 6.8818 6.8818 7.0746 7.0746 7.1244 7.1244 7.1856 7.1856 7.4564 7.4564 7.5586 7.5586 7.6047 7.6047 7.8327 7.8327 7.9132 7.9132 8.0029 8.0029 8.1126 8.1126 8.1934 8.1934 8.2408 8.2408 8.3227 8.3227 8.3353 8.3353 8.5370 8.5370 9.0798 9.0798 9.4401 9.4401 9.6950 9.6950 10.4347 10.4347 10.5242 10.5242 11.1551 11.1551 11.7229 11.7229 11.9284 11.9284 12.5357 12.5357 12.5518 12.5518 12.6979 12.6979 13.7627 13.7627 13.7927 13.7927 k = 0.4324 0.4046 0.2209 ( 6638 PWs) bands (ev): 0.5956 0.5956 0.8577 0.8577 2.2341 2.2341 3.5931 3.5931 5.3001 5.3001 5.4275 5.4275 5.7533 5.7533 5.9806 5.9806 6.1711 6.1711 6.3159 6.3159 6.4972 6.4972 6.5093 6.5093 6.6950 6.6950 6.7299 6.7299 6.8803 6.8803 7.0765 7.0765 7.1257 7.1257 7.1949 7.1949 7.4657 7.4657 7.5538 7.5538 7.6113 7.6113 7.8337 7.8337 7.9131 7.9131 7.9874 7.9874 8.1116 8.1116 8.1947 8.1947 8.2364 8.2364 8.3399 8.3399 8.4131 8.4131 8.5427 8.5427 9.0808 9.0808 9.4480 9.4480 9.7283 9.7283 10.5126 10.5126 10.6188 10.6188 11.0690 11.0690 11.7074 11.7074 11.9732 11.9732 12.5206 12.5206 12.5965 12.5965 12.7194 12.7194 13.7291 13.7291 13.7420 13.7420 k = 0.4385 0.3939 0.2008 ( 6656 PWs) bands (ev): 0.5685 0.5685 0.8369 0.8369 2.2175 2.2175 3.5933 3.5933 5.2788 5.2788 5.4636 5.4636 5.7812 5.7812 5.9610 5.9610 6.1845 6.1845 6.2910 6.2910 6.4837 6.4837 6.4943 6.4943 6.6916 6.6916 6.7352 6.7352 6.8791 6.8791 7.0775 7.0775 7.1273 7.1273 7.2047 7.2047 7.4745 7.4745 7.5493 7.5493 7.6178 7.6178 7.8340 7.8340 7.9117 7.9117 7.9732 7.9732 8.1097 8.1097 8.1955 8.1955 8.2297 8.2297 8.3441 8.3441 8.5022 8.5022 8.5522 8.5522 9.0836 9.0836 9.4577 9.4577 9.7605 9.7605 10.5899 10.5899 10.7138 10.7138 10.9811 10.9811 11.6931 11.6931 12.0179 12.0179 12.4953 12.4953 12.6503 12.6503 12.7386 12.7386 13.6745 13.6745 13.7137 13.7137 k = 0.4447 0.3832 0.1807 ( 6670 PWs) bands (ev): 0.5439 0.5439 0.8178 0.8178 2.2021 2.2021 3.5935 3.5935 5.2593 5.2593 5.4982 5.4982 5.8087 5.8087 5.9430 5.9430 6.1961 6.1961 6.2662 6.2662 6.4700 6.4700 6.4808 6.4808 6.6882 6.6882 6.7400 6.7400 6.8780 6.8780 7.0779 7.0779 7.1291 7.1291 7.2146 7.2146 7.4830 7.4830 7.5453 7.5453 7.6240 7.6240 7.8337 7.8337 7.9087 7.9087 7.9609 7.9609 8.1073 8.1073 8.1957 8.1957 8.2229 8.2229 8.3477 8.3477 8.5426 8.5426 8.6084 8.6084 9.0897 9.0897 9.4689 9.4689 9.7912 9.7912 10.6659 10.6659 10.8081 10.8081 10.8921 10.8921 11.6800 11.6800 12.0615 12.0615 12.4698 12.4698 12.7014 12.7014 12.7570 12.7570 13.6202 13.6202 13.6708 13.6708 k = 0.4508 0.3725 0.1606 ( 6682 PWs) bands (ev): 0.5218 0.5218 0.8005 0.8005 2.1880 2.1880 3.5937 3.5937 5.2418 5.2418 5.5308 5.5308 5.8355 5.8355 5.9266 5.9266 6.2059 6.2059 6.2418 6.2418 6.4569 6.4569 6.4682 6.4682 6.6848 6.6848 6.7443 6.7443 6.8772 6.8772 7.0778 7.0778 7.1310 7.1310 7.2242 7.2242 7.4909 7.4909 7.5417 7.5417 7.6299 7.6299 7.8329 7.8329 7.9035 7.9035 7.9514 7.9514 8.1048 8.1048 8.1951 8.1951 8.2172 8.2172 8.3507 8.3507 8.5493 8.5493 8.6920 8.6920 9.1017 9.1017 9.4814 9.4814 9.8200 9.8200 10.7394 10.7394 10.8016 10.8016 10.9020 10.9020 11.6680 11.6680 12.1035 12.1035 12.4444 12.4444 12.7422 12.7422 12.7813 12.7813 13.5631 13.5632 13.5743 13.5743 k = 0.4570 0.3618 0.1406 ( 6668 PWs) bands (ev): 0.5023 0.5023 0.7852 0.7852 2.1754 2.1754 3.5938 3.5938 5.2264 5.2264 5.5610 5.5610 5.8618 5.8618 5.9119 5.9119 6.2115 6.2115 6.2203 6.2203 6.4447 6.4447 6.4566 6.4566 6.6816 6.6816 6.7481 6.7481 6.8766 6.8766 7.0775 7.0775 7.1331 7.1331 7.2333 7.2333 7.4982 7.4982 7.5387 7.5387 7.6354 7.6354 7.8319 7.8319 7.8963 7.8963 7.9448 7.9448 8.1023 8.1023 8.1930 8.1930 8.2131 8.2131 8.3532 8.3532 8.5533 8.5533 8.7672 8.7672 9.1230 9.1230 9.4953 9.4953 9.8465 9.8465 10.7116 10.7116 10.8096 10.8096 10.9926 10.9926 11.6573 11.6573 12.1431 12.1431 12.4195 12.4195 12.7610 12.7610 12.8225 12.8225 13.4636 13.4636 13.5225 13.5225 k = 0.4631 0.3510 0.1205 ( 6662 PWs) bands (ev): 0.4853 0.4853 0.7717 0.7717 2.1643 2.1643 3.5940 3.5940 5.2129 5.2129 5.5883 5.5883 5.8873 5.8873 5.8994 5.8994 6.1919 6.1919 6.2229 6.2229 6.4335 6.4335 6.4460 6.4460 6.6786 6.6786 6.7514 6.7514 6.8762 6.8762 7.0770 7.0770 7.1351 7.1351 7.2416 7.2416 7.5049 7.5049 7.5362 7.5362 7.6403 7.6403 7.8308 7.8308 7.8878 7.8878 7.9406 7.9406 8.0999 8.0999 8.1895 8.1895 8.2110 8.2110 8.3553 8.3553 8.5564 8.5564 8.8269 8.8269 9.1569 9.1569 9.5108 9.5108 9.8705 9.8705 10.6225 10.6225 10.8749 10.8749 11.0794 11.0794 11.6478 11.6478 12.1795 12.1795 12.3955 12.3955 12.7676 12.7676 12.8700 12.8700 13.3679 13.3679 13.4789 13.4789 k = 0.4693 0.3403 0.1004 ( 6670 PWs) bands (ev): 0.4709 0.4709 0.7603 0.7603 2.1548 2.1548 3.5940 3.5940 5.2015 5.2015 5.6125 5.6125 5.8880 5.8880 5.9129 5.9129 6.1681 6.1681 6.2286 6.2286 6.4234 6.4234 6.4366 6.4366 6.6760 6.6760 6.7541 6.7541 6.8758 6.8758 7.0764 7.0764 7.1369 7.1369 7.2489 7.2489 7.5107 7.5107 7.5342 7.5342 7.6446 7.6446 7.8297 7.8297 7.8789 7.8789 7.9379 7.9379 8.0977 8.0977 8.1852 8.1852 8.2103 8.2103 8.3569 8.3569 8.5590 8.5590 8.8686 8.8686 9.2030 9.2030 9.5285 9.5285 9.8914 9.8914 10.5354 10.5354 10.9340 10.9340 11.1605 11.1605 11.6396 11.6396 12.2117 12.2117 12.3731 12.3731 12.7674 12.7674 12.9174 12.9174 13.2832 13.2832 13.4399 13.4399 k = 0.4754 0.3296 0.0803 ( 6666 PWs) bands (ev): 0.4591 0.4591 0.7509 0.7509 2.1470 2.1470 3.5941 3.5941 5.1922 5.1922 5.6329 5.6329 5.8793 5.8793 5.9372 5.9372 6.1447 6.1447 6.2334 6.2334 6.4146 6.4146 6.4288 6.4288 6.6737 6.6737 6.7563 6.7563 6.8756 6.8756 7.0759 7.0759 7.1385 7.1385 7.2552 7.2552 7.5154 7.5154 7.5331 7.5331 7.6482 7.6482 7.8289 7.8289 7.8706 7.8706 7.9361 7.9361 8.0958 8.0958 8.1810 8.1810 8.2102 8.2102 8.3582 8.3582 8.5610 8.5610 8.8946 8.8946 9.2553 9.2553 9.5494 9.5494 9.9090 9.9090 10.4523 10.4523 10.9856 10.9856 11.2334 11.2334 11.6327 11.6327 12.2388 12.2388 12.3533 12.3533 12.7615 12.7615 12.9627 12.9627 13.2124 13.2124 13.4054 13.4054 k = 0.4816 0.3189 0.0602 ( 6668 PWs) bands (ev): 0.4499 0.4499 0.7435 0.7435 2.1408 2.1408 3.5942 3.5942 5.1850 5.1850 5.6492 5.6492 5.8724 5.8724 5.9608 5.9608 6.1218 6.1218 6.2371 6.2371 6.4073 6.4073 6.4227 6.4227 6.6719 6.6719 6.7580 6.7580 6.8755 6.8755 7.0754 7.0754 7.1398 7.1398 7.2601 7.2601 7.5186 7.5186 7.5327 7.5327 7.6509 7.6509 7.8284 7.8284 7.8633 7.8633 7.9350 7.9350 8.0943 8.0943 8.1774 8.1774 8.2104 8.2104 8.3591 8.3591 8.5627 8.5627 8.9098 8.9098 9.3043 9.3043 9.5743 9.5743 9.9229 9.9229 10.3764 10.3764 11.0279 11.0279 11.2955 11.2955 11.6273 11.6273 12.2596 12.2596 12.3376 12.3376 12.7512 12.7512 13.0044 13.0044 13.1576 13.1576 13.3742 13.3742 k = 0.4877 0.3082 0.0402 ( 6676 PWs) bands (ev): 0.4434 0.4434 0.7382 0.7382 2.1364 2.1364 3.5942 3.5942 5.1798 5.1798 5.6611 5.6611 5.8676 5.8676 5.9827 5.9827 6.1002 6.1002 6.2398 6.2398 6.4018 6.4018 6.4183 6.4183 6.6706 6.6706 6.7592 6.7592 6.8753 6.8753 7.0750 7.0750 7.1408 7.1408 7.2638 7.2638 7.5204 7.5204 7.5332 7.5332 7.6529 7.6529 7.8283 7.8283 7.8575 7.8575 7.9343 7.9343 8.0932 8.0932 8.1746 8.1746 8.2106 8.2106 8.3598 8.3598 8.5638 8.5638 8.9183 8.9183 9.3421 9.3421 9.6015 9.6015 9.9330 9.9330 10.3129 10.3129 11.0595 11.0595 11.3433 11.3433 11.6234 11.6234 12.2731 12.2731 12.3273 12.3273 12.7390 12.7390 13.0404 13.0404 13.1197 13.1197 13.3449 13.3449 k = 0.4939 0.2974 0.0201 ( 6680 PWs) bands (ev): 0.4394 0.4394 0.7351 0.7351 2.1338 2.1338 3.5942 3.5942 5.1766 5.1766 5.6684 5.6684 5.8647 5.8647 6.0011 6.0011 6.0822 6.0822 6.2414 6.2414 6.3984 6.3984 6.4156 6.4156 6.6698 6.6698 6.7599 6.7599 6.8753 6.8753 7.0748 7.0748 7.1413 7.1413 7.2659 7.2659 7.5212 7.5212 7.5338 7.5338 7.6540 7.6540 7.8285 7.8285 7.8537 7.8537 7.9339 7.9339 8.0925 8.0925 8.1729 8.1729 8.2107 8.2107 8.3602 8.3602 8.5645 8.5645 8.9226 8.9226 9.3649 9.3649 9.6245 9.6245 9.9390 9.9390 10.2691 10.2691 11.0790 11.0790 11.3737 11.3737 11.6210 11.6210 12.2791 12.2791 12.3230 12.3230 12.7290 12.7290 13.0661 13.0661 13.0982 13.0982 13.3215 13.3215 k = 0.5000 0.2867 0.0000 ( 6682 PWs) bands (ev): 0.4381 0.4381 0.7340 0.7340 2.1329 2.1329 3.5942 3.5942 5.1756 5.1756 5.6708 5.6708 5.8637 5.8637 6.0093 6.0093 6.0739 6.0739 6.2420 6.2420 6.3972 6.3972 6.4148 6.4148 6.6695 6.6695 6.7601 6.7601 6.8752 6.8752 7.0747 7.0747 7.1415 7.1415 7.2666 7.2666 7.5214 7.5214 7.5341 7.5341 7.6544 7.6544 7.8286 7.8286 7.8524 7.8524 7.9338 7.9338 8.0923 8.0923 8.1723 8.1723 8.2108 8.2108 8.3603 8.3603 8.5647 8.5647 8.9239 8.9239 9.3723 9.3723 9.6337 9.6337 9.9410 9.9410 10.2532 10.2532 11.0857 11.0857 11.3841 11.3841 11.6202 11.6202 12.2804 12.2804 12.3222 12.3222 12.7251 12.7251 13.0754 13.0754 13.0918 13.0918 13.3122 13.3122 k = 0.5000 0.2867 0.0000 ( 6682 PWs) bands (ev): 0.4381 0.4381 0.7340 0.7340 2.1329 2.1329 3.5942 3.5942 5.1756 5.1756 5.6708 5.6708 5.8637 5.8637 6.0093 6.0093 6.0739 6.0739 6.2420 6.2420 6.3972 6.3972 6.4148 6.4148 6.6695 6.6695 6.7601 6.7601 6.8752 6.8752 7.0747 7.0747 7.1415 7.1415 7.2666 7.2666 7.5214 7.5214 7.5341 7.5341 7.6544 7.6544 7.8286 7.8286 7.8524 7.8524 7.9338 7.9338 8.0923 8.0923 8.1723 8.1723 8.2108 8.2108 8.3603 8.3603 8.5647 8.5647 8.9239 8.9239 9.3723 9.3723 9.6337 9.6337 9.9410 9.9410 10.2532 10.2532 11.0857 11.0857 11.3841 11.3841 11.6202 11.6202 12.2804 12.2804 12.3222 12.3222 12.7251 12.7251 13.0754 13.0754 13.0918 13.0918 13.3122 13.3122 k = 0.4792 0.2748 0.0000 ( 6680 PWs) bands (ev): 0.4263 0.4263 0.7473 0.7473 2.1336 2.1336 3.5948 3.5948 5.1728 5.1728 5.6623 5.6623 5.8618 5.8618 6.0153 6.0153 6.0744 6.0744 6.2423 6.2423 6.3979 6.3979 6.4157 6.4157 6.6706 6.6706 6.7613 6.7613 6.8750 6.8750 7.0748 7.0748 7.1417 7.1417 7.2664 7.2664 7.5211 7.5211 7.5341 7.5341 7.6543 7.6543 7.8214 7.8214 7.8513 7.8513 7.9338 7.9338 8.0901 8.0901 8.1743 8.1743 8.2108 8.2108 8.3603 8.3603 8.5692 8.5692 8.9323 8.9323 9.3704 9.3704 9.6328 9.6328 9.9387 9.9387 10.2546 10.2546 11.0893 11.0893 11.3877 11.3877 11.6178 11.6178 12.2855 12.2855 12.3262 12.3262 12.7169 12.7169 13.0746 13.0746 13.0883 13.0883 13.3132 13.3132 k = 0.4583 0.2628 0.0000 ( 6676 PWs) bands (ev): 0.3960 0.3960 0.7822 0.7822 2.1357 2.1357 3.5964 3.5964 5.1647 5.1647 5.6383 5.6383 5.8562 5.8562 6.0311 6.0311 6.0759 6.0759 6.2434 6.2434 6.3998 6.3998 6.4184 6.4184 6.6739 6.6739 6.7648 6.7648 6.8745 6.8745 7.0749 7.0749 7.1420 7.1420 7.2656 7.2656 7.5201 7.5201 7.5338 7.5338 7.6539 7.6539 7.7999 7.7999 7.8504 7.8504 7.9338 7.9338 8.0837 8.0837 8.1746 8.1746 8.2108 8.2108 8.3646 8.3646 8.5822 8.5822 8.9565 8.9565 9.3648 9.3648 9.6303 9.6303 9.9319 9.9319 10.2586 10.2586 11.1001 11.1001 11.3982 11.3982 11.6111 11.6111 12.3005 12.3005 12.3382 12.3382 12.6930 12.6930 13.0723 13.0723 13.0806 13.0806 13.2778 13.2778 k = 0.4375 0.2509 0.0000 ( 6672 PWs) bands (ev): 0.3555 0.3555 0.8304 0.8304 2.1393 2.1393 3.5992 3.5992 5.1513 5.1513 5.6027 5.6027 5.8472 5.8472 6.0507 6.0507 6.0804 6.0804 6.2452 6.2452 6.4029 6.4029 6.4233 6.4233 6.6792 6.6792 6.7706 6.7706 6.8736 6.8736 7.0752 7.0752 7.1426 7.1426 7.2644 7.2644 7.5185 7.5185 7.5334 7.5334 7.6527 7.6527 7.7685 7.7685 7.8508 7.8508 7.9335 7.9335 8.0737 8.0737 8.1628 8.1628 8.2112 8.2112 8.3820 8.3820 8.6029 8.6029 8.9933 8.9933 9.3557 9.3557 9.6261 9.6261 9.9207 9.9207 10.2654 10.2654 11.1178 11.1178 11.4156 11.4156 11.6008 11.6008 12.3242 12.3242 12.3581 12.3581 12.6560 12.6560 13.0684 13.0684 13.0733 13.0733 13.2176 13.2176 k = 0.4167 0.2389 0.0000 ( 6670 PWs) bands (ev): 0.3104 0.3104 0.8861 0.8861 2.1442 2.1442 3.6030 3.6030 5.1333 5.1333 5.5588 5.5588 5.8351 5.8351 6.0643 6.0643 6.0942 6.0942 6.2476 6.2476 6.4072 6.4072 6.4300 6.4300 6.6863 6.6863 6.7787 6.7787 6.8724 6.8724 7.0756 7.0756 7.1435 7.1435 7.2627 7.2627 7.5163 7.5163 7.5327 7.5327 7.6494 7.6494 7.7332 7.7332 7.8518 7.8518 7.9327 7.9327 8.0606 8.0606 8.1359 8.1359 8.2118 8.2118 8.4147 8.4147 8.6303 8.6303 9.0394 9.0394 9.3434 9.3434 9.6204 9.6204 9.9057 9.9057 10.2747 10.2747 11.1423 11.1423 11.4392 11.4392 11.5884 11.5884 12.3550 12.3550 12.3858 12.3858 12.6092 12.6092 13.0623 13.0623 13.0688 13.0688 13.1519 13.1519 k = 0.3958 0.2270 0.0000 ( 6662 PWs) bands (ev): 0.2638 0.2638 0.9462 0.9462 2.1504 2.1504 3.6079 3.6079 5.1110 5.1110 5.5093 5.5093 5.8199 5.8199 6.0694 6.0694 6.1171 6.1171 6.2507 6.2507 6.4130 6.4130 6.4384 6.4384 6.6950 6.6950 6.7889 6.7889 6.8709 6.8709 7.0760 7.0760 7.1447 7.1447 7.2606 7.2606 7.5136 7.5136 7.5317 7.5317 7.6397 7.6397 7.7017 7.7017 7.8531 7.8531 7.9315 7.9315 8.0447 8.0447 8.0991 8.0991 8.2123 8.2123 8.4585 8.4585 8.6638 8.6638 9.0919 9.0919 9.3283 9.3283 9.6134 9.6134 9.8873 9.8873 10.2865 10.2865 11.1732 11.1732 11.4684 11.4684 11.5752 11.5752 12.3905 12.3905 12.4208 12.4208 12.5564 12.5564 13.0545 13.0545 13.0621 13.0621 13.0904 13.0904 k = 0.3750 0.2150 0.0000 ( 6668 PWs) bands (ev): 0.2173 0.2173 1.0089 1.0089 2.1578 2.1578 3.6138 3.6138 5.0852 5.0852 5.4559 5.4559 5.8016 5.8016 6.0720 6.0720 6.1417 6.1417 6.2544 6.2544 6.4209 6.4209 6.4478 6.4478 6.7048 6.7048 6.8012 6.8012 6.8691 6.8691 7.0764 7.0764 7.1462 7.1462 7.2582 7.2582 7.5102 7.5102 7.5303 7.5303 7.6159 7.6159 7.6835 7.6835 7.8544 7.8544 7.9296 7.9296 8.0235 8.0235 8.0604 8.0604 8.2128 8.2128 8.5084 8.5084 8.7023 8.7023 9.1485 9.1485 9.3109 9.3109 9.6052 9.6052 9.8661 9.8661 10.3005 10.3005 11.2101 11.2101 11.5025 11.5025 11.5627 11.5627 12.4241 12.4241 12.4622 12.4622 12.5056 12.5056 13.0130 13.0130 13.0452 13.0452 13.0754 13.0754 k = 0.3542 0.2031 0.0000 ( 6660 PWs) bands (ev): 0.1717 0.1717 1.0732 1.0732 2.1664 2.1664 3.6207 3.6207 5.0564 5.0564 5.4000 5.4000 5.7804 5.7804 6.0739 6.0739 6.1649 6.1649 6.2586 6.2586 6.4312 6.4312 6.4576 6.4576 6.7156 6.7156 6.8152 6.8152 6.8672 6.8672 7.0769 7.0769 7.1482 7.1482 7.2556 7.2556 7.5060 7.5060 7.5283 7.5283 7.5809 7.5809 7.6773 7.6773 7.8555 7.8555 7.9265 7.9265 7.9901 7.9901 8.0317 8.0317 8.2133 8.2133 8.5612 8.5612 8.7454 8.7454 9.2074 9.2074 9.2917 9.2917 9.5961 9.5961 9.8427 9.8427 10.3166 10.3166 11.2526 11.2526 11.5365 11.5365 11.5564 11.5564 12.4118 12.4118 12.4965 12.4965 12.5138 12.5138 12.9511 12.9511 13.0342 13.0342 13.0784 13.0784 k = 0.3333 0.1911 0.0000 ( 6650 PWs) bands (ev): 0.1276 0.1276 1.1384 1.1384 2.1759 2.1759 3.6285 3.6285 5.0254 5.0254 5.3425 5.3425 5.7566 5.7566 6.0757 6.0757 6.1858 6.1858 6.2633 6.2633 6.4442 6.4442 6.4676 6.4676 6.7272 6.7272 6.8307 6.8307 6.8652 6.8652 7.0774 7.0774 7.1505 7.1505 7.2529 7.2529 7.5001 7.5001 7.5248 7.5248 7.5445 7.5445 7.6760 7.6760 7.8556 7.8556 7.9180 7.9180 7.9508 7.9508 8.0133 8.0133 8.2139 8.2139 8.6149 8.6149 8.7924 8.7924 9.2655 9.2655 9.2732 9.2732 9.5862 9.5862 9.8176 9.8176 10.3343 10.3343 11.3003 11.3003 11.5384 11.5384 11.5884 11.5884 12.3535 12.3535 12.5368 12.5368 12.5665 12.5665 12.8932 12.8932 13.0215 13.0215 13.0842 13.0842 k = 0.3125 0.1792 0.0000 ( 6650 PWs) bands (ev): 0.0854 0.0854 1.2038 1.2038 2.1864 2.1864 3.6371 3.6371 4.9926 4.9926 5.2840 5.2840 5.7303 5.7303 6.0775 6.0775 6.2041 6.2041 6.2682 6.2682 6.4596 6.4596 6.4773 6.4773 6.7392 6.7392 6.8471 6.8471 6.8635 6.8635 7.0780 7.0780 7.1533 7.1533 7.2501 7.2501 7.4856 7.4856 7.5100 7.5100 7.5265 7.5265 7.6764 7.6764 7.8531 7.8531 7.8879 7.8879 7.9313 7.9313 7.9994 7.9994 8.2144 8.2144 8.6680 8.6680 8.8428 8.8428 9.2494 9.2494 9.3283 9.3283 9.5759 9.5759 9.7915 9.7915 10.3534 10.3534 11.3528 11.3528 11.5333 11.5333 11.6341 11.6341 12.2876 12.2876 12.5796 12.5796 12.6253 12.6253 12.8433 12.8433 13.0071 13.0071 13.0917 13.0917 k = 0.2917 0.1673 0.0000 ( 6650 PWs) bands (ev): 0.0452 0.0452 1.2690 1.2690 2.1975 2.1975 3.6465 3.6465 4.9587 4.9587 5.2253 5.2253 5.7021 5.7021 6.0792 6.0792 6.2197 6.2197 6.2734 6.2734 6.4769 6.4769 6.4868 6.4868 6.7516 6.7516 6.8587 6.8587 6.8673 6.8673 7.0789 7.0789 7.1564 7.1564 7.2474 7.2474 7.4532 7.4532 7.4994 7.4994 7.5222 7.5222 7.6778 7.6778 7.8326 7.8326 7.8605 7.8605 7.9253 7.9253 7.9885 7.9885 8.2150 8.2150 8.7197 8.7197 8.8962 8.8962 9.2277 9.2277 9.3879 9.3879 9.5653 9.5653 9.7648 9.7648 10.3733 10.3733 11.4096 11.4096 11.5312 11.5312 11.6831 11.6831 12.2195 12.2195 12.6128 12.6128 12.6890 12.6890 12.8093 12.8093 12.9910 12.9910 13.1004 13.1004 k = 0.2708 0.1553 0.0000 ( 6642 PWs) bands (ev): 0.0074 0.0074 1.3334 1.3334 2.2093 2.2093 3.6566 3.6566 4.9243 4.9243 5.1671 5.1671 5.6722 5.6722 6.0811 6.0811 6.2332 6.2332 6.2787 6.2787 6.4926 6.4926 6.4989 6.4989 6.7643 6.7643 6.8580 6.8580 6.8837 6.8837 7.0800 7.0800 7.1599 7.1599 7.2448 7.2448 7.4167 7.4167 7.4932 7.4932 7.5182 7.5182 7.6796 7.6796 7.7891 7.7891 7.8530 7.8530 7.9212 7.9212 7.9805 7.9805 8.2157 8.2157 8.7691 8.7691 8.9520 8.9520 9.2060 9.2060 9.4457 9.4457 9.5551 9.5551 9.7381 9.7381 10.3937 10.3937 11.4702 11.4702 11.5333 11.5333 11.7345 11.7345 12.1505 12.1505 12.6216 12.6216 12.7561 12.7561 12.8057 12.8057 12.9736 12.9736 13.1099 13.1099 k = 0.2500 0.1434 0.0000 ( 6640 PWs) bands (ev): -0.0281 -0.0281 1.3966 1.3966 2.2214 2.2214 3.6672 3.6672 4.8898 4.8898 5.1097 5.1097 5.6412 5.6412 6.0830 6.0830 6.2449 6.2449 6.2841 6.2841 6.5016 6.5016 6.5180 6.5180 6.7771 6.7771 6.8564 6.8564 6.9010 6.9010 7.0816 7.0816 7.1638 7.1638 7.2422 7.2422 7.3809 7.3809 7.4876 7.4876 7.5135 7.5135 7.6815 7.6815 7.7446 7.7446 7.8458 7.8458 7.9180 7.9180 7.9752 7.9752 8.2163 8.2163 8.8157 8.8157 9.0096 9.0096 9.1849 9.1849 9.4988 9.4988 9.5478 9.5478 9.7117 9.7117 10.4138 10.4138 11.5280 11.5280 11.5460 11.5460 11.7876 11.7876 12.0811 12.0811 12.6033 12.6033 12.8198 12.8198 12.8393 12.8393 12.9562 12.9562 13.1199 13.1199 k = 0.2292 0.1314 0.0000 ( 6634 PWs) bands (ev): -0.0610 -0.0610 1.4580 1.4580 2.2337 2.2337 3.6782 3.6782 4.8558 4.8558 5.0539 5.0539 5.6097 5.6097 6.0850 6.0850 6.2550 6.2550 6.2894 6.2894 6.5088 6.5088 6.5386 6.5386 6.7898 6.7898 6.8548 6.8548 6.9177 6.9177 7.0839 7.0839 7.1680 7.1680 7.2397 7.2397 7.3470 7.3470 7.4820 7.4820 7.5081 7.5081 7.6822 7.6822 7.7035 7.7035 7.8368 7.8368 7.9157 7.9157 7.9721 7.9721 8.2169 8.2169 8.8591 8.8591 9.0685 9.0685 9.1645 9.1645 9.5231 9.5231 9.5671 9.5671 9.6861 9.6861 10.4334 10.4334 11.5455 11.5455 11.6064 11.6064 11.8418 11.8418 12.0123 12.0123 12.5732 12.5732 12.8688 12.8688 12.8940 12.8940 12.9506 12.9506 13.1301 13.1301 k = 0.2083 0.1195 0.0000 ( 6628 PWs) bands (ev): -0.0913 -0.0913 1.5170 1.5170 2.2459 2.2459 3.6894 3.6894 4.8227 4.8227 5.0003 5.0003 5.5780 5.5780 6.0869 6.0869 6.2638 6.2638 6.2947 6.2947 6.5152 6.5152 6.5592 6.5592 6.8025 6.8025 6.8536 6.8536 6.9332 6.9332 7.0868 7.0868 7.1723 7.1723 7.2370 7.2370 7.3161 7.3161 7.4760 7.4760 7.5015 7.5015 7.6593 7.6593 7.6893 7.6893 7.8263 7.8263 7.9141 7.9141 7.9708 7.9708 8.2175 8.2175 8.8990 8.8990 9.1270 9.1270 9.1463 9.1463 9.5170 9.5170 9.6143 9.6143 9.6616 9.6616 10.4519 10.4519 11.5589 11.5589 11.6774 11.6774 11.8949 11.8949 11.9460 11.9460 12.5417 12.5417 12.8915 12.8915 12.9229 12.9229 13.0039 13.0039 13.1402 13.1402 k = 0.1875 0.1075 0.0000 ( 6628 PWs) bands (ev): -0.1189 -0.1189 1.5731 1.5731 2.2580 2.2580 3.7007 3.7007 4.7909 4.7909 4.9492 4.9492 5.5470 5.5470 6.0888 6.0888 6.2716 6.2716 6.2997 6.2997 6.5208 6.5208 6.5791 6.5791 6.8148 6.8148 6.8530 6.8530 6.9470 6.9470 7.0906 7.0906 7.1765 7.1765 7.2333 7.2333 7.2893 7.2893 7.4693 7.4693 7.4937 7.4937 7.6243 7.6243 7.6910 7.6910 7.8147 7.8147 7.9130 7.9130 7.9709 7.9709 8.2181 8.2181 8.9353 8.9353 9.1265 9.1265 9.1882 9.1882 9.5079 9.5079 9.6385 9.6385 9.6616 9.6616 10.4690 10.4690 11.5744 11.5744 11.7516 11.7516 11.8744 11.8744 11.9551 11.9551 12.5131 12.5131 12.8707 12.8707 12.9721 12.9721 13.0816 13.0816 13.1505 13.1505 k = 0.1667 0.0956 0.0000 ( 6616 PWs) bands (ev): -0.1438 -0.1438 1.6257 1.6257 2.2695 2.2695 3.7118 3.7118 4.7609 4.7609 4.9014 4.9014 5.5170 5.5170 6.0906 6.0906 6.2784 6.2784 6.3046 6.3046 6.5257 6.5257 6.5980 6.5980 6.8262 6.8262 6.8535 6.8535 6.9589 6.9589 7.0950 7.0950 7.1801 7.1801 7.2274 7.2274 7.2691 7.2691 7.4607 7.4607 7.4850 7.4850 7.5937 7.5937 7.6937 7.6937 7.8028 7.8028 7.9122 7.9122 7.9718 7.9718 8.2187 8.2187 8.9677 8.9677 9.1102 9.1102 9.2463 9.2463 9.4989 9.4989 9.6172 9.6172 9.7056 9.7056 10.4844 10.4844 11.5914 11.5914 11.8100 11.8100 11.8293 11.8293 12.0093 12.0093 12.4895 12.4895 12.8442 12.8442 13.0219 13.0219 13.1492 13.1492 13.1747 13.1747 k = 0.1458 0.0836 0.0000 ( 6608 PWs) bands (ev): -0.1658 -0.1658 1.6742 1.6742 2.2803 2.2803 3.7226 3.7226 4.7331 4.7331 4.8575 4.8575 5.4889 5.4889 6.0923 6.0923 6.2844 6.2844 6.3092 6.3092 6.5300 6.5300 6.6154 6.6154 6.8356 6.8356 6.8562 6.8562 6.9687 6.9687 7.0993 7.0993 7.1812 7.1812 7.2196 7.2196 7.2577 7.2577 7.4479 7.4479 7.4765 7.4765 7.5692 7.5692 7.6964 7.6964 7.7910 7.7910 7.9115 7.9115 7.9732 7.9732 8.2192 8.2192 8.9963 8.9963 9.0954 9.0954 9.3024 9.3024 9.4905 9.4905 9.5980 9.5980 9.7455 9.7455 10.4980 10.4980 11.6088 11.6088 11.7492 11.7492 11.9077 11.9077 12.0635 12.0635 12.4720 12.4720 12.8153 12.8153 13.0701 13.0701 13.1630 13.1630 13.2526 13.2526 k = 0.1250 0.0717 0.0000 ( 6608 PWs) bands (ev): -0.1850 -0.1850 1.7180 1.7180 2.2903 2.2903 3.7327 3.7327 4.7079 4.7079 4.8179 4.8179 5.4630 5.4630 6.0939 6.0939 6.2895 6.2895 6.3134 6.3134 6.5336 6.5336 6.6309 6.6309 6.8411 6.8411 6.8628 6.8628 6.9765 6.9765 7.1026 7.1026 7.1768 7.1768 7.2161 7.2161 7.2527 7.2527 7.4297 7.4297 7.4697 7.4697 7.5511 7.5511 7.6991 7.6991 7.7798 7.7798 7.9109 7.9109 7.9750 7.9750 8.2197 8.2197 9.0209 9.0209 9.0824 9.0824 9.3550 9.3550 9.4830 9.4830 9.5810 9.5810 9.7810 9.7810 10.5097 10.5097 11.6254 11.6254 11.6920 11.6920 11.9881 11.9881 12.1165 12.1165 12.4610 12.4610 12.7848 12.7848 13.1155 13.1155 13.1703 13.1703 13.3295 13.3295 k = 0.1042 0.0597-0.0000 ( 6602 PWs) bands (ev): -0.2013 -0.2013 1.7564 1.7564 2.2991 2.2991 3.7420 3.7420 4.6858 4.6858 4.7832 4.7832 5.4401 5.4401 6.0953 6.0953 6.2937 6.2937 6.3172 6.3172 6.5367 6.5367 6.6444 6.6444 6.8435 6.8435 6.8721 6.8721 6.9826 6.9826 7.1033 7.1033 7.1691 7.1691 7.2196 7.2196 7.2508 7.2508 7.4074 7.4074 7.4646 7.4646 7.5384 7.5384 7.7019 7.7019 7.7694 7.7694 7.9104 7.9104 7.9769 7.9769 8.2201 8.2201 9.0417 9.0417 9.0713 9.0713 9.4027 9.4027 9.4764 9.4764 9.5666 9.5666 9.8116 9.8116 10.5195 10.5195 11.6381 11.6381 11.6423 11.6423 12.0689 12.0689 12.1673 12.1673 12.4563 12.4563 12.7534 12.7534 13.1549 13.1549 13.1776 13.1776 13.2538 13.2538 k = 0.0833 0.0478 0.0000 ( 6602 PWs) bands (ev): -0.2147 -0.2147 1.7887 1.7887 2.3065 2.3065 3.7500 3.7500 4.6670 4.6670 4.7540 4.7540 5.4205 5.4205 6.0965 6.0965 6.2972 6.2972 6.3204 6.3204 6.5392 6.5392 6.6556 6.6556 6.8447 6.8447 6.8819 6.8819 6.9870 6.9870 7.1000 7.1000 7.1638 7.1638 7.2276 7.2276 7.2503 7.2503 7.3830 7.3830 7.4607 7.4607 7.5297 7.5297 7.7045 7.7045 7.7602 7.7602 7.9098 7.9098 7.9787 7.9787 8.2204 8.2204 9.0583 9.0583 9.0625 9.0625 9.4435 9.4435 9.4713 9.4713 9.5553 9.5553 9.8370 9.8370 10.5274 10.5274 11.5949 11.5949 11.6526 11.6526 12.1485 12.1485 12.2149 12.2149 12.4569 12.4569 12.7220 12.7220 13.1494 13.1494 13.1745 13.1745 13.2044 13.2044 k = 0.0625 0.0358 0.0000 ( 6603 PWs) bands (ev): -0.2251 -0.2251 1.8146 1.8146 2.3125 2.3125 3.7566 3.7566 4.6520 4.6520 4.7307 4.7307 5.4048 5.4048 6.0975 6.0975 6.2999 6.2999 6.3231 6.3231 6.5411 6.5411 6.6644 6.6644 6.8454 6.8454 6.8910 6.8910 6.9902 6.9902 7.0935 7.0935 7.1620 7.1620 7.2384 7.2384 7.2505 7.2505 7.3586 7.3586 7.4577 7.4577 7.5237 7.5237 7.7069 7.7069 7.7524 7.7524 7.9094 7.9094 7.9802 7.9802 8.2207 8.2207 9.0548 9.0548 9.0720 9.0720 9.4646 9.4646 9.4784 9.4784 9.5478 9.5478 9.8570 9.8570 10.5335 10.5335 11.5579 11.5579 11.6619 11.6619 12.2242 12.2242 12.2575 12.2575 12.4611 12.4611 12.6921 12.6921 13.0597 13.0597 13.1787 13.1787 13.2326 13.2326 k = 0.0417 0.0239 0.0000 ( 6591 PWs) bands (ev): -0.2326 -0.2326 1.8334 1.8334 2.3169 2.3169 3.7615 3.7615 4.6411 4.6411 4.7138 4.7138 5.3934 5.3934 6.0982 6.0982 6.3018 6.3018 6.3250 6.3250 6.5425 6.5425 6.6708 6.6708 6.8460 6.8460 6.8984 6.8984 6.9924 6.9924 7.0866 7.0866 7.1625 7.1625 7.2488 7.2488 7.2535 7.2535 7.3352 7.3352 7.4556 7.4556 7.5198 7.5198 7.7092 7.7092 7.7463 7.7463 7.9091 7.9091 7.9814 7.9814 8.2209 8.2209 9.0497 9.0497 9.0813 9.0813 9.4624 9.4624 9.4988 9.4988 9.5453 9.5453 9.8715 9.8715 10.5378 10.5378 11.5303 11.5303 11.6684 11.6684 12.2902 12.2902 12.2932 12.2932 12.4668 12.4668 12.6661 12.6661 12.9817 12.9817 13.1808 13.1808 13.2559 13.2559 k = 0.0208 0.0119 0.0000 ( 6583 PWs) bands (ev): -0.2371 -0.2371 1.8449 1.8449 2.3196 2.3196 3.7645 3.7645 4.6344 4.6344 4.7035 4.7035 5.3864 5.3864 6.0986 6.0986 6.3029 6.3029 6.3262 6.3262 6.5433 6.5433 6.6746 6.6746 6.8463 6.8463 6.9032 6.9032 6.9936 6.9936 7.0815 7.0815 7.1634 7.1634 7.2502 7.2502 7.2667 7.2667 7.3145 7.3145 7.4544 7.4544 7.5176 7.5176 7.7108 7.7108 7.7423 7.7423 7.9089 7.9089 7.9822 7.9822 8.2210 8.2210 9.0466 9.0466 9.0869 9.0869 9.4606 9.4606 9.5083 9.5083 9.5476 9.5476 9.8802 9.8802 10.5404 10.5404 11.5133 11.5133 11.6722 11.6722 12.3163 12.3163 12.3396 12.3396 12.4714 12.4714 12.6477 12.6477 12.9262 12.9262 13.1819 13.1819 13.2686 13.2690 k = 0.0000 0.0000 0.0000 ( 6595 PWs) bands (ev): -0.2386 -0.2386 1.8487 1.8487 2.3205 2.3205 3.7655 3.7655 4.6321 4.6321 4.7000 4.7000 5.3840 5.3840 6.0988 6.0988 6.3033 6.3033 6.3266 6.3266 6.5436 6.5436 6.6759 6.6759 6.8464 6.8464 6.9049 6.9049 6.9940 6.9940 7.0796 7.0796 7.1637 7.1637 7.2504 7.2504 7.2760 7.2760 7.3030 7.3030 7.4540 7.4540 7.5168 7.5168 7.7114 7.7114 7.7408 7.7408 7.9089 7.9089 7.9824 7.9824 8.2211 8.2211 9.0456 9.0456 9.0888 9.0888 9.4600 9.4600 9.5104 9.5104 9.5494 9.5494 9.8831 9.8831 10.5412 10.5412 11.5075 11.5075 11.6734 11.6734 12.3250 12.3250 12.3581 12.3581 12.4732 12.4732 12.6409 12.6409 12.9055 12.9055 13.1822 13.1822 13.2657 13.2758 k = 0.0000 0.0000 0.0000 ( 6595 PWs) bands (ev): -0.2386 -0.2386 1.8487 1.8487 2.3205 2.3205 3.7655 3.7655 4.6321 4.6321 4.7000 4.7000 5.3840 5.3840 6.0988 6.0988 6.3033 6.3033 6.3266 6.3266 6.5436 6.5436 6.6759 6.6759 6.8464 6.8464 6.9049 6.9049 6.9940 6.9940 7.0796 7.0796 7.1637 7.1637 7.2504 7.2504 7.2760 7.2760 7.3030 7.3030 7.4540 7.4540 7.5168 7.5168 7.7114 7.7114 7.7408 7.7408 7.9089 7.9089 7.9824 7.9824 8.2211 8.2211 9.0456 9.0456 9.0888 9.0888 9.4600 9.4600 9.5104 9.5104 9.5494 9.5494 9.8831 9.8831 10.5412 10.5412 11.5075 11.5075 11.6734 11.6734 12.3250 12.3250 12.3581 12.3581 12.4732 12.4732 12.6409 12.6409 12.9055 12.9055 13.1822 13.1822 13.2657 13.2779 k = 0.0100-0.0174 0.0124 ( 6591 PWs) bands (ev): -0.2371 -0.2371 1.8488 1.8488 2.3175 2.3175 3.7604 3.7604 4.6183 4.6183 4.7176 4.7176 5.3888 5.3888 6.0988 6.0988 6.3029 6.3029 6.3270 6.3270 6.5424 6.5424 6.6767 6.6767 6.8463 6.8463 6.9041 6.9041 6.9942 6.9942 7.0793 7.0793 7.1635 7.1635 7.2514 7.2514 7.2762 7.2762 7.3025 7.3025 7.4542 7.4542 7.5169 7.5169 7.7110 7.7110 7.7426 7.7426 7.9088 7.9088 7.9822 7.9822 8.2237 8.2237 9.0445 9.0445 9.0872 9.0872 9.4594 9.4594 9.5102 9.5102 9.5492 9.5492 9.8841 9.8841 10.5349 10.5349 11.5132 11.5132 11.6712 11.6712 12.3079 12.3079 12.3780 12.3780 12.4742 12.4742 12.6291 12.6291 12.9176 12.9176 13.1084 13.1084 13.2719 13.2719 k = 0.0200-0.0348 0.0247 ( 6593 PWs) bands (ev): -0.2329 -0.2329 1.8493 1.8493 2.3087 2.3087 3.7452 3.7452 4.5936 4.5936 4.7531 4.7531 5.4030 5.4030 6.0987 6.0987 6.3018 6.3018 6.3282 6.3282 6.5386 6.5386 6.6794 6.6794 6.8463 6.8463 6.9018 6.9018 6.9947 6.9947 7.0782 7.0782 7.1627 7.1627 7.2544 7.2544 7.2771 7.2771 7.3012 7.3012 7.4549 7.4549 7.5173 7.5173 7.7098 7.7098 7.7479 7.7479 7.9089 7.9089 7.9816 7.9816 8.2316 8.2316 9.0413 9.0413 9.0824 9.0824 9.4576 9.4576 9.5095 9.5095 9.5487 9.5487 9.8869 9.8869 10.5164 10.5164 11.5293 11.5293 11.6643 11.6643 12.2831 12.2831 12.4111 12.4111 12.4772 12.4772 12.5995 12.5995 12.9474 12.9474 13.0094 13.0094 13.2587 13.2587 k = 0.0300-0.0523 0.0371 ( 6599 PWs) bands (ev): -0.2258 -0.2258 1.8499 1.8499 2.2942 2.2942 3.7207 3.7207 4.5697 4.5697 4.7950 4.7950 5.4258 5.4258 6.0987 6.0987 6.2998 6.2998 6.3301 6.3301 6.5325 6.5325 6.6836 6.6836 6.8462 6.8462 6.8981 6.8981 6.9954 6.9954 7.0766 7.0766 7.1616 7.1616 7.2592 7.2592 7.2783 7.2783 7.2992 7.2992 7.4562 7.4562 7.5178 7.5178 7.7080 7.7080 7.7560 7.7560 7.9093 7.9093 7.9808 7.9808 8.2448 8.2448 9.0362 9.0362 9.0743 9.0743 9.4548 9.4548 9.5078 9.5078 9.5482 9.5482 9.8916 9.8916 10.4879 10.4879 11.5526 11.5526 11.6530 11.6530 12.2597 12.2597 12.4483 12.4483 12.4825 12.4825 12.5615 12.5615 12.9127 12.9127 12.9868 12.9868 13.2381 13.2381 k = 0.0400-0.0697 0.0494 ( 6601 PWs) bands (ev): -0.2159 -0.2159 1.8507 1.8507 2.2740 2.2740 3.6883 3.6883 4.5490 4.5490 4.8407 4.8407 5.4558 5.4558 6.0987 6.0987 6.2972 6.2972 6.3328 6.3328 6.5240 6.5240 6.6893 6.6893 6.8462 6.8462 6.8931 6.8931 6.9961 6.9961 7.0747 7.0747 7.1602 7.1602 7.2653 7.2653 7.2797 7.2797 7.2969 7.2969 7.4579 7.4579 7.5186 7.5186 7.7055 7.7055 7.7663 7.7663 7.9110 7.9110 7.9799 7.9799 8.2633 8.2633 9.0293 9.0293 9.0626 9.0626 9.4510 9.4510 9.5047 9.5047 9.5477 9.5477 9.8982 9.8982 10.4520 10.4520 11.5784 11.5784 11.6374 11.6374 12.2385 12.2385 12.4840 12.4840 12.4942 12.4942 12.5213 12.5213 12.8276 12.8276 13.0234 13.0234 13.2121 13.2121 k = 0.0499-0.0871 0.0618 ( 6615 PWs) bands (ev): -0.2031 -0.2031 1.8515 1.8515 2.2486 2.2486 3.6491 3.6491 4.5324 4.5324 4.8891 4.8891 5.4916 5.4916 6.0986 6.0986 6.2939 6.2939 6.3361 6.3361 6.5133 6.5133 6.6962 6.6962 6.8462 6.8462 6.8872 6.8872 6.9965 6.9965 7.0726 7.0726 7.1587 7.1587 7.2715 7.2715 7.2807 7.2807 7.2958 7.2958 7.4599 7.4599 7.5199 7.5199 7.7024 7.7024 7.7774 7.7774 7.9147 7.9147 7.9794 7.9794 8.2871 8.2871 9.0211 9.0211 9.0473 9.0473 9.4464 9.4464 9.4997 9.4997 9.5474 9.5474 9.9068 9.9068 10.4111 10.4111 11.6006 11.6006 11.6186 11.6186 12.2194 12.2194 12.4807 12.4807 12.4972 12.4972 12.5347 12.5347 12.7552 12.7552 13.0536 13.0536 13.1824 13.1824 k = 0.0599-0.1045 0.0741 ( 6611 PWs) bands (ev): -0.1876 -0.1876 1.8522 1.8522 2.2181 2.2181 3.6049 3.6049 4.5201 4.5201 4.9396 4.9396 5.5317 5.5317 6.0987 6.0987 6.2900 6.2900 6.3402 6.3402 6.5004 6.5004 6.7040 6.7040 6.8463 6.8463 6.8804 6.8804 6.9965 6.9965 7.0709 7.0709 7.1570 7.1570 7.2742 7.2742 7.2820 7.2820 7.2986 7.2986 7.4622 7.4622 7.5218 7.5218 7.6987 7.6987 7.7876 7.7876 7.9214 7.9214 7.9805 7.9805 8.3164 8.3164 9.0118 9.0118 9.0281 9.0281 9.4412 9.4412 9.4925 9.4925 9.5471 9.5471 9.9174 9.9174 10.3677 10.3677 11.5917 11.5917 11.6182 11.6182 12.2024 12.2024 12.4437 12.4437 12.5083 12.5083 12.5809 12.5809 12.7000 12.7000 13.0736 13.0736 13.1506 13.1506 k = 0.0699-0.1219 0.0865 ( 6613 PWs) bands (ev): -0.1693 -0.1693 1.8525 1.8525 2.1830 2.1830 3.5570 3.5570 4.5123 4.5123 4.9918 4.9918 5.5746 5.5746 6.0988 6.0988 6.2854 6.2854 6.3448 6.3448 6.4855 6.4855 6.7123 6.7123 6.8464 6.8464 6.8730 6.8730 6.9957 6.9957 7.0699 7.0699 7.1554 7.1554 7.2704 7.2704 7.2851 7.2851 7.3063 7.3063 7.4647 7.4647 7.5244 7.5244 7.6944 7.6944 7.7953 7.7953 7.9301 7.9301 7.9858 7.9858 8.3511 8.3511 9.0014 9.0014 9.0052 9.0052 9.4356 9.4356 9.4831 9.4831 9.5463 9.5463 9.9300 9.9300 10.3233 10.3233 11.5643 11.5643 11.6188 11.6188 12.1873 12.1873 12.4096 12.4096 12.5214 12.5214 12.6298 12.6298 12.6659 12.6659 13.0812 13.0812 13.1183 13.1183 k = 0.0799-0.1393 0.0988 ( 6615 PWs) bands (ev): -0.1483 -0.1483 1.8522 1.8522 2.1436 2.1436 3.5070 3.5070 4.5091 4.5091 5.0454 5.0454 5.6187 5.6187 6.0990 6.0990 6.2803 6.2803 6.3500 6.3500 6.4687 6.4687 6.7206 6.7206 6.8465 6.8465 6.8651 6.8651 6.9942 6.9942 7.0701 7.0701 7.1537 7.1537 7.2633 7.2633 7.2881 7.2881 7.3170 7.3170 7.4669 7.4669 7.5280 7.5280 7.6896 7.6896 7.7998 7.7998 7.9370 7.9370 8.0002 8.0002 8.3913 8.3913 8.9771 8.9771 8.9916 8.9916 9.4298 9.4298 9.4716 9.4716 9.5447 9.5447 9.9444 9.9444 10.2795 10.2795 11.5329 11.5329 11.6028 11.6028 12.1741 12.1741 12.3790 12.3790 12.5363 12.5363 12.6529 12.6529 12.6828 12.6828 13.0753 13.0753 13.0882 13.0882 k = 0.0899-0.1568 0.1112 ( 6623 PWs) bands (ev): -0.1245 -0.1245 1.8511 1.8511 2.1003 2.1003 3.4560 3.4560 4.5104 4.5104 5.0999 5.0999 5.6628 5.6628 6.0993 6.0993 6.2746 6.2746 6.3555 6.3555 6.4504 6.4504 6.7284 6.7284 6.8462 6.8462 6.8572 6.8572 6.9918 6.9918 7.0721 7.0721 7.1521 7.1521 7.2542 7.2542 7.2907 7.2907 7.3295 7.3295 7.4689 7.4689 7.5328 7.5328 7.6844 7.6844 7.8014 7.8014 7.9391 7.9391 8.0267 8.0267 8.4369 8.4369 8.9456 8.9456 8.9810 8.9810 9.4242 9.4242 9.4579 9.4579 9.5419 9.5419 9.9604 9.9604 10.2371 10.2371 11.4980 11.4980 11.5691 11.5691 12.1625 12.1625 12.3517 12.3517 12.5530 12.5530 12.6637 12.6637 12.7364 12.7364 13.0510 13.0510 13.0678 13.0678 k = 0.0999-0.1742 0.1236 ( 6615 PWs) bands (ev): -0.0980 -0.0980 1.8488 1.8488 2.0536 2.0536 3.4053 3.4053 4.5162 4.5162 5.1551 5.1551 5.7056 5.7056 6.0999 6.0999 6.2684 6.2684 6.3607 6.3607 6.4312 6.4312 6.7350 6.7350 6.8437 6.8437 6.8515 6.8515 6.9885 6.9885 7.0762 7.0762 7.1505 7.1505 7.2434 7.2434 7.2931 7.2931 7.3431 7.3431 7.4705 7.4705 7.5390 7.5390 7.6788 7.6788 7.8009 7.8009 7.9375 7.9375 8.0637 8.0637 8.4877 8.4877 8.9101 8.9101 8.9707 8.9707 9.4190 9.4190 9.4422 9.4422 9.5376 9.5376 9.9777 9.9777 10.1970 10.1970 11.4600 11.4600 11.5200 11.5200 12.1524 12.1524 12.3272 12.3272 12.5713 12.5713 12.6932 12.6932 12.7920 12.7920 13.0219 13.0219 13.0470 13.0470 k = 0.1099-0.1916 0.1359 ( 6623 PWs) bands (ev): -0.0688 -0.0688 1.8449 1.8449 2.0039 2.0039 3.3560 3.3560 4.5263 4.5263 5.2108 5.2108 5.7462 5.7462 6.1006 6.1006 6.2618 6.2618 6.3643 6.3643 6.4128 6.4128 6.7400 6.7400 6.8365 6.8365 6.8505 6.8505 6.9843 6.9843 7.0825 7.0825 7.1489 7.1489 7.2310 7.2310 7.2953 7.2953 7.3571 7.3571 7.4716 7.4716 7.5465 7.5465 7.6729 7.6729 7.7992 7.7992 7.9337 7.9337 8.1090 8.1090 8.5437 8.5437 8.8709 8.8709 8.9607 8.9607 9.4146 9.4146 9.4245 9.4245 9.5316 9.5316 9.9955 9.9955 10.1601 10.1601 11.4190 11.4190 11.4590 11.4590 12.1437 12.1437 12.3045 12.3045 12.5909 12.5909 12.7368 12.7368 12.8486 12.8486 12.9947 12.9947 13.0228 13.0228 k = 0.1199-0.2090 0.1483 ( 6621 PWs) bands (ev): -0.0370 -0.0370 1.8391 1.8391 1.9516 1.9516 3.3091 3.3091 4.5405 4.5405 5.2668 5.2668 5.7837 5.7837 6.1016 6.1016 6.2548 6.2548 6.3610 6.3610 6.4005 6.4005 6.7430 6.7430 6.8276 6.8276 6.8515 6.8515 6.9794 6.9794 7.0910 7.0910 7.1474 7.1474 7.2172 7.2172 7.2973 7.2973 7.3714 7.3714 7.4722 7.4722 7.5553 7.5553 7.6670 7.6670 7.7970 7.7970 7.9285 7.9285 8.1611 8.1611 8.6048 8.6048 8.8285 8.8285 8.9513 8.9513 9.4046 9.4046 9.4114 9.4114 9.5238 9.5238 10.0117 10.0117 10.1278 10.1278 11.3737 11.3737 11.3914 11.3914 12.1362 12.1362 12.2824 12.2824 12.6116 12.6116 12.7894 12.7894 12.9046 12.9046 12.9721 12.9721 12.9978 12.9978 k = 0.1298-0.2264 0.1606 ( 6631 PWs) bands (ev): -0.0027 -0.0027 1.8310 1.8310 1.8972 1.8972 3.2656 3.2656 4.5588 4.5588 5.3229 5.3229 5.8170 5.8170 6.1028 6.1028 6.2473 6.2473 6.3458 6.3458 6.3998 6.3998 6.7434 6.7434 6.8183 6.8183 6.8537 6.8537 6.9735 6.9735 7.1012 7.1012 7.1463 7.1463 7.2019 7.2019 7.2992 7.2992 7.3856 7.3856 7.4724 7.4724 7.5651 7.5651 7.6613 7.6613 7.7949 7.7949 7.9223 7.9223 8.2190 8.2190 8.6705 8.6705 8.7834 8.7834 8.9426 8.9426 9.3827 9.3827 9.4094 9.4094 9.5142 9.5142 10.0214 10.0214 10.1048 10.1048 11.3102 11.3102 11.3345 11.3345 12.1298 12.1298 12.2592 12.2592 12.6328 12.6328 12.8448 12.8448 12.9398 12.9398 12.9697 12.9697 12.9808 12.9808 k = 0.1398-0.2438 0.1730 ( 6629 PWs) bands (ev): 0.0342 0.0342 1.8201 1.8201 1.8410 1.8410 3.2262 3.2262 4.5809 4.5809 5.3789 5.3789 5.8454 5.8454 6.1045 6.1045 6.2395 6.2395 6.3244 6.3244 6.4056 6.4056 6.7415 6.7415 6.8089 6.8089 6.8571 6.8571 6.9669 6.9669 7.1113 7.1113 7.1465 7.1465 7.1859 7.1859 7.3011 7.3011 7.3994 7.3994 7.4724 7.4724 7.5755 7.5755 7.6561 7.6561 7.7930 7.7930 7.9154 7.9154 8.2820 8.2820 8.7319 8.7319 8.7452 8.7452 8.9350 8.9350 9.3589 9.3589 9.4092 9.4092 9.5030 9.5030 10.0150 10.0150 10.0998 10.0998 11.2335 11.2335 11.2862 11.2862 12.1243 12.1243 12.2332 12.2332 12.6537 12.6537 12.8879 12.8879 12.9424 12.9424 12.9556 12.9556 13.0289 13.0289 k = 0.1498-0.2613 0.1853 ( 6629 PWs) bands (ev): 0.0735 0.0735 1.7832 1.7832 1.8066 1.8066 3.1916 3.1916 4.6067 4.6067 5.4346 5.4346 5.8680 5.8680 6.1067 6.1067 6.2310 6.2310 6.3015 6.3015 6.4136 6.4136 6.7373 6.7373 6.7995 6.7995 6.8616 6.8616 6.9594 6.9594 7.1180 7.1180 7.1493 7.1493 7.1709 7.1709 7.3030 7.3030 7.4125 7.4125 7.4725 7.4725 7.5857 7.5857 7.6520 7.6520 7.7916 7.7916 7.9078 7.9078 8.3487 8.3487 8.6877 8.6877 8.8156 8.8156 8.9288 8.9288 9.3331 9.3331 9.4110 9.4110 9.4902 9.4902 9.9939 9.9939 10.1105 10.1105 11.1551 11.1551 11.2370 11.2370 12.1196 12.1196 12.2026 12.2026 12.6733 12.6733 12.8944 12.8944 12.9401 12.9401 12.9821 12.9821 13.0844 13.0844 k = 0.1598-0.2787 0.1977 ( 6637 PWs) bands (ev): 0.1153 0.1153 1.7246 1.7246 1.7895 1.7895 3.1624 3.1624 4.6361 4.6361 5.4900 5.4900 5.8840 5.8840 6.1093 6.1093 6.2215 6.2215 6.2793 6.2793 6.4226 6.4226 6.7312 6.7312 6.7902 6.7902 6.8672 6.8672 6.9513 6.9513 7.1176 7.1176 7.1461 7.1461 7.1691 7.1691 7.3049 7.3049 7.4243 7.4243 7.4729 7.4729 7.5946 7.5946 7.6501 7.6501 7.7905 7.7905 7.8996 7.8996 8.4164 8.4164 8.6419 8.6419 8.8898 8.8898 8.9273 8.9273 9.3055 9.3055 9.4151 9.4151 9.4763 9.4763 9.9673 9.9673 10.1265 10.1265 11.0775 11.0775 11.1865 11.1865 12.1154 12.1154 12.1663 12.1663 12.6902 12.6902 12.8902 12.8902 12.9365 12.9365 13.0258 13.0258 13.1383 13.1383 k = 0.1698-0.2961 0.2100 ( 6643 PWs) bands (ev): 0.1593 0.1593 1.6652 1.6652 1.7692 1.7692 3.1391 3.1391 4.6687 4.6687 5.5449 5.5449 5.8925 5.8925 6.1124 6.1124 6.2107 6.2107 6.2596 6.2596 6.4323 6.4323 6.7238 6.7238 6.7810 6.7810 6.8738 6.8738 6.9426 6.9426 7.1087 7.1087 7.1357 7.1357 7.1827 7.1827 7.3069 7.3069 7.4340 7.4340 7.4745 7.4745 7.6006 7.6006 7.6520 7.6520 7.7899 7.7899 7.8911 7.8911 8.4745 8.4745 8.6086 8.6086 8.9135 8.9135 8.9808 8.9808 9.2765 9.2765 9.4218 9.4218 9.4613 9.4613 9.9392 9.9392 10.1423 10.1423 11.0024 11.0024 11.1345 11.1345 12.1092 12.1092 12.1257 12.1257 12.7029 12.7029 12.8901 12.8901 12.9419 12.9419 13.0589 13.0589 13.1890 13.1890 k = 0.1798-0.3135 0.2224 ( 6639 PWs) bands (ev): 0.2056 0.2056 1.6055 1.6055 1.7454 1.7454 3.1217 3.1217 4.7046 4.7046 5.5991 5.5991 5.8931 5.8931 6.1159 6.1159 6.1983 6.1983 6.2434 6.2434 6.4422 6.4422 6.7156 6.7156 6.7721 6.7721 6.8812 6.8812 6.9333 6.9333 7.0924 7.0924 7.1287 7.1287 7.2001 7.2001 7.3089 7.3089 7.4407 7.4407 7.4781 7.4781 7.6027 7.6027 7.6586 7.6586 7.7895 7.7895 7.8822 7.8822 8.4844 8.4844 8.6263 8.6263 8.9117 8.9117 9.0625 9.0625 9.2474 9.2474 9.4313 9.4313 9.4459 9.4459 9.9110 9.9110 10.1551 10.1551 10.9317 10.9317 11.0812 11.0812 12.0698 12.0698 12.1120 12.1120 12.7103 12.7103 12.8971 12.8971 12.9565 12.9565 13.0750 13.0750 13.2348 13.2348 k = 0.1898-0.3309 0.2348 ( 6631 PWs) bands (ev): 0.2541 0.2541 1.5456 1.5456 1.7185 1.7185 3.1105 3.1105 4.7434 4.7434 5.6526 5.6526 5.8854 5.8854 6.1197 6.1197 6.1848 6.1848 6.2307 6.2307 6.4524 6.4524 6.7069 6.7069 6.7636 6.7636 6.8893 6.8893 6.9237 6.9237 7.0725 7.0725 7.1236 7.1236 7.2187 7.2187 7.3111 7.3111 7.4438 7.4438 7.4840 7.4840 7.6019 7.6019 7.6689 7.6689 7.7892 7.7892 7.8731 7.8731 8.4483 8.4483 8.6923 8.6923 8.9100 8.9100 9.1379 9.1379 9.2270 9.2270 9.4298 9.4298 9.4445 9.4445 9.8830 9.8830 10.1622 10.1622 10.8673 10.8673 11.0265 11.0265 12.0134 12.0134 12.1091 12.1091 12.7131 12.7131 12.9112 12.9112 12.9792 12.9792 13.0734 13.0734 13.2745 13.2745 k = 0.1998-0.3484 0.2471 ( 6623 PWs) bands (ev): 0.3045 0.3045 1.4858 1.4858 1.6886 1.6886 3.1053 3.1053 4.7850 4.7850 5.7050 5.7050 5.8698 5.8698 6.1235 6.1235 6.1714 6.1714 6.2205 6.2205 6.4625 6.4625 6.6978 6.6978 6.7557 6.7557 6.8977 6.8977 6.9139 6.9139 7.0513 7.0513 7.1191 7.1191 7.2378 7.2378 7.3134 7.3134 7.4442 7.4442 7.4914 7.4914 7.5996 7.5996 7.6813 7.6813 7.7885 7.7885 7.8640 7.8640 8.4013 8.4013 8.7710 8.7710 8.9097 8.9097 9.1533 9.1533 9.2673 9.2673 9.4144 9.4144 9.4611 9.4611 9.8558 9.8558 10.1614 10.1614 10.8115 10.8115 10.9704 10.9704 11.9507 11.9507 12.1072 12.1072 12.7126 12.7126 12.9307 12.9307 13.0073 13.0073 13.0597 13.0597 13.3067 13.3067 k = 0.2097-0.3658 0.2595 ( 6636 PWs) bands (ev): 0.3569 0.3569 1.4263 1.4263 1.6560 1.6560 3.1059 3.1059 4.8292 4.8292 5.7562 5.7562 5.8471 5.8471 6.1273 6.1273 6.1587 6.1587 6.2118 6.2118 6.4726 6.4726 6.6884 6.6884 6.7485 6.7485 6.9016 6.9016 6.9088 6.9088 7.0295 7.0295 7.1149 7.1149 7.2567 7.2567 7.3156 7.3156 7.4428 7.4428 7.4991 7.4991 7.5970 7.5970 7.6944 7.6944 7.7872 7.7872 7.8552 7.8552 8.3526 8.3526 8.8514 8.8514 8.9121 8.9121 9.1236 9.1236 9.3510 9.3510 9.3998 9.3998 9.4830 9.4830 9.8298 9.8298 10.1502 10.1502 10.7664 10.7664 10.9128 10.9128 11.8831 11.8831 12.1056 12.1056 12.7106 12.7106 12.9531 12.9531 13.0206 13.0206 13.0586 13.0586 13.3302 13.3302 k = 0.2197-0.3832 0.2718 ( 6646 PWs) bands (ev): 0.4109 0.4109 1.3675 1.3675 1.6214 1.6214 3.1119 3.1119 4.8758 4.8758 5.8039 5.8039 5.8202 5.8202 6.1311 6.1311 6.1467 6.1467 6.2038 6.2038 6.4824 6.4824 6.6789 6.6789 6.7424 6.7424 6.8921 6.8921 6.9171 6.9171 7.0076 7.0076 7.1109 7.1109 7.2753 7.2753 7.3180 7.3180 7.4402 7.4402 7.5066 7.5066 7.5947 7.5947 7.7076 7.7076 7.7849 7.7849 7.8470 7.8470 8.3047 8.3047 8.9042 8.9042 8.9430 8.9430 9.0863 9.0863 9.3839 9.3839 9.4375 9.4375 9.5162 9.5162 9.8059 9.8059 10.1270 10.1270 10.7334 10.7334 10.8538 10.8538 11.8114 11.8114 12.1043 12.1043 12.7084 12.7084 12.9729 12.9729 13.0026 13.0026 13.0943 13.0943 13.3442 13.3442 k = 0.2297-0.4006 0.2842 ( 6634 PWs) bands (ev): 0.4664 0.4664 1.3094 1.3094 1.5852 1.5852 3.1230 3.1230 4.9248 4.9248 5.7832 5.7832 5.8551 5.8551 6.1348 6.1348 6.1354 6.1354 6.1962 6.1962 6.4919 6.4919 6.6690 6.6690 6.7375 6.7375 6.8817 6.8817 6.9267 6.9267 6.9860 6.9860 7.1073 7.1073 7.2931 7.2931 7.3205 7.3205 7.4369 7.4369 7.5134 7.5134 7.5932 7.5932 7.7202 7.7202 7.7813 7.7813 7.8397 7.8397 8.2589 8.2589 8.9113 8.9113 9.0178 9.0178 9.0461 9.0461 9.3714 9.3714 9.4980 9.4980 9.5801 9.5801 9.7856 9.7856 10.0919 10.0919 10.7125 10.7125 10.7933 10.7933 11.7366 11.7366 12.1032 12.1032 12.7069 12.7069 12.9616 12.9616 13.0111 13.0111 13.1380 13.1380 13.3483 13.3483 k = 0.2397-0.4180 0.2965 ( 6634 PWs) bands (ev): 0.5232 0.5232 1.2523 1.2523 1.5481 1.5481 3.1387 3.1387 4.9757 4.9757 5.7455 5.7455 5.9007 5.9007 6.1235 6.1235 6.1390 6.1390 6.1888 6.1888 6.5011 6.5011 6.6586 6.6586 6.7342 6.7342 6.8711 6.8711 6.9362 6.9362 6.9649 6.9649 7.1043 7.1043 7.3086 7.3086 7.3243 7.3243 7.4332 7.4332 7.5194 7.5194 7.5926 7.5926 7.7311 7.7311 7.7767 7.7767 7.8335 7.8335 8.2162 8.2162 8.9163 8.9163 9.0038 9.0038 9.0898 9.0898 9.3601 9.3601 9.5365 9.5365 9.6711 9.6711 9.7715 9.7715 10.0464 10.0464 10.7017 10.7017 10.7317 10.7317 11.6594 11.6594 12.1021 12.1021 12.7065 12.7065 12.9357 12.9357 13.0347 13.0347 13.1841 13.1841 13.3425 13.3425 k = 0.2497-0.4354 0.3089 ( 6632 PWs) bands (ev): 0.5808 0.5808 1.1963 1.1963 1.5108 1.5108 3.1584 3.1584 5.0286 5.0286 5.7048 5.7048 5.9436 5.9436 6.1112 6.1112 6.1433 6.1433 6.1820 6.1820 6.5099 6.5099 6.6476 6.6476 6.7326 6.7326 6.8601 6.8601 6.9392 6.9392 6.9509 6.9509 7.1021 7.1021 7.3173 7.3173 7.3335 7.3335 7.4294 7.4294 7.5247 7.5247 7.5929 7.5929 7.7386 7.7386 7.7726 7.7726 7.8283 7.8283 8.1775 8.1775 8.9222 8.9222 8.9601 8.9601 9.1518 9.1518 9.3506 9.3506 9.5716 9.5716 9.7504 9.7504 9.7859 9.7859 9.9933 9.9933 10.6656 10.6656 10.7023 10.7023 11.5802 11.5802 12.1010 12.1010 12.7076 12.7076 12.9114 12.9114 13.0586 13.0586 13.2306 13.2306 13.3272 13.3272 k = 0.2597-0.4529 0.3212 ( 6652 PWs) bands (ev): 0.6387 0.6387 1.1416 1.1416 1.4742 1.4742 3.1818 3.1818 5.0830 5.0830 5.6618 5.6618 5.9827 5.9827 6.0978 6.0978 6.1480 6.1480 6.1760 6.1760 6.5183 6.5183 6.6357 6.6357 6.7329 6.7329 6.8484 6.8484 6.9211 6.9211 6.9585 6.9585 7.1010 7.1010 7.3198 7.3198 7.3469 7.3469 7.4259 7.4259 7.5294 7.5294 7.5942 7.5942 7.7397 7.7397 7.7714 7.7714 7.8243 7.8243 8.1436 8.1436 8.9144 8.9144 8.9300 8.9300 9.1990 9.1990 9.3433 9.3433 9.6080 9.6080 9.7608 9.7608 9.8817 9.8817 9.9374 9.9374 10.6003 10.6003 10.7065 10.7065 11.4998 11.4998 12.0997 12.0997 12.7104 12.7104 12.8906 12.8906 13.0809 13.0809 13.2752 13.2752 13.3037 13.3037 k = 0.2697-0.4703 0.3336 ( 6666 PWs) bands (ev): 0.6964 0.6964 1.0883 1.0883 1.4391 1.4391 3.2083 3.2083 5.1389 5.1389 5.6172 5.6172 6.0168 6.0168 6.0834 6.0834 6.1529 6.1529 6.1719 6.1719 6.5265 6.5265 6.6231 6.6231 6.7350 6.7350 6.8351 6.8351 6.9016 6.9016 6.9686 6.9686 7.1014 7.1014 7.3201 7.3201 7.3592 7.3592 7.4238 7.4238 7.5338 7.5338 7.5965 7.5965 7.7341 7.7341 7.7732 7.7732 7.8220 7.8220 8.1149 8.1149 8.8684 8.8684 8.9382 8.9382 9.2277 9.2277 9.3385 9.3385 9.6471 9.6471 9.7692 9.7692 9.8849 9.8849 9.9892 9.9892 10.5327 10.5327 10.7158 10.7158 11.4184 11.4184 12.0983 12.0983 12.7148 12.7148 12.8743 12.8743 13.1008 13.1008 13.2702 13.2702 13.3188 13.3188 k = 0.2797-0.4877 0.3459 ( 6682 PWs) bands (ev): 0.7528 0.7528 1.0365 1.0365 1.4068 1.4068 3.2374 3.2374 5.1960 5.1960 5.5717 5.5717 6.0432 6.0432 6.0693 6.0693 6.1573 6.1573 6.1715 6.1715 6.5341 6.5341 6.6102 6.6102 6.7385 6.7385 6.8191 6.8191 6.8839 6.8839 6.9789 6.9789 7.1039 7.1039 7.3192 7.3192 7.3679 7.3679 7.4248 7.4248 7.5379 7.5379 7.5996 7.5996 7.7246 7.7246 7.7742 7.7742 7.8223 7.8223 8.0917 8.0917 8.8212 8.8212 8.9480 8.9480 9.2371 9.2371 9.3361 9.3361 9.6891 9.6891 9.7548 9.7548 9.8691 9.8691 10.0967 10.0967 10.4632 10.4632 10.7289 10.7289 11.3365 11.3365 12.0965 12.0965 12.7208 12.7208 12.8628 12.8628 13.1178 13.1178 13.2314 13.2314 13.3563 13.3563 k = 0.2897-0.5051 0.3583 ( 6682 PWs) bands (ev): 0.8064 0.8064 0.9864 0.9864 1.3791 1.3791 3.2685 3.2685 5.2541 5.2541 5.5256 5.5256 6.0449 6.0449 6.0713 6.0713 6.1597 6.1597 6.1769 6.1769 6.5403 6.5403 6.5983 6.5983 6.7429 6.7429 6.7994 6.7994 6.8692 6.8692 6.9894 6.9894 7.1089 7.1089 7.3172 7.3172 7.3713 7.3713 7.4306 7.4306 7.5419 7.5419 7.6036 7.6036 7.7136 7.7136 7.7727 7.7727 7.8255 7.8255 8.0739 8.0739 8.7732 8.7732 8.9593 8.9593 9.2294 9.2294 9.3359 9.3359 9.7034 9.7034 9.7345 9.7345 9.9001 9.9001 10.2045 10.2045 10.3930 10.3930 10.7453 10.7453 11.2543 11.2543 12.0943 12.0943 12.7282 12.7282 12.8561 12.8561 13.1307 13.1307 13.1870 13.1870 13.3880 13.3880 k = 0.2996-0.5225 0.3707 ( 6684 PWs) bands (ev): 0.8550 0.8550 0.9380 0.9380 1.3582 1.3582 3.3013 3.3013 5.3128 5.3128 5.4796 5.4796 6.0279 6.0279 6.0831 6.0831 6.1615 6.1615 6.1868 6.1868 6.5416 6.5416 6.5907 6.5907 6.7455 6.7455 6.7776 6.7776 6.8576 6.8576 7.0002 7.0002 7.1168 7.1168 7.3141 7.3141 7.3699 7.3699 7.4408 7.4408 7.5458 7.5458 7.6085 7.6085 7.7018 7.7018 7.7694 7.7694 7.8307 7.8307 8.0611 8.0611 8.7246 8.7246 8.9719 8.9719 9.2083 9.2083 9.3379 9.3379 9.6413 9.6413 9.7823 9.7823 9.9495 9.9495 10.2897 10.2897 10.3440 10.3440 10.7652 10.7652 11.1723 11.1723 12.0914 12.0914 12.7369 12.7369 12.8542 12.8542 13.1259 13.1259 13.1518 13.1518 13.4125 13.4125 k = 0.3096-0.5399 0.3830 ( 6672 PWs) bands (ev): 0.8914 0.8914 0.8957 0.8957 1.3472 1.3472 3.3351 3.3351 5.3719 5.3719 5.4340 5.4340 6.0086 6.0086 6.0899 6.0899 6.1643 6.1643 6.1985 6.1985 6.5339 6.5339 6.5918 6.5918 6.7336 6.7336 6.7662 6.7662 6.8488 6.8488 7.0114 7.0114 7.1281 7.1281 7.3099 7.3099 7.3656 7.3656 7.4537 7.4537 7.5494 7.5494 7.6144 7.6144 7.6897 7.6897 7.7659 7.7659 7.8370 7.8370 8.0525 8.0525 8.6756 8.6756 8.9859 8.9859 9.1770 9.1770 9.3422 9.3422 9.5773 9.5773 9.8332 9.8332 10.0039 10.0039 10.2343 10.2343 10.4343 10.4343 10.7892 10.7892 11.0906 11.0906 12.0878 12.0878 12.7468 12.7468 12.8568 12.8568 13.0758 13.0758 13.1540 13.1540 13.4290 13.4290 k = 0.3096-0.5399 0.3830 ( 6672 PWs) bands (ev): 0.8914 0.8914 0.8957 0.8957 1.3472 1.3472 3.3351 3.3351 5.3719 5.3719 5.4340 5.4340 6.0086 6.0086 6.0899 6.0899 6.1643 6.1643 6.1985 6.1985 6.5339 6.5339 6.5918 6.5918 6.7336 6.7336 6.7662 6.7662 6.8488 6.8488 7.0114 7.0114 7.1281 7.1281 7.3099 7.3099 7.3656 7.3656 7.4537 7.4537 7.5494 7.5494 7.6144 7.6144 7.6897 7.6897 7.7659 7.7659 7.8370 7.8370 8.0525 8.0525 8.6756 8.6756 8.9859 8.9859 9.1770 9.1770 9.3422 9.3422 9.5773 9.5773 9.8332 9.8332 10.0039 10.0039 10.2343 10.2343 10.4343 10.4343 10.7892 10.7892 11.0906 11.0906 12.0878 12.0878 12.7468 12.7468 12.8568 12.8568 13.0758 13.0758 13.1540 13.1540 13.4290 13.4290 k = 0.3232-0.5223 0.3777 ( 6676 PWs) bands (ev): 0.8651 0.8651 0.9230 0.9230 1.3544 1.3544 3.3191 3.3191 5.3361 5.3361 5.4633 5.4633 6.0165 6.0165 6.0887 6.0887 6.1631 6.1631 6.1939 6.1939 6.5380 6.5380 6.5899 6.5899 6.7414 6.7414 6.7700 6.7700 6.8523 6.8523 7.0067 7.0067 7.1225 7.1225 7.3117 7.3117 7.3675 7.3675 7.4482 7.4482 7.5476 7.5476 7.6101 7.6101 7.6948 7.6948 7.7674 7.7674 7.8345 7.8345 8.0563 8.0563 8.6964 8.6964 8.9795 8.9795 9.1919 9.1919 9.3403 9.3403 9.6063 9.6063 9.8099 9.8099 9.9799 9.9799 10.2608 10.2608 10.3858 10.3858 10.7867 10.7867 11.1276 11.1276 12.0891 12.0891 12.7377 12.7377 12.8582 12.8582 13.0993 13.0993 13.1505 13.1505 13.4255 13.4255 k = 0.3368-0.5046 0.3725 ( 6678 PWs) bands (ev): 0.8374 0.8374 0.9446 0.9446 1.3722 1.3722 3.3004 3.3004 5.2948 5.2948 5.4975 5.4975 6.0219 6.0219 6.0900 6.0900 6.1620 6.1620 6.1907 6.1907 6.5396 6.5396 6.5889 6.5889 6.7436 6.7436 6.7804 6.7804 6.8563 6.8563 7.0022 7.0022 7.1169 7.1169 7.3130 7.3130 7.3689 7.3689 7.4435 7.4435 7.5452 7.5452 7.6034 7.6034 7.6997 7.6997 7.7690 7.7690 7.8325 7.8325 8.0617 8.0617 8.7172 8.7172 8.9730 8.9730 9.2065 9.2065 9.3391 9.3391 9.6383 9.6383 9.7849 9.7849 9.9549 9.9549 10.2763 10.2763 10.3333 10.3333 10.8016 10.8016 11.1688 11.1688 12.0890 12.0890 12.7202 12.7202 12.8650 12.8650 13.1197 13.1197 13.1467 13.1467 13.4262 13.4262 k = 0.3504-0.4869 0.3672 ( 6670 PWs) bands (ev): 0.8118 0.8118 0.9573 0.9573 1.4002 1.4002 3.2789 3.2789 5.2543 5.2543 5.5308 5.5308 6.0228 6.0228 6.0955 6.0955 6.1612 6.1612 6.1894 6.1894 6.5390 6.5390 6.5888 6.5888 6.7423 6.7423 6.7943 6.7943 6.8610 6.8610 6.9982 6.9982 7.1114 7.1114 7.3136 7.3136 7.3699 7.3699 7.4396 7.4396 7.5421 7.5421 7.5949 7.5949 7.7045 7.7045 7.7703 7.7703 7.8310 7.8310 8.0682 8.0682 8.7384 8.7384 8.9665 8.9665 9.2207 9.2207 9.3388 9.3388 9.6719 9.6719 9.7590 9.7590 9.9297 9.9297 10.2715 10.2715 10.2882 10.2882 10.8315 10.8315 11.2135 11.2135 12.0865 12.0865 12.6950 12.6950 12.8762 12.8762 13.1234 13.1234 13.1564 13.1564 13.4317 13.4317 k = 0.3640-0.4693 0.3619 ( 6663 PWs) bands (ev): 0.7882 0.7882 0.9628 0.9628 1.4362 1.4362 3.2549 3.2549 5.2163 5.2163 5.5621 5.5621 6.0187 6.0187 6.1049 6.1049 6.1604 6.1604 6.1908 6.1908 6.5369 6.5369 6.5893 6.5893 6.7398 6.7398 6.8083 6.8083 6.8666 6.8666 6.9948 6.9948 7.1060 7.1060 7.3132 7.3132 7.3706 7.3706 7.4366 7.4366 7.5378 7.5378 7.5857 7.5857 7.7091 7.7091 7.7712 7.7712 7.8302 7.8302 8.0755 8.0755 8.7604 8.7604 8.9600 8.9600 9.2344 9.2344 9.3395 9.3395 9.7045 9.7045 9.7335 9.7335 9.9055 9.9055 10.2178 10.2178 10.2829 10.2829 10.8730 10.8730 11.2609 11.2609 12.0808 12.0808 12.6631 12.6631 12.8909 12.8909 13.1132 13.1132 13.1777 13.1777 13.4425 13.4425 k = 0.3776-0.4516 0.3567 ( 6653 PWs) bands (ev): 0.7667 0.7667 0.9630 0.9630 1.4779 1.4779 3.2288 3.2288 5.1813 5.1813 5.5909 5.5909 6.0109 6.0109 6.1161 6.1161 6.1597 6.1597 6.1960 6.1960 6.5338 6.5338 6.5896 6.5896 6.7368 6.7368 6.8206 6.8206 6.8730 6.8730 6.9922 6.9922 7.1012 7.1012 7.3116 7.3116 7.3712 7.3712 7.4342 7.4342 7.5322 7.5322 7.5767 7.5767 7.7137 7.7137 7.7716 7.7716 7.8299 7.8299 8.0832 8.0832 8.7839 8.7839 8.9538 8.9538 9.2470 9.2470 9.3413 9.3413 9.7036 9.7036 9.7385 9.7385 9.8845 9.8845 10.1609 10.1609 10.2753 10.2753 10.9224 10.9224 11.3106 11.3106 12.0711 12.0711 12.6252 12.6252 12.9085 12.9085 13.0992 13.0992 13.2006 13.2006 13.4592 13.4592 k = 0.3912-0.4339 0.3514 ( 6648 PWs) bands (ev): 0.7474 0.7474 0.9597 0.9597 1.5226 1.5226 3.2010 3.2010 5.1498 5.1498 5.6172 5.6172 6.0009 6.0009 6.1264 6.1264 6.1591 6.1591 6.2060 6.2060 6.5302 6.5302 6.5895 6.5895 6.7337 6.7337 6.8307 6.8307 6.8797 6.8797 6.9906 6.9906 7.0971 7.0971 7.3087 7.3087 7.3720 7.3720 7.4324 7.4324 7.5248 7.5248 7.5689 7.5689 7.7181 7.7181 7.7712 7.7712 7.8301 7.8301 8.0906 8.0906 8.8092 8.8092 8.9479 8.9479 9.2581 9.2581 9.3442 9.3442 9.6782 9.6782 9.7601 9.7601 9.8719 9.8719 10.1058 10.1058 10.2641 10.2641 10.9767 10.9767 11.3620 11.3620 12.0569 12.0569 12.5825 12.5825 12.9283 12.9283 13.0834 13.0834 13.2235 13.2235 13.4819 13.4819 k = 0.4048-0.4163 0.3461 ( 6641 PWs) bands (ev): 0.7303 0.7303 0.9547 0.9547 1.5682 1.5682 3.1724 3.1724 5.1220 5.1220 5.6409 5.6409 5.9897 5.9897 6.1341 6.1341 6.1587 6.1587 6.2209 6.2209 6.5266 6.5266 6.5884 6.5884 6.7307 6.7307 6.8385 6.8385 6.8858 6.8858 6.9904 6.9904 7.0944 7.0944 7.3047 7.3047 7.3730 7.3730 7.4310 7.4310 7.5158 7.5158 7.5628 7.5628 7.7225 7.7225 7.7703 7.7703 7.8306 7.8306 8.0977 8.0977 8.8363 8.8363 8.9423 8.9423 9.2669 9.2669 9.3479 9.3479 9.6529 9.6529 9.7663 9.7663 9.8747 9.8747 10.0547 10.0547 10.2501 10.2501 11.0334 11.0334 11.4147 11.4147 12.0379 12.0379 12.5365 12.5365 12.9494 12.9494 13.0667 13.0667 13.2456 13.2456 13.5109 13.5109 k = 0.4184-0.3986 0.3409 ( 6637 PWs) bands (ev): 0.7154 0.7154 0.9489 0.9489 1.6126 1.6126 3.1437 3.1437 5.0980 5.0980 5.6618 5.6618 5.9781 5.9781 6.1392 6.1392 6.1585 6.1585 6.2397 6.2397 6.5232 6.5232 6.5863 6.5863 6.7278 6.7278 6.8445 6.8445 6.8899 6.8899 6.9914 6.9914 7.0935 7.0935 7.2996 7.2996 7.3741 7.3741 7.4298 7.4298 7.5058 7.5058 7.5583 7.5583 7.7267 7.7267 7.7688 7.7688 7.8314 7.8314 8.1040 8.1040 8.8653 8.8653 8.9374 8.9374 9.2724 9.2724 9.3525 9.3525 9.6288 9.6288 9.7582 9.7582 9.8886 9.8886 10.0114 10.0114 10.2343 10.2343 11.0903 11.0903 11.4682 11.4682 12.0140 12.0140 12.4889 12.4889 12.9707 12.9707 13.0499 13.0499 13.2662 13.2662 13.5463 13.5463 k = 0.4320-0.3809 0.3356 ( 6636 PWs) bands (ev): 0.7027 0.7027 0.9430 0.9430 1.6540 1.6540 3.1162 3.1162 5.0779 5.0779 5.6801 5.6801 5.9667 5.9667 6.1421 6.1421 6.1586 6.1586 6.2605 6.2605 6.5201 6.5201 6.5830 6.5830 6.7253 6.7253 6.8493 6.8493 6.8917 6.8917 6.9934 6.9934 7.0946 7.0946 7.2938 7.2938 7.3753 7.3753 7.4288 7.4288 7.4959 7.4959 7.5550 7.5550 7.7309 7.7309 7.7668 7.7668 7.8323 7.8323 8.1096 8.1096 8.8955 8.8955 8.9331 8.9331 9.2737 9.2737 9.3575 9.3575 9.6066 9.6066 9.7457 9.7457 9.8950 9.8950 9.9867 9.9867 10.2169 10.2169 11.1453 11.1453 11.5220 11.5220 11.9853 11.9853 12.4416 12.4416 12.9907 12.9907 13.0342 13.0342 13.2848 13.2848 13.5879 13.5879 k = 0.4456-0.3633 0.3303 ( 6631 PWs) bands (ev): 0.6923 0.6923 0.9377 0.9377 1.6909 1.6909 3.0911 3.0911 5.0616 5.0616 5.6956 5.6956 5.9561 5.9561 6.1438 6.1438 6.1588 6.1588 6.2813 6.2813 6.5173 6.5173 6.5788 6.5788 6.7231 6.7231 6.8535 6.8535 6.8911 6.8911 6.9956 6.9956 7.0975 7.0975 7.2877 7.2877 7.3765 7.3765 7.4279 7.4279 7.4868 7.4868 7.5527 7.5527 7.7349 7.7349 7.7645 7.7645 7.8333 7.8333 8.1141 8.1141 8.9243 8.9243 8.9313 8.9313 9.2703 9.2703 9.3629 9.3629 9.5867 9.5867 9.7350 9.7350 9.8781 9.8781 9.9917 9.9917 10.1985 10.1985 11.1962 11.1962 11.5758 11.5758 11.9521 11.9521 12.3969 12.3969 13.0052 13.0052 13.0237 13.0237 13.3007 13.3007 13.6350 13.6350 k = 0.4592-0.3456 0.3251 ( 6621 PWs) bands (ev): 0.6842 0.6842 0.9333 0.9333 1.7216 1.7216 3.0697 3.0697 5.0490 5.0490 5.7082 5.7082 5.9470 5.9470 6.1448 6.1448 6.1592 6.1592 6.3004 6.3004 6.5152 6.5152 6.5741 6.5741 6.7214 6.7214 6.8571 6.8571 6.8889 6.8889 6.9975 6.9975 7.1018 7.1018 7.2817 7.2817 7.3776 7.3776 7.4271 7.4271 7.4792 7.4792 7.5510 7.5510 7.7388 7.7388 7.7618 7.7618 7.8341 7.8341 8.1177 8.1177 8.9257 8.9257 8.9566 8.9566 9.2623 9.2623 9.3683 9.3683 9.5699 9.5699 9.7290 9.7290 9.8499 9.8499 10.0124 10.0124 10.1794 10.1794 11.2403 11.2403 11.6291 11.6291 11.9147 11.9147 12.3575 12.3575 13.0018 13.0018 13.0305 13.0305 13.3135 13.3135 13.6862 13.6862 k = 0.4728-0.3279 0.3198 ( 6619 PWs) bands (ev): 0.6785 0.6785 0.9300 0.9300 1.7448 1.7448 3.0532 3.0532 5.0400 5.0400 5.7176 5.7176 5.9398 5.9398 6.1452 6.1452 6.1595 6.1595 6.3159 6.3159 6.5135 6.5135 6.5696 6.5696 6.7202 6.7202 6.8603 6.8603 6.8861 6.8861 6.9988 6.9988 7.1062 7.1062 7.2766 7.2766 7.3784 7.3784 7.4264 7.4264 7.4736 7.4736 7.5499 7.5499 7.7424 7.7424 7.7590 7.7590 7.8347 7.8347 8.1202 8.1202 8.9237 8.9237 8.9824 8.9824 9.2518 9.2518 9.3731 9.3731 9.5569 9.5569 9.7286 9.7286 9.8227 9.8227 10.0357 10.0357 10.1603 10.1603 11.2748 11.2748 11.6814 11.6814 11.8737 11.8737 12.3262 12.3262 12.9935 12.9935 13.0413 13.0413 13.3228 13.3228 13.7382 13.7382 k = 0.4864-0.3103 0.3145 ( 6620 PWs) bands (ev): 0.6750 0.6750 0.9279 0.9279 1.7592 1.7592 3.0429 3.0429 5.0347 5.0347 5.7234 5.7234 5.9352 5.9352 6.1454 6.1454 6.1597 6.1597 6.3261 6.3261 6.5125 6.5125 6.5663 6.5663 6.7195 6.7195 6.8627 6.8627 6.8835 6.8835 6.9996 6.9996 7.1095 7.1095 7.2731 7.2731 7.3789 7.3789 7.4260 7.4260 7.4701 7.4701 7.5493 7.5493 7.7455 7.7455 7.7564 7.7564 7.8351 7.8351 8.1217 8.1217 8.9225 8.9225 9.0009 9.0009 9.2423 9.2423 9.3765 9.3765 9.5485 9.5485 9.7320 9.7320 9.8020 9.8020 10.0556 10.0556 10.1437 10.1437 11.2970 11.2970 11.7323 11.7323 11.8296 11.8296 12.3060 12.3060 12.9879 12.9879 13.0486 13.0486 13.3285 13.3285 13.7829 13.7829 k = 0.5000-0.2926 0.3093 ( 6618 PWs) bands (ev): 0.6738 0.6738 0.9272 0.9272 1.7641 1.7641 3.0393 3.0393 5.0329 5.0329 5.7253 5.7253 5.9337 5.9337 6.1455 6.1455 6.1598 6.1598 6.3297 6.3297 6.5122 6.5122 6.5651 6.5651 6.7193 6.7193 6.8638 6.8638 6.8824 6.8824 6.9998 6.9998 7.1108 7.1108 7.2718 7.2718 7.3791 7.3791 7.4259 7.4259 7.4690 7.4690 7.5490 7.5490 7.7470 7.7470 7.7551 7.7551 7.8353 7.8353 8.1222 8.1222 8.9220 8.9220 9.0078 9.0078 9.2384 9.2384 9.3777 9.3777 9.5456 9.5456 9.7346 9.7346 9.7936 9.7936 10.0644 10.0644 10.1361 10.1361 11.3046 11.3046 11.7751 11.7751 11.7890 11.7890 12.2989 12.2989 12.9859 12.9859 13.0511 13.0511 13.3303 13.3303 13.8024 13.8024 k = 0.5000-0.2926 0.3093 ( 6618 PWs) bands (ev): 0.6738 0.6738 0.9272 0.9272 1.7641 1.7641 3.0393 3.0393 5.0329 5.0329 5.7253 5.7253 5.9337 5.9337 6.1455 6.1455 6.1598 6.1598 6.3297 6.3297 6.5122 6.5122 6.5651 6.5651 6.7193 6.7193 6.8638 6.8638 6.8824 6.8824 6.9998 6.9998 7.1108 7.1108 7.2718 7.2718 7.3791 7.3791 7.4259 7.4259 7.4690 7.4690 7.5490 7.5490 7.7470 7.7470 7.7551 7.7551 7.8353 7.8353 8.1222 8.1222 8.9220 8.9220 9.0078 9.0078 9.2384 9.2384 9.3777 9.3777 9.5456 9.5456 9.7346 9.7346 9.7936 9.7936 10.0644 10.0644 10.1361 10.1361 11.3046 11.3046 11.7751 11.7751 11.7890 11.7890 12.2989 12.2989 12.9859 12.9859 13.0511 13.0511 13.3303 13.3303 13.8024 13.8024 k = 0.4938-0.2817 0.3297 ( 6616 PWs) bands (ev): 0.6751 0.6751 0.9285 0.9285 1.7645 1.7645 3.0403 3.0403 5.0341 5.0341 5.7259 5.7259 5.9341 5.9341 6.1433 6.1433 6.1597 6.1597 6.3299 6.3299 6.5120 6.5120 6.5655 6.5655 6.7193 6.7193 6.8622 6.8622 6.8840 6.8840 6.9997 6.9997 7.1108 7.1108 7.2716 7.2716 7.3755 7.3755 7.4280 7.4280 7.4686 7.4686 7.5496 7.5496 7.7464 7.7464 7.7552 7.7552 7.8353 7.8353 8.1223 8.1223 8.9166 8.9166 9.0103 9.0103 9.2372 9.2372 9.3707 9.3707 9.5323 9.5323 9.7404 9.7404 9.7989 9.7989 10.0711 10.0711 10.1374 10.1374 11.3001 11.3001 11.7667 11.7667 11.7848 11.7848 12.3067 12.3067 12.9944 12.9944 13.0542 13.0542 13.3295 13.3295 13.7938 13.7938 k = 0.4875-0.2708 0.3501 ( 6620 PWs) bands (ev): 0.6788 0.6788 0.9322 0.9322 1.7658 1.7658 3.0433 3.0433 5.0376 5.0376 5.7274 5.7274 5.9354 5.9354 6.1371 6.1371 6.1593 6.1593 6.3303 6.3303 6.5117 6.5117 6.5667 6.5667 6.7195 6.7195 6.8586 6.8586 6.8877 6.8877 6.9992 6.9992 7.1110 7.1110 7.2711 7.2711 7.3665 7.3665 7.4320 7.4320 7.4682 7.4682 7.5514 7.5514 7.7448 7.7448 7.7551 7.7551 7.8355 7.8355 8.1225 8.1225 8.9020 8.9020 9.0160 9.0160 9.2325 9.2325 9.3525 9.3525 9.4981 9.4981 9.7530 9.7530 9.8133 9.8133 10.0902 10.0902 10.1414 10.1414 11.2865 11.2865 11.7432 11.7432 11.7725 11.7725 12.3284 12.3284 13.0193 13.0193 13.0630 13.0630 13.3277 13.3277 13.7700 13.7700 k = 0.4813-0.2599 0.3705 ( 6632 PWs) bands (ev): 0.6850 0.6850 0.9384 0.9384 1.7679 1.7679 3.0482 3.0482 5.0434 5.0434 5.7297 5.7297 5.9373 5.9373 6.1274 6.1274 6.1582 6.1582 6.3311 6.3311 6.5112 6.5112 6.5686 6.5686 6.7198 6.7198 6.8542 6.8542 6.8922 6.8922 6.9985 6.9985 7.1112 7.1112 7.2701 7.2701 7.3548 7.3548 7.4341 7.4341 7.4692 7.4692 7.5540 7.5540 7.7424 7.7424 7.7549 7.7549 7.8358 7.8358 8.1229 8.1229 8.8807 8.8807 9.0223 9.0223 9.2200 9.2200 9.3303 9.3303 9.4522 9.4522 9.7657 9.7657 9.8336 9.8336 10.1189 10.1189 10.1483 10.1483 11.2633 11.2633 11.7087 11.7087 11.7541 11.7541 12.3601 12.3601 13.0590 13.0590 13.0758 13.0758 13.3266 13.3266 13.7362 13.7362 k = 0.4750-0.2490 0.3909 ( 6628 PWs) bands (ev): 0.6936 0.6936 0.9470 0.9470 1.7708 1.7708 3.0550 3.0550 5.0514 5.0514 5.7327 5.7327 5.9398 5.9398 6.1147 6.1147 6.1564 6.1564 6.3319 6.3319 6.5108 6.5108 6.5712 6.5712 6.7204 6.7204 6.8499 6.8499 6.8967 6.8967 6.9976 6.9976 7.1115 7.1115 7.2684 7.2684 7.3421 7.3421 7.4320 7.4320 7.4727 7.4727 7.5574 7.5574 7.7393 7.7393 7.7543 7.7543 7.8363 7.8363 8.1235 8.1235 8.8544 8.8544 9.0272 9.0272 9.1935 9.1935 9.3138 9.3138 9.4016 9.4016 9.7756 9.7756 9.8564 9.8564 10.1509 10.1509 10.1609 10.1609 11.2301 11.2301 11.6673 11.6673 11.7323 11.7323 12.3978 12.3978 13.0891 13.0891 13.1117 13.1117 13.3293 13.3293 13.6978 13.6978 k = 0.4688-0.2381 0.4113 ( 6632 PWs) bands (ev): 0.7046 0.7046 0.9581 0.9581 1.7746 1.7746 3.0637 3.0637 5.0617 5.0617 5.7361 5.7361 5.9426 5.9426 6.0994 6.0994 6.1542 6.1542 6.3328 6.3328 6.5106 6.5106 6.5744 6.5744 6.7211 6.7211 6.8457 6.8457 6.9010 6.9010 6.9964 6.9964 7.1120 7.1120 7.2653 7.2653 7.3295 7.3295 7.4261 7.4261 7.4778 7.4778 7.5614 7.5614 7.7355 7.7355 7.7534 7.7534 7.8370 7.8370 8.1242 8.1242 8.8239 8.8239 9.0294 9.0294 9.1522 9.1522 9.3056 9.3056 9.3516 9.3516 9.7820 9.7820 9.8791 9.8791 10.1671 10.1671 10.1948 10.1948 11.1867 11.1867 11.6225 11.6225 11.7096 11.7096 12.4384 12.4384 13.0991 13.0991 13.1746 13.1746 13.3400 13.3400 13.6596 13.6596 k = 0.4625-0.2272 0.4318 ( 6630 PWs) bands (ev): 0.7181 0.7181 0.9716 0.9716 1.7792 1.7792 3.0741 3.0741 5.0740 5.0740 5.7392 5.7392 5.9452 5.9452 6.0820 6.0820 6.1518 6.1518 6.3335 6.3335 6.5106 6.5106 6.5781 6.5781 6.7221 6.7221 6.8419 6.8419 6.9047 6.9047 6.9951 6.9951 7.1125 7.1125 7.2603 7.2603 7.3181 7.3181 7.4177 7.4177 7.4835 7.4835 7.5658 7.5658 7.7311 7.7311 7.7520 7.7520 7.8379 7.8379 8.1250 8.1250 8.7896 8.7896 9.0272 9.0272 9.1010 9.1010 9.2886 9.2886 9.3197 9.3197 9.7853 9.7853 9.8999 9.8999 10.1814 10.1814 10.2329 10.2329 11.1335 11.1335 11.5769 11.5769 11.6877 11.6877 12.4792 12.4792 13.1022 13.1022 13.2457 13.2457 13.3613 13.3613 13.6256 13.6256 k = 0.4562-0.2163 0.4522 ( 6630 PWs) bands (ev): 0.7339 0.7339 0.9876 0.9876 1.7846 1.7846 3.0864 3.0864 5.0885 5.0885 5.7412 5.7412 5.9472 5.9472 6.0637 6.0637 6.1496 6.1496 6.3341 6.3341 6.5110 6.5110 6.5823 6.5823 6.7234 6.7234 6.8385 6.8385 6.9078 6.9078 6.9936 6.9936 7.1132 7.1132 7.2523 7.2523 7.3091 7.3091 7.4074 7.4074 7.4887 7.4887 7.5705 7.5705 7.7261 7.7261 7.7502 7.7502 7.8391 7.8391 8.1259 8.1259 8.7516 8.7516 9.0174 9.0174 9.0466 9.0466 9.2490 9.2490 9.3196 9.3196 9.7857 9.7857 9.9178 9.9178 10.1975 10.1975 10.2692 10.2692 11.0719 11.0719 11.5322 11.5322 11.6677 11.6677 12.5186 12.5186 13.0981 13.0981 13.3223 13.3223 13.3913 13.3913 13.6004 13.6004 k = 0.4500-0.2054 0.4726 ( 6628 PWs) bands (ev): 0.7520 0.7520 1.0059 1.0059 1.7908 1.7908 3.1002 3.1002 5.1048 5.1048 5.7410 5.7410 5.9479 5.9479 6.0454 6.0454 6.1481 6.1481 6.3345 6.3345 6.5119 6.5119 6.5870 6.5870 6.7250 6.7250 6.8356 6.8356 6.9101 6.9101 6.9919 6.9919 7.1141 7.1141 7.2411 7.2411 7.3027 7.3027 7.3961 7.3961 7.4930 7.4930 7.5753 7.5753 7.7205 7.7205 7.7481 7.7481 7.8405 7.8405 8.1269 8.1269 8.7102 8.7102 8.9776 8.9776 9.0123 9.0123 9.2129 9.2129 9.3262 9.3262 9.7833 9.7833 9.9319 9.9319 10.2150 10.2150 10.3014 10.3014 11.0034 11.0034 11.4901 11.4901 11.6497 11.6497 12.5548 12.5548 13.0897 13.0897 13.3971 13.3971 13.4263 13.4263 13.5905 13.5905 k = 0.4437-0.1945 0.4930 ( 6640 PWs) bands (ev): 0.7723 0.7723 1.0266 1.0266 1.7978 1.7978 3.1156 3.1156 5.1229 5.1229 5.7370 5.7370 5.9468 5.9468 6.0288 6.0288 6.1478 6.1478 6.3346 6.3346 6.5133 6.5133 6.5920 6.5920 6.7269 6.7269 6.8331 6.8331 6.9116 6.9116 6.9901 6.9901 7.1150 7.1150 7.2271 7.2271 7.2985 7.2985 7.3840 7.3840 7.4963 7.4963 7.5802 7.5802 7.7143 7.7143 7.7456 7.7456 7.8423 7.8423 8.1281 8.1281 8.6656 8.6656 8.9180 8.9180 8.9888 8.9888 9.1856 9.1856 9.3350 9.3350 9.7781 9.7781 9.9420 9.9420 10.2331 10.2331 10.3284 10.3284 10.9303 10.9303 11.4515 11.4515 11.6338 11.6338 12.5863 12.5863 13.0807 13.0807 13.4285 13.4285 13.4899 13.4899 13.5892 13.5892 k = 0.4375-0.1836 0.5134 ( 6648 PWs) bands (ev): 0.7949 0.7949 1.0497 1.0497 1.8056 1.8056 3.1324 3.1324 5.1426 5.1426 5.7271 5.7271 5.9438 5.9438 6.0153 6.0153 6.1495 6.1495 6.3345 6.3345 6.5151 6.5151 6.5975 6.5975 6.7293 6.7293 6.8311 6.8311 6.9122 6.9122 6.9881 6.9881 7.1162 7.1162 7.2113 7.2113 7.2956 7.2956 7.3717 7.3717 7.4986 7.4986 7.5851 7.5851 7.7075 7.7075 7.7429 7.7429 7.8442 7.8442 8.1293 8.1293 8.6183 8.6183 8.8567 8.8567 8.9598 8.9598 9.1674 9.1674 9.3448 9.3448 9.7700 9.7700 9.9477 9.9477 10.2506 10.2506 10.3491 10.3491 10.8551 10.8551 11.4173 11.4173 11.6197 11.6197 12.6111 12.6111 13.0747 13.0747 13.4307 13.4307 13.5257 13.5257 13.6013 13.6013 k = 0.4313-0.1727 0.5338 ( 6648 PWs) bands (ev): 0.8195 0.8195 1.0750 1.0750 1.8142 1.8142 3.1504 3.1504 5.1637 5.1637 5.7097 5.7097 5.9389 5.9389 6.0061 6.0061 6.1535 6.1535 6.3343 6.3343 6.5175 6.5175 6.6034 6.6034 6.7322 6.7322 6.8297 6.8297 6.9120 6.9120 6.9858 6.9858 7.1175 7.1175 7.1945 7.1945 7.2930 7.2930 7.3598 7.3598 7.4998 7.4998 7.5898 7.5898 7.7003 7.7003 7.7399 7.7399 7.8464 7.8464 8.1306 8.1306 8.5689 8.5689 8.7960 8.7960 8.9264 8.9264 9.1562 9.1562 9.3550 9.3550 9.7588 9.7588 9.9487 9.9487 10.2658 10.2658 10.3631 10.3631 10.7810 10.7810 11.3880 11.3880 11.6075 11.6075 12.6275 12.6275 13.0746 13.0746 13.4253 13.4253 13.4980 13.4980 13.6748 13.6748 k = 0.4250-0.1618 0.5543 ( 6650 PWs) bands (ev): 0.8461 0.8461 1.1026 1.1026 1.8236 1.8236 3.1695 3.1695 5.1859 5.1859 5.6837 5.6837 5.9322 5.9322 6.0020 6.0020 6.1600 6.1600 6.3339 6.3339 6.5202 6.5202 6.6095 6.6095 6.7355 6.7355 6.8288 6.8288 6.9110 6.9110 6.9832 6.9832 7.1189 7.1189 7.1773 7.1773 7.2898 7.2898 7.3492 7.3492 7.5000 7.5000 7.5942 7.5942 7.6925 7.6925 7.7366 7.7366 7.8488 7.8488 8.1321 8.1321 8.5179 8.5179 8.7365 8.7365 8.8908 8.8908 9.1497 9.1497 9.3653 9.3653 9.7445 9.7445 9.9446 9.9446 10.2755 10.2755 10.3702 10.3702 10.7120 10.7120 11.3639 11.3639 11.5970 11.5970 12.6343 12.6343 13.0820 13.0820 13.4192 13.4192 13.4661 13.4661 13.7522 13.7522 k = 0.4188-0.1509 0.5747 ( 6650 PWs) bands (ev): 0.8746 0.8746 1.1324 1.1324 1.8338 1.8338 3.1895 3.1895 5.2088 5.2088 5.6494 5.6494 5.9231 5.9231 6.0037 6.0037 6.1692 6.1692 6.3334 6.3334 6.5232 6.5232 6.6160 6.6160 6.7394 6.7394 6.8284 6.8284 6.9091 6.9091 6.9802 6.9802 7.1199 7.1199 7.1603 7.1603 7.2848 7.2848 7.3408 7.3408 7.4994 7.4994 7.5982 7.5982 7.6843 7.6843 7.7331 7.7331 7.8514 7.8514 8.1338 8.1338 8.4663 8.4663 8.6789 8.6789 8.8545 8.8545 9.1462 9.1462 9.3750 9.3750 9.7269 9.7269 9.9347 9.9347 10.2757 10.2757 10.3705 10.3705 10.6538 10.6538 11.3450 11.3450 11.5884 11.5884 12.6312 12.6312 13.0966 13.0966 13.4111 13.4111 13.4425 13.4425 13.8228 13.8228 k = 0.4125-0.1400 0.5951 ( 6654 PWs) bands (ev): 0.9050 0.9050 1.1644 1.1644 1.8448 1.8448 3.2101 3.2101 5.2321 5.2321 5.6077 5.6077 5.9112 5.9112 6.0110 6.0110 6.1806 6.1806 6.3328 6.3328 6.5264 6.5264 6.6228 6.6228 6.7438 6.7438 6.8286 6.8286 6.9066 6.9066 6.9768 6.9768 7.1193 7.1193 7.1453 7.1453 7.2776 7.2776 7.3354 7.3354 7.4979 7.4979 7.6018 7.6018 7.6756 7.6756 7.7294 7.7294 7.8541 7.8541 8.1356 8.1356 8.4146 8.4146 8.6236 8.6236 8.8183 8.8183 9.1446 9.1446 9.3839 9.3839 9.7061 9.7061 9.9179 9.9179 10.2618 10.2618 10.3646 10.3646 10.6127 10.6127 11.3310 11.3310 11.5821 11.5821 12.6192 12.6192 13.1167 13.1167 13.3924 13.3924 13.4392 13.4392 13.8813 13.8813 k = 0.4062-0.1291 0.6155 ( 6660 PWs) bands (ev): 0.9370 0.9370 1.1985 1.1985 1.8566 1.8566 3.2312 3.2312 5.2552 5.2552 5.5597 5.5597 5.8972 5.8972 6.0229 6.0229 6.1939 6.1939 6.3323 6.3323 6.5297 6.5297 6.6297 6.6297 6.7489 6.7489 6.8293 6.8293 6.9036 6.9036 6.9728 6.9728 7.1125 7.1125 7.1370 7.1370 7.2683 7.2683 7.3331 7.3331 7.4956 7.4956 7.6047 7.6047 7.6666 7.6666 7.7255 7.7255 7.8569 7.8569 8.1376 8.1376 8.3636 8.3636 8.5707 8.5707 8.7826 8.7826 9.1443 9.1443 9.3913 9.3913 9.6822 9.6822 9.8927 9.8927 10.2330 10.2330 10.3528 10.3528 10.5920 10.5920 11.3215 11.3215 11.5784 11.5784 12.6002 12.6002 13.1387 13.1387 13.3694 13.3694 13.4523 13.4523 13.9233 13.9233 k = 0.4000-0.1182 0.6359 ( 6660 PWs) bands (ev): 0.9705 0.9705 1.2346 1.2346 1.8693 1.8693 3.2524 3.2524 5.2775 5.2775 5.5065 5.5065 5.8821 5.8821 6.0383 6.0383 6.2088 6.2088 6.3320 6.3320 6.5328 6.5328 6.6367 6.6367 6.7546 6.7546 6.8307 6.8307 6.9001 6.9001 6.9684 6.9684 7.0988 7.0988 7.1364 7.1364 7.2577 7.2577 7.3332 7.3332 7.4926 7.4926 7.6069 7.6069 7.6575 7.6575 7.7214 7.7214 7.8599 7.8599 8.1399 8.1399 8.3138 8.3138 8.5206 8.5206 8.7474 8.7474 9.1448 9.1448 9.3968 9.3968 9.6553 9.6553 9.8575 9.8575 10.1941 10.1941 10.3359 10.3359 10.5889 10.5889 11.3159 11.3159 11.5776 11.5776 12.5757 12.5757 13.1595 13.1595 13.3479 13.3479 13.4773 13.4773 13.9476 13.9476 k = 0.3937-0.1073 0.6563 ( 6652 PWs) bands (ev): 1.0053 1.0053 1.2728 1.2728 1.8828 1.8828 3.2735 3.2735 5.2983 5.2983 5.4488 5.4488 5.8673 5.8673 6.0563 6.0563 6.2246 6.2246 6.3319 6.3319 6.5356 6.5356 6.6436 6.6436 6.7610 6.7610 6.8326 6.8326 6.8965 6.8965 6.9635 6.9635 7.0831 7.0831 7.1386 7.1386 7.2468 7.2468 7.3350 7.3350 7.4891 7.4891 7.6083 7.6083 7.6483 7.6483 7.7171 7.7171 7.8628 7.8628 8.1424 8.1424 8.2657 8.2657 8.4733 8.4733 8.7129 8.7129 9.1458 9.1458 9.3998 9.3998 9.6257 9.6257 9.8108 9.8108 10.1528 10.1528 10.3147 10.3147 10.5976 10.5976 11.3137 11.3137 11.5802 11.5802 12.5475 12.5475 13.1764 13.1764 13.3292 13.3292 13.5139 13.5139 13.9544 13.9544 k = 0.3875-0.0964 0.6768 ( 6644 PWs) bands (ev): 1.0413 1.0413 1.3128 1.3128 1.8973 1.8973 3.2941 3.2941 5.3165 5.3165 5.3874 5.3874 5.8539 5.8539 6.0761 6.0761 6.2412 6.2412 6.3322 6.3322 6.5379 6.5379 6.6503 6.6503 6.7681 6.7681 6.8352 6.8352 6.8929 6.8929 6.9581 6.9581 7.0674 7.0674 7.1419 7.1419 7.2362 7.2362 7.3381 7.3381 7.4851 7.4851 7.6083 7.6083 7.6396 7.6396 7.7125 7.7125 7.8658 7.8658 8.1453 8.1453 8.2197 8.2197 8.4290 8.4290 8.6791 8.6791 9.1471 9.1471 9.3996 9.3996 9.5937 9.5937 9.7531 9.7531 10.1144 10.1144 10.2903 10.2903 10.6129 10.6129 11.3141 11.3141 11.5867 11.5867 12.5168 12.5168 13.1886 13.1886 13.3134 13.3134 13.5611 13.5611 13.9415 13.9415 k = 0.3812-0.0855 0.6972 ( 6644 PWs) bands (ev): 1.0782 1.0782 1.3546 1.3546 1.9127 1.9127 3.3138 3.3138 5.3223 5.3223 5.3320 5.3320 5.8433 5.8433 6.0970 6.0970 6.2579 6.2579 6.3330 6.3330 6.5396 6.5396 6.6565 6.6565 6.7758 6.7758 6.8384 6.8384 6.8896 6.8896 6.9526 6.9526 7.0524 7.0524 7.1456 7.1456 7.2266 7.2266 7.3422 7.3422 7.4806 7.4806 7.6064 7.6064 7.6322 7.6322 7.7078 7.7078 7.8688 7.8688 8.1482 8.1482 8.1763 8.1763 8.3875 8.3875 8.6459 8.6459 9.1483 9.1483 9.3954 9.3954 9.5598 9.5598 9.6862 9.6862 10.0809 10.0809 10.2636 10.2636 10.6316 10.6316 11.3167 11.3167 11.5975 11.5975 12.4847 12.4847 13.1963 13.1963 13.3006 13.3006 13.6171 13.6171 13.9098 13.9098 k = 0.3750-0.0746 0.7176 ( 6644 PWs) bands (ev): 1.1158 1.1158 1.3982 1.3982 1.9292 1.9292 3.3322 3.3322 5.2554 5.2554 5.3423 5.3423 5.8368 5.8368 6.1185 6.1185 6.2745 6.2745 6.3346 6.3346 6.5407 6.5407 6.6620 6.6620 6.7840 6.7840 6.8420 6.8420 6.8868 6.8868 6.9473 6.9473 7.0384 7.0384 7.1493 7.1493 7.2183 7.2183 7.3470 7.3470 7.4757 7.4757 7.6014 7.6014 7.6270 7.6270 7.7027 7.7027 7.8717 7.8717 8.1335 8.1335 8.1534 8.1534 8.3489 8.3489 8.6134 8.6134 9.1491 9.1491 9.3862 9.3862 9.5244 9.5244 9.6132 9.6132 10.0522 10.0522 10.2352 10.2352 10.6515 10.6515 11.3207 11.3207 11.6129 11.6129 12.4518 12.4518 13.2006 13.2006 13.2908 13.2908 13.6799 13.6799 13.8683 13.8683 k = 0.3688-0.0637 0.7380 ( 6632 PWs) bands (ev): 1.1538 1.1538 1.4434 1.4434 1.9468 1.9468 3.3490 3.3490 5.1858 5.1858 5.3484 5.3484 5.8352 5.8352 6.1400 6.1400 6.2903 6.2903 6.3373 6.3373 6.5411 6.5411 6.6666 6.6666 6.7928 6.7928 6.8458 6.8458 6.8848 6.8848 6.9428 6.9428 7.0256 7.0256 7.1526 7.1526 7.2118 7.2118 7.3526 7.3526 7.4706 7.4706 7.5938 7.5938 7.6241 7.6241 7.6975 7.6975 7.8745 7.8745 8.0956 8.0956 8.1569 8.1569 8.3132 8.3132 8.5816 8.5816 9.1491 9.1491 9.3703 9.3703 9.4881 9.4881 9.5382 9.5382 10.0275 10.0275 10.2059 10.2059 10.6714 10.6714 11.3258 11.3258 11.6330 11.6330 12.4188 12.4188 13.2025 13.2025 13.2841 13.2841 13.7471 13.7471 13.8239 13.8239 k = 0.3625-0.0528 0.7584 ( 6630 PWs) bands (ev): 1.1919 1.1919 1.4902 1.4902 1.9656 1.9656 3.3637 3.3637 5.1145 5.1145 5.3497 5.3497 5.8388 5.8388 6.1611 6.1611 6.3049 6.3049 6.3414 6.3414 6.5410 6.5410 6.6699 6.6699 6.8017 6.8017 6.8494 6.8494 6.8838 6.8838 6.9399 6.9399 7.0141 7.0141 7.1551 7.1551 7.2076 7.2076 7.3588 7.3588 7.4651 7.4651 7.5844 7.5844 7.6223 7.6223 7.6921 7.6921 7.8772 7.8772 8.0599 8.0599 8.1612 8.1612 8.2804 8.2804 8.5504 8.5504 9.1480 9.1480 9.3448 9.3448 9.4494 9.4494 9.4677 9.4677 10.0061 10.0061 10.1762 10.1762 10.6905 10.6905 11.3314 11.3314 11.6580 11.6580 12.3862 12.3862 13.2030 13.2030 13.2804 13.2804 13.7771 13.7771 13.8194 13.8194 k = 0.3563-0.0419 0.7788 ( 6628 PWs) bands (ev): 1.2299 1.2299 1.5382 1.5382 1.9857 1.9857 3.3758 3.3758 5.0417 5.0417 5.3469 5.3469 5.8472 5.8472 6.1812 6.1812 6.3178 6.3178 6.3475 6.3475 6.5407 6.5407 6.6716 6.6716 6.8105 6.8105 6.8523 6.8523 6.8843 6.8843 6.9397 6.9397 7.0039 7.0039 7.1564 7.1564 7.2061 7.2061 7.3656 7.3656 7.4595 7.4595 7.5744 7.5744 7.6211 7.6211 7.6864 7.6864 7.8796 7.8796 8.0268 8.0268 8.1654 8.1654 8.2509 8.2509 8.5201 8.5201 9.1451 9.1451 9.3040 9.3040 9.3969 9.3969 9.4211 9.4211 9.9872 9.9872 10.1467 10.1467 10.7084 10.7084 11.3370 11.3370 11.6877 11.6877 12.3544 12.3544 13.2031 13.2031 13.2799 13.2799 13.7351 13.7351 13.8893 13.8893 k = 0.3500-0.0310 0.7993 ( 6622 PWs) bands (ev): 1.2673 1.2673 1.5875 1.5875 2.0071 2.0071 3.3849 3.3849 4.9679 4.9679 5.3409 5.3409 5.8596 5.8596 6.1998 6.1998 6.3286 6.3286 6.3558 6.3558 6.5406 6.5406 6.6715 6.6715 6.8185 6.8185 6.8540 6.8540 6.8869 6.8869 6.9427 6.9427 6.9952 6.9952 7.1564 7.1564 7.2072 7.2072 7.3729 7.3729 7.4536 7.4536 7.5642 7.5642 7.6199 7.6199 7.6807 7.6807 7.8818 7.8818 7.9965 7.9965 8.1682 8.1682 8.2259 8.2259 8.4907 8.4907 9.1398 9.1398 9.2449 9.2449 9.3480 9.3480 9.3860 9.3860 9.9707 9.9707 10.1178 10.1178 10.7248 10.7248 11.3424 11.3424 11.7219 11.7219 12.3237 12.3237 13.2035 13.2035 13.2827 13.2827 13.6950 13.6950 13.9345 13.9345 k = 0.3438-0.0201 0.8197 ( 6614 PWs) bands (ev): 1.3039 1.3039 1.6379 1.6379 2.0301 2.0301 3.3906 3.3906 4.8937 4.8937 5.3332 5.3332 5.8747 5.8747 6.2165 6.2165 6.3380 6.3380 6.3657 6.3657 6.5410 6.5410 6.6695 6.6695 6.8252 6.8252 6.8543 6.8543 6.8921 6.8921 6.9491 6.9491 6.9879 6.9879 7.1555 7.1555 7.2104 7.2104 7.3807 7.3807 7.4477 7.4477 7.5541 7.5541 7.6188 7.6188 7.6748 7.6748 7.8836 7.8836 7.9689 7.9689 8.1648 8.1648 8.2101 8.2101 8.4623 8.4623 9.1308 9.1308 9.1759 9.1759 9.3065 9.3065 9.3527 9.3527 9.9562 9.9562 10.0900 10.0900 10.7396 10.7396 11.3473 11.3473 11.7603 11.7603 12.2942 12.2942 13.2047 13.2047 13.2890 13.2890 13.6583 13.6583 13.9268 13.9268 k = 0.3375-0.0092 0.8401 ( 6608 PWs) bands (ev): 1.3393 1.3393 1.6891 1.6891 2.0546 2.0546 3.3927 3.3927 4.8193 4.8193 5.3249 5.3249 5.8911 5.8911 6.2311 6.2311 6.3467 6.3467 6.3766 6.3766 6.5423 6.5423 6.6656 6.6656 6.8303 6.8303 6.8535 6.8535 6.9000 6.9000 6.9578 6.9578 6.9830 6.9830 7.1543 7.1543 7.2151 7.2151 7.3889 7.3889 7.4417 7.4417 7.5445 7.5445 7.6177 7.6177 7.6691 7.6691 7.8849 7.8849 7.9440 7.9440 8.1505 8.1505 8.2079 8.2079 8.4351 8.4351 9.0979 9.0979 9.1241 9.1241 9.2666 9.2666 9.3209 9.3209 9.9437 9.9437 10.0637 10.0637 10.7528 10.7528 11.3514 11.3514 11.8023 11.8023 12.2662 12.2662 13.2072 13.2072 13.2987 13.2987 13.6254 13.6254 13.9200 13.9200 k = 0.3312 0.0017 0.8605 ( 6610 PWs) bands (ev): 1.3730 1.3730 1.7409 1.7409 2.0805 2.0805 3.3907 3.3907 4.7454 4.7454 5.3172 5.3172 5.9073 5.9073 6.2436 6.2436 6.3552 6.3552 6.3881 6.3881 6.5446 6.5446 6.6599 6.6599 6.8337 6.8337 6.8526 6.8526 6.9097 6.9097 6.9653 6.9653 6.9834 6.9834 7.1533 7.1533 7.2205 7.2205 7.3972 7.3972 7.4358 7.4358 7.5354 7.5354 7.6166 7.6166 7.6636 7.6636 7.8855 7.8855 7.9217 7.9217 8.1306 8.1306 8.2142 8.2142 8.4092 8.4092 9.0285 9.0285 9.1057 9.1057 9.2258 9.2258 9.2913 9.2913 9.9328 9.9328 10.0391 10.0391 10.7645 10.7645 11.3545 11.3545 11.8473 11.8473 12.2398 12.2398 13.2115 13.2115 13.3120 13.3120 13.5964 13.5964 13.9151 13.9151 k = 0.3250 0.0126 0.8809 ( 6610 PWs) bands (ev): 1.4049 1.4049 1.7930 1.7930 2.1079 2.1079 3.3848 3.3848 4.6724 4.6724 5.3112 5.3112 5.9219 5.9219 6.2542 6.2542 6.3637 6.3637 6.4000 6.4000 6.5478 6.5478 6.6527 6.6527 6.8358 6.8358 6.8521 6.8521 6.9197 6.9197 6.9676 6.9676 6.9930 6.9930 7.1530 7.1530 7.2262 7.2262 7.4052 7.4052 7.4305 7.4305 7.5270 7.5270 7.6155 7.6155 7.6584 7.6584 7.8844 7.8844 7.9028 7.9028 8.1096 8.1096 8.2243 8.2243 8.3848 8.3848 8.9598 8.9598 9.0848 9.0848 9.1825 9.1825 9.2652 9.2652 9.9234 9.9234 10.0165 10.0165 10.7748 10.7748 11.3567 11.3567 11.8946 11.8946 12.2151 12.2151 13.2176 13.2176 13.3288 13.3288 13.5713 13.5713 13.9121 13.9121 k = 0.3187 0.0235 0.9013 ( 6614 PWs) bands (ev): 1.4347 1.4347 1.8452 1.8452 2.1366 2.1366 3.3748 3.3748 4.6009 4.6009 5.3074 5.3074 5.9339 5.9339 6.2631 6.2631 6.3727 6.3727 6.4122 6.4122 6.5518 6.5518 6.6445 6.6445 6.8368 6.8368 6.8524 6.8524 6.9276 6.9276 6.9699 6.9699 7.0074 7.0074 7.1537 7.1537 7.2318 7.2318 7.4110 7.4110 7.4276 7.4276 7.5193 7.5193 7.6146 7.6146 7.6540 7.6540 7.8770 7.8770 7.8918 7.8918 8.0887 8.0887 8.2368 8.2368 8.3622 8.3622 8.8945 8.8945 9.0604 9.0604 9.1362 9.1362 9.2429 9.2429 9.9153 9.9153 9.9962 9.9962 10.7837 10.7837 11.3579 11.3579 11.9436 11.9436 12.1921 12.1921 13.2256 13.2256 13.3490 13.3490 13.5498 13.5498 13.9104 13.9104 k = 0.3125 0.0344 0.9218 ( 6616 PWs) bands (ev): 1.4620 1.4620 1.8969 1.8969 2.1664 2.1664 3.3609 3.3609 4.5315 4.5315 5.3063 5.3063 5.9424 5.9424 6.2708 6.2708 6.3826 6.3826 6.4241 6.4241 6.5562 6.5562 6.6358 6.6358 6.8371 6.8371 6.8534 6.8534 6.9315 6.9315 6.9758 6.9758 7.0235 7.0235 7.1557 7.1557 7.2371 7.2371 7.4110 7.4110 7.4308 7.4308 7.5125 7.5125 7.6138 7.6138 7.6504 7.6504 7.8629 7.8629 7.8887 7.8887 8.0683 8.0683 8.2511 8.2511 8.3419 8.3419 8.8337 8.8337 9.0336 9.0336 9.0868 9.0868 9.2239 9.2239 9.9083 9.9083 9.9782 9.9782 10.7914 10.7914 11.3582 11.3582 11.9934 11.9934 12.1708 12.1708 13.2354 13.2354 13.3722 13.3722 13.5317 13.5317 13.9079 13.9079 k = 0.3063 0.0453 0.9422 ( 6618 PWs) bands (ev): 1.4868 1.4868 1.9479 1.9479 2.1967 2.1967 3.3436 3.3436 4.4648 4.4648 5.3079 5.3079 5.9468 5.9468 6.2776 6.2776 6.3937 6.3937 6.4355 6.4355 6.5605 6.5605 6.6272 6.6272 6.8372 6.8372 6.8548 6.8548 6.9320 6.9320 6.9846 6.9846 7.0399 7.0399 7.1593 7.1593 7.2417 7.2417 7.4071 7.4071 7.4377 7.4377 7.5067 7.5067 7.6134 7.6134 7.6480 7.6480 7.8488 7.8488 7.8867 7.8867 8.0485 8.0485 8.2663 8.2663 8.3248 8.3248 8.7778 8.7778 9.0056 9.0056 9.0351 9.0351 9.2075 9.2075 9.9022 9.9022 9.9625 9.9625 10.7980 10.7980 11.3577 11.3577 12.0431 12.0431 12.1515 12.1515 13.2468 13.2468 13.3980 13.3980 13.5168 13.5168 13.8987 13.8987 k = 0.3000 0.0562 0.9626 ( 6610 PWs) bands (ev): 1.5090 1.5090 1.9974 1.9974 2.2272 2.2272 3.3235 3.3235 4.4017 4.4017 5.3122 5.3122 5.9473 5.9473 6.2837 6.2837 6.4059 6.4059 6.4459 6.4459 6.5643 6.5643 6.6191 6.6191 6.8373 6.8373 6.8566 6.8566 6.9307 6.9307 6.9941 6.9941 7.0562 7.0562 7.1648 7.1648 7.2458 7.2458 7.4024 7.4024 7.4449 7.4449 7.5019 7.5019 7.6135 7.6135 7.6468 7.6468 7.8359 7.8359 7.8843 7.8843 8.0292 8.0292 8.2786 8.2786 8.3153 8.3153 8.7273 8.7273 8.9772 8.9772 8.9821 8.9821 9.1928 9.1928 9.8971 9.8971 9.9492 9.9492 10.8037 10.8037 11.3566 11.3566 12.0918 12.0918 12.1341 12.1341 13.2594 13.2594 13.4252 13.4252 13.5051 13.5051 13.8850 13.8850 k = 0.2938 0.0671 0.9830 ( 6608 PWs) bands (ev): 1.5284 1.5284 2.0449 2.0449 2.2572 2.2572 3.3012 3.3012 4.3428 4.3428 5.3188 5.3188 5.9441 5.9441 6.2895 6.2895 6.4186 6.4186 6.4553 6.4553 6.5674 6.5674 6.6120 6.6120 6.8374 6.8374 6.8585 6.8585 6.9286 6.9286 7.0026 7.0026 7.0718 7.0718 7.1720 7.1720 7.2493 7.2493 7.3978 7.3978 7.4509 7.4509 7.4987 7.4987 7.6144 7.6144 7.6468 7.6468 7.8244 7.8244 7.8813 7.8813 8.0107 8.0107 8.2777 8.2777 8.3236 8.3236 8.6824 8.6824 8.9267 8.9267 8.9512 8.9512 9.1796 9.1796 9.8926 9.8926 9.9381 9.9381 10.8084 10.8084 11.3550 11.3550 12.1178 12.1178 12.1394 12.1394 13.2727 13.2727 13.4504 13.4504 13.4990 13.4990 13.8709 13.8709 k = 0.2875 0.0780 1.0034 ( 6612 PWs) bands (ev): 1.5451 1.5451 2.0895 2.0895 2.2858 2.2858 3.2778 3.2778 4.2891 4.2891 5.3271 5.3271 5.9380 5.9380 6.2949 6.2949 6.4306 6.4306 6.4642 6.4642 6.5697 6.5697 6.6062 6.6062 6.8375 6.8375 6.8604 6.8604 6.9265 6.9265 7.0093 7.0093 7.0863 7.0863 7.1807 7.1807 7.2522 7.2522 7.3935 7.3935 7.4544 7.4544 7.4976 7.4976 7.6162 7.6162 7.6479 7.6479 7.8143 7.8143 7.8776 7.8776 7.9932 7.9932 8.2689 8.2689 8.3449 8.3449 8.6435 8.6435 8.8717 8.8717 8.9263 8.9263 9.1677 9.1677 9.8888 9.8888 9.9290 9.9290 10.8124 10.8124 11.3532 11.3532 12.1044 12.1044 12.1831 12.1831 13.2860 13.2860 13.4625 13.4625 13.5083 13.5083 13.8575 13.8575 k = 0.2812 0.0889 1.0238 ( 6614 PWs) bands (ev): 1.5591 1.5591 2.1303 2.1303 2.3122 2.3122 3.2545 3.2545 4.2414 4.2414 5.3364 5.3364 5.9301 5.9301 6.2999 6.2999 6.4401 6.4401 6.4736 6.4736 6.5712 6.5712 6.6015 6.6015 6.8376 6.8376 6.8624 6.8624 6.9245 6.9245 7.0140 7.0140 7.0991 7.0991 7.1906 7.1906 7.2545 7.2545 7.3897 7.3897 7.4550 7.4550 7.4988 7.4988 7.6188 7.6188 7.6498 7.6498 7.8056 7.8056 7.8734 7.8734 7.9770 7.9770 8.2597 8.2597 8.3715 8.3715 8.6106 8.6106 8.8169 8.8169 8.9041 8.9041 9.1572 9.1572 9.8856 9.8856 9.9218 9.9218 10.8156 10.8156 11.3513 11.3513 12.0928 12.0928 12.2230 12.2230 13.2988 13.2988 13.4594 13.4594 13.5340 13.5340 13.8446 13.8446 k = 0.2750 0.0998 1.0443 ( 6610 PWs) bands (ev): 1.5704 1.5704 2.1662 2.1662 2.3356 2.3356 3.2326 3.2326 4.2007 4.2007 5.3459 5.3459 5.9214 5.9214 6.3045 6.3045 6.4460 6.4460 6.4841 6.4841 6.5722 6.5722 6.5977 6.5977 6.8377 6.8377 6.8642 6.8642 6.9228 6.9228 7.0170 7.0170 7.1098 7.1098 7.2010 7.2010 7.2563 7.2563 7.3866 7.3866 7.4532 7.4532 7.5017 7.5017 7.6222 7.6222 7.6523 7.6523 7.7984 7.7984 7.8687 7.8687 7.9627 7.9627 8.2520 8.2520 8.4017 8.4017 8.5839 8.5839 8.7629 8.7629 8.8851 8.8851 9.1482 9.1482 9.8830 9.8830 9.9162 9.9162 10.8181 10.8181 11.3495 11.3495 12.0832 12.0832 12.2578 12.2578 13.3104 13.3104 13.4525 13.4525 13.5637 13.5637 13.8320 13.8320 k = 0.2687 0.1107 1.0647 ( 6610 PWs) bands (ev): 1.5792 1.5792 2.1960 2.1960 2.3550 2.3550 3.2134 3.2134 4.1679 4.1679 5.3546 5.3546 5.9131 5.9131 6.3085 6.3085 6.4488 6.4488 6.4947 6.4947 6.5729 6.5729 6.5945 6.5945 6.8378 6.8378 6.8658 6.8658 6.9214 6.9214 7.0187 7.0187 7.1182 7.1182 7.2113 7.2113 7.2571 7.2571 7.3842 7.3842 7.4501 7.4501 7.5051 7.5051 7.6259 7.6259 7.6548 7.6548 7.7928 7.7928 7.8639 7.8639 7.9509 7.9509 8.2460 8.2460 8.4350 8.4350 8.5635 8.5635 8.7104 8.7104 8.8697 8.8697 9.1409 9.1409 9.8810 9.8810 9.9121 9.9121 10.8200 10.8200 11.3479 11.3479 12.0756 12.0756 12.2864 12.2864 13.3202 13.3202 13.4456 13.4456 13.5923 13.5923 13.8195 13.8195 k = 0.2625 0.1216 1.0851 ( 6612 PWs) bands (ev): 1.5854 1.5854 2.2184 2.2184 2.3695 2.3695 3.1984 3.1984 4.1438 4.1438 5.3616 5.3616 5.9063 5.9063 6.3116 6.3116 6.4497 6.4497 6.5039 6.5039 6.5735 6.5735 6.5917 6.5917 6.8378 6.8378 6.8670 6.8670 6.9204 6.9204 7.0194 7.0194 7.1241 7.1241 7.2207 7.2207 7.2566 7.2566 7.3826 7.3826 7.4468 7.4468 7.5081 7.5081 7.6293 7.6293 7.6570 7.6570 7.7888 7.7888 7.8596 7.8596 7.9421 7.9421 8.2418 8.2418 8.4703 8.4703 8.5497 8.5497 8.6602 8.6602 8.8585 8.8585 9.1355 9.1355 9.8796 9.8796 9.9093 9.9093 10.8214 10.8214 11.3467 11.3467 12.0702 12.0702 12.3077 12.3077 13.3275 13.3275 13.4399 13.4399 13.6170 13.6170 13.8078 13.8078 k = 0.2562 0.1325 1.1055 ( 6606 PWs) bands (ev): 1.5891 1.5891 2.2324 2.2324 2.3785 2.3785 3.1888 3.1888 4.1291 4.1291 5.3662 5.3662 5.9018 5.9018 6.3136 6.3136 6.4498 6.4498 6.5103 6.5103 6.5739 6.5739 6.5898 6.5898 6.8379 6.8379 6.8678 6.8678 6.9197 6.9197 7.0198 7.0198 7.1276 7.1276 7.2279 7.2279 7.2553 7.2553 7.3818 7.3818 7.4443 7.4443 7.5101 7.5101 7.6317 7.6317 7.6585 7.6585 7.7865 7.7865 7.8566 7.8566 7.9366 7.9366 8.2394 8.2394 8.5037 8.5037 8.5456 8.5456 8.6137 8.6137 8.8516 8.8516 9.1322 9.1322 9.8787 9.8787 9.9077 9.9077 10.8222 10.8222 11.3460 11.3460 12.0669 12.0669 12.3209 12.3209 13.3321 13.3321 13.4361 13.4361 13.6345 13.6345 13.7986 13.7986 k = 0.2500 0.1434 1.1259 ( 6600 PWs) bands (ev): 1.5903 1.5903 2.2372 2.2372 2.3816 2.3816 3.1855 3.1855 4.1241 4.1241 5.3678 5.3678 5.9002 5.9002 6.3143 6.3143 6.4497 6.4497 6.5125 6.5125 6.5741 6.5741 6.5891 6.5891 6.8379 6.8379 6.8681 6.8681 6.9195 6.9195 7.0198 7.0198 7.1287 7.1287 7.2309 7.2309 7.2543 7.2543 7.3816 7.3816 7.4434 7.4434 7.5109 7.5109 7.6326 7.6326 7.6591 7.6591 7.7857 7.7857 7.8554 7.8554 7.9348 7.9348 8.2385 8.2385 8.5177 8.5177 8.5569 8.5569 8.5827 8.5827 8.8493 8.8493 9.1311 9.1311 9.8784 9.8784 9.9072 9.9072 10.8224 10.8224 11.3457 11.3457 12.0659 12.0659 12.3253 12.3253 13.3337 13.3337 13.4348 13.4348 13.6410 13.6410 13.7950 13.7950 k = 0.0822-0.1434 1.1259 ( 6605 PWs) bands (ev): 1.5814 1.5814 2.2101 2.2101 2.2662 2.2662 3.2159 3.2159 4.3689 4.3689 5.1877 5.1877 5.8236 5.8236 6.2600 6.2600 6.3953 6.3953 6.5435 6.5435 6.5998 6.5998 6.6959 6.6959 6.7937 6.7937 6.8951 6.8951 6.9232 6.9232 7.0685 7.0685 7.1097 7.1097 7.1973 7.1973 7.2886 7.2886 7.3977 7.3977 7.4604 7.4604 7.5440 7.5440 7.6004 7.6004 7.6842 7.6842 7.7438 7.7438 7.9074 7.9074 7.9881 7.9881 8.2026 8.2026 8.5666 8.5666 8.6334 8.6334 8.6840 8.6840 8.9002 8.9002 8.9092 8.9092 9.6134 9.6134 10.0616 10.0616 11.1555 11.1555 11.2202 11.2202 12.0693 12.0693 12.1828 12.1828 13.2189 13.2189 13.4584 13.4584 13.7996 13.7996 13.8195 13.8195 k = 0.0884-0.1541 1.1059 ( 6607 PWs) bands (ev): 1.5757 1.5757 2.1656 2.1656 2.2570 2.2570 3.2257 3.2257 4.4143 4.4143 5.1844 5.1844 5.8172 5.8172 6.2575 6.2575 6.3900 6.3900 6.5408 6.5408 6.5956 6.5956 6.6993 6.6993 6.7933 6.7933 6.8953 6.8953 6.9197 6.9197 7.0614 7.0614 7.1000 7.1000 7.1957 7.1957 7.2881 7.2881 7.3885 7.3885 7.4583 7.4583 7.5421 7.5421 7.5972 7.5972 7.6934 7.6934 7.7476 7.7476 7.9125 7.9125 7.9769 7.9769 8.2590 8.2590 8.5946 8.5946 8.6245 8.6245 8.6792 8.6792 8.9163 8.9163 8.9338 8.9338 9.6182 9.6182 10.0546 10.0546 11.1570 11.1570 11.2288 11.2288 12.0765 12.0765 12.1492 12.1492 13.1908 13.1908 13.4435 13.4435 13.7980 13.7980 13.8188 13.8188 k = 0.0945-0.1648 1.0858 ( 6603 PWs) bands (ev): 1.5676 1.5676 2.1183 2.1183 2.2404 2.2404 3.2405 3.2405 4.4642 4.4642 5.1833 5.1833 5.8126 5.8126 6.2513 6.2513 6.3833 6.3833 6.5380 6.5380 6.5903 6.5903 6.7035 6.7035 6.7923 6.7923 6.8907 6.8907 6.9206 6.9206 7.0520 7.0520 7.0896 7.0896 7.1940 7.1940 7.2875 7.2875 7.3790 7.3790 7.4546 7.4546 7.5407 7.5407 7.5951 7.5951 7.7025 7.7025 7.7530 7.7530 7.9174 7.9174 7.9677 7.9677 8.3158 8.3158 8.5967 8.5967 8.6401 8.6401 8.6824 8.6824 8.9341 8.9341 8.9675 8.9675 9.6228 9.6228 10.0491 10.0491 11.1569 11.1569 11.2362 11.2362 12.0805 12.0805 12.1159 12.1159 13.1621 13.1621 13.4316 13.4316 13.7874 13.7874 13.8161 13.8161 k = 0.1007-0.1755 1.0657 ( 6609 PWs) bands (ev): 1.5573 1.5573 2.0688 2.0688 2.2175 2.2175 3.2591 3.2591 4.5180 4.5180 5.1849 5.1849 5.8095 5.8095 6.2415 6.2415 6.3749 6.3749 6.5352 6.5352 6.5845 6.5845 6.7083 6.7083 6.7909 6.7909 6.8828 6.8828 6.9243 6.9243 7.0401 7.0401 7.0789 7.0789 7.1921 7.1921 7.2868 7.2868 7.3697 7.3697 7.4501 7.4501 7.5395 7.5395 7.5945 7.5945 7.7115 7.7115 7.7597 7.7597 7.9218 7.9218 7.9605 7.9605 8.3697 8.3697 8.5909 8.5909 8.6553 8.6553 8.7031 8.7031 8.9575 8.9575 9.0060 9.0060 9.6273 9.6273 10.0453 10.0453 11.1549 11.1549 11.2426 11.2426 12.0605 12.0605 12.1038 12.1038 13.1336 13.1336 13.4228 13.4228 13.7722 13.7722 13.8125 13.8125 k = 0.1068-0.1862 1.0456 ( 6612 PWs) bands (ev): 1.5450 1.5450 2.0177 2.0177 2.1892 2.1892 3.2803 3.2803 4.5753 4.5753 5.1898 5.1898 5.8073 5.8073 6.2282 6.2282 6.3646 6.3646 6.5328 6.5328 6.5786 6.5786 6.7135 6.7135 6.7889 6.7889 6.8738 6.8738 6.9288 6.9288 7.0260 7.0260 7.0683 7.0683 7.1898 7.1898 7.2858 7.2858 7.3616 7.3616 7.4457 7.4457 7.5383 7.5383 7.5954 7.5954 7.7202 7.7202 7.7673 7.7673 7.9250 7.9250 7.9561 7.9561 8.4154 8.4154 8.5939 8.5939 8.6602 8.6602 8.7384 8.7384 8.9863 8.9863 9.0488 9.0488 9.6316 9.6316 10.0431 10.0431 11.1508 11.1508 11.2486 11.2486 12.0199 12.0199 12.1094 12.1094 13.1061 13.1061 13.4170 13.4170 13.7560 13.7560 13.8083 13.8083 k = 0.1129-0.1970 1.0255 ( 6619 PWs) bands (ev): 1.5307 1.5307 1.9653 1.9653 2.1566 2.1566 3.3026 3.3026 4.6353 4.6353 5.1981 5.1981 5.8057 5.8057 6.2118 6.2118 6.3523 6.3523 6.5307 6.5307 6.5733 6.5733 6.7189 6.7189 6.7862 6.7862 6.8643 6.8643 6.9329 6.9329 7.0104 7.0104 7.0577 7.0577 7.1873 7.1873 7.2841 7.2841 7.3555 7.3555 7.4420 7.4420 7.5369 7.5369 7.5978 7.5978 7.7285 7.7285 7.7756 7.7756 7.9261 7.9261 7.9550 7.9550 8.4463 8.4463 8.6115 8.6115 8.6650 8.6650 8.7782 8.7782 9.0202 9.0202 9.0958 9.0958 9.6358 9.6358 10.0425 10.0425 11.1442 11.1442 11.2546 11.2546 11.9745 11.9745 12.1173 12.1173 13.0801 13.0801 13.4140 13.4140 13.7414 13.7414 13.8038 13.8038 k = 0.1191-0.2077 1.0055 ( 6622 PWs) bands (ev): 1.5146 1.5146 1.9121 1.9121 2.1208 2.1208 3.3251 3.3251 4.6975 4.6975 5.2103 5.2103 5.8044 5.8044 6.1924 6.1924 6.3381 6.3381 6.5280 6.5280 6.5696 6.5696 6.7242 6.7242 6.7828 6.7828 6.8548 6.8548 6.9353 6.9353 6.9948 6.9948 7.0472 7.0472 7.1847 7.1847 7.2809 7.2809 7.3525 7.3525 7.4395 7.4395 7.5355 7.5355 7.6014 7.6014 7.7362 7.7362 7.7845 7.7845 7.9250 7.9250 7.9573 7.9573 8.4614 8.4614 8.6375 8.6375 8.6788 8.6788 8.8191 8.8191 9.0591 9.0591 9.1469 9.1469 9.6400 9.6400 10.0435 10.0435 11.1349 11.1349 11.2612 11.2612 11.9265 11.9265 12.1255 12.1255 13.0560 13.0560 13.4132 13.4132 13.7299 13.7299 13.7998 13.7998 k = 0.1252-0.2184 0.9854 ( 6626 PWs) bands (ev): 1.4967 1.4967 1.8586 1.8586 2.0827 2.0827 3.3466 3.3466 4.7616 4.7616 5.2263 5.2263 5.8030 5.8030 6.1705 6.1705 6.3221 6.3221 6.5238 6.5238 6.5687 6.5687 6.7291 6.7291 6.7786 6.7786 6.8457 6.8457 6.9338 6.9338 6.9821 6.9821 7.0367 7.0367 7.1822 7.1822 7.2760 7.2760 7.3531 7.3531 7.4385 7.4385 7.5342 7.5342 7.6056 7.6056 7.7431 7.7431 7.7937 7.7937 7.9226 7.9226 7.9619 7.9619 8.4670 8.4670 8.6525 8.6525 8.7151 8.7151 8.8596 8.8596 9.1026 9.1026 9.2015 9.2015 9.6443 9.6443 10.0463 10.0463 11.1227 11.1227 11.2687 11.2687 11.8769 11.8769 12.1338 12.1338 13.0339 13.0339 13.4139 13.4139 13.7222 13.7222 13.7966 13.7966 k = 0.1314-0.2291 0.9653 ( 6623 PWs) bands (ev): 1.4772 1.4772 1.8049 1.8049 2.0431 2.0431 3.3665 3.3665 4.8269 4.8269 5.2462 5.2462 5.8014 5.8014 6.1462 6.1462 6.3049 6.3049 6.5174 6.5174 6.5711 6.5711 6.7330 6.7330 6.7739 6.7739 6.8373 6.8373 6.9253 6.9253 6.9754 6.9754 7.0265 7.0265 7.1802 7.1802 7.2696 7.2696 7.3573 7.3573 7.4390 7.4390 7.5336 7.5336 7.6102 7.6102 7.7492 7.7492 7.8033 7.8033 7.9199 7.9199 7.9679 7.9679 8.4688 8.4688 8.6599 8.6599 8.7644 8.7644 8.8993 8.8993 9.1506 9.1506 9.2595 9.2595 9.6488 9.6488 10.0506 10.0506 11.1075 11.1075 11.2775 11.2775 11.8261 11.8261 12.1423 12.1423 13.0141 13.0141 13.4154 13.4154 13.7190 13.7190 13.7951 13.7951 k = 0.1375-0.2398 0.9452 ( 6631 PWs) bands (ev): 1.4562 1.4562 1.7514 1.7514 2.0026 2.0026 3.3842 3.3842 4.8931 4.8931 5.2697 5.2697 5.7993 5.7993 6.1201 6.1201 6.2868 6.2868 6.5088 6.5088 6.5764 6.5764 6.7352 6.7352 6.7689 6.7689 6.8299 6.8299 6.9109 6.9109 6.9741 6.9741 7.0172 7.0172 7.1788 7.1788 7.2621 7.2621 7.3643 7.3643 7.4410 7.4410 7.5336 7.5336 7.6151 7.6151 7.7544 7.7544 7.8130 7.8130 7.9174 7.9174 7.9747 7.9747 8.4700 8.4700 8.6661 8.6661 8.8166 8.8166 8.9375 8.9375 9.2026 9.2026 9.3200 9.3200 9.6538 9.6538 10.0567 10.0567 11.0893 11.0893 11.2882 11.2882 11.7745 11.7745 12.1514 12.1514 12.9964 12.9964 13.4166 13.4166 13.7203 13.7203 13.7957 13.7957 k = 0.1437-0.2505 0.9251 ( 6631 PWs) bands (ev): 1.4338 1.4338 1.6984 1.6984 1.9618 1.9618 3.3993 3.3993 4.9596 4.9596 5.2963 5.2963 5.7968 5.7968 6.0924 6.0924 6.2684 6.2684 6.4986 6.4986 6.5839 6.5839 6.7342 6.7342 6.7645 6.7645 6.8239 6.8239 6.8941 6.8941 6.9741 6.9741 7.0101 7.0101 7.1781 7.1781 7.2541 7.2541 7.3735 7.3735 7.4445 7.4445 7.5348 7.5348 7.6200 7.6200 7.7585 7.7585 7.8226 7.8226 7.9154 7.9154 7.9822 7.9822 8.4720 8.4720 8.6729 8.6729 8.8686 8.8686 8.9743 8.9743 9.2578 9.2578 9.3826 9.3826 9.6596 9.6596 10.0645 10.0645 11.0682 11.0682 11.3010 11.3010 11.7227 11.7227 12.1613 12.1613 12.9808 12.9808 13.4168 13.4168 13.7261 13.7261 13.7989 13.7989 k = 0.1498-0.2613 0.9051 ( 6636 PWs) bands (ev): 1.4100 1.4100 1.6461 1.6461 1.9211 1.9211 3.4117 3.4117 5.0260 5.0260 5.3257 5.3257 5.7936 5.7936 6.0637 6.0637 6.2501 6.2501 6.4872 6.4872 6.5929 6.5929 6.7293 6.7293 6.7609 6.7609 6.8195 6.8195 6.8774 6.8774 6.9719 6.9719 7.0070 7.0070 7.1783 7.1783 7.2461 7.2461 7.3841 7.3841 7.4494 7.4494 7.5373 7.5373 7.6248 7.6248 7.7615 7.7615 7.8319 7.8319 7.9145 7.9145 7.9903 7.9903 8.4753 8.4753 8.6805 8.6805 8.9191 8.9191 9.0094 9.0094 9.3154 9.3154 9.4465 9.4465 9.6668 9.6668 10.0740 10.0740 11.0444 11.0444 11.3162 11.3162 11.6711 11.6711 12.1724 12.1724 12.9671 12.9671 13.4150 13.4150 13.7361 13.7361 13.8051 13.8051 k = 0.1560-0.2720 0.8850 ( 6627 PWs) bands (ev): 1.3851 1.3851 1.5946 1.5946 1.8808 1.8808 3.4214 3.4214 5.0918 5.0918 5.3570 5.3570 5.7899 5.7899 6.0342 6.0342 6.2327 6.2327 6.4746 6.4746 6.6028 6.6028 6.7211 6.7211 6.7571 6.7571 6.8168 6.8168 6.8624 6.8624 6.9662 6.9662 7.0088 7.0088 7.1792 7.1792 7.2383 7.2383 7.3953 7.3953 7.4558 7.4558 7.5414 7.5414 7.6295 7.6295 7.7633 7.7633 7.8404 7.8404 7.9149 7.9149 7.9991 7.9991 8.4801 8.4801 8.6891 8.6891 8.9675 8.9675 9.0431 9.0431 9.3739 9.3739 9.5109 9.5109 9.6763 9.6763 10.0851 10.0851 11.0181 11.0181 11.3341 11.3341 11.6199 11.6199 12.1852 12.1852 12.9549 12.9549 13.4106 13.4106 13.7500 13.7500 13.8144 13.8144 k = 0.1621-0.2827 0.8649 ( 6621 PWs) bands (ev): 1.3592 1.3592 1.5442 1.5442 1.8414 1.8414 3.4285 3.4285 5.1564 5.1564 5.3895 5.3895 5.7856 5.7856 6.0046 6.0046 6.2164 6.2164 6.4611 6.4611 6.6130 6.6130 6.7108 6.7108 6.7519 6.7519 6.8153 6.8153 6.8503 6.8503 6.9584 6.9584 7.0139 7.0139 7.1808 7.1808 7.2312 7.2312 7.4065 7.4065 7.4634 7.4634 7.5478 7.5478 7.6341 7.6341 7.7640 7.7640 7.8475 7.8475 7.9174 7.9174 8.0089 8.0089 8.4866 8.4866 8.6985 8.6985 9.0135 9.0135 9.0752 9.0752 9.4315 9.4315 9.5752 9.5752 9.6896 9.6896 10.0979 10.0979 10.9895 10.9895 11.3547 11.3547 11.5697 11.5697 12.1998 12.1998 12.9441 12.9441 13.4030 13.4030 13.7670 13.7670 13.8267 13.8267 k = 0.1683-0.2934 0.8448 ( 6619 PWs) bands (ev): 1.3325 1.3325 1.4950 1.4950 1.8029 1.8029 3.4330 3.4330 5.2193 5.2193 5.4223 5.4223 5.7810 5.7810 5.9753 5.9753 6.2018 6.2018 6.4467 6.4467 6.6227 6.6227 6.6996 6.6996 6.7448 6.7448 6.8136 6.8136 6.8427 6.8427 6.9498 6.9498 7.0209 7.0209 7.1830 7.1830 7.2248 7.2248 7.4169 7.4169 7.4716 7.4716 7.5569 7.5569 7.6385 7.6385 7.7636 7.7636 7.8526 7.8526 7.9224 7.9224 8.0201 8.0201 8.4947 8.4947 8.7088 8.7088 9.0569 9.0569 9.1059 9.1059 9.4853 9.4853 9.6384 9.6384 9.7092 9.7092 10.1122 10.1122 10.9593 10.9593 11.3778 11.3778 11.5210 11.5210 12.2167 12.2167 12.9343 12.9343 13.3919 13.3919 13.7862 13.7862 13.8416 13.8416 k = 0.1744-0.3041 0.8247 ( 6621 PWs) bands (ev): 1.3051 1.3051 1.4471 1.4471 1.7656 1.7656 3.4353 3.4353 5.2797 5.2797 5.4542 5.4542 5.7765 5.7765 5.9471 5.9471 6.1892 6.1892 6.4316 6.4316 6.6309 6.6309 6.6887 6.6887 6.7362 6.7362 6.8104 6.8104 6.8404 6.8404 6.9410 6.9410 7.0294 7.0294 7.1853 7.1853 7.2197 7.2197 7.4263 7.4263 7.4799 7.4799 7.5690 7.5690 7.6429 7.6429 7.7622 7.7622 7.8554 7.8554 7.9300 7.9300 8.0330 8.0330 8.5042 8.5042 8.7200 8.7200 9.0974 9.0974 9.1353 9.1353 9.5316 9.5316 9.6994 9.6994 9.7388 9.7388 10.1280 10.1280 10.9277 10.9277 11.4015 11.4015 11.4759 11.4759 12.2360 12.2360 12.9254 12.9254 13.3771 13.3771 13.8060 13.8060 13.8580 13.8580 k = 0.1806-0.3149 0.8047 ( 6623 PWs) bands (ev): 1.2773 1.2773 1.4007 1.4007 1.7296 1.7296 3.4355 3.4355 5.3367 5.3367 5.4841 5.4841 5.7727 5.7727 5.9206 5.9206 6.1788 6.1788 6.4160 6.4160 6.6358 6.6358 6.6795 6.6795 6.7273 6.7273 6.8059 6.8059 6.8423 6.8423 6.9324 6.9324 7.0390 7.0390 7.1871 7.1871 7.2165 7.2165 7.4347 7.4347 7.4874 7.4874 7.5843 7.5843 7.6473 7.6473 7.7598 7.7598 7.8563 7.8563 7.9398 7.9398 8.0486 8.0486 8.5150 8.5150 8.7319 8.7319 9.1347 9.1347 9.1639 9.1639 9.5678 9.5678 9.7567 9.7567 9.7816 9.7816 10.1451 10.1451 10.8953 10.8953 11.4068 11.4068 11.4535 11.4535 12.2580 12.2580 12.9172 12.9172 13.3586 13.3586 13.8241 13.8241 13.8747 13.8747 k = 0.1867-0.3256 0.7846 ( 6633 PWs) bands (ev): 1.2491 1.2491 1.3559 1.3559 1.6951 1.6951 3.4340 3.4340 5.3891 5.3891 5.5105 5.5105 5.7703 5.7703 5.8972 5.8972 6.1707 6.1707 6.3998 6.3998 6.6353 6.6353 6.6738 6.6738 6.7192 6.7192 6.8013 6.8013 6.8466 6.8466 6.9242 6.9242 7.0497 7.0497 7.1875 7.1875 7.2160 7.2160 7.4423 7.4423 7.4939 7.4939 7.6017 7.6017 7.6518 7.6518 7.7565 7.7565 7.8558 7.8558 7.9508 7.9508 8.0677 8.0677 8.5268 8.5268 8.7446 8.7446 9.1677 9.1677 9.1927 9.1927 9.5941 9.5941 9.8120 9.8120 9.8345 9.8345 10.1635 10.1635 10.8627 10.8627 11.3711 11.3711 11.4764 11.4764 12.2827 12.2827 12.9099 12.9099 13.3365 13.3365 13.8368 13.8368 13.8888 13.8888 k = 0.1928-0.3363 0.7645 ( 6635 PWs) bands (ev): 1.2209 1.2209 1.3127 1.3127 1.6620 1.6620 3.4309 3.4309 5.4352 5.4352 5.5320 5.5320 5.7708 5.7708 5.8781 5.8781 6.1650 6.1650 6.3832 6.3832 6.6289 6.6289 6.6708 6.6708 6.7136 6.7136 6.7970 6.7970 6.8522 6.8522 6.9164 6.9164 7.0614 7.0614 7.1861 7.1861 7.2186 7.2186 7.4493 7.4493 7.4993 7.4993 7.6199 7.6199 7.6570 7.6570 7.7525 7.7525 7.8543 7.8543 7.9621 7.9621 8.0915 8.0915 8.5395 8.5395 8.7581 8.7581 9.1955 9.1955 9.2229 9.2229 9.6135 9.6135 9.8683 9.8683 9.8901 9.8901 10.1832 10.1832 10.8305 10.8305 11.3291 11.3291 11.5096 11.5096 12.3102 12.3102 12.9035 12.9035 13.3109 13.3109 13.8384 13.8384 13.8967 13.8967 k = 0.1990-0.3470 0.7444 ( 6641 PWs) bands (ev): 1.1929 1.1929 1.2713 1.2713 1.6305 1.6305 3.4266 3.4266 5.4733 5.4733 5.5473 5.5473 5.7750 5.7750 5.8652 5.8652 6.1615 6.1615 6.3665 6.3665 6.6195 6.6195 6.6669 6.6669 6.7118 6.7118 6.7932 6.7932 6.8586 6.8586 6.9092 6.9092 7.0740 7.0740 7.1836 7.1836 7.2235 7.2235 7.4557 7.4557 7.5039 7.5039 7.6365 7.6365 7.6639 7.6639 7.7480 7.7480 7.8521 7.8521 7.9730 7.9730 8.1209 8.1209 8.5527 8.5527 8.7722 8.7722 9.2185 9.2185 9.2543 9.2543 9.6288 9.6288 9.9242 9.9242 9.9454 9.9454 10.2043 10.2043 10.7995 10.7995 11.2877 11.2877 11.5459 11.5459 12.3404 12.3404 12.8985 12.8985 13.2822 13.2822 13.8223 13.8223 13.8944 13.8944 k = 0.2051-0.3577 0.7244 ( 6638 PWs) bands (ev): 1.1652 1.1652 1.2318 1.2318 1.6005 1.6005 3.4213 3.4213 5.5012 5.5012 5.5557 5.5557 5.7838 5.7838 5.8604 5.8604 6.1599 6.1599 6.3497 6.3497 6.6093 6.6093 6.6608 6.6608 6.7133 6.7133 6.7898 6.7898 6.8654 6.8654 6.9027 6.9027 7.0875 7.0875 7.1806 7.1806 7.2298 7.2298 7.4616 7.4616 7.5077 7.5077 7.6483 7.6483 7.6743 7.6743 7.7432 7.7432 7.8497 7.8497 7.9832 7.9832 8.1567 8.1567 8.5663 8.5663 8.7870 8.7870 9.2378 9.2378 9.2861 9.2861 9.6420 9.6420 9.9763 9.9763 9.9997 9.9997 10.2270 10.2270 10.7707 10.7707 11.2479 11.2479 11.5840 11.5840 12.3732 12.3732 12.8954 12.8954 13.2508 13.2508 13.7858 13.7858 13.8807 13.8807 k = 0.2113-0.3684 0.7043 ( 6632 PWs) bands (ev): 1.1381 1.1381 1.1942 1.1942 1.5722 1.5722 3.4153 3.4153 5.5177 5.5177 5.5577 5.5577 5.7968 5.7968 5.8647 5.8647 6.1599 6.1599 6.3331 6.3331 6.5991 6.5991 6.6532 6.6532 6.7164 6.7164 6.7869 6.7869 6.8722 6.8722 6.8972 6.8972 7.1018 7.1018 7.1776 7.1776 7.2372 7.2372 7.4672 7.4672 7.5109 7.5109 7.6554 7.6554 7.6868 7.6868 7.7389 7.7389 7.8472 7.8472 7.9923 7.9923 8.1992 8.1992 8.5798 8.5798 8.8024 8.8024 9.2541 9.2541 9.3180 9.3180 9.6541 9.6541 10.0224 10.0224 10.0518 10.0518 10.2515 10.2515 10.7454 10.7454 11.2101 11.2101 11.6231 11.6231 12.4083 12.4083 12.8947 12.8947 13.2172 13.2172 13.7329 13.7329 13.8565 13.8565 k = 0.2174-0.3792 0.6842 ( 6636 PWs) bands (ev): 1.1117 1.1117 1.1585 1.1585 1.5454 1.5454 3.4086 3.4086 5.5232 5.5232 5.5544 5.5544 5.8130 5.8130 5.8778 5.8778 6.1611 6.1611 6.3167 6.3167 6.5896 6.5896 6.6452 6.6452 6.7199 6.7199 6.7842 6.7842 6.8777 6.8777 6.8941 6.8941 7.1166 7.1166 7.1749 7.1749 7.2452 7.2452 7.4723 7.4723 7.5136 7.5136 7.6599 7.6599 7.6973 7.6973 7.7363 7.7363 7.8446 7.8446 8.0006 8.0006 8.2482 8.2482 8.5930 8.5930 8.8185 8.8185 9.2677 9.2677 9.3503 9.3503 9.6656 9.6656 10.0619 10.0619 10.0988 10.0988 10.2778 10.2778 10.7251 10.7251 11.1744 11.1744 11.6625 11.6625 12.4455 12.4455 12.8972 12.8972 13.1823 13.1823 13.6696 13.6696 13.8236 13.8236 k = 0.2236-0.3899 0.6641 ( 6632 PWs) bands (ev): 1.0863 1.0863 1.1249 1.1249 1.5203 1.5203 3.4016 3.4016 5.5198 5.5198 5.5472 5.5472 5.8311 5.8311 5.8976 5.8976 6.1631 6.1631 6.3009 6.3009 6.5808 6.5808 6.6374 6.6374 6.7232 6.7232 6.7819 6.7819 6.8786 6.8786 6.8965 6.8965 7.1315 7.1315 7.1730 7.1730 7.2536 7.2536 7.4769 7.4769 7.5160 7.5160 7.6634 7.6634 7.7019 7.7019 7.7378 7.7378 7.8423 7.8423 8.0079 8.0079 8.3033 8.3033 8.6056 8.6056 8.8351 8.8351 9.2788 9.2788 9.3833 9.3833 9.6765 9.6765 10.0950 10.0950 10.1377 10.1377 10.3059 10.3059 10.7117 10.7117 11.1411 11.1411 11.7017 11.7017 12.4841 12.4841 12.9036 12.9036 13.1468 13.1468 13.6002 13.6002 13.7843 13.7843 k = 0.2297-0.4006 0.6440 ( 6638 PWs) bands (ev): 1.0619 1.0619 1.0934 1.0934 1.4968 1.4968 3.3944 3.3944 5.5102 5.5102 5.5375 5.5375 5.8500 5.8500 5.9212 5.9212 6.1654 6.1654 6.2858 6.2858 6.5728 6.5728 6.6300 6.6300 6.7260 6.7260 6.7797 6.7797 6.8757 6.8757 6.9037 6.9037 7.1449 7.1449 7.1732 7.1732 7.2623 7.2623 7.4809 7.4809 7.5181 7.5181 7.6662 7.6662 7.7003 7.7003 7.7432 7.7432 7.8402 7.8402 8.0146 8.0146 8.3638 8.3638 8.6174 8.6174 8.8523 8.8523 9.2876 9.2876 9.4172 9.4172 9.6869 9.6869 10.1217 10.1217 10.1660 10.1660 10.3347 10.3347 10.7069 10.7069 11.1103 11.1103 11.7403 11.7403 12.5237 12.5237 12.9145 12.9145 13.1120 13.1120 13.5275 13.5275 13.7402 13.7402 k = 0.2359-0.4113 0.6240 ( 6644 PWs) bands (ev): 1.0387 1.0387 1.0641 1.0641 1.4750 1.4750 3.3872 3.3872 5.4969 5.4969 5.5264 5.5264 5.8689 5.8689 5.9464 5.9464 6.1676 6.1676 6.2717 6.2717 6.5658 6.5658 6.6232 6.6232 6.7283 6.7283 6.7778 6.7778 6.8720 6.8720 6.9126 6.9126 7.1530 7.1530 7.1791 7.1791 7.2712 7.2712 7.4842 7.4842 7.5199 7.5199 7.6682 7.6682 7.6955 7.6955 7.7496 7.7496 7.8385 7.8385 8.0205 8.0205 8.4290 8.4290 8.6282 8.6282 8.8698 8.8698 9.2943 9.2943 9.4524 9.4524 9.6963 9.6963 10.1423 10.1423 10.1827 10.1827 10.3633 10.3633 10.7115 10.7115 11.0823 11.0823 11.7779 11.7779 12.5634 12.5634 12.9304 12.9304 13.0790 13.0790 13.4535 13.4535 13.6926 13.6926 k = 0.2420-0.4220 0.6039 ( 6648 PWs) bands (ev): 1.0170 1.0170 1.0370 1.0370 1.4548 1.4548 3.3800 3.3800 5.4817 5.4817 5.5145 5.5145 5.8874 5.8874 5.9712 5.9712 6.1694 6.1694 6.2588 6.2588 6.5597 6.5597 6.6171 6.6171 6.7301 6.7301 6.7760 6.7760 6.8684 6.8684 6.9223 6.9223 7.1545 7.1545 7.1920 7.1920 7.2800 7.2800 7.4867 7.4867 7.5218 7.5218 7.6690 7.6690 7.6899 7.6899 7.7553 7.7553 7.8373 7.8373 8.0259 8.0259 8.4978 8.4978 8.6379 8.6379 8.8878 8.8878 9.2993 9.2993 9.4890 9.4890 9.7043 9.7043 10.1558 10.1558 10.1894 10.1894 10.3900 10.3900 10.7246 10.7246 11.0578 11.0578 11.8144 11.8144 12.6023 12.6023 12.9517 12.9517 13.0493 13.0493 13.3798 13.3798 13.6422 13.6422 k = 0.2482-0.4328 0.5838 ( 6645 PWs) bands (ev): 0.9967 0.9967 1.0120 1.0120 1.4363 1.4363 3.3731 3.3731 5.4657 5.4657 5.5026 5.5026 5.9053 5.9053 5.9946 5.9946 6.1704 6.1704 6.2474 6.2474 6.5544 6.5544 6.6118 6.6118 6.7314 6.7314 6.7744 6.7744 6.8650 6.8650 6.9326 6.9326 7.1531 7.1531 7.2077 7.2077 7.2888 7.2888 7.4881 7.4881 7.5238 7.5238 7.6677 7.6677 7.6856 7.6856 7.7598 7.7598 7.8364 7.8364 8.0307 8.0307 8.5690 8.5690 8.6467 8.6467 8.9062 8.9062 9.3028 9.3028 9.5270 9.5270 9.7104 9.7104 10.1581 10.1581 10.1932 10.1932 10.4137 10.4137 10.7435 10.7435 11.0374 11.0374 11.8496 11.8496 12.6391 12.6391 12.9779 12.9779 13.0246 13.0246 13.3079 13.3079 13.5895 13.5895 k = 0.2543-0.4435 0.5637 ( 6645 PWs) bands (ev): 0.9780 0.9780 0.9894 0.9894 1.4195 1.4195 3.3665 3.3665 5.4500 5.4500 5.4909 5.4909 5.9223 5.9223 6.0158 6.0158 6.1704 6.1704 6.2374 6.2374 6.5499 6.5499 6.6071 6.6071 6.7323 6.7323 6.7729 6.7729 6.8619 6.8619 6.9432 6.9432 7.1508 7.1508 7.2242 7.2242 7.2974 7.2974 7.4882 7.4882 7.5261 7.5261 7.6633 7.6633 7.6839 7.6839 7.7630 7.7630 7.8359 7.8359 8.0349 8.0349 8.6384 8.6384 8.6574 8.6574 8.9250 8.9250 9.3050 9.3050 9.5662 9.5662 9.7138 9.7138 10.1466 10.1466 10.1996 10.1996 10.4331 10.4331 10.7644 10.7644 11.0224 11.0224 11.8837 11.8837 12.6724 12.6724 12.9982 12.9982 13.0162 13.0162 13.2399 13.2399 13.5353 13.5353 k = 0.2605-0.4542 0.5436 ( 6648 PWs) bands (ev): 0.9611 0.9611 0.9691 0.9691 1.4044 1.4044 3.3603 3.3603 5.4349 5.4349 5.4799 5.4799 5.9383 5.9383 6.0344 6.0344 6.1695 6.1695 6.2291 6.2291 6.5462 6.5462 6.6033 6.6033 6.7329 6.7329 6.7715 6.7715 6.8592 6.8592 6.9540 6.9540 7.1480 7.1480 7.2405 7.2405 7.3060 7.3060 7.4870 7.4870 7.5287 7.5287 7.6567 7.6567 7.6840 7.6840 7.7650 7.7650 7.8358 7.8358 8.0387 8.0387 8.6578 8.6578 8.7168 8.7168 8.9445 8.9445 9.3064 9.3064 9.6062 9.6062 9.7137 9.7137 10.1268 10.1268 10.2070 10.2070 10.4475 10.4475 10.7833 10.7833 11.0143 11.0143 11.9166 11.9166 12.7005 12.7005 12.9896 12.9896 13.0445 13.0445 13.1806 13.1806 13.4801 13.4801 k = 0.2666-0.4649 0.5236 ( 6650 PWs) bands (ev): 0.9459 0.9459 0.9511 0.9511 1.3911 1.3911 3.3547 3.3547 5.4209 5.4209 5.4697 5.4697 5.9531 5.9531 6.0502 6.0502 6.1678 6.1678 6.2222 6.2222 6.5430 6.5430 6.6001 6.6001 6.7333 6.7333 6.7703 6.7703 6.8568 6.8568 6.9646 6.9646 7.1449 7.1449 7.2561 7.2561 7.3144 7.3144 7.4845 7.4845 7.5317 7.5317 7.6493 7.6493 7.6849 7.6849 7.7662 7.7662 7.8358 7.8358 8.0420 8.0420 8.6631 8.6631 8.7869 8.7869 8.9654 8.9654 9.3073 9.3073 9.6465 9.6465 9.7093 9.7093 10.1032 10.1032 10.2138 10.2138 10.4565 10.4565 10.7967 10.7967 11.0143 11.0143 11.9484 11.9484 12.7220 12.7220 12.9854 12.9854 13.0574 13.0574 13.1506 13.1506 13.4250 13.4250 k = 0.2728-0.4756 0.5035 ( 6654 PWs) bands (ev): 0.9325 0.9325 0.9356 0.9356 1.3795 1.3795 3.3497 3.3497 5.4084 5.4084 5.4606 5.4606 5.9666 5.9666 6.0630 6.0630 6.1660 6.1660 6.2165 6.2165 6.5404 6.5404 6.5975 6.5975 6.7335 6.7335 6.7693 6.7693 6.8547 6.8547 6.9749 6.9749 7.1417 7.1417 7.2703 7.2703 7.3230 7.3230 7.4808 7.4808 7.5350 7.5350 7.6418 7.6418 7.6860 7.6860 7.7667 7.7667 7.8360 7.8360 8.0448 8.0448 8.6671 8.6671 8.8515 8.8515 8.9896 8.9896 9.3083 9.3083 9.6853 9.6853 9.7003 9.7003 10.0790 10.0790 10.2195 10.2195 10.4601 10.4601 10.8033 10.8033 11.0223 11.0223 11.9788 11.9788 12.7364 12.7364 12.9867 12.9867 13.0282 13.0282 13.1754 13.1754 13.3712 13.3712 k = 0.2789-0.4864 0.4834 ( 6649 PWs) bands (ev): 0.9208 0.9208 0.9227 0.9227 1.3696 1.3696 3.3453 3.3453 5.3975 5.3975 5.4527 5.4527 5.9786 5.9786 6.0730 6.0730 6.1643 6.1643 6.2117 6.2117 6.5384 6.5384 6.5956 6.5956 6.7336 6.7336 6.7683 6.7683 6.8529 6.8529 6.9847 6.9847 7.1385 7.1385 7.2829 7.2829 7.3319 7.3319 7.4759 7.4759 7.5383 7.5383 7.6347 7.6347 7.6870 7.6870 7.7668 7.7668 7.8363 7.8363 8.0472 8.0472 8.6701 8.6701 8.9045 8.9045 9.0210 9.0210 9.3098 9.3098 9.6830 9.6830 9.7249 9.7249 10.0565 10.0565 10.2242 10.2242 10.4591 10.4591 10.8040 10.8040 11.0359 11.0359 12.0074 12.0074 12.7445 12.7445 12.9719 12.9719 13.0090 13.0090 13.2219 13.2219 13.3204 13.3204 k = 0.2850-0.4971 0.4633 ( 6654 PWs) bands (ev): 0.9105 0.9105 0.9127 0.9127 1.3616 1.3616 3.3417 3.3417 5.3884 5.3884 5.4460 5.4460 5.9889 5.9889 6.0802 6.0802 6.1634 6.1634 6.2075 6.2075 6.5367 6.5367 6.5941 6.5941 6.7337 6.7337 6.7676 6.7676 6.8514 6.8514 6.9934 6.9934 7.1353 7.1353 7.2930 7.2930 7.3410 7.3410 7.4704 7.4704 7.5416 7.5416 7.6282 7.6282 7.6879 7.6879 7.7667 7.7667 7.8365 7.8365 8.0491 8.0491 8.6723 8.6723 8.9410 8.9410 9.0618 9.0618 9.3128 9.3128 9.6616 9.6616 9.7596 9.7596 10.0374 10.0374 10.2279 10.2279 10.4545 10.4545 10.8011 10.8011 11.0519 11.0519 12.0334 12.0334 12.7480 12.7480 12.9347 12.9347 13.0203 13.0203 13.2597 13.2597 13.2880 13.2880 k = 0.2912-0.5078 0.4433 ( 6660 PWs) bands (ev): 0.9023 0.9023 0.9052 0.9052 1.3553 1.3553 3.3388 3.3388 5.3813 5.3813 5.4408 5.4408 5.9973 5.9973 6.0850 6.0850 6.1632 6.1632 6.2040 6.2040 6.5355 6.5355 6.5930 6.5930 6.7337 6.7337 6.7670 6.7670 6.8503 6.8503 7.0008 7.0008 7.1325 7.1325 7.3007 7.3007 7.3499 7.3499 7.4645 7.4645 7.5447 7.5447 7.6226 7.6226 7.6887 7.6887 7.7664 7.7664 7.8368 7.8368 8.0506 8.0506 8.6738 8.6738 8.9632 8.9632 9.1062 9.1062 9.3184 9.3184 9.6356 9.6356 9.7896 9.7896 10.0224 10.0224 10.2307 10.2307 10.4479 10.4479 10.7969 10.7969 11.0673 11.0673 12.0556 12.0556 12.7487 12.7487 12.9017 12.9017 13.0367 13.0367 13.2260 13.2260 13.3324 13.3324 k = 0.2973-0.5185 0.4232 ( 6668 PWs) bands (ev): 0.8963 0.8963 0.8999 0.8999 1.3508 1.3508 3.3368 3.3368 5.3761 5.3761 5.4370 5.4370 6.0035 6.0035 6.0880 6.0880 6.1635 6.1635 6.2011 6.2011 6.5346 6.5346 6.5923 6.5923 6.7336 6.7336 6.7666 6.7666 6.8495 6.8495 7.0065 7.0065 7.1302 7.1302 7.3059 7.3059 7.3579 7.3579 7.4591 7.4591 7.5472 7.5472 7.6182 7.6182 7.6892 7.6892 7.7662 7.7662 7.8369 7.8369 8.0517 8.0517 8.6748 8.6748 8.9764 8.9764 9.1442 9.1442 9.3272 9.3272 9.6084 9.6084 9.8131 9.8131 10.0120 10.0120 10.2327 10.2327 10.4412 10.4412 10.7929 10.7929 11.0797 11.0797 12.0729 12.0729 12.7481 12.7481 12.8770 12.8770 13.0538 13.0538 13.1909 13.1909 13.3798 13.3798 k = 0.3035-0.5292 0.4031 ( 6668 PWs) bands (ev): 0.8926 0.8926 0.8967 0.8967 1.3481 1.3481 3.3355 3.3355 5.3730 5.3730 5.4347 5.4347 6.0073 6.0073 6.0895 6.0895 6.1640 6.1640 6.1992 6.1992 6.5341 6.5341 6.5919 6.5919 6.7336 6.7336 6.7663 6.7663 6.8490 6.8490 7.0101 7.0101 7.1287 7.1287 7.3089 7.3089 7.3635 7.3635 7.4551 7.4551 7.5488 7.5488 7.6154 7.6154 7.6896 7.6896 7.7660 7.7660 7.8370 7.8370 8.0523 8.0523 8.6754 8.6754 8.9836 8.9836 9.1687 9.1687 9.3374 9.3374 9.5862 9.5862 9.8280 9.8280 10.0059 10.0059 10.2339 10.2339 10.4362 10.4362 10.7902 10.7902 11.0878 11.0878 12.0839 12.0839 12.7472 12.7472 12.8619 12.8619 13.0689 13.0689 13.1647 13.1647 13.4153 13.4153 k = 0.3096-0.5399 0.3830 ( 6672 PWs) bands (ev): 0.8914 0.8914 0.8957 0.8957 1.3472 1.3472 3.3351 3.3351 5.3719 5.3719 5.4340 5.4340 6.0086 6.0086 6.0899 6.0899 6.1643 6.1643 6.1985 6.1985 6.5339 6.5339 6.5918 6.5918 6.7336 6.7336 6.7662 6.7662 6.8488 6.8488 7.0114 7.0114 7.1281 7.1281 7.3099 7.3099 7.3656 7.3656 7.4537 7.4537 7.5494 7.5494 7.6144 7.6144 7.6897 7.6897 7.7659 7.7659 7.8370 7.8370 8.0525 8.0525 8.6756 8.6756 8.9859 8.9859 9.1770 9.1770 9.3422 9.3422 9.5773 9.5773 9.8332 9.8332 10.0039 10.0039 10.2343 10.2343 10.4343 10.4343 10.7892 10.7892 11.0906 11.0906 12.0878 12.0878 12.7468 12.7468 12.8568 12.8568 13.0758 13.0758 13.1540 13.1540 13.4290 13.4290 k = 0.6904-0.0452 0.2355 ( 6672 PWs) bands (ev): 0.8914 0.8914 0.8957 0.8957 1.3472 1.3472 3.3351 3.3351 5.3719 5.3719 5.4340 5.4340 6.0086 6.0086 6.0899 6.0899 6.1643 6.1643 6.1985 6.1985 6.5339 6.5339 6.5918 6.5918 6.7336 6.7336 6.7662 6.7662 6.8488 6.8488 7.0114 7.0114 7.1281 7.1281 7.3099 7.3099 7.3656 7.3656 7.4537 7.4537 7.5494 7.5494 7.6144 7.6144 7.6897 7.6897 7.7659 7.7659 7.8370 7.8370 8.0525 8.0525 8.6756 8.6756 8.9859 8.9859 9.1770 9.1770 9.3422 9.3422 9.5773 9.5773 9.8332 9.8332 10.0039 10.0039 10.2343 10.2343 10.4343 10.4343 10.7892 10.7892 11.0906 11.0906 12.0878 12.0878 12.7468 12.7468 12.8568 12.8568 13.0758 13.0758 13.1540 13.1540 13.4290 13.4290 k = 0.6803-0.0278 0.2231 ( 6656 PWs) bands (ev): 0.8468 0.8468 0.9249 0.9249 1.3495 1.3495 3.3695 3.3695 5.3891 5.3891 5.4313 5.4313 5.9882 5.9882 6.0927 6.0927 6.1678 6.1678 6.2100 6.2100 6.5180 6.5180 6.5997 6.5997 6.7047 6.7047 6.7683 6.7683 6.8421 6.8421 7.0229 7.0229 7.1433 7.1433 7.3049 7.3049 7.3602 7.3602 7.4678 7.4678 7.5528 7.5528 7.6214 7.6214 7.6776 7.6776 7.7635 7.7635 7.8437 7.8437 8.0474 8.0474 8.6262 8.6262 9.0013 9.0013 9.1379 9.1379 9.3486 9.3486 9.5144 9.5144 9.8870 9.8870 10.0573 10.0573 10.1573 10.1573 10.5447 10.5447 10.8182 10.8182 11.0092 11.0092 12.0831 12.0831 12.7575 12.7575 12.8637 12.8637 13.0170 13.0170 13.1580 13.1580 13.4370 13.4370 k = 0.6703-0.0103 0.2107 ( 6652 PWs) bands (ev): 0.8041 0.8041 0.9406 0.9406 1.3676 1.3676 3.4039 3.4039 5.3456 5.3456 5.4903 5.4903 5.9674 5.9674 6.0929 6.0929 6.1718 6.1718 6.2201 6.2201 6.4968 6.4968 6.6102 6.6102 6.6717 6.6717 6.7722 6.7722 6.8370 6.8370 7.0347 7.0347 7.1620 7.1620 7.2994 7.2994 7.3548 7.3548 7.4824 7.4824 7.5557 7.5557 7.6297 7.6297 7.6656 7.6656 7.7631 7.7631 7.8504 7.8504 8.0451 8.0451 8.5767 8.5767 9.0180 9.0180 9.0929 9.0929 9.3562 9.3562 9.4548 9.4548 9.9432 9.9432 10.0756 10.0756 10.1079 10.1079 10.6564 10.6564 10.8532 10.8532 10.9287 10.9287 12.0770 12.0770 12.7688 12.7688 12.8739 12.8739 12.9554 12.9554 13.1598 13.1598 13.4366 13.4366 k = 0.6603 0.0072 0.1983 ( 6662 PWs) bands (ev): 0.7635 0.7635 0.9431 0.9431 1.4006 1.4006 3.4377 3.4377 5.3041 5.3041 5.5487 5.5487 5.9463 5.9463 6.0919 6.0919 6.1761 6.1761 6.2285 6.2285 6.4709 6.4709 6.6162 6.6162 6.6435 6.6435 6.7751 6.7751 6.8334 6.8334 7.0464 7.0464 7.1830 7.1830 7.2944 7.2944 7.3510 7.3510 7.4966 7.4966 7.5584 7.5584 7.6393 7.6393 7.6541 7.6541 7.7650 7.7650 7.8569 7.8569 8.0448 8.0448 8.5273 8.5273 9.0335 9.0335 9.0457 9.0457 9.3590 9.3590 9.4050 9.4050 9.9837 9.9837 10.0121 10.0121 10.1494 10.1494 10.7681 10.7681 10.8494 10.8494 10.8947 10.8947 12.0693 12.0693 12.7804 12.7804 12.8758 12.8758 12.9036 12.9036 13.1593 13.1593 13.4282 13.4282 k = 0.6503 0.0246 0.1859 ( 6656 PWs) bands (ev): 0.7251 0.7251 0.9354 0.9354 1.4457 1.4457 3.4701 3.4701 5.2651 5.2651 5.6058 5.6058 5.9252 5.9252 6.0901 6.0901 6.1805 6.1805 6.2353 6.2353 6.4401 6.4401 6.5955 6.5955 6.6435 6.6435 6.7765 6.7765 6.8310 6.8310 7.0579 7.0579 7.2026 7.2026 7.2916 7.2916 7.3513 7.3513 7.5097 7.5097 7.5613 7.5613 7.6429 7.6429 7.6506 7.6506 7.7695 7.7695 7.8634 7.8634 8.0462 8.0462 8.4782 8.4782 8.9885 8.9885 9.0567 9.0567 9.3284 9.3284 9.3939 9.3939 9.9055 9.9055 10.0668 10.0668 10.1840 10.1840 10.7699 10.7699 10.8814 10.8814 10.9426 10.9426 12.0593 12.0593 12.7918 12.7918 12.8196 12.8196 12.9121 12.9121 13.1569 13.1569 13.4129 13.4129 k = 0.6403 0.0421 0.1735 ( 6656 PWs) bands (ev): 0.6889 0.6889 0.9210 0.9210 1.4991 1.4991 3.5007 3.5007 5.2293 5.2293 5.6614 5.6614 5.9044 5.9044 6.0881 6.0881 6.1850 6.1850 6.2407 6.2407 6.4037 6.4037 6.5665 6.5665 6.6546 6.6546 6.7762 6.7762 6.8298 6.8298 7.0688 7.0688 7.2144 7.2144 7.2925 7.2925 7.3607 7.3607 7.5207 7.5207 7.5654 7.5654 7.6328 7.6328 7.6630 7.6630 7.7766 7.7766 7.8699 7.8699 8.0488 8.0488 8.4297 8.4297 8.9324 8.9324 9.0775 9.0775 9.2806 9.2806 9.4052 9.4052 9.8185 9.8185 10.1306 10.1306 10.2109 10.2109 10.6931 10.6931 10.9892 10.9892 11.0004 11.0004 12.0464 12.0464 12.7542 12.7542 12.8026 12.8026 12.9327 12.9327 13.1532 13.1532 13.3917 13.3917 k = 0.6303 0.0596 0.1611 ( 6670 PWs) bands (ev): 0.6549 0.6549 0.9029 0.9029 1.5576 1.5576 3.5287 3.5287 5.1972 5.1972 5.7146 5.7146 5.8839 5.8839 6.0859 6.0859 6.1898 6.1898 6.2450 6.2450 6.3621 6.3621 6.5400 6.5400 6.6664 6.6664 6.7743 6.7743 6.8296 6.8296 7.0790 7.0790 7.2152 7.2152 7.2940 7.2940 7.3849 7.3849 7.5286 7.5286 7.5711 7.5711 7.6240 7.6240 7.6769 7.6769 7.7861 7.7861 7.8766 7.8766 8.0522 8.0522 8.3819 8.3819 8.8742 8.8742 9.0997 9.0997 9.2336 9.2336 9.4205 9.4205 9.7292 9.7292 10.1969 10.1969 10.2307 10.2307 10.6177 10.6177 11.0531 11.0531 11.1065 11.1065 12.0298 12.0298 12.6894 12.6894 12.8124 12.8124 12.9567 12.9567 13.1485 13.1485 13.3661 13.3661 k = 0.6202 0.0771 0.1487 ( 6666 PWs) bands (ev): 0.6234 0.6234 0.8829 0.8829 1.6190 1.6190 3.5534 3.5534 5.1695 5.1695 5.7648 5.7648 5.8640 5.8640 6.0837 6.0837 6.1948 6.1948 6.2473 6.2473 6.3177 6.3177 6.5170 6.5170 6.6776 6.6776 6.7710 6.7710 6.8304 6.8304 7.0883 7.0883 7.2083 7.2083 7.2931 7.2931 7.4223 7.4223 7.5337 7.5337 7.5780 7.5780 7.6175 7.6175 7.6928 7.6928 7.7975 7.7975 7.8838 7.8838 8.0562 8.0562 8.3350 8.3350 8.8150 8.8150 9.1232 9.1232 9.1894 9.1894 9.4375 9.4375 9.6382 9.6382 10.2438 10.2438 10.2660 10.2660 10.5441 10.5441 11.1147 11.1147 11.2178 11.2178 12.0085 12.0085 12.6271 12.6271 12.8208 12.8208 12.9831 12.9831 13.1436 13.1436 13.3371 13.3371 k = 0.6102 0.0945 0.1363 ( 6658 PWs) bands (ev): 0.5941 0.5941 0.8624 0.8624 1.6816 1.6816 3.5744 3.5744 5.1469 5.1469 5.8108 5.8108 5.8453 5.8453 6.0816 6.0816 6.1999 6.1999 6.2395 6.2395 6.2812 6.2812 6.4972 6.4972 6.6878 6.6878 6.7666 6.7666 6.8323 6.8323 7.0968 7.0968 7.1974 7.1974 7.2904 7.2904 7.4657 7.4657 7.5381 7.5381 7.5833 7.5833 7.6158 7.6158 7.7110 7.7110 7.8105 7.8105 7.8922 7.8922 8.0607 8.0607 8.2893 8.2893 8.7554 8.7554 9.1468 9.1468 9.1491 9.1491 9.4548 9.4548 9.5464 9.5464 10.2527 10.2527 10.3363 10.3363 10.4725 10.4725 11.1777 11.1777 11.3287 11.3287 11.9812 11.9812 12.5688 12.5688 12.8273 12.8273 13.0113 13.0113 13.1388 13.1388 13.3062 13.3062 k = 0.6002 0.1120 0.1239 ( 6664 PWs) bands (ev): 0.5673 0.5673 0.8423 0.8423 1.7442 1.7442 3.5912 3.5912 5.1297 5.1297 5.8241 5.8241 5.8552 5.8552 6.0794 6.0794 6.1956 6.1956 6.2117 6.2117 6.2742 6.2742 6.4799 6.4799 6.6967 6.6967 6.7614 6.7614 6.8351 6.8351 7.1042 7.1042 7.1847 7.1847 7.2869 7.2869 7.5028 7.5028 7.5473 7.5473 7.5861 7.5861 7.6219 7.6219 7.7326 7.7326 7.8244 7.8244 7.9022 7.9022 8.0654 8.0654 8.2452 8.2452 8.6961 8.6961 9.1101 9.1101 9.1733 9.1733 9.4452 9.4452 9.4807 9.4807 10.2572 10.2572 10.4019 10.4019 10.4103 10.4103 11.2408 11.2408 11.4388 11.4388 11.9470 11.9470 12.5162 12.5162 12.8318 12.8318 13.0405 13.0405 13.1349 13.1349 13.2744 13.2744 k = 0.5902 0.1295 0.1115 ( 6656 PWs) bands (ev): 0.5430 0.5430 0.8232 0.8232 1.8054 1.8054 3.6036 3.6036 5.1184 5.1184 5.8065 5.8065 5.8914 5.8914 6.0768 6.0768 6.1499 6.1499 6.2145 6.2145 6.2805 6.2805 6.4648 6.4648 6.7037 6.7037 6.7561 6.7561 6.8387 6.8387 7.1103 7.1103 7.1712 7.1712 7.2833 7.2833 7.5182 7.5182 7.5610 7.5610 7.5960 7.5960 7.6372 7.6372 7.7594 7.7594 7.8391 7.8391 7.9148 7.9148 8.0702 8.0702 8.2027 8.2027 8.6377 8.6377 9.0750 9.0750 9.1994 9.1994 9.3543 9.3543 9.4959 9.4959 10.2579 10.2579 10.3376 10.3376 10.4830 10.4830 11.3025 11.3025 11.5479 11.5479 11.9050 11.9050 12.4705 12.4705 12.8337 12.8337 13.0687 13.0687 13.1336 13.1336 13.2428 13.2428 k = 0.5802 0.1469 0.0992 ( 6664 PWs) bands (ev): 0.5211 0.5211 0.8054 0.8054 1.8644 1.8644 3.6114 3.6114 5.1129 5.1129 5.7888 5.7888 5.9225 5.9225 6.0709 6.0709 6.1034 6.1034 6.2204 6.2204 6.2915 6.2915 6.4516 6.4516 6.7083 6.7083 6.7514 6.7514 6.8431 6.8431 7.1149 7.1149 7.1581 7.1581 7.2798 7.2798 7.5215 7.5215 7.5620 7.5620 7.6134 7.6134 7.6641 7.6641 7.7923 7.7923 7.8564 7.8564 7.9305 7.9305 8.0748 8.0748 8.1626 8.1626 8.5805 8.5805 9.0429 9.0429 9.2240 9.2240 9.2610 9.2610 9.5147 9.5147 10.2481 10.2481 10.2832 10.2832 10.5584 10.5584 11.3616 11.3616 11.6554 11.6554 11.8551 11.8551 12.4323 12.4323 12.8329 12.8329 13.0909 13.0909 13.1396 13.1396 13.2125 13.2125 k = 0.5701 0.1644 0.0868 ( 6666 PWs) bands (ev): 0.5017 0.5017 0.7892 0.7892 1.9202 1.9202 3.6151 3.6151 5.1132 5.1132 5.7712 5.7712 5.9477 5.9477 6.0417 6.0417 6.0819 6.0819 6.2259 6.2259 6.3063 6.3063 6.4400 6.4400 6.7091 6.7091 6.7488 6.7488 6.8481 6.8481 7.1168 7.1168 7.1468 7.1468 7.2766 7.2766 7.5219 7.5219 7.5580 7.5580 7.6255 7.6255 7.6952 7.6952 7.8240 7.8240 7.8857 7.8857 7.9492 7.9492 8.0790 8.0790 8.1255 8.1255 8.5250 8.5250 9.0134 9.0134 9.1615 9.1615 9.2545 9.2545 9.5338 9.5338 10.2022 10.2022 10.2666 10.2666 10.6350 10.6350 11.4169 11.4169 11.7601 11.7601 11.7988 11.7988 12.4014 12.4014 12.8290 12.8290 13.1003 13.1003 13.1579 13.1579 13.1853 13.1853 k = 0.5601 0.1819 0.0744 ( 6656 PWs) bands (ev): 0.4849 0.4849 0.7749 0.7749 1.9716 1.9716 3.6152 3.6152 5.1185 5.1185 5.7535 5.7535 5.9670 5.9670 5.9989 5.9989 6.0781 6.0781 6.2306 6.2306 6.3240 6.3240 6.4302 6.4302 6.7057 6.7057 6.7489 6.7489 6.8533 6.8533 7.1138 7.1138 7.1402 7.1402 7.2739 7.2739 7.5215 7.5215 7.5531 7.5531 7.6340 7.6340 7.7229 7.7229 7.8421 7.8421 7.9379 7.9379 7.9701 7.9701 8.0799 8.0799 8.0958 8.0958 8.4714 8.4714 8.9848 8.9848 9.0685 9.0685 9.2799 9.2799 9.5527 9.5527 10.1465 10.1465 10.2627 10.2627 10.7123 10.7123 11.4673 11.4673 11.7337 11.7337 11.8648 11.8648 12.3771 12.3771 12.8216 12.8216 13.1015 13.1015 13.1545 13.1545 13.1910 13.1910 k = 0.5501 0.1994 0.0620 ( 6650 PWs) bands (ev): 0.4706 0.4706 0.7626 0.7626 2.0177 2.0177 3.6125 3.6125 5.1279 5.1279 5.7356 5.7356 5.9569 5.9569 5.9836 5.9836 6.0765 6.0765 6.2343 6.2343 6.3435 6.3435 6.4219 6.4219 6.6993 6.6993 6.7509 6.7509 6.8587 6.8587 7.1058 7.1058 7.1386 7.1386 7.2716 7.2716 7.5211 7.5211 7.5483 7.5483 7.6406 7.6406 7.7467 7.7467 7.8510 7.8510 7.9836 7.9836 8.0105 8.0105 8.0637 8.0637 8.0914 8.0914 8.4199 8.4199 8.9425 8.9425 8.9925 8.9925 9.3044 9.3044 9.5712 9.5712 10.0934 10.0934 10.2600 10.2600 10.7898 10.7898 11.5118 11.5118 11.6660 11.6660 11.9637 11.9637 12.3586 12.3586 12.8101 12.8101 13.1000 13.1000 13.1323 13.1323 13.2208 13.2208 k = 0.5401 0.2168 0.0496 ( 6646 PWs) bands (ev): 0.4589 0.4589 0.7524 0.7524 2.0573 2.0573 3.6080 3.6080 5.1400 5.1400 5.7175 5.7175 5.9234 5.9234 5.9937 5.9937 6.0755 6.0755 6.2372 6.2372 6.3629 6.3629 6.4154 6.4154 6.6913 6.6913 6.7537 6.7537 6.8639 6.8639 7.0963 7.0963 7.1392 7.1392 7.2698 7.2698 7.5208 7.5208 7.5439 7.5439 7.6457 7.6457 7.7682 7.7682 7.8557 7.8557 7.9869 7.9869 8.0594 8.0594 8.0850 8.0850 8.0964 8.0964 8.3708 8.3708 8.8606 8.8606 8.9604 8.9604 9.3267 9.3267 9.5891 9.5891 10.0452 10.0452 10.2578 10.2578 10.8666 10.8666 11.5494 11.5494 11.5957 11.5957 12.0570 12.0570 12.3448 12.3448 12.7942 12.7942 13.0978 13.0978 13.1128 13.1128 13.2507 13.2507 k = 0.5301 0.2343 0.0372 ( 6648 PWs) bands (ev): 0.4498 0.4498 0.7444 0.7444 2.0895 2.0895 3.6030 3.6030 5.1529 5.1529 5.7001 5.7001 5.8969 5.8969 6.0011 6.0011 6.0748 6.0748 6.2394 6.2394 6.3802 6.3802 6.4108 6.4108 6.6832 6.6832 6.7563 6.7563 6.8684 6.8684 7.0875 7.0875 7.1401 7.1401 7.2684 7.2684 7.5208 7.5208 7.5400 7.5400 7.6496 7.6496 7.7880 7.7880 7.8579 7.8579 7.9716 7.9716 8.0741 8.0741 8.1028 8.1028 8.1662 8.1662 8.3246 8.3246 8.7691 8.7691 8.9436 8.9436 9.3456 9.3456 9.6058 9.6058 10.0034 10.0034 10.2559 10.2559 10.9409 10.9409 11.5248 11.5248 11.5803 11.5803 12.1416 12.1416 12.3348 12.3348 12.7741 12.7741 13.0946 13.0946 13.0980 13.0980 13.2778 13.2778 k = 0.5200 0.2518 0.0248 ( 6660 PWs) bands (ev): 0.4433 0.4433 0.7386 0.7386 2.1133 2.1133 3.5985 3.5985 5.1646 5.1646 5.6850 5.6850 5.8783 5.8783 6.0058 6.0058 6.0744 6.0744 6.2409 6.2409 6.3924 6.3924 6.4096 6.4096 6.6761 6.6761 6.7584 6.7584 6.8721 6.8721 7.0806 7.0806 7.1409 7.1409 7.2674 7.2674 7.5210 7.5210 7.5369 7.5369 7.6523 7.6523 7.8061 7.8061 7.8577 7.8577 7.9531 7.9531 8.0867 8.0867 8.1216 8.1216 8.2410 8.2410 8.2864 8.2864 8.6802 8.6802 8.9325 8.9325 9.3601 9.3601 9.6200 9.6200 9.9704 9.9704 10.2544 10.2544 11.0093 11.0093 11.4588 11.4588 11.6023 11.6023 12.2125 12.2125 12.3280 12.3280 12.7519 12.7519 13.0848 13.0848 13.0940 13.0940 13.2989 13.2989 k = 0.5100 0.2693 0.0124 ( 6676 PWs) bands (ev): 0.4394 0.4394 0.7352 0.7352 2.1279 2.1279 3.5953 3.5953 5.1727 5.1727 5.6746 5.6746 5.8673 5.8673 6.0085 6.0085 6.0740 6.0740 6.2417 6.2417 6.3967 6.3967 6.4127 6.4127 6.6712 6.6712 6.7597 6.7597 6.8744 6.8744 7.0762 7.0762 7.1414 7.1414 7.2668 7.2668 7.5213 7.5213 7.5349 7.5349 7.6539 7.6539 7.8214 7.8214 7.8550 7.8550 7.9391 7.9391 8.0912 8.0912 8.1506 8.1506 8.2345 8.2345 8.3254 8.3254 8.6025 8.6025 8.9260 8.9260 9.3692 9.3692 9.6300 9.6300 9.9487 9.9487 10.2535 10.2535 11.0633 11.0633 11.4061 11.4061 11.6157 11.6157 12.2620 12.2620 12.3238 12.3238 12.7329 12.7329 13.0778 13.0778 13.0924 13.0924 13.3100 13.3100 k = 0.5000 0.2867 0.0000 ( 6682 PWs) bands (ev): 0.4381 0.4381 0.7340 0.7340 2.1329 2.1329 3.5942 3.5942 5.1756 5.1756 5.6708 5.6708 5.8637 5.8637 6.0093 6.0093 6.0739 6.0739 6.2420 6.2420 6.3972 6.3972 6.4148 6.4148 6.6695 6.6695 6.7601 6.7601 6.8752 6.8752 7.0747 7.0747 7.1415 7.1415 7.2666 7.2666 7.5214 7.5214 7.5341 7.5341 7.6544 7.6544 7.8286 7.8286 7.8524 7.8524 7.9338 7.9338 8.0923 8.0923 8.1723 8.1723 8.2108 8.2108 8.3603 8.3603 8.5647 8.5647 8.9239 8.9239 9.3723 9.3723 9.6337 9.6337 9.9410 9.9410 10.2532 10.2532 11.0857 11.0857 11.3841 11.3841 11.6202 11.6202 12.2804 12.2804 12.3222 12.3222 12.7251 12.7251 13.0754 13.0754 13.0918 13.0918 13.3122 13.3122 Writing output data file Zr3xSiCux4.save init_run : 0.65s CPU 0.82s WALL ( 1 calls) electrons : 938.97s CPU 946.76s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.02s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 938.96s CPU 946.75s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.12s CPU 0.14s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.12s CPU 0.21s WALL ( 335 calls) cegterg : 858.84s CPU 865.44s WALL ( 935 calls) Called by sum_band: Called by *egterg: h_psi : 571.82s CPU 576.23s WALL ( 16281 calls) s_psi : 58.12s CPU 58.06s WALL ( 16281 calls) g_psi : 0.87s CPU 0.91s WALL ( 15011 calls) cdiaghg : 212.60s CPU 214.81s WALL ( 15346 calls) cegterg:over : 30.56s CPU 30.70s WALL ( 15011 calls) cegterg:upda : 27.25s CPU 27.53s WALL ( 15011 calls) cegterg:last : 13.63s CPU 13.64s WALL ( 1940 calls) cdiaghg:chol : 12.34s CPU 12.57s WALL ( 15346 calls) cdiaghg:inve : 9.06s CPU 9.14s WALL ( 15346 calls) cdiaghg:para : 15.50s CPU 15.76s WALL ( 30692 calls) Called by h_psi: h_psi:vloc : 488.24s CPU 492.54s WALL ( 16281 calls) h_psi:vnl : 82.32s CPU 82.48s WALL ( 16281 calls) add_vuspsi : 44.22s CPU 44.28s WALL ( 16281 calls) General routines calbec : 38.02s CPU 38.15s WALL ( 16281 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 461.96s CPU 466.05s WALL ( 2013676 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.34s CPU 0.46s WALL ( 670 calls) Parallel routines fft_scatter : 135.34s CPU 136.97s WALL ( 2013699 calls) PWSCF : 16m13.14s CPU 16m44.43s WALL This run was terminated on: 18: 9: 3 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=