Program PWSCF v.5.4.0 starts on 11Feb2017 at 5:49:47 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./LiAlAs2O7.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 85 85 23 3135 3135 458 Max 86 86 24 3138 3138 462 Sum 3089 3089 861 112903 112903 16573 bravais-lattice index = 14 lattice parameter (alat) = 9.7942 a.u. unit-cell volume = 799.4056 (a.u.)^3 number of atoms/cell = 11 number of atomic types = 4 number of electrons = 58.00 number of Kohn-Sham states= 70 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.794176 celldm(2)= 1.000000 celldm(3)= 0.894295 celldm(4)= 0.155036 celldm(5)= 0.155036 celldm(6)= -0.193360 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.193360 0.981128 0.000000 ) a(3) = ( 0.138648 0.168640 0.867237 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.197080 -0.198197 ) b(2) = ( 0.000000 1.019235 -0.198197 ) b(3) = ( 0.000000 0.000000 1.153087 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) As 5.00 74.92160 As( 1.00) Li 3.00 6.94100 Li( 1.00) Al 3.00 26.98150 Al( 1.00) No symmetry 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 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E Cartesian axes number of k points= 330 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 k( 2) = ( 0.0102191 0.0124297 -0.0024170), wk = 0.0030303 k( 3) = ( 0.0204383 0.0248594 -0.0048341), wk = 0.0030303 k( 4) = ( 0.0306574 0.0372891 -0.0072511), wk = 0.0030303 k( 5) = ( 0.0408766 0.0497188 -0.0096681), wk = 0.0030303 k( 6) = ( 0.0510957 0.0621485 -0.0120852), wk = 0.0030303 k( 7) = ( 0.0613149 0.0745782 -0.0145022), wk = 0.0030303 k( 8) = ( 0.0715340 0.0870079 -0.0169192), wk = 0.0030303 k( 9) = ( 0.0817532 0.0994376 -0.0193363), wk = 0.0030303 k( 10) = ( 0.0919723 0.1118673 -0.0217533), wk = 0.0030303 k( 11) = ( 0.1021915 0.1242970 -0.0241703), wk = 0.0030303 k( 12) = ( 0.1124106 0.1367267 -0.0265874), wk = 0.0030303 k( 13) = ( 0.1226297 0.1491564 -0.0290044), wk = 0.0030303 k( 14) = ( 0.1328489 0.1615861 -0.0314214), wk = 0.0030303 k( 15) = ( 0.1430680 0.1740158 -0.0338385), wk = 0.0030303 k( 16) = ( 0.1532872 0.1864455 -0.0362555), wk = 0.0030303 k( 17) = ( 0.1635063 0.1988752 -0.0386725), wk = 0.0030303 k( 18) = ( 0.1737255 0.2113049 -0.0410895), wk = 0.0030303 k( 19) = ( 0.1839446 0.2237346 -0.0435066), wk = 0.0030303 k( 20) = ( 0.1941638 0.2361642 -0.0459236), wk = 0.0030303 k( 21) = ( 0.2043829 0.2485939 -0.0483406), wk = 0.0030303 k( 22) = ( 0.2146020 0.2610236 -0.0507577), wk = 0.0030303 k( 23) = ( 0.2248212 0.2734533 -0.0531747), wk = 0.0030303 k( 24) = ( 0.2350404 0.2858830 -0.0555917), wk = 0.0030303 k( 25) = ( 0.2452595 0.2983127 -0.0580088), wk = 0.0030303 k( 26) = ( 0.2554786 0.3107424 -0.0604258), wk = 0.0030303 k( 27) = ( 0.2656978 0.3231721 -0.0628428), wk = 0.0030303 k( 28) = ( 0.2759169 0.3356018 -0.0652599), wk = 0.0030303 k( 29) = ( 0.2861361 0.3480315 -0.0676769), wk = 0.0030303 k( 30) = ( 0.2963552 0.3604612 -0.0700939), wk = 0.0030303 k( 31) = ( 0.3065744 0.3728909 -0.0725110), wk = 0.0030303 k( 32) = ( 0.3167935 0.3853206 -0.0749280), wk = 0.0030303 k( 33) = ( 0.3270127 0.3977503 -0.0773450), wk = 0.0030303 k( 34) = ( 0.3372318 0.4101800 -0.0797621), wk = 0.0030303 k( 35) = ( 0.3474509 0.4226097 -0.0821791), wk = 0.0030303 k( 36) = ( 0.3576701 0.4350394 -0.0845961), wk = 0.0030303 k( 37) = ( 0.3678892 0.4474691 -0.0870132), wk = 0.0030303 k( 38) = ( 0.3781084 0.4598988 -0.0894302), wk = 0.0030303 k( 39) = ( 0.3883275 0.4723285 -0.0918472), wk = 0.0030303 k( 40) = ( 0.3985467 0.4847582 -0.0942643), wk = 0.0030303 k( 41) = ( 0.4087658 0.4971879 -0.0966813), wk = 0.0030303 k( 42) = ( 0.4189850 0.5096176 -0.0990983), wk = 0.0030303 k( 43) = ( 0.4189850 0.5096176 -0.0990983), wk = 0.0030303 k( 44) = ( 0.4215293 0.5127123 -0.0831835), wk = 0.0030303 k( 45) = ( 0.4240737 0.5158071 -0.0672686), wk = 0.0030303 k( 46) = ( 0.4266180 0.5189018 -0.0513538), wk = 0.0030303 k( 47) = ( 0.4291624 0.5219965 -0.0354390), wk = 0.0030303 k( 48) = ( 0.4317067 0.5250913 -0.0195241), wk = 0.0030303 k( 49) = ( 0.4342511 0.5281860 -0.0036093), wk = 0.0030303 k( 50) = ( 0.4367955 0.5312808 0.0123055), wk = 0.0030303 k( 51) = ( 0.4393398 0.5343755 0.0282204), wk = 0.0030303 k( 52) = ( 0.4418842 0.5374702 0.0441352), wk = 0.0030303 k( 53) = ( 0.4444285 0.5405650 0.0600501), wk = 0.0030303 k( 54) = ( 0.4469729 0.5436597 0.0759649), wk = 0.0030303 k( 55) = ( 0.4495172 0.5467545 0.0918797), wk = 0.0030303 k( 56) = ( 0.4520616 0.5498492 0.1077946), wk = 0.0030303 k( 57) = ( 0.4546060 0.5529439 0.1237094), wk = 0.0030303 k( 58) = ( 0.4571503 0.5560387 0.1396243), wk = 0.0030303 k( 59) = ( 0.4596947 0.5591334 0.1555391), wk = 0.0030303 k( 60) = ( 0.4622390 0.5622282 0.1714539), wk = 0.0030303 k( 61) = ( 0.4647834 0.5653229 0.1873688), wk = 0.0030303 k( 62) = ( 0.4673278 0.5684176 0.2032836), wk = 0.0030303 k( 63) = ( 0.4698721 0.5715124 0.2191984), wk = 0.0030303 k( 64) = ( 0.4724165 0.5746071 0.2351133), wk = 0.0030303 k( 65) = ( 0.4749608 0.5777019 0.2510281), wk = 0.0030303 k( 66) = ( 0.4775052 0.5807966 0.2669430), wk = 0.0030303 k( 67) = ( 0.4800495 0.5838913 0.2828578), wk = 0.0030303 k( 68) = ( 0.4825939 0.5869861 0.2987726), wk = 0.0030303 k( 69) = ( 0.4851383 0.5900808 0.3146875), wk = 0.0030303 k( 70) = ( 0.4876826 0.5931756 0.3306023), wk = 0.0030303 k( 71) = ( 0.4902270 0.5962703 0.3465172), wk = 0.0030303 k( 72) = ( 0.4927713 0.5993650 0.3624320), wk = 0.0030303 k( 73) = ( 0.4953157 0.6024598 0.3783468), wk = 0.0030303 k( 74) = ( 0.4953157 0.6024598 0.3783468), wk = 0.0030303 k( 75) = ( 0.4872809 0.5926869 0.3887782), wk = 0.0030303 k( 76) = ( 0.4792461 0.5829141 0.3992096), wk = 0.0030303 k( 77) = ( 0.4712113 0.5731412 0.4096410), wk = 0.0030303 k( 78) = ( 0.4631764 0.5633683 0.4200725), wk = 0.0030303 k( 79) = ( 0.4551416 0.5535955 0.4305038), wk = 0.0030303 k( 80) = ( 0.4471068 0.5438226 0.4409353), wk = 0.0030303 k( 81) = ( 0.4390720 0.5340497 0.4513667), wk = 0.0030303 k( 82) = ( 0.4310372 0.5242769 0.4617981), wk = 0.0030303 k( 83) = ( 0.4230024 0.5145040 0.4722295), wk = 0.0030303 k( 84) = ( 0.4149676 0.5047312 0.4826609), wk = 0.0030303 k( 85) = ( 0.4069327 0.4949583 0.4930923), wk = 0.0030303 k( 86) = ( 0.3988979 0.4851854 0.5035237), wk = 0.0030303 k( 87) = ( 0.3908631 0.4754126 0.5139551), wk = 0.0030303 k( 88) = ( 0.3828283 0.4656397 0.5243865), wk = 0.0030303 k( 89) = ( 0.3747935 0.4558669 0.5348179), wk = 0.0030303 k( 90) = ( 0.3667587 0.4460940 0.5452493), wk = 0.0030303 k( 91) = ( 0.3587239 0.4363211 0.5556807), wk = 0.0030303 k( 92) = ( 0.3506891 0.4265483 0.5661121), wk = 0.0030303 k( 93) = ( 0.3426542 0.4167754 0.5765435), wk = 0.0030303 k( 94) = ( 0.3426542 0.4167754 0.5765435), wk = 0.0030303 k( 95) = ( 0.3322708 0.4041458 0.5765435), wk = 0.0030303 k( 96) = ( 0.3218873 0.3915163 0.5765435), wk = 0.0030303 k( 97) = ( 0.3115039 0.3788867 0.5765435), wk = 0.0030303 k( 98) = ( 0.3011204 0.3662572 0.5765435), wk = 0.0030303 k( 99) = ( 0.2907369 0.3536276 0.5765435), wk = 0.0030303 k( 100) = ( 0.2803535 0.3409980 0.5765435), wk = 0.0030303 k( 101) = ( 0.2699700 0.3283685 0.5765435), wk = 0.0030303 k( 102) = ( 0.2595865 0.3157389 0.5765435), wk = 0.0030303 k( 103) = ( 0.2492031 0.3031094 0.5765435), wk = 0.0030303 k( 104) = ( 0.2388196 0.2904798 0.5765435), wk = 0.0030303 k( 105) = ( 0.2284362 0.2778503 0.5765435), wk = 0.0030303 k( 106) = ( 0.2180527 0.2652207 0.5765435), wk = 0.0030303 k( 107) = ( 0.2076692 0.2525911 0.5765435), wk = 0.0030303 k( 108) = ( 0.1972858 0.2399616 0.5765435), wk = 0.0030303 k( 109) = ( 0.1869023 0.2273320 0.5765435), wk = 0.0030303 k( 110) = ( 0.1765189 0.2147025 0.5765435), wk = 0.0030303 k( 111) = ( 0.1661354 0.2020729 0.5765435), wk = 0.0030303 k( 112) = ( 0.1557519 0.1894434 0.5765435), wk = 0.0030303 k( 113) = ( 0.1453685 0.1768138 0.5765435), wk = 0.0030303 k( 114) = ( 0.1349850 0.1641842 0.5765435), wk = 0.0030303 k( 115) = ( 0.1246015 0.1515547 0.5765435), wk = 0.0030303 k( 116) = ( 0.1142181 0.1389251 0.5765435), wk = 0.0030303 k( 117) = ( 0.1038346 0.1262956 0.5765435), wk = 0.0030303 k( 118) = ( 0.0934511 0.1136660 0.5765435), wk = 0.0030303 k( 119) = ( 0.0830677 0.1010365 0.5765435), wk = 0.0030303 k( 120) = ( 0.0726842 0.0884069 0.5765435), wk = 0.0030303 k( 121) = ( 0.0623008 0.0757773 0.5765435), wk = 0.0030303 k( 122) = ( 0.0519173 0.0631478 0.5765435), wk = 0.0030303 k( 123) = ( 0.0415338 0.0505182 0.5765435), wk = 0.0030303 k( 124) = ( 0.0311504 0.0378887 0.5765435), wk = 0.0030303 k( 125) = ( 0.0207669 0.0252591 0.5765435), wk = 0.0030303 k( 126) = ( 0.0103835 0.0126296 0.5765435), wk = 0.0030303 k( 127) = ( 0.0000000 0.0000000 0.5765435), wk = 0.0030303 k( 128) = ( 0.0000000 0.0000000 0.5765435), wk = 0.0030303 k( 129) = ( 0.0125000 -0.0102769 0.5765435), wk = 0.0030303 k( 130) = ( 0.0250000 -0.0205539 0.5765435), wk = 0.0030303 k( 131) = ( 0.0375000 -0.0308308 0.5765435), wk = 0.0030303 k( 132) = ( 0.0500000 -0.0411078 0.5765435), wk = 0.0030303 k( 133) = ( 0.0625000 -0.0513847 0.5765435), wk = 0.0030303 k( 134) = ( 0.0750000 -0.0616617 0.5765435), wk = 0.0030303 k( 135) = ( 0.0875000 -0.0719386 0.5765435), wk = 0.0030303 k( 136) = ( 0.1000000 -0.0822156 0.5765435), wk = 0.0030303 k( 137) = ( 0.1125000 -0.0924925 0.5765435), wk = 0.0030303 k( 138) = ( 0.1250000 -0.1027695 0.5765435), wk = 0.0030303 k( 139) = ( 0.1375000 -0.1130464 0.5765435), wk = 0.0030303 k( 140) = ( 0.1500000 -0.1233233 0.5765435), wk = 0.0030303 k( 141) = ( 0.1625000 -0.1336003 0.5765435), wk = 0.0030303 k( 142) = ( 0.1750000 -0.1438772 0.5765435), wk = 0.0030303 k( 143) = ( 0.1875000 -0.1541542 0.5765435), wk = 0.0030303 k( 144) = ( 0.2000000 -0.1644311 0.5765435), wk = 0.0030303 k( 145) = ( 0.2125000 -0.1747081 0.5765435), wk = 0.0030303 k( 146) = ( 0.2250000 -0.1849850 0.5765435), wk = 0.0030303 k( 147) = ( 0.2375000 -0.1952620 0.5765435), wk = 0.0030303 k( 148) = ( 0.2500000 -0.2055389 0.5765435), wk = 0.0030303 k( 149) = ( 0.2625000 -0.2158158 0.5765435), wk = 0.0030303 k( 150) = ( 0.2750000 -0.2260928 0.5765435), wk = 0.0030303 k( 151) = ( 0.2875000 -0.2363697 0.5765435), wk = 0.0030303 k( 152) = ( 0.3000000 -0.2466467 0.5765435), wk = 0.0030303 k( 153) = ( 0.3125000 -0.2569236 0.5765435), wk = 0.0030303 k( 154) = ( 0.3250000 -0.2672006 0.5765435), wk = 0.0030303 k( 155) = ( 0.3375000 -0.2774775 0.5765435), wk = 0.0030303 k( 156) = ( 0.3500000 -0.2877545 0.5765435), wk = 0.0030303 k( 157) = ( 0.3625000 -0.2980314 0.5765435), wk = 0.0030303 k( 158) = ( 0.3750000 -0.3083084 0.5765435), wk = 0.0030303 k( 159) = ( 0.3875000 -0.3185853 0.5765435), wk = 0.0030303 k( 160) = ( 0.4000000 -0.3288622 0.5765435), wk = 0.0030303 k( 161) = ( 0.4125000 -0.3391392 0.5765435), wk = 0.0030303 k( 162) = ( 0.4250000 -0.3494161 0.5765435), wk = 0.0030303 k( 163) = ( 0.4375000 -0.3596931 0.5765435), wk = 0.0030303 k( 164) = ( 0.4500000 -0.3699700 0.5765435), wk = 0.0030303 k( 165) = ( 0.4625000 -0.3802470 0.5765435), wk = 0.0030303 k( 166) = ( 0.4750000 -0.3905239 0.5765435), wk = 0.0030303 k( 167) = ( 0.4875000 -0.4008009 0.5765435), wk = 0.0030303 k( 168) = ( 0.5000000 -0.4110778 0.5765435), wk = 0.0030303 k( 169) = ( 0.5000000 -0.4110778 0.5765435), wk = 0.0030303 k( 170) = ( 0.5046843 -0.4053802 0.5765435), wk = 0.0030303 k( 171) = ( 0.6573458 -0.2196958 0.3783468), wk = 0.0030303 k( 172) = ( 0.6548014 -0.2227906 0.3624320), wk = 0.0030303 k( 173) = ( 0.6522571 -0.2258853 0.3465172), wk = 0.0030303 k( 174) = ( 0.6497127 -0.2289801 0.3306023), wk = 0.0030303 k( 175) = ( 0.6471683 -0.2320748 0.3146875), wk = 0.0030303 k( 176) = ( 0.6446240 -0.2351695 0.2987726), wk = 0.0030303 k( 177) = ( 0.6420796 -0.2382643 0.2828578), wk = 0.0030303 k( 178) = ( 0.6395353 -0.2413590 0.2669430), wk = 0.0030303 k( 179) = ( 0.6369909 -0.2444538 0.2510281), wk = 0.0030303 k( 180) = ( 0.6344466 -0.2475485 0.2351133), wk = 0.0030303 k( 181) = ( 0.6319022 -0.2506432 0.2191984), wk = 0.0030303 k( 182) = ( 0.6293578 -0.2537380 0.2032836), wk = 0.0030303 k( 183) = ( 0.6268135 -0.2568327 0.1873688), wk = 0.0030303 k( 184) = ( 0.6242691 -0.2599274 0.1714539), wk = 0.0030303 k( 185) = ( 0.6217248 -0.2630222 0.1555391), wk = 0.0030303 k( 186) = ( 0.6191804 -0.2661169 0.1396243), wk = 0.0030303 k( 187) = ( 0.6166360 -0.2692117 0.1237094), wk = 0.0030303 k( 188) = ( 0.6140917 -0.2723064 0.1077946), wk = 0.0030303 k( 189) = ( 0.6115473 -0.2754011 0.0918797), wk = 0.0030303 k( 190) = ( 0.6090030 -0.2784959 0.0759649), wk = 0.0030303 k( 191) = ( 0.6064586 -0.2815906 0.0600501), wk = 0.0030303 k( 192) = ( 0.6039143 -0.2846854 0.0441352), wk = 0.0030303 k( 193) = ( 0.6013699 -0.2877801 0.0282204), wk = 0.0030303 k( 194) = ( 0.5988255 -0.2908748 0.0123055), wk = 0.0030303 k( 195) = ( 0.5962812 -0.2939696 -0.0036093), wk = 0.0030303 k( 196) = ( 0.5937368 -0.2970643 -0.0195241), wk = 0.0030303 k( 197) = ( 0.5911925 -0.3001591 -0.0354390), wk = 0.0030303 k( 198) = ( 0.5886481 -0.3032538 -0.0513538), wk = 0.0030303 k( 199) = ( 0.5861038 -0.3063485 -0.0672686), wk = 0.0030303 k( 200) = ( 0.5835594 -0.3094433 -0.0831835), wk = 0.0030303 k( 201) = ( 0.5810150 -0.3125380 -0.0990983), wk = 0.0030303 k( 202) = ( 0.5810150 -0.3125380 -0.0990983), wk = 0.0030303 k( 203) = ( 0.5729135 -0.3223920 -0.0891885), wk = 0.0030303 k( 204) = ( 0.5648120 -0.3322460 -0.0792787), wk = 0.0030303 k( 205) = ( 0.5567105 -0.3421000 -0.0693688), wk = 0.0030303 k( 206) = ( 0.5486090 -0.3519539 -0.0594590), wk = 0.0030303 k( 207) = ( 0.5405075 -0.3618079 -0.0495492), wk = 0.0030303 k( 208) = ( 0.5324060 -0.3716619 -0.0396393), wk = 0.0030303 k( 209) = ( 0.5243045 -0.3815159 -0.0297295), wk = 0.0030303 k( 210) = ( 0.5162030 -0.3913698 -0.0198197), wk = 0.0030303 k( 211) = ( 0.5081015 -0.4012238 -0.0099098), wk = 0.0030303 k( 212) = ( 0.5000000 -0.4110778 -0.0000000), wk = 0.0030303 k( 213) = ( 0.5000000 -0.4110778 -0.0000000), wk = 0.0030303 k( 214) = ( 0.4875000 -0.4008009 -0.0000000), wk = 0.0030303 k( 215) = ( 0.4750000 -0.3905239 -0.0000000), wk = 0.0030303 k( 216) = ( 0.4625000 -0.3802470 -0.0000000), wk = 0.0030303 k( 217) = ( 0.4500000 -0.3699700 -0.0000000), wk = 0.0030303 k( 218) = ( 0.4375000 -0.3596931 -0.0000000), wk = 0.0030303 k( 219) = ( 0.4250000 -0.3494161 -0.0000000), wk = 0.0030303 k( 220) = ( 0.4125000 -0.3391392 -0.0000000), wk = 0.0030303 k( 221) = ( 0.4000000 -0.3288622 -0.0000000), wk = 0.0030303 k( 222) = ( 0.3875000 -0.3185853 -0.0000000), wk = 0.0030303 k( 223) = ( 0.3750000 -0.3083084 -0.0000000), wk = 0.0030303 k( 224) = ( 0.3625000 -0.2980314 -0.0000000), wk = 0.0030303 k( 225) = ( 0.3500000 -0.2877545 -0.0000000), wk = 0.0030303 k( 226) = ( 0.3375000 -0.2774775 -0.0000000), wk = 0.0030303 k( 227) = ( 0.3250000 -0.2672006 -0.0000000), wk = 0.0030303 k( 228) = ( 0.3125000 -0.2569236 -0.0000000), wk = 0.0030303 k( 229) = ( 0.3000000 -0.2466467 -0.0000000), wk = 0.0030303 k( 230) = ( 0.2875000 -0.2363697 -0.0000000), wk = 0.0030303 k( 231) = ( 0.2750000 -0.2260928 -0.0000000), wk = 0.0030303 k( 232) = ( 0.2625000 -0.2158158 -0.0000000), wk = 0.0030303 k( 233) = ( 0.2500000 -0.2055389 -0.0000000), wk = 0.0030303 k( 234) = ( 0.2375000 -0.1952620 -0.0000000), wk = 0.0030303 k( 235) = ( 0.2250000 -0.1849850 -0.0000000), wk = 0.0030303 k( 236) = ( 0.2125000 -0.1747081 -0.0000000), wk = 0.0030303 k( 237) = ( 0.2000000 -0.1644311 -0.0000000), wk = 0.0030303 k( 238) = ( 0.1875000 -0.1541542 -0.0000000), wk = 0.0030303 k( 239) = ( 0.1750000 -0.1438772 -0.0000000), wk = 0.0030303 k( 240) = ( 0.1625000 -0.1336003 -0.0000000), wk = 0.0030303 k( 241) = ( 0.1500000 -0.1233233 -0.0000000), wk = 0.0030303 k( 242) = ( 0.1375000 -0.1130464 -0.0000000), wk = 0.0030303 k( 243) = ( 0.1250000 -0.1027695 -0.0000000), wk = 0.0030303 k( 244) = ( 0.1125000 -0.0924925 -0.0000000), wk = 0.0030303 k( 245) = ( 0.1000000 -0.0822156 -0.0000000), wk = 0.0030303 k( 246) = ( 0.0875000 -0.0719386 -0.0000000), wk = 0.0030303 k( 247) = ( 0.0750000 -0.0616617 -0.0000000), wk = 0.0030303 k( 248) = ( 0.0625000 -0.0513847 -0.0000000), wk = 0.0030303 k( 249) = ( 0.0500000 -0.0411078 -0.0000000), wk = 0.0030303 k( 250) = ( 0.0375000 -0.0308308 -0.0000000), wk = 0.0030303 k( 251) = ( 0.0250000 -0.0205539 -0.0000000), wk = 0.0030303 k( 252) = ( 0.0125000 -0.0102769 -0.0000000), wk = 0.0030303 k( 253) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 k( 254) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 k( 255) = ( 0.0156250 0.0030794 -0.0030968), wk = 0.0030303 k( 256) = ( 0.0312500 0.0061587 -0.0061936), wk = 0.0030303 k( 257) = ( 0.0468750 0.0092381 -0.0092905), wk = 0.0030303 k( 258) = ( 0.0625000 0.0123175 -0.0123873), wk = 0.0030303 k( 259) = ( 0.0781250 0.0153968 -0.0154841), wk = 0.0030303 k( 260) = ( 0.0937500 0.0184762 -0.0185809), wk = 0.0030303 k( 261) = ( 0.1093750 0.0215556 -0.0216778), wk = 0.0030303 k( 262) = ( 0.1250000 0.0246349 -0.0247746), wk = 0.0030303 k( 263) = ( 0.1406250 0.0277143 -0.0278714), wk = 0.0030303 k( 264) = ( 0.1562500 0.0307937 -0.0309682), wk = 0.0030303 k( 265) = ( 0.1718750 0.0338731 -0.0340650), wk = 0.0030303 k( 266) = ( 0.1875000 0.0369524 -0.0371619), wk = 0.0030303 k( 267) = ( 0.2031250 0.0400318 -0.0402587), wk = 0.0030303 k( 268) = ( 0.2187500 0.0431112 -0.0433555), wk = 0.0030303 k( 269) = ( 0.2343750 0.0461905 -0.0464523), wk = 0.0030303 k( 270) = ( 0.2500000 0.0492699 -0.0495492), wk = 0.0030303 k( 271) = ( 0.2656250 0.0523493 -0.0526460), wk = 0.0030303 k( 272) = ( 0.2812500 0.0554286 -0.0557428), wk = 0.0030303 k( 273) = ( 0.2968750 0.0585080 -0.0588396), wk = 0.0030303 k( 274) = ( 0.3125000 0.0615874 -0.0619365), wk = 0.0030303 k( 275) = ( 0.3281250 0.0646667 -0.0650333), wk = 0.0030303 k( 276) = ( 0.3437500 0.0677461 -0.0681301), wk = 0.0030303 k( 277) = ( 0.3593750 0.0708255 -0.0712269), wk = 0.0030303 k( 278) = ( 0.3750000 0.0739048 -0.0743237), wk = 0.0030303 k( 279) = ( 0.3906250 0.0769842 -0.0774206), wk = 0.0030303 k( 280) = ( 0.4062500 0.0800636 -0.0805174), wk = 0.0030303 k( 281) = ( 0.4218750 0.0831429 -0.0836142), wk = 0.0030303 k( 282) = ( 0.4375000 0.0862223 -0.0867110), wk = 0.0030303 k( 283) = ( 0.4531250 0.0893017 -0.0898079), wk = 0.0030303 k( 284) = ( 0.4687500 0.0923810 -0.0929047), wk = 0.0030303 k( 285) = ( 0.4843750 0.0954604 -0.0960015), wk = 0.0030303 k( 286) = ( 0.5000000 0.0985398 -0.0990983), wk = 0.0030303 k( 287) = ( 0.5000000 0.0985398 0.4774452), wk = 0.0030303 k( 288) = ( 0.4883721 0.0962482 0.4663418), wk = 0.0030303 k( 289) = ( 0.4767442 0.0939565 0.4552384), wk = 0.0030303 k( 290) = ( 0.4651163 0.0916649 0.4441350), wk = 0.0030303 k( 291) = ( 0.4534884 0.0893733 0.4330317), wk = 0.0030303 k( 292) = ( 0.4418605 0.0870817 0.4219283), wk = 0.0030303 k( 293) = ( 0.4302326 0.0847900 0.4108249), wk = 0.0030303 k( 294) = ( 0.4186047 0.0824984 0.3997215), wk = 0.0030303 k( 295) = ( 0.4069767 0.0802068 0.3886181), wk = 0.0030303 k( 296) = ( 0.3953488 0.0779152 0.3775148), wk = 0.0030303 k( 297) = ( 0.3837209 0.0756236 0.3664114), wk = 0.0030303 k( 298) = ( 0.3720930 0.0733319 0.3553080), wk = 0.0030303 k( 299) = ( 0.3604651 0.0710403 0.3442047), wk = 0.0030303 k( 300) = ( 0.3488372 0.0687487 0.3331013), wk = 0.0030303 k( 301) = ( 0.3372093 0.0664571 0.3219979), wk = 0.0030303 k( 302) = ( 0.3255814 0.0641654 0.3108945), wk = 0.0030303 k( 303) = ( 0.3139535 0.0618738 0.2997911), wk = 0.0030303 k( 304) = ( 0.3023256 0.0595822 0.2886878), wk = 0.0030303 k( 305) = ( 0.2906977 0.0572906 0.2775844), wk = 0.0030303 k( 306) = ( 0.2790698 0.0549989 0.2664810), wk = 0.0030303 k( 307) = ( 0.2674419 0.0527073 0.2553776), wk = 0.0030303 k( 308) = ( 0.2558140 0.0504157 0.2442743), wk = 0.0030303 k( 309) = ( 0.2441860 0.0481241 0.2331709), wk = 0.0030303 k( 310) = ( 0.2325581 0.0458325 0.2220675), wk = 0.0030303 k( 311) = ( 0.2209302 0.0435408 0.2109641), wk = 0.0030303 k( 312) = ( 0.2093023 0.0412492 0.1998608), wk = 0.0030303 k( 313) = ( 0.1976744 0.0389576 0.1887574), wk = 0.0030303 k( 314) = ( 0.1860465 0.0366660 0.1776540), wk = 0.0030303 k( 315) = ( 0.1744186 0.0343743 0.1665506), wk = 0.0030303 k( 316) = ( 0.1627907 0.0320827 0.1554473), wk = 0.0030303 k( 317) = ( 0.1511628 0.0297911 0.1443439), wk = 0.0030303 k( 318) = ( 0.1395349 0.0274995 0.1332405), wk = 0.0030303 k( 319) = ( 0.1279070 0.0252079 0.1221371), wk = 0.0030303 k( 320) = ( 0.1162791 0.0229162 0.1110338), wk = 0.0030303 k( 321) = ( 0.1046512 0.0206246 0.0999304), wk = 0.0030303 k( 322) = ( 0.0930233 0.0183330 0.0888270), wk = 0.0030303 k( 323) = ( 0.0813954 0.0160414 0.0777236), wk = 0.0030303 k( 324) = ( 0.0697674 0.0137497 0.0666203), wk = 0.0030303 k( 325) = ( 0.0581395 0.0114581 0.0555169), wk = 0.0030303 k( 326) = ( 0.0465116 0.0091665 0.0444135), wk = 0.0030303 k( 327) = ( 0.0348837 0.0068749 0.0333101), wk = 0.0030303 k( 328) = ( 0.0232558 0.0045832 0.0222067), wk = 0.0030303 k( 329) = ( 0.0116279 0.0022916 0.0111034), wk = 0.0030303 k( 330) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 k( 2) = ( 0.0102191 0.0102191 0.0014169), wk = 0.0030303 k( 3) = ( 0.0204383 0.0204383 0.0028337), wk = 0.0030303 k( 4) = ( 0.0306574 0.0306574 0.0042506), wk = 0.0030303 k( 5) = ( 0.0408766 0.0408766 0.0056675), wk = 0.0030303 k( 6) = ( 0.0510957 0.0510957 0.0070843), wk = 0.0030303 k( 7) = ( 0.0613149 0.0613149 0.0085012), wk = 0.0030303 k( 8) = ( 0.0715340 0.0715340 0.0099181), wk = 0.0030303 k( 9) = ( 0.0817532 0.0817532 0.0113349), wk = 0.0030303 k( 10) = ( 0.0919723 0.0919723 0.0127518), wk = 0.0030303 k( 11) = ( 0.1021915 0.1021915 0.0141687), wk = 0.0030303 k( 12) = ( 0.1124106 0.1124106 0.0155855), wk = 0.0030303 k( 13) = ( 0.1226297 0.1226298 0.0170024), wk = 0.0030303 k( 14) = ( 0.1328489 0.1328489 0.0184192), wk = 0.0030303 k( 15) = ( 0.1430680 0.1430680 0.0198361), wk = 0.0030303 k( 16) = ( 0.1532872 0.1532872 0.0212530), wk = 0.0030303 k( 17) = ( 0.1635063 0.1635063 0.0226698), wk = 0.0030303 k( 18) = ( 0.1737255 0.1737255 0.0240867), wk = 0.0030303 k( 19) = ( 0.1839446 0.1839446 0.0255036), wk = 0.0030303 k( 20) = ( 0.1941638 0.1941638 0.0269204), wk = 0.0030303 k( 21) = ( 0.2043829 0.2043829 0.0283373), wk = 0.0030303 k( 22) = ( 0.2146020 0.2146021 0.0297542), wk = 0.0030303 k( 23) = ( 0.2248212 0.2248212 0.0311710), wk = 0.0030303 k( 24) = ( 0.2350404 0.2350404 0.0325879), wk = 0.0030303 k( 25) = ( 0.2452595 0.2452595 0.0340048), wk = 0.0030303 k( 26) = ( 0.2554786 0.2554786 0.0354216), wk = 0.0030303 k( 27) = ( 0.2656978 0.2656978 0.0368385), wk = 0.0030303 k( 28) = ( 0.2759169 0.2759169 0.0382554), wk = 0.0030303 k( 29) = ( 0.2861361 0.2861361 0.0396722), wk = 0.0030303 k( 30) = ( 0.2963552 0.2963552 0.0410891), wk = 0.0030303 k( 31) = ( 0.3065744 0.3065744 0.0425060), wk = 0.0030303 k( 32) = ( 0.3167935 0.3167935 0.0439228), wk = 0.0030303 k( 33) = ( 0.3270127 0.3270127 0.0453397), wk = 0.0030303 k( 34) = ( 0.3372318 0.3372318 0.0467565), wk = 0.0030303 k( 35) = ( 0.3474509 0.3474509 0.0481734), wk = 0.0030303 k( 36) = ( 0.3576701 0.3576701 0.0495903), wk = 0.0030303 k( 37) = ( 0.3678892 0.3678892 0.0510071), wk = 0.0030303 k( 38) = ( 0.3781084 0.3781084 0.0524240), wk = 0.0030303 k( 39) = ( 0.3883275 0.3883275 0.0538409), wk = 0.0030303 k( 40) = ( 0.3985467 0.3985467 0.0552577), wk = 0.0030303 k( 41) = ( 0.4087658 0.4087658 0.0566746), wk = 0.0030303 k( 42) = ( 0.4189850 0.4189850 0.0580915), wk = 0.0030303 k( 43) = ( 0.4189850 0.4189850 0.0580915), wk = 0.0030303 k( 44) = ( 0.4215293 0.4215293 0.0727681), wk = 0.0030303 k( 45) = ( 0.4240737 0.4240737 0.0874447), wk = 0.0030303 k( 46) = ( 0.4266180 0.4266180 0.1021213), wk = 0.0030303 k( 47) = ( 0.4291624 0.4291624 0.1167979), wk = 0.0030303 k( 48) = ( 0.4317067 0.4317068 0.1314745), wk = 0.0030303 k( 49) = ( 0.4342511 0.4342511 0.1461511), wk = 0.0030303 k( 50) = ( 0.4367955 0.4367955 0.1608277), wk = 0.0030303 k( 51) = ( 0.4393398 0.4393398 0.1755043), wk = 0.0030303 k( 52) = ( 0.4418842 0.4418842 0.1901809), wk = 0.0030303 k( 53) = ( 0.4444285 0.4444285 0.2048575), wk = 0.0030303 k( 54) = ( 0.4469729 0.4469729 0.2195341), wk = 0.0030303 k( 55) = ( 0.4495172 0.4495172 0.2342107), wk = 0.0030303 k( 56) = ( 0.4520616 0.4520616 0.2488874), wk = 0.0030303 k( 57) = ( 0.4546060 0.4546060 0.2635640), wk = 0.0030303 k( 58) = ( 0.4571503 0.4571503 0.2782406), wk = 0.0030303 k( 59) = ( 0.4596947 0.4596947 0.2929172), wk = 0.0030303 k( 60) = ( 0.4622390 0.4622390 0.3075938), wk = 0.0030303 k( 61) = ( 0.4647834 0.4647834 0.3222704), wk = 0.0030303 k( 62) = ( 0.4673278 0.4673278 0.3369470), wk = 0.0030303 k( 63) = ( 0.4698721 0.4698721 0.3516236), wk = 0.0030303 k( 64) = ( 0.4724165 0.4724165 0.3663002), wk = 0.0030303 k( 65) = ( 0.4749608 0.4749608 0.3809768), wk = 0.0030303 k( 66) = ( 0.4775052 0.4775052 0.3956534), wk = 0.0030303 k( 67) = ( 0.4800495 0.4800495 0.4103300), wk = 0.0030303 k( 68) = ( 0.4825939 0.4825939 0.4250066), wk = 0.0030303 k( 69) = ( 0.4851383 0.4851383 0.4396833), wk = 0.0030303 k( 70) = ( 0.4876826 0.4876826 0.4543599), wk = 0.0030303 k( 71) = ( 0.4902270 0.4902270 0.4690365), wk = 0.0030303 k( 72) = ( 0.4927713 0.4927713 0.4837131), wk = 0.0030303 k( 73) = ( 0.4953157 0.4953157 0.4983897), wk = 0.0030303 k( 74) = ( 0.4953157 0.4953157 0.4983897), wk = 0.0030303 k( 75) = ( 0.4872809 0.4872809 0.5046741), wk = 0.0030303 k( 76) = ( 0.4792461 0.4792461 0.5109585), wk = 0.0030303 k( 77) = ( 0.4712113 0.4712113 0.5172429), wk = 0.0030303 k( 78) = ( 0.4631764 0.4631764 0.5235273), wk = 0.0030303 k( 79) = ( 0.4551416 0.4551416 0.5298117), wk = 0.0030303 k( 80) = ( 0.4471068 0.4471068 0.5360961), wk = 0.0030303 k( 81) = ( 0.4390720 0.4390720 0.5423805), wk = 0.0030303 k( 82) = ( 0.4310372 0.4310372 0.5486649), wk = 0.0030303 k( 83) = ( 0.4230024 0.4230024 0.5549493), wk = 0.0030303 k( 84) = ( 0.4149676 0.4149676 0.5612337), wk = 0.0030303 k( 85) = ( 0.4069327 0.4069327 0.5675180), wk = 0.0030303 k( 86) = ( 0.3988979 0.3988979 0.5738024), wk = 0.0030303 k( 87) = ( 0.3908631 0.3908631 0.5800869), wk = 0.0030303 k( 88) = ( 0.3828283 0.3828283 0.5863713), wk = 0.0030303 k( 89) = ( 0.3747935 0.3747935 0.5926556), wk = 0.0030303 k( 90) = ( 0.3667587 0.3667587 0.5989400), wk = 0.0030303 k( 91) = ( 0.3587239 0.3587239 0.6052244), wk = 0.0030303 k( 92) = ( 0.3506891 0.3506891 0.6115088), wk = 0.0030303 k( 93) = ( 0.3426542 0.3426542 0.6177932), wk = 0.0030303 k( 94) = ( 0.3426542 0.3426542 0.6177932), wk = 0.0030303 k( 95) = ( 0.3322708 0.3322708 0.6142237), wk = 0.0030303 k( 96) = ( 0.3218873 0.3218873 0.6106542), wk = 0.0030303 k( 97) = ( 0.3115039 0.3115039 0.6070847), wk = 0.0030303 k( 98) = ( 0.3011204 0.3011204 0.6035153), wk = 0.0030303 k( 99) = ( 0.2907369 0.2907369 0.5999458), wk = 0.0030303 k( 100) = ( 0.2803535 0.2803535 0.5963763), wk = 0.0030303 k( 101) = ( 0.2699700 0.2699700 0.5928068), wk = 0.0030303 k( 102) = ( 0.2595865 0.2595865 0.5892373), wk = 0.0030303 k( 103) = ( 0.2492031 0.2492031 0.5856678), wk = 0.0030303 k( 104) = ( 0.2388196 0.2388196 0.5820983), wk = 0.0030303 k( 105) = ( 0.2284362 0.2284362 0.5785288), wk = 0.0030303 k( 106) = ( 0.2180527 0.2180527 0.5749593), wk = 0.0030303 k( 107) = ( 0.2076692 0.2076692 0.5713898), wk = 0.0030303 k( 108) = ( 0.1972858 0.1972858 0.5678203), wk = 0.0030303 k( 109) = ( 0.1869023 0.1869023 0.5642508), wk = 0.0030303 k( 110) = ( 0.1765189 0.1765189 0.5606814), wk = 0.0030303 k( 111) = ( 0.1661354 0.1661354 0.5571119), wk = 0.0030303 k( 112) = ( 0.1557519 0.1557519 0.5535424), wk = 0.0030303 k( 113) = ( 0.1453685 0.1453685 0.5499729), wk = 0.0030303 k( 114) = ( 0.1349850 0.1349850 0.5464034), wk = 0.0030303 k( 115) = ( 0.1246015 0.1246015 0.5428339), wk = 0.0030303 k( 116) = ( 0.1142181 0.1142181 0.5392644), wk = 0.0030303 k( 117) = ( 0.1038346 0.1038346 0.5356949), wk = 0.0030303 k( 118) = ( 0.0934511 0.0934512 0.5321254), wk = 0.0030303 k( 119) = ( 0.0830677 0.0830677 0.5285559), wk = 0.0030303 k( 120) = ( 0.0726842 0.0726842 0.5249864), wk = 0.0030303 k( 121) = ( 0.0623008 0.0623008 0.5214169), wk = 0.0030303 k( 122) = ( 0.0519173 0.0519173 0.5178475), wk = 0.0030303 k( 123) = ( 0.0415338 0.0415339 0.5142780), wk = 0.0030303 k( 124) = ( 0.0311504 0.0311504 0.5107085), wk = 0.0030303 k( 125) = ( 0.0207669 0.0207669 0.5071390), wk = 0.0030303 k( 126) = ( 0.0103835 0.0103835 0.5035695), wk = 0.0030303 k( 127) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030303 k( 128) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0030303 k( 129) = ( 0.0125000 -0.0125000 0.5000000), wk = 0.0030303 k( 130) = ( 0.0250000 -0.0250000 0.5000000), wk = 0.0030303 k( 131) = ( 0.0375000 -0.0375000 0.5000000), wk = 0.0030303 k( 132) = ( 0.0500000 -0.0500000 0.5000000), wk = 0.0030303 k( 133) = ( 0.0625000 -0.0625000 0.5000000), wk = 0.0030303 k( 134) = ( 0.0750000 -0.0750000 0.5000000), wk = 0.0030303 k( 135) = ( 0.0875000 -0.0875000 0.5000000), wk = 0.0030303 k( 136) = ( 0.1000000 -0.1000000 0.5000000), wk = 0.0030303 k( 137) = ( 0.1125000 -0.1125000 0.5000000), wk = 0.0030303 k( 138) = ( 0.1250000 -0.1250000 0.5000000), wk = 0.0030303 k( 139) = ( 0.1375000 -0.1375000 0.5000000), wk = 0.0030303 k( 140) = ( 0.1500000 -0.1500000 0.5000000), wk = 0.0030303 k( 141) = ( 0.1625000 -0.1625000 0.5000000), wk = 0.0030303 k( 142) = ( 0.1750000 -0.1750000 0.5000000), wk = 0.0030303 k( 143) = ( 0.1875000 -0.1875000 0.5000000), wk = 0.0030303 k( 144) = ( 0.2000000 -0.2000000 0.5000000), wk = 0.0030303 k( 145) = ( 0.2125000 -0.2125000 0.5000000), wk = 0.0030303 k( 146) = ( 0.2250000 -0.2250000 0.5000000), wk = 0.0030303 k( 147) = ( 0.2375000 -0.2375000 0.5000000), wk = 0.0030303 k( 148) = ( 0.2500000 -0.2500000 0.5000000), wk = 0.0030303 k( 149) = ( 0.2625000 -0.2625000 0.5000000), wk = 0.0030303 k( 150) = ( 0.2750000 -0.2750000 0.5000000), wk = 0.0030303 k( 151) = ( 0.2875000 -0.2875000 0.5000000), wk = 0.0030303 k( 152) = ( 0.3000000 -0.3000000 0.5000000), wk = 0.0030303 k( 153) = ( 0.3125000 -0.3125000 0.5000000), wk = 0.0030303 k( 154) = ( 0.3250000 -0.3250000 0.5000000), wk = 0.0030303 k( 155) = ( 0.3375000 -0.3375000 0.5000000), wk = 0.0030303 k( 156) = ( 0.3500000 -0.3500000 0.5000000), wk = 0.0030303 k( 157) = ( 0.3625000 -0.3625000 0.5000000), wk = 0.0030303 k( 158) = ( 0.3750000 -0.3750000 0.5000000), wk = 0.0030303 k( 159) = ( 0.3875000 -0.3875000 0.5000000), wk = 0.0030303 k( 160) = ( 0.4000000 -0.4000000 0.5000000), wk = 0.0030303 k( 161) = ( 0.4125000 -0.4125000 0.5000000), wk = 0.0030303 k( 162) = ( 0.4250000 -0.4250000 0.5000000), wk = 0.0030303 k( 163) = ( 0.4375000 -0.4375000 0.5000000), wk = 0.0030303 k( 164) = ( 0.4500000 -0.4500000 0.5000000), wk = 0.0030303 k( 165) = ( 0.4625000 -0.4625000 0.5000000), wk = 0.0030303 k( 166) = ( 0.4750000 -0.4750000 0.5000000), wk = 0.0030303 k( 167) = ( 0.4875000 -0.4875000 0.5000000), wk = 0.0030303 k( 168) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0030303 k( 169) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0030303 k( 170) = ( 0.5046843 -0.4953157 0.5016103), wk = 0.0030303 k( 171) = ( 0.6573458 -0.3426542 0.3822068), wk = 0.0030303 k( 172) = ( 0.6548014 -0.3451986 0.3675302), wk = 0.0030303 k( 173) = ( 0.6522571 -0.3477430 0.3528536), wk = 0.0030303 k( 174) = ( 0.6497127 -0.3502873 0.3381769), wk = 0.0030303 k( 175) = ( 0.6471683 -0.3528317 0.3235003), wk = 0.0030303 k( 176) = ( 0.6446240 -0.3553760 0.3088237), wk = 0.0030303 k( 177) = ( 0.6420796 -0.3579204 0.2941471), wk = 0.0030303 k( 178) = ( 0.6395353 -0.3604647 0.2794705), wk = 0.0030303 k( 179) = ( 0.6369909 -0.3630091 0.2647939), wk = 0.0030303 k( 180) = ( 0.6344466 -0.3655535 0.2501173), wk = 0.0030303 k( 181) = ( 0.6319022 -0.3680978 0.2354407), wk = 0.0030303 k( 182) = ( 0.6293578 -0.3706422 0.2207641), wk = 0.0030303 k( 183) = ( 0.6268135 -0.3731865 0.2060875), wk = 0.0030303 k( 184) = ( 0.6242691 -0.3757309 0.1914109), wk = 0.0030303 k( 185) = ( 0.6217248 -0.3782752 0.1767343), wk = 0.0030303 k( 186) = ( 0.6191804 -0.3808196 0.1620577), wk = 0.0030303 k( 187) = ( 0.6166360 -0.3833640 0.1473811), wk = 0.0030303 k( 188) = ( 0.6140917 -0.3859083 0.1327044), wk = 0.0030303 k( 189) = ( 0.6115473 -0.3884527 0.1180278), wk = 0.0030303 k( 190) = ( 0.6090030 -0.3909970 0.1033512), wk = 0.0030303 k( 191) = ( 0.6064586 -0.3935414 0.0886746), wk = 0.0030303 k( 192) = ( 0.6039143 -0.3960857 0.0739980), wk = 0.0030303 k( 193) = ( 0.6013699 -0.3986301 0.0593214), wk = 0.0030303 k( 194) = ( 0.5988255 -0.4011745 0.0446448), wk = 0.0030303 k( 195) = ( 0.5962812 -0.4037188 0.0299682), wk = 0.0030303 k( 196) = ( 0.5937368 -0.4062632 0.0152916), wk = 0.0030303 k( 197) = ( 0.5911925 -0.4088075 0.0006150), wk = 0.0030303 k( 198) = ( 0.5886481 -0.4113519 -0.0140616), wk = 0.0030303 k( 199) = ( 0.5861038 -0.4138963 -0.0287382), wk = 0.0030303 k( 200) = ( 0.5835594 -0.4164406 -0.0434148), wk = 0.0030303 k( 201) = ( 0.5810150 -0.4189850 -0.0580915), wk = 0.0030303 k( 202) = ( 0.5810150 -0.4189850 -0.0580915), wk = 0.0030303 k( 203) = ( 0.5729135 -0.4270865 -0.0522823), wk = 0.0030303 k( 204) = ( 0.5648120 -0.4351880 -0.0464732), wk = 0.0030303 k( 205) = ( 0.5567105 -0.4432895 -0.0406640), wk = 0.0030303 k( 206) = ( 0.5486090 -0.4513910 -0.0348549), wk = 0.0030303 k( 207) = ( 0.5405075 -0.4594925 -0.0290457), wk = 0.0030303 k( 208) = ( 0.5324060 -0.4675940 -0.0232366), wk = 0.0030303 k( 209) = ( 0.5243045 -0.4756955 -0.0174274), wk = 0.0030303 k( 210) = ( 0.5162030 -0.4837970 -0.0116183), wk = 0.0030303 k( 211) = ( 0.5081015 -0.4918985 -0.0058091), wk = 0.0030303 k( 212) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0030303 k( 213) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0030303 k( 214) = ( 0.4875000 -0.4875000 0.0000000), wk = 0.0030303 k( 215) = ( 0.4750000 -0.4750000 0.0000000), wk = 0.0030303 k( 216) = ( 0.4625000 -0.4625000 -0.0000000), wk = 0.0030303 k( 217) = ( 0.4500000 -0.4500000 0.0000000), wk = 0.0030303 k( 218) = ( 0.4375000 -0.4375000 0.0000000), wk = 0.0030303 k( 219) = ( 0.4250000 -0.4250000 0.0000000), wk = 0.0030303 k( 220) = ( 0.4125000 -0.4125000 -0.0000000), wk = 0.0030303 k( 221) = ( 0.4000000 -0.4000000 0.0000000), wk = 0.0030303 k( 222) = ( 0.3875000 -0.3875000 0.0000000), wk = 0.0030303 k( 223) = ( 0.3750000 -0.3750000 0.0000000), wk = 0.0030303 k( 224) = ( 0.3625000 -0.3625000 0.0000000), wk = 0.0030303 k( 225) = ( 0.3500000 -0.3500000 0.0000000), wk = 0.0030303 k( 226) = ( 0.3375000 -0.3375000 0.0000000), wk = 0.0030303 k( 227) = ( 0.3250000 -0.3250000 0.0000000), wk = 0.0030303 k( 228) = ( 0.3125000 -0.3125000 0.0000000), wk = 0.0030303 k( 229) = ( 0.3000000 -0.3000000 0.0000000), wk = 0.0030303 k( 230) = ( 0.2875000 -0.2875000 0.0000000), wk = 0.0030303 k( 231) = ( 0.2750000 -0.2750000 -0.0000000), wk = 0.0030303 k( 232) = ( 0.2625000 -0.2625000 0.0000000), wk = 0.0030303 k( 233) = ( 0.2500000 -0.2500000 0.0000000), wk = 0.0030303 k( 234) = ( 0.2375000 -0.2375000 0.0000000), wk = 0.0030303 k( 235) = ( 0.2250000 -0.2250000 0.0000000), wk = 0.0030303 k( 236) = ( 0.2125000 -0.2125000 0.0000000), wk = 0.0030303 k( 237) = ( 0.2000000 -0.2000000 0.0000000), wk = 0.0030303 k( 238) = ( 0.1875000 -0.1875000 0.0000000), wk = 0.0030303 k( 239) = ( 0.1750000 -0.1750000 0.0000000), wk = 0.0030303 k( 240) = ( 0.1625000 -0.1625000 0.0000000), wk = 0.0030303 k( 241) = ( 0.1500000 -0.1500000 0.0000000), wk = 0.0030303 k( 242) = ( 0.1375000 -0.1375000 -0.0000000), wk = 0.0030303 k( 243) = ( 0.1250000 -0.1250000 0.0000000), wk = 0.0030303 k( 244) = ( 0.1125000 -0.1125000 0.0000000), wk = 0.0030303 k( 245) = ( 0.1000000 -0.1000000 0.0000000), wk = 0.0030303 k( 246) = ( 0.0875000 -0.0875000 0.0000000), wk = 0.0030303 k( 247) = ( 0.0750000 -0.0750000 0.0000000), wk = 0.0030303 k( 248) = ( 0.0625000 -0.0625000 0.0000000), wk = 0.0030303 k( 249) = ( 0.0500000 -0.0500000 0.0000000), wk = 0.0030303 k( 250) = ( 0.0375000 -0.0375000 0.0000000), wk = 0.0030303 k( 251) = ( 0.0250000 -0.0250000 0.0000000), wk = 0.0030303 k( 252) = ( 0.0125000 -0.0125000 0.0000000), wk = 0.0030303 k( 253) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 k( 254) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 k( 255) = ( 0.0156250 0.0000000 0.0000000), wk = 0.0030303 k( 256) = ( 0.0312500 0.0000000 0.0000000), wk = 0.0030303 k( 257) = ( 0.0468750 -0.0000000 0.0000000), wk = 0.0030303 k( 258) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0030303 k( 259) = ( 0.0781250 0.0000000 0.0000000), wk = 0.0030303 k( 260) = ( 0.0937500 -0.0000000 0.0000000), wk = 0.0030303 k( 261) = ( 0.1093750 -0.0000000 0.0000000), wk = 0.0030303 k( 262) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0030303 k( 263) = ( 0.1406250 -0.0000000 0.0000000), wk = 0.0030303 k( 264) = ( 0.1562500 0.0000000 0.0000000), wk = 0.0030303 k( 265) = ( 0.1718750 -0.0000000 0.0000000), wk = 0.0030303 k( 266) = ( 0.1875000 -0.0000000 0.0000000), wk = 0.0030303 k( 267) = ( 0.2031250 -0.0000000 0.0000000), wk = 0.0030303 k( 268) = ( 0.2187500 -0.0000000 0.0000000), wk = 0.0030303 k( 269) = ( 0.2343750 -0.0000000 0.0000000), wk = 0.0030303 k( 270) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0030303 k( 271) = ( 0.2656250 -0.0000000 0.0000000), wk = 0.0030303 k( 272) = ( 0.2812500 -0.0000000 0.0000000), wk = 0.0030303 k( 273) = ( 0.2968750 0.0000000 0.0000000), wk = 0.0030303 k( 274) = ( 0.3125000 0.0000000 0.0000000), wk = 0.0030303 k( 275) = ( 0.3281250 -0.0000000 0.0000000), wk = 0.0030303 k( 276) = ( 0.3437500 -0.0000000 0.0000000), wk = 0.0030303 k( 277) = ( 0.3593750 -0.0000000 0.0000000), wk = 0.0030303 k( 278) = ( 0.3750000 -0.0000000 0.0000000), wk = 0.0030303 k( 279) = ( 0.3906250 -0.0000000 0.0000000), wk = 0.0030303 k( 280) = ( 0.4062500 -0.0000000 0.0000000), wk = 0.0030303 k( 281) = ( 0.4218750 -0.0000000 0.0000000), wk = 0.0030303 k( 282) = ( 0.4375000 -0.0000000 0.0000000), wk = 0.0030303 k( 283) = ( 0.4531250 -0.0000000 0.0000000), wk = 0.0030303 k( 284) = ( 0.4687500 -0.0000000 0.0000000), wk = 0.0030303 k( 285) = ( 0.4843750 -0.0000000 -0.0000000), wk = 0.0030303 k( 286) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0030303 k( 287) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0030303 k( 288) = ( 0.4883721 -0.0000000 0.4883721), wk = 0.0030303 k( 289) = ( 0.4767442 -0.0000000 0.4767442), wk = 0.0030303 k( 290) = ( 0.4651163 -0.0000000 0.4651163), wk = 0.0030303 k( 291) = ( 0.4534884 0.0000000 0.4534884), wk = 0.0030303 k( 292) = ( 0.4418605 -0.0000000 0.4418605), wk = 0.0030303 k( 293) = ( 0.4302326 0.0000000 0.4302326), wk = 0.0030303 k( 294) = ( 0.4186047 -0.0000000 0.4186047), wk = 0.0030303 k( 295) = ( 0.4069767 -0.0000000 0.4069767), wk = 0.0030303 k( 296) = ( 0.3953488 -0.0000000 0.3953488), wk = 0.0030303 k( 297) = ( 0.3837209 -0.0000000 0.3837209), wk = 0.0030303 k( 298) = ( 0.3720930 0.0000000 0.3720930), wk = 0.0030303 k( 299) = ( 0.3604651 0.0000000 0.3604651), wk = 0.0030303 k( 300) = ( 0.3488372 -0.0000000 0.3488372), wk = 0.0030303 k( 301) = ( 0.3372093 0.0000000 0.3372093), wk = 0.0030303 k( 302) = ( 0.3255814 -0.0000000 0.3255814), wk = 0.0030303 k( 303) = ( 0.3139535 -0.0000000 0.3139535), wk = 0.0030303 k( 304) = ( 0.3023256 -0.0000000 0.3023256), wk = 0.0030303 k( 305) = ( 0.2906977 -0.0000000 0.2906977), wk = 0.0030303 k( 306) = ( 0.2790698 -0.0000000 0.2790698), wk = 0.0030303 k( 307) = ( 0.2674419 -0.0000000 0.2674419), wk = 0.0030303 k( 308) = ( 0.2558140 -0.0000000 0.2558140), wk = 0.0030303 k( 309) = ( 0.2441860 -0.0000000 0.2441860), wk = 0.0030303 k( 310) = ( 0.2325581 -0.0000000 0.2325581), wk = 0.0030303 k( 311) = ( 0.2209302 -0.0000000 0.2209302), wk = 0.0030303 k( 312) = ( 0.2093023 -0.0000000 0.2093023), wk = 0.0030303 k( 313) = ( 0.1976744 -0.0000000 0.1976744), wk = 0.0030303 k( 314) = ( 0.1860465 0.0000000 0.1860465), wk = 0.0030303 k( 315) = ( 0.1744186 -0.0000000 0.1744186), wk = 0.0030303 k( 316) = ( 0.1627907 -0.0000000 0.1627907), wk = 0.0030303 k( 317) = ( 0.1511628 -0.0000000 0.1511628), wk = 0.0030303 k( 318) = ( 0.1395349 -0.0000000 0.1395349), wk = 0.0030303 k( 319) = ( 0.1279070 -0.0000000 0.1279070), wk = 0.0030303 k( 320) = ( 0.1162791 -0.0000000 0.1162791), wk = 0.0030303 k( 321) = ( 0.1046512 -0.0000000 0.1046512), wk = 0.0030303 k( 322) = ( 0.0930233 0.0000000 0.0930233), wk = 0.0030303 k( 323) = ( 0.0813954 -0.0000000 0.0813954), wk = 0.0030303 k( 324) = ( 0.0697674 -0.0000000 0.0697674), wk = 0.0030303 k( 325) = ( 0.0581395 -0.0000000 0.0581395), wk = 0.0030303 k( 326) = ( 0.0465116 0.0000000 0.0465116), wk = 0.0030303 k( 327) = ( 0.0348837 -0.0000000 0.0348837), wk = 0.0030303 k( 328) = ( 0.0232558 -0.0000000 0.0232558), wk = 0.0030303 k( 329) = ( 0.0116279 -0.0000000 0.0116279), wk = 0.0030303 k( 330) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030303 Dense grid: 112903 G-vectors FFT dimensions: ( 64, 64, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.87 Mb ( 810, 70) NL pseudopotentials 1.08 Mb ( 405, 174) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 3136) G-vector shells 0.02 Mb ( 2960) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.46 Mb ( 810, 280) Each subspace H/S matrix 0.07 Mb ( 70, 70) Each matrix 0.37 Mb ( 174, 2, 70) The potential is recalculated from file : ./LiAlAs2O7.save/charge-density.dat Starting wfc are 90 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 6.3 secs Computing kpt #: 3 total cpu time spent up to now is 8.3 secs Computing kpt #: 4 total cpu time spent up to now is 10.3 secs Computing kpt #: 5 total cpu time spent up to now is 12.4 secs Computing kpt #: 6 total cpu time spent up to now is 14.5 secs Computing kpt #: 7 total cpu time spent up to now is 16.8 secs Computing kpt #: 8 total cpu time spent up to now is 18.8 secs Computing kpt #: 9 total cpu time spent up to now is 21.3 secs Computing kpt #: 10 total cpu time spent up to now is 23.4 secs Computing kpt #: 11 total cpu time spent up to now is 25.7 secs Computing kpt #: 12 total cpu time spent up to now is 28.1 secs Computing kpt #: 13 total cpu time spent up to now is 30.1 secs Computing kpt #: 14 total cpu time spent up to now is 31.8 secs Computing kpt #: 15 total cpu time spent up to now is 33.6 secs Computing kpt #: 16 total cpu time spent up to now is 35.2 secs Computing kpt #: 17 total cpu time spent up to now is 37.0 secs Computing kpt #: 18 total cpu time spent up to now is 38.6 secs Computing kpt #: 19 total cpu time spent up to now is 40.3 secs Computing kpt #: 20 total cpu time spent up to now is 41.9 secs Computing kpt #: 21 total cpu time spent up to now is 43.5 secs Computing kpt #: 22 total cpu time spent up to now is 45.2 secs Computing kpt #: 23 total cpu time spent up to now is 46.7 secs Computing kpt #: 24 total cpu time spent up to now is 48.3 secs Computing kpt #: 25 total cpu time spent up to now is 49.8 secs Computing kpt #: 26 total cpu time spent up to now is 51.5 secs Computing kpt #: 27 total cpu time spent up to now is 53.0 secs Computing kpt #: 28 total cpu time spent up to now is 54.5 secs Computing kpt #: 29 total cpu time spent up to now is 56.0 secs Computing kpt #: 30 total cpu time spent up to now is 57.5 secs Computing kpt #: 31 total cpu time spent up to now is 58.9 secs Computing kpt #: 32 total cpu time spent up to now is 60.5 secs Computing kpt #: 33 total cpu time spent up to now is 62.0 secs Computing kpt #: 34 total cpu time spent up to now is 63.5 secs Computing kpt #: 35 total cpu time spent up to now is 64.9 secs Computing kpt #: 36 total cpu time spent up to now is 66.4 secs Computing kpt #: 37 total cpu time spent up to now is 67.8 secs Computing kpt #: 38 total cpu time spent up to now is 69.2 secs Computing kpt #: 39 total cpu time spent up to now is 70.5 secs Computing kpt #: 40 total cpu time spent up to now is 71.9 secs Computing kpt #: 41 total cpu time spent up to now is 73.2 secs Computing kpt #: 42 total cpu time spent up to now is 74.5 secs Computing kpt #: 43 total cpu time spent up to now is 75.9 secs Computing kpt #: 44 total cpu time spent up to now is 77.3 secs Computing kpt #: 45 total cpu time spent up to now is 78.6 secs Computing kpt #: 46 total cpu time spent up to now is 80.0 secs Computing kpt #: 47 total cpu time spent up to now is 81.4 secs Computing kpt #: 48 total cpu time spent up to now is 82.8 secs Computing kpt #: 49 total cpu time spent up to now is 84.3 secs Computing kpt #: 50 total cpu time spent up to now is 85.8 secs Computing kpt #: 51 total cpu time spent up to now is 87.6 secs Computing kpt #: 52 total cpu time spent up to now is 89.1 secs Computing kpt #: 53 total cpu time spent up to now is 90.8 secs Computing kpt #: 54 total cpu time spent up to now is 92.6 secs Computing kpt #: 55 total cpu time spent up to now is 94.2 secs Computing kpt #: 56 total cpu time spent up to now is 95.8 secs Computing kpt #: 57 total cpu time spent up to now is 97.4 secs Computing kpt #: 58 total cpu time spent up to now is 99.1 secs Computing kpt #: 59 total cpu time spent up to now is 100.8 secs Computing kpt #: 60 total cpu time spent up to now is 102.5 secs Computing kpt #: 61 total cpu time spent up to now is 104.3 secs Computing kpt #: 62 total cpu time spent up to now is 106.1 secs Computing kpt #: 63 total cpu time spent up to now is 107.9 secs Computing kpt #: 64 total cpu time spent up to now is 109.6 secs Computing kpt #: 65 total cpu time spent up to now is 111.3 secs Computing kpt #: 66 total cpu time spent up to now is 113.0 secs Computing kpt #: 67 total cpu time spent up to now is 114.7 secs Computing kpt #: 68 total cpu time spent up to now is 116.5 secs Computing kpt #: 69 total cpu time spent up to now is 118.2 secs Computing kpt #: 70 total cpu time spent up to now is 120.0 secs Computing kpt #: 71 total cpu time spent up to now is 121.9 secs Computing kpt #: 72 total cpu time spent up to now is 123.6 secs Computing kpt #: 73 total cpu time spent up to now is 125.2 secs Computing kpt #: 74 total cpu time spent up to now is 126.9 secs Computing kpt #: 75 total cpu time spent up to now is 128.7 secs Computing kpt #: 76 total cpu time spent up to now is 130.4 secs Computing kpt #: 77 total cpu time spent up to now is 132.2 secs Computing kpt #: 78 total cpu time spent up to now is 133.9 secs Computing kpt #: 79 total cpu time spent up to now is 135.8 secs Computing kpt #: 80 total cpu time spent up to now is 137.7 secs Computing kpt #: 81 total cpu time spent up to now is 139.6 secs Computing kpt #: 82 total cpu time spent up to now is 141.5 secs Computing kpt #: 83 total cpu time spent up to now is 143.4 secs Computing kpt #: 84 total cpu time spent up to now is 145.4 secs Computing kpt #: 85 total cpu time spent up to now is 147.3 secs Computing kpt #: 86 total cpu time spent up to now is 149.2 secs Computing kpt #: 87 total cpu time spent up to now is 151.1 secs Computing kpt #: 88 total cpu time spent up to now is 153.0 secs Computing kpt #: 89 total cpu time spent up to now is 154.9 secs Computing kpt #: 90 total cpu time spent up to now is 156.8 secs Computing kpt #: 91 total cpu time spent up to now is 158.7 secs Computing kpt #: 92 total cpu time spent up to now is 160.6 secs Computing kpt #: 93 total cpu time spent up to now is 162.6 secs Computing kpt #: 94 total cpu time spent up to now is 164.5 secs Computing kpt #: 95 total cpu time spent up to now is 166.4 secs Computing kpt #: 96 total cpu time spent up to now is 168.4 secs Computing kpt #: 97 total cpu time spent up to now is 170.5 secs Computing kpt #: 98 total cpu time spent up to now is 172.6 secs Computing kpt #: 99 total cpu time spent up to now is 174.6 secs Computing kpt #: 100 total cpu time spent up to now is 176.7 secs Computing kpt #: 101 total cpu time spent up to now is 178.7 secs Computing kpt #: 102 total cpu time spent up to now is 180.7 secs Computing kpt #: 103 total cpu time spent up to now is 182.6 secs Computing kpt #: 104 total cpu time spent up to now is 184.5 secs Computing kpt #: 105 total cpu time spent up to now is 186.4 secs Computing kpt #: 106 total cpu time spent up to now is 188.1 secs Computing kpt #: 107 total cpu time spent up to now is 189.9 secs Computing kpt #: 108 total cpu time spent up to now is 191.3 secs Computing kpt #: 109 total cpu time spent up to now is 193.0 secs Computing kpt #: 110 total cpu time spent up to now is 194.6 secs Computing kpt #: 111 total cpu time spent up to now is 195.9 secs Computing kpt #: 112 total cpu time spent up to now is 197.4 secs Computing kpt #: 113 total cpu time spent up to now is 198.9 secs Computing kpt #: 114 total cpu time spent up to now is 200.3 secs Computing kpt #: 115 total cpu time spent up to now is 201.7 secs Computing kpt #: 116 total cpu time spent up to now is 203.2 secs Computing kpt #: 117 total cpu time spent up to now is 204.4 secs Computing kpt #: 118 total cpu time spent up to now is 205.8 secs Computing kpt #: 119 total cpu time spent up to now is 207.0 secs Computing kpt #: 120 total cpu time spent up to now is 208.2 secs Computing kpt #: 121 total cpu time spent up to now is 209.4 secs Computing kpt #: 122 total cpu time spent up to now is 210.7 secs Computing kpt #: 123 total cpu time spent up to now is 212.4 secs Computing kpt #: 124 total cpu time spent up to now is 213.6 secs Computing kpt #: 125 total cpu time spent up to now is 214.7 secs Computing kpt #: 126 total cpu time spent up to now is 215.9 secs Computing kpt #: 127 total cpu time spent up to now is 217.1 secs Computing kpt #: 128 total cpu time spent up to now is 218.3 secs Computing kpt #: 129 total cpu time spent up to now is 219.5 secs Computing kpt #: 130 total cpu time spent up to now is 220.7 secs Computing kpt #: 131 total cpu time spent up to now is 221.9 secs Computing kpt #: 132 total cpu time spent up to now is 223.2 secs Computing kpt #: 133 total cpu time spent up to now is 224.4 secs Computing kpt #: 134 total cpu time spent up to now is 225.7 secs Computing kpt #: 135 total cpu time spent up to now is 227.2 secs Computing kpt #: 136 total cpu time spent up to now is 228.7 secs Computing kpt #: 137 total cpu time spent up to now is 230.1 secs Computing kpt #: 138 total cpu time spent up to now is 231.7 secs Computing kpt #: 139 total cpu time spent up to now is 233.2 secs Computing kpt #: 140 total cpu time spent up to now is 234.8 secs Computing kpt #: 141 total cpu time spent up to now is 236.4 secs Computing kpt #: 142 total cpu time spent up to now is 238.0 secs Computing kpt #: 143 total cpu time spent up to now is 239.6 secs Computing kpt #: 144 total cpu time spent up to now is 241.4 secs Computing kpt #: 145 total cpu time spent up to now is 243.1 secs Computing kpt #: 146 total cpu time spent up to now is 244.9 secs Computing kpt #: 147 total cpu time spent up to now is 246.6 secs Computing kpt #: 148 total cpu time spent up to now is 248.4 secs Computing kpt #: 149 total cpu time spent up to now is 250.2 secs Computing kpt #: 150 total cpu time spent up to now is 252.0 secs Computing kpt #: 151 total cpu time spent up to now is 253.7 secs Computing kpt #: 152 total cpu time spent up to now is 255.6 secs Computing kpt #: 153 total cpu time spent up to now is 257.5 secs Computing kpt #: 154 total cpu time spent up to now is 259.3 secs Computing kpt #: 155 total cpu time spent up to now is 261.1 secs Computing kpt #: 156 total cpu time spent up to now is 263.0 secs Computing kpt #: 157 total cpu time spent up to now is 264.8 secs Computing kpt #: 158 total cpu time spent up to now is 266.6 secs Computing kpt #: 159 total cpu time spent up to now is 268.4 secs Computing kpt #: 160 total cpu time spent up to now is 270.2 secs Computing kpt #: 161 total cpu time spent up to now is 272.0 secs Computing kpt #: 162 total cpu time spent up to now is 273.8 secs Computing kpt #: 163 total cpu time spent up to now is 275.6 secs Computing kpt #: 164 total cpu time spent up to now is 277.3 secs Computing kpt #: 165 total cpu time spent up to now is 279.1 secs Computing kpt #: 166 total cpu time spent up to now is 280.8 secs Computing kpt #: 167 total cpu time spent up to now is 282.5 secs Computing kpt #: 168 total cpu time spent up to now is 284.3 secs Computing kpt #: 169 total cpu time spent up to now is 286.0 secs Computing kpt #: 170 total cpu time spent up to now is 287.7 secs Computing kpt #: 171 total cpu time spent up to now is 289.6 secs Computing kpt #: 172 total cpu time spent up to now is 291.5 secs Computing kpt #: 173 total cpu time spent up to now is 293.5 secs Computing kpt #: 174 total cpu time spent up to now is 295.3 secs Computing kpt #: 175 total cpu time spent up to now is 297.3 secs Computing kpt #: 176 total cpu time spent up to now is 299.2 secs Computing kpt #: 177 total cpu time spent up to now is 301.0 secs Computing kpt #: 178 total cpu time spent up to now is 302.7 secs Computing kpt #: 179 total cpu time spent up to now is 304.4 secs Computing kpt #: 180 total cpu time spent up to now is 306.1 secs Computing kpt #: 181 total cpu time spent up to now is 307.7 secs Computing kpt #: 182 total cpu time spent up to now is 309.5 secs Computing kpt #: 183 total cpu time spent up to now is 311.1 secs Computing kpt #: 184 total cpu time spent up to now is 312.6 secs Computing kpt #: 185 total cpu time spent up to now is 314.3 secs Computing kpt #: 186 total cpu time spent up to now is 315.8 secs Computing kpt #: 187 total cpu time spent up to now is 317.3 secs Computing kpt #: 188 total cpu time spent up to now is 320.0 secs Computing kpt #: 189 total cpu time spent up to now is 321.4 secs Computing kpt #: 190 total cpu time spent up to now is 322.8 secs Computing kpt #: 191 total cpu time spent up to now is 324.2 secs Computing kpt #: 192 total cpu time spent up to now is 325.6 secs Computing kpt #: 193 total cpu time spent up to now is 327.0 secs Computing kpt #: 194 total cpu time spent up to now is 328.2 secs Computing kpt #: 195 total cpu time spent up to now is 329.5 secs Computing kpt #: 196 total cpu time spent up to now is 330.7 secs Computing kpt #: 197 total cpu time spent up to now is 332.1 secs Computing kpt #: 198 total cpu time spent up to now is 333.4 secs Computing kpt #: 199 total cpu time spent up to now is 334.9 secs Computing kpt #: 200 total cpu time spent up to now is 336.1 secs Computing kpt #: 201 total cpu time spent up to now is 337.5 secs Computing kpt #: 202 total cpu time spent up to now is 338.7 secs Computing kpt #: 203 total cpu time spent up to now is 340.2 secs Computing kpt #: 204 total cpu time spent up to now is 341.6 secs Computing kpt #: 205 total cpu time spent up to now is 343.0 secs Computing kpt #: 206 total cpu time spent up to now is 344.4 secs Computing kpt #: 207 total cpu time spent up to now is 345.8 secs Computing kpt #: 208 total cpu time spent up to now is 347.2 secs Computing kpt #: 209 total cpu time spent up to now is 348.6 secs Computing kpt #: 210 total cpu time spent up to now is 350.0 secs Computing kpt #: 211 total cpu time spent up to now is 351.4 secs Computing kpt #: 212 total cpu time spent up to now is 352.8 secs Computing kpt #: 213 total cpu time spent up to now is 354.2 secs Computing kpt #: 214 total cpu time spent up to now is 355.6 secs Computing kpt #: 215 total cpu time spent up to now is 357.0 secs Computing kpt #: 216 total cpu time spent up to now is 358.3 secs Computing kpt #: 217 total cpu time spent up to now is 359.7 secs Computing kpt #: 218 total cpu time spent up to now is 361.1 secs Computing kpt #: 219 total cpu time spent up to now is 362.5 secs Computing kpt #: 220 total cpu time spent up to now is 364.0 secs Computing kpt #: 221 total cpu time spent up to now is 365.5 secs Computing kpt #: 222 total cpu time spent up to now is 367.0 secs Computing kpt #: 223 total cpu time spent up to now is 368.5 secs Computing kpt #: 224 total cpu time spent up to now is 370.0 secs Computing kpt #: 225 total cpu time spent up to now is 371.7 secs Computing kpt #: 226 total cpu time spent up to now is 373.3 secs Computing kpt #: 227 total cpu time spent up to now is 375.0 secs Computing kpt #: 228 total cpu time spent up to now is 376.7 secs Computing kpt #: 229 total cpu time spent up to now is 378.5 secs Computing kpt #: 230 total cpu time spent up to now is 380.3 secs Computing kpt #: 231 total cpu time spent up to now is 382.1 secs Computing kpt #: 232 total cpu time spent up to now is 384.2 secs Computing kpt #: 233 total cpu time spent up to now is 386.2 secs Computing kpt #: 234 total cpu time spent up to now is 388.2 secs Computing kpt #: 235 total cpu time spent up to now is 390.4 secs Computing kpt #: 236 total cpu time spent up to now is 392.7 secs Computing kpt #: 237 total cpu time spent up to now is 395.6 secs Computing kpt #: 238 total cpu time spent up to now is 398.6 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 402.0 secs Computing kpt #: 240 total cpu time spent up to now is 405.0 secs Computing kpt #: 241 total cpu time spent up to now is 408.3 secs Computing kpt #: 242 total cpu time spent up to now is 410.6 secs Computing kpt #: 243 total cpu time spent up to now is 413.4 secs Computing kpt #: 244 total cpu time spent up to now is 415.5 secs Computing kpt #: 245 total cpu time spent up to now is 417.5 secs Computing kpt #: 246 total cpu time spent up to now is 419.5 secs Computing kpt #: 247 total cpu time spent up to now is 421.5 secs Computing kpt #: 248 total cpu time spent up to now is 423.4 secs Computing kpt #: 249 total cpu time spent up to now is 425.1 secs Computing kpt #: 250 total cpu time spent up to now is 426.6 secs Computing kpt #: 251 total cpu time spent up to now is 428.6 secs Computing kpt #: 252 total cpu time spent up to now is 430.4 secs Computing kpt #: 253 total cpu time spent up to now is 431.9 secs Computing kpt #: 254 total cpu time spent up to now is 433.5 secs Computing kpt #: 255 total cpu time spent up to now is 435.3 secs Computing kpt #: 256 total cpu time spent up to now is 437.3 secs Computing kpt #: 257 total cpu time spent up to now is 439.3 secs Computing kpt #: 258 total cpu time spent up to now is 441.2 secs Computing kpt #: 259 total cpu time spent up to now is 443.4 secs Computing kpt #: 260 total cpu time spent up to now is 445.7 secs Computing kpt #: 261 total cpu time spent up to now is 447.8 secs Computing kpt #: 262 total cpu time spent up to now is 450.4 secs Computing kpt #: 263 total cpu time spent up to now is 452.7 secs Computing kpt #: 264 total cpu time spent up to now is 455.0 secs Computing kpt #: 265 total cpu time spent up to now is 457.7 secs Computing kpt #: 266 total cpu time spent up to now is 459.7 secs Computing kpt #: 267 total cpu time spent up to now is 461.9 secs Computing kpt #: 268 total cpu time spent up to now is 464.0 secs Computing kpt #: 269 total cpu time spent up to now is 465.9 secs Computing kpt #: 270 total cpu time spent up to now is 467.6 secs Computing kpt #: 271 total cpu time spent up to now is 469.3 secs Computing kpt #: 272 total cpu time spent up to now is 471.0 secs Computing kpt #: 273 total cpu time spent up to now is 472.7 secs Computing kpt #: 274 total cpu time spent up to now is 474.4 secs Computing kpt #: 275 total cpu time spent up to now is 476.0 secs Computing kpt #: 276 total cpu time spent up to now is 477.7 secs Computing kpt #: 277 total cpu time spent up to now is 479.4 secs Computing kpt #: 278 total cpu time spent up to now is 481.0 secs Computing kpt #: 279 total cpu time spent up to now is 482.7 secs Computing kpt #: 280 total cpu time spent up to now is 484.3 secs Computing kpt #: 281 total cpu time spent up to now is 486.0 secs Computing kpt #: 282 total cpu time spent up to now is 487.6 secs Computing kpt #: 283 total cpu time spent up to now is 489.1 secs Computing kpt #: 284 total cpu time spent up to now is 490.8 secs Computing kpt #: 285 total cpu time spent up to now is 492.5 secs Computing kpt #: 286 total cpu time spent up to now is 494.1 secs Computing kpt #: 287 total cpu time spent up to now is 495.8 secs Computing kpt #: 288 total cpu time spent up to now is 497.7 secs Computing kpt #: 289 total cpu time spent up to now is 499.5 secs Computing kpt #: 290 total cpu time spent up to now is 501.3 secs Computing kpt #: 291 total cpu time spent up to now is 503.1 secs Computing kpt #: 292 total cpu time spent up to now is 504.8 secs Computing kpt #: 293 total cpu time spent up to now is 506.7 secs Computing kpt #: 294 total cpu time spent up to now is 508.5 secs Computing kpt #: 295 total cpu time spent up to now is 510.3 secs Computing kpt #: 296 total cpu time spent up to now is 512.5 secs Computing kpt #: 297 total cpu time spent up to now is 514.4 secs Computing kpt #: 298 total cpu time spent up to now is 516.5 secs Computing kpt #: 299 total cpu time spent up to now is 518.2 secs Computing kpt #: 300 total cpu time spent up to now is 520.1 secs Computing kpt #: 301 total cpu time spent up to now is 522.1 secs Computing kpt #: 302 total cpu time spent up to now is 524.0 secs Computing kpt #: 303 total cpu time spent up to now is 525.9 secs Computing kpt #: 304 total cpu time spent up to now is 527.9 secs Computing kpt #: 305 total cpu time spent up to now is 529.9 secs Computing kpt #: 306 total cpu time spent up to now is 532.0 secs Computing kpt #: 307 total cpu time spent up to now is 534.0 secs Computing kpt #: 308 total cpu time spent up to now is 536.1 secs Computing kpt #: 309 total cpu time spent up to now is 538.3 secs Computing kpt #: 310 total cpu time spent up to now is 541.3 secs Computing kpt #: 311 total cpu time spent up to now is 543.5 secs Computing kpt #: 312 total cpu time spent up to now is 545.6 secs Computing kpt #: 313 total cpu time spent up to now is 547.8 secs Computing kpt #: 314 total cpu time spent up to now is 550.2 secs Computing kpt #: 315 total cpu time spent up to now is 552.4 secs Computing kpt #: 316 total cpu time spent up to now is 555.2 secs Computing kpt #: 317 total cpu time spent up to now is 557.6 secs Computing kpt #: 318 total cpu time spent up to now is 559.8 secs Computing kpt #: 319 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 563.3 secs Computing kpt #: 320 total cpu time spent up to now is 565.4 secs Computing kpt #: 321 total cpu time spent up to now is 567.8 secs Computing kpt #: 322 total cpu time spent up to now is 569.9 secs Computing kpt #: 323 total cpu time spent up to now is 572.0 secs Computing kpt #: 324 total cpu time spent up to now is 574.0 secs Computing kpt #: 325 total cpu time spent up to now is 575.9 secs Computing kpt #: 326 total cpu time spent up to now is 577.3 secs Computing kpt #: 327 total cpu time spent up to now is 579.2 secs Computing kpt #: 328 total cpu time spent up to now is 581.0 secs Computing kpt #: 329 total cpu time spent up to now is 582.5 secs Computing kpt #: 330 total cpu time spent up to now is 583.9 secs ethr = 1.72E-08, avg # of iterations = 39.3 total cpu time spent up to now is 583.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14119 PWs) bands (ev): -37.8013 -37.8013 -15.8497 -15.8497 -14.0701 -14.0701 -13.4764 -13.4764 -12.7219 -12.7219 -12.6684 -12.6684 -12.6473 -12.6473 -12.3480 -12.3480 -4.8627 -4.8627 -4.3820 -4.3820 -1.1004 -1.1004 -0.9850 -0.9850 -0.2628 -0.2628 -0.1042 -0.1042 0.0921 0.0921 0.4907 0.4907 1.3801 1.3801 1.8993 1.8993 2.1637 2.1637 2.1909 2.1909 2.4360 2.4360 2.9825 2.9825 3.5394 3.5394 3.6914 3.6914 3.7962 3.7962 3.9260 3.9260 4.3143 4.3143 4.4145 4.4145 4.6335 4.6335 8.5288 8.5288 11.4532 11.4532 12.5891 12.5891 12.7066 12.7066 13.0559 13.0559 13.9182 13.9182 k = 0.0102 0.0124-0.0024 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.8490 -15.8490 -14.0736 -14.0735 -13.4741 -13.4731 -12.7233 -12.7210 -12.6691 -12.6674 -12.6475 -12.6470 -12.3484 -12.3477 -4.8680 -4.8675 -4.3765 -4.3758 -1.1055 -1.0971 -0.9876 -0.9817 -0.2661 -0.2621 -0.1064 -0.1020 0.0892 0.0950 0.4906 0.4929 1.3797 1.3823 1.8972 1.8978 2.1556 2.1609 2.1960 2.2010 2.4367 2.4370 2.9806 2.9811 3.5384 3.5398 3.6908 3.6934 3.7970 3.7977 3.9237 3.9242 4.3140 4.3142 4.4144 4.4144 4.6324 4.6327 8.5320 8.5322 11.4512 11.4523 12.5686 12.6052 12.6884 12.7267 13.0510 13.0560 13.9096 13.9306 k = 0.0204 0.0249-0.0048 ( 14118 PWs) bands (ev): -37.8013 -37.8013 -15.8471 -15.8471 -14.0838 -14.0835 -13.4663 -13.4645 -12.7250 -12.7205 -12.6691 -12.6660 -12.6477 -12.6467 -12.3487 -12.3473 -4.8827 -4.8817 -4.3602 -4.3589 -1.1120 -1.0959 -0.9889 -0.9779 -0.2721 -0.2643 -0.1084 -0.0996 0.0865 0.0980 0.4927 0.4972 1.3810 1.3862 1.8914 1.8925 2.1465 2.1531 2.2103 2.2161 2.4393 2.4400 2.9756 2.9765 3.5369 3.5397 3.6913 3.6965 3.8003 3.8016 3.9172 3.9183 4.3133 4.3136 4.4140 4.4141 4.6292 4.6298 8.5418 8.5422 11.4461 11.4483 12.5456 12.6117 12.6775 12.7474 13.0417 13.0510 13.9048 13.9461 k = 0.0307 0.0373-0.0073 ( 14118 PWs) bands (ev): -37.8013 -37.8013 -15.8439 -15.8438 -14.0999 -14.0996 -13.4538 -13.4510 -12.7268 -12.7204 -12.6686 -12.6644 -12.6477 -12.6464 -12.3489 -12.3469 -4.9049 -4.9036 -4.3348 -4.3329 -1.1194 -1.0969 -0.9891 -0.9741 -0.2807 -0.2692 -0.1101 -0.0971 0.0840 0.1009 0.4968 0.5035 1.3841 1.3917 1.8824 1.8838 2.1405 2.1474 2.2255 2.2313 2.4445 2.4456 2.9679 2.9692 3.5348 3.5389 3.6922 3.6998 3.8064 3.8082 3.9067 3.9084 4.3122 4.3127 4.4135 4.4136 4.6242 4.6249 8.5581 8.5586 11.4380 11.4413 12.5207 12.6018 12.6803 12.7679 13.0292 13.0415 13.9026 13.9628 k = 0.0409 0.0497-0.0097 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.8393 -15.8393 -14.1212 -14.1209 -13.4373 -13.4337 -12.7288 -12.7209 -12.6674 -12.6627 -12.6477 -12.6462 -12.3492 -12.3465 -4.9326 -4.9310 -4.3023 -4.3000 -1.1276 -1.1000 -0.9880 -0.9707 -0.2917 -0.2767 -0.1113 -0.0943 0.0818 0.1037 0.5030 0.5115 1.3889 1.3986 1.8706 1.8722 2.1383 2.1456 2.2387 2.2442 2.4532 2.4548 2.9579 2.9595 3.5323 3.5375 3.6927 3.7023 3.8157 3.8177 3.8922 3.8948 4.3107 4.3113 4.4128 4.4130 4.6173 4.6183 8.5806 8.5813 11.4271 11.4313 12.4942 12.5800 12.6920 12.7884 13.0148 13.0283 13.9017 13.9777 k = 0.0511 0.0621-0.0121 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.8335 -15.8334 -14.1468 -14.1464 -13.4179 -13.4136 -12.7307 -12.7217 -12.6657 -12.6610 -12.6476 -12.6461 -12.3494 -12.3461 -4.9639 -4.9621 -4.2646 -4.2619 -1.1362 -1.1052 -0.9862 -0.9679 -0.3051 -0.2870 -0.1116 -0.0911 0.0798 0.1064 0.5109 0.5211 1.3952 1.4068 1.8567 1.8584 2.1402 2.1478 2.2481 2.2533 2.4661 2.4683 2.9462 2.9481 3.5293 3.5354 3.6918 3.7029 3.8280 3.8300 3.8742 3.8783 4.3087 4.3095 4.4121 4.4124 4.6088 4.6101 8.6092 8.6100 11.4134 11.4185 12.4661 12.5524 12.7064 12.8086 12.9997 13.0125 13.9005 13.9880 k = 0.0613 0.0746-0.0145 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.8265 -15.8264 -14.1756 -14.1753 -13.3964 -13.3914 -12.7324 -12.7227 -12.6633 -12.6594 -12.6473 -12.6461 -12.3496 -12.3456 -4.9975 -4.9955 -4.2232 -4.2201 -1.1452 -1.1119 -0.9840 -0.9659 -0.3206 -0.2997 -0.1109 -0.0873 0.0780 0.1088 0.5205 0.5319 1.4029 1.4161 1.8415 1.8433 2.1457 2.1537 2.2529 2.2577 2.4838 2.4866 2.9334 2.9355 3.5258 3.5328 3.6889 3.7010 3.8385 3.8441 3.8541 3.8633 4.3061 4.3071 4.4115 4.4120 4.5990 4.6005 8.6435 8.6445 11.3969 11.4028 12.4368 12.5214 12.7207 12.8285 12.9851 12.9957 13.8978 13.9923 k = 0.0715 0.0870-0.0169 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.8182 -15.8181 -14.2071 -14.2068 -13.3738 -13.3681 -12.7339 -12.7239 -12.6607 -12.6580 -12.6471 -12.6459 -12.3498 -12.3451 -5.0321 -5.0300 -4.1791 -4.1757 -1.1543 -1.1200 -0.9819 -0.9648 -0.3383 -0.3148 -0.1088 -0.0827 0.0765 0.1108 0.5314 0.5439 1.4117 1.4261 1.8257 1.8278 2.1543 2.1627 2.2532 2.2576 2.5058 2.5092 2.9202 2.9224 3.5218 3.5295 3.6834 3.6960 3.8263 3.8290 3.8643 3.8697 4.3029 4.3042 4.4111 4.4117 4.5879 4.5897 8.6833 8.6843 11.3778 11.3843 12.4063 12.4882 12.7339 12.8474 12.9712 12.9804 13.8926 13.9907 k = 0.0818 0.0994-0.0193 ( 14097 PWs) bands (ev): -37.8012 -37.8012 -15.8088 -15.8086 -14.2404 -14.2402 -13.3507 -13.3444 -12.7351 -12.7250 -12.6588 -12.6559 -12.6475 -12.6450 -12.3499 -12.3445 -5.0670 -5.0648 -4.1331 -4.1294 -1.1637 -1.1292 -0.9801 -0.9645 -0.3578 -0.3320 -0.1052 -0.0770 0.0751 0.1124 0.5436 0.5567 1.4214 1.4366 1.8102 1.8126 2.1654 2.1739 2.2500 2.2541 2.5314 2.5352 2.9069 2.9092 3.5173 3.5255 3.6746 3.6875 3.8018 3.8053 3.8844 3.8876 4.2990 4.3006 4.4110 4.4119 4.5758 4.5778 8.7281 8.7293 11.3562 11.3632 12.3752 12.4533 12.7450 12.8643 12.9577 12.9697 13.8845 13.9841 k = 0.0920 0.1119-0.0218 ( 14099 PWs) bands (ev): -37.8012 -37.8012 -15.7981 -15.7980 -14.2751 -14.2750 -13.3277 -13.3208 -12.7358 -12.7260 -12.6585 -12.6526 -12.6483 -12.6432 -12.3499 -12.3440 -5.1017 -5.0993 -4.0858 -4.0818 -1.1732 -1.1395 -0.9792 -0.9648 -0.3791 -0.3513 -0.0999 -0.0700 0.0738 0.1134 0.5567 0.5703 1.4318 1.4474 1.7955 1.7985 2.1776 2.1855 2.2451 2.2489 2.5595 2.5637 2.8942 2.8965 3.5123 3.5208 3.6617 3.6744 3.7763 3.7813 3.9056 3.9078 4.2942 4.2962 4.4114 4.4125 4.5630 4.5652 8.7776 8.7789 11.3321 11.3394 12.3439 12.4175 12.7535 12.8761 12.9483 12.9645 13.8733 13.9734 k = 0.1022 0.1243-0.0242 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.7864 -15.7862 -14.3108 -14.3106 -13.3053 -13.2979 -12.7362 -12.7268 -12.6593 -12.6506 -12.6475 -12.6409 -12.3500 -12.3433 -5.1356 -5.1331 -4.0376 -4.0334 -1.1831 -1.1509 -0.9794 -0.9652 -0.4020 -0.3722 -0.0928 -0.0617 0.0724 0.1138 0.5706 0.5844 1.4425 1.4581 1.7824 1.7860 2.1884 2.1940 2.2414 2.2462 2.5892 2.5937 2.8823 2.8845 3.5066 3.5153 3.6435 3.6557 3.7527 3.7590 3.9271 3.9285 4.2886 4.2910 4.4122 4.4137 4.5494 4.5519 8.8313 8.8327 11.3056 11.3130 12.3127 12.3815 12.7590 12.8780 12.9490 12.9643 13.8588 13.9594 k = 0.1124 0.1367-0.0266 ( 14092 PWs) bands (ev): -37.8012 -37.8012 -15.7736 -15.7734 -14.3470 -14.3467 -13.2839 -13.2761 -12.7360 -12.7272 -12.6608 -12.6522 -12.6431 -12.6378 -12.3499 -12.3426 -5.1684 -5.1657 -3.9888 -3.9843 -1.1935 -1.1634 -0.9808 -0.9654 -0.4263 -0.3946 -0.0839 -0.0521 0.0709 0.1134 0.5851 0.5988 1.4532 1.4684 1.7713 1.7755 2.1918 2.1940 2.2442 2.2522 2.6195 2.6243 2.8715 2.8737 3.5000 3.5086 3.6196 3.6311 3.7325 3.7398 3.9483 3.9489 4.2821 4.2848 4.4137 4.4156 4.5354 4.5382 8.8890 8.8904 11.2767 11.2840 12.2824 12.3459 12.7616 12.8702 12.9599 12.9690 13.8413 13.9423 k = 0.1226 0.1492-0.0290 ( 14098 PWs) bands (ev): -37.8012 -37.8012 -15.7597 -15.7595 -14.3833 -14.3830 -13.2639 -13.2556 -12.7353 -12.7273 -12.6630 -12.6547 -12.6379 -12.6342 -12.3498 -12.3419 -5.1997 -5.1970 -3.9398 -3.9351 -1.2044 -1.1772 -0.9832 -0.9652 -0.4519 -0.4183 -0.0732 -0.0411 0.0694 0.1122 0.6002 0.6136 1.4636 1.4781 1.7626 1.7675 2.1845 2.1868 2.2563 2.2668 2.6497 2.6546 2.8620 2.8641 3.4921 3.5004 3.5912 3.6020 3.7161 3.7236 3.9686 3.9687 4.2746 4.2778 4.4156 4.4180 4.5211 4.5243 8.9501 8.9516 11.2454 11.2525 12.2533 12.3114 12.7618 12.8580 12.9739 12.9798 13.8210 13.9225 k = 0.1328 0.1616-0.0314 ( 14084 PWs) bands (ev): -37.8012 -37.8012 -15.7449 -15.7447 -14.4196 -14.4191 -13.2455 -13.2369 -12.7343 -12.7269 -12.6659 -12.6578 -12.6324 -12.6298 -12.3496 -12.3410 -5.2295 -5.2266 -3.8908 -3.8857 -1.2161 -1.1924 -0.9862 -0.9645 -0.4786 -0.4430 -0.0609 -0.0292 0.0679 0.1102 0.6156 0.6285 1.4736 1.4872 1.7565 1.7622 2.1718 2.1750 2.2741 2.2857 2.6789 2.6839 2.8542 2.8562 3.4818 3.4895 3.5610 3.5714 3.7026 3.7099 3.9870 3.9879 4.2663 4.2699 4.4178 4.4209 4.5066 4.5103 9.0143 9.0159 11.2118 11.2186 12.2260 12.2786 12.7603 12.8448 12.9863 12.9972 13.7981 13.9004 k = 0.1431 0.1740-0.0338 ( 14091 PWs) bands (ev): -37.8012 -37.8012 -15.7292 -15.7290 -14.4554 -14.4549 -13.2289 -13.2200 -12.7330 -12.7262 -12.6694 -12.6615 -12.6268 -12.6245 -12.3493 -12.3401 -5.2573 -5.2543 -3.8418 -3.8365 -1.2289 -1.2092 -0.9892 -0.9635 -0.5061 -0.4685 -0.0471 -0.0167 0.0667 0.1073 0.6313 0.6435 1.4830 1.4955 1.7534 1.7596 2.1572 2.1608 2.2941 2.3062 2.7063 2.7112 2.8484 2.8502 3.4673 3.4736 3.5333 3.5433 3.6911 3.6977 4.0036 4.0053 4.2571 4.2612 4.4198 4.4240 4.4925 4.4969 9.0812 9.0828 11.1759 11.1824 12.2010 12.2480 12.7575 12.8318 12.9997 13.0165 13.7731 13.8760 k = 0.1533 0.1864-0.0363 ( 14091 PWs) bands (ev): -37.8012 -37.8012 -15.7128 -15.7126 -14.4907 -14.4900 -13.2141 -13.2052 -12.7320 -12.7249 -12.6737 -12.6657 -12.6211 -12.6181 -12.3489 -12.3391 -5.2831 -5.2801 -3.7932 -3.7877 -1.2430 -1.2277 -0.9918 -0.9619 -0.5343 -0.4947 -0.0320 -0.0045 0.0665 0.1037 0.6472 0.6585 1.4918 1.5032 1.7532 1.7597 2.1417 2.1457 2.3147 2.3271 2.7310 2.7355 2.8449 2.8466 3.4466 3.4508 3.5121 3.5212 3.6811 3.6867 4.0182 4.0208 4.2471 4.2518 4.4208 4.4263 4.4794 4.4846 9.1504 9.1521 11.1378 11.1439 12.1786 12.2202 12.7542 12.8197 13.0143 13.0359 13.7463 13.8499 k = 0.1635 0.1989-0.0387 ( 14101 PWs) bands (ev): -37.8012 -37.8012 -15.6956 -15.6954 -14.5251 -14.5243 -13.2014 -13.1923 -12.7315 -12.7232 -12.6785 -12.6700 -12.6150 -12.6110 -12.3484 -12.3380 -5.3068 -5.3036 -3.7450 -3.7393 -1.2585 -1.2481 -0.9936 -0.9596 -0.5629 -0.5213 -0.0161 0.0057 0.0686 0.0995 0.6632 0.6734 1.5001 1.5106 1.7557 1.7623 2.1260 2.1304 2.3347 2.3473 2.7516 2.7555 2.8443 2.8461 3.4208 3.4232 3.4975 3.5052 3.6722 3.6766 4.0303 4.0340 4.2366 4.2420 4.4194 4.4262 4.4690 4.4750 9.2217 9.2234 11.0976 11.1035 12.1591 12.1953 12.7507 12.8085 13.0296 13.0550 13.7181 13.8223 k = 0.1737 0.2113-0.0411 ( 14103 PWs) bands (ev): -37.8012 -37.8012 -15.6779 -15.6777 -14.5584 -14.5576 -13.1907 -13.1816 -12.7322 -12.7215 -12.6838 -12.6741 -12.6085 -12.6034 -12.3478 -12.3368 -5.3281 -5.3248 -3.6974 -3.6914 -1.2757 -1.2701 -0.9943 -0.9566 -0.5918 -0.5483 0.0003 0.0122 0.0746 0.0948 0.6792 0.6883 1.5082 1.5179 1.7606 1.7672 2.1104 2.1151 2.3529 2.3658 2.7672 2.7702 2.8472 2.8493 3.3939 3.3951 3.4865 3.4928 3.6645 3.6674 4.0396 4.0444 4.2257 4.2319 4.4139 4.4210 4.4640 4.4697 9.2946 9.2962 11.0554 11.0612 12.1428 12.1737 12.7473 12.7985 13.0449 13.0735 13.6889 13.7937 k = 0.1839 0.2237-0.0435 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.6598 -15.6596 -14.5905 -14.5895 -13.1818 -13.1728 -12.7345 -12.7206 -12.6891 -12.6774 -12.6014 -12.5954 -12.3470 -12.3355 -5.3469 -5.3436 -3.6506 -3.6443 -1.2955 -1.2931 -0.9937 -0.9527 -0.6207 -0.5754 0.0137 0.0168 0.0853 0.0903 0.6952 0.7030 1.5164 1.5255 1.7677 1.7739 2.0953 2.1003 2.3682 2.3812 2.7775 2.7797 2.8535 2.8561 3.3693 3.3698 3.4771 3.4821 3.6581 3.6595 4.0457 4.0518 4.2147 4.2218 4.4038 4.4103 4.4647 4.4691 9.3688 9.3704 11.0114 11.0175 12.1296 12.1554 12.7442 12.7895 13.0599 13.0911 13.6593 13.7645 k = 0.1942 0.2362-0.0459 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.6414 -15.6413 -14.6210 -14.6200 -13.1748 -13.1658 -12.7388 -12.7221 -12.6930 -12.6795 -12.5939 -12.5870 -12.3461 -12.3340 -5.3633 -5.3599 -3.6045 -3.5981 -1.3205 -1.3145 -0.9918 -0.9479 -0.6495 -0.6025 0.0119 0.0311 0.0873 0.0995 0.7111 0.7175 1.5250 1.5337 1.7766 1.7820 2.0808 2.0861 2.3790 2.3922 2.7840 2.7858 2.8620 2.8651 3.3489 3.3492 3.4685 3.4722 3.6530 3.6531 4.0484 4.0559 4.2039 4.2120 4.3906 4.3965 4.4686 4.4716 9.4440 9.4456 10.9659 10.9725 12.1196 12.1406 12.7414 12.7816 13.0742 13.1075 13.6296 13.7351 k = 0.2044 0.2486-0.0483 ( 14096 PWs) bands (ev): -37.8012 -37.8012 -15.6230 -15.6228 -14.6497 -14.6486 -13.1695 -13.1607 -12.7454 -12.7275 -12.6942 -12.6802 -12.5860 -12.5785 -12.3450 -12.3324 -5.3770 -5.3735 -3.5595 -3.5528 -1.3479 -1.3368 -0.9887 -0.9422 -0.6779 -0.6293 0.0074 0.0408 0.0886 0.1159 0.7268 0.7318 1.5344 1.5429 1.7868 1.7914 2.0670 2.0726 2.3840 2.3974 2.7889 2.7908 2.8715 2.8747 3.3336 3.3342 3.4602 3.4626 3.6481 3.6498 4.0475 4.0562 4.1935 4.2027 4.3756 4.3811 4.4740 4.4759 9.5199 9.5215 10.9192 10.9265 12.1127 12.1291 12.7390 12.7746 13.0875 13.1225 13.6003 13.7061 k = 0.2146 0.2610-0.0508 ( 14103 PWs) bands (ev): -37.8012 -37.8012 -15.6046 -15.6045 -14.6764 -14.6753 -13.1657 -13.1571 -12.7544 -12.7368 -12.6928 -12.6797 -12.5778 -12.5698 -12.3436 -12.3307 -5.3881 -5.3846 -3.5155 -3.5087 -1.3768 -1.3606 -0.9844 -0.9357 -0.7057 -0.6559 0.0013 0.0428 0.0971 0.1332 0.7423 0.7459 1.5447 1.5532 1.7981 1.8017 2.0541 2.0599 2.3817 2.3951 2.7946 2.7968 2.8811 2.8843 3.3233 3.3245 3.4520 3.4535 3.6453 3.6483 4.0427 4.0526 4.1838 4.1940 4.3597 4.3651 4.4801 4.4812 9.5962 9.5978 10.8716 10.8798 12.1088 12.1209 12.7369 12.7686 13.0994 13.1357 13.5720 13.6779 k = 0.2248 0.2735-0.0532 ( 14103 PWs) bands (ev): -37.8012 -37.8012 -15.5867 -15.5865 -14.7009 -14.6997 -13.1633 -13.1550 -12.7656 -12.7488 -12.6900 -12.6782 -12.5695 -12.5612 -12.3421 -12.3287 -5.3966 -5.3929 -3.4727 -3.4657 -1.4070 -1.3859 -0.9791 -0.9286 -0.7326 -0.6819 -0.0056 0.0389 0.1109 0.1508 0.7573 0.7598 1.5561 1.5646 1.8101 1.8126 2.0421 2.0481 2.3712 2.3847 2.8027 2.8052 2.8909 2.8939 3.3175 3.3191 3.4439 3.4452 3.6445 3.6488 4.0344 4.0450 4.1748 4.1858 4.3433 4.3488 4.4866 4.4870 9.6727 9.6743 10.8236 10.8326 12.1074 12.1159 12.7351 12.7635 13.1097 13.1470 13.5451 13.6509 k = 0.2350 0.2859-0.0556 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.5693 -15.5692 -14.7227 -14.7216 -13.1622 -13.1541 -12.7787 -12.7629 -12.6866 -12.6759 -12.5611 -12.5527 -12.3404 -12.3267 -5.4023 -5.3986 -3.4312 -3.4242 -1.4383 -1.4126 -0.9732 -0.9212 -0.7582 -0.7071 -0.0132 0.0322 0.1269 0.1683 0.7714 0.7739 1.5685 1.5773 1.8226 1.8239 2.0313 2.0374 2.3526 2.3659 2.8141 2.8168 2.9010 2.9038 3.3146 3.3166 3.4363 3.4380 3.6461 3.6513 4.0226 4.0339 4.1663 4.1777 4.3268 4.3323 4.4930 4.4931 9.7491 9.7506 10.7753 10.7852 12.1080 12.1142 12.7336 12.7590 13.1182 13.1562 13.5201 13.6256 k = 0.2453 0.2983-0.0580 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.5529 -15.5528 -14.7418 -14.7405 -13.1622 -13.1543 -12.7935 -12.7787 -12.6830 -12.6732 -12.5529 -12.5445 -12.3384 -12.3245 -5.4053 -5.4015 -3.3912 -3.3841 -1.4706 -1.4403 -0.9672 -0.9141 -0.7818 -0.7313 -0.0210 0.0242 0.1434 0.1854 0.7847 0.7880 1.5820 1.5910 1.8352 1.8355 2.0218 2.0279 2.3267 2.3398 2.8290 2.8317 2.9118 2.9144 3.3133 3.3155 3.4298 3.4320 3.6500 3.6559 4.0080 4.0195 4.1579 4.1697 4.3103 4.3159 4.4992 4.4997 9.8251 9.8266 10.7271 10.7379 12.1099 12.1162 12.7321 12.7552 13.1248 13.1630 13.4973 13.6023 k = 0.2555 0.3107-0.0604 ( 14098 PWs) bands (ev): -37.8012 -37.8012 -15.5376 -15.5376 -14.7576 -14.7564 -13.1632 -13.1556 -12.8101 -12.7961 -12.6792 -12.6701 -12.5449 -12.5366 -12.3362 -12.3221 -5.4056 -5.4018 -3.3528 -3.3457 -1.5034 -1.4690 -0.9617 -0.9083 -0.8022 -0.7539 -0.0288 0.0157 0.1598 0.2019 0.7971 0.8019 1.5963 1.6056 1.8468 1.8477 2.0138 2.0197 2.2950 2.3078 2.8468 2.8495 2.9235 2.9259 3.3120 3.3142 3.4252 3.4275 3.6560 3.6623 3.9907 4.0024 4.1494 4.1613 4.2939 4.2996 4.5053 4.5061 9.9005 9.9019 10.6794 10.6910 12.1130 12.1213 12.7305 12.7518 13.1295 13.1674 13.4770 13.5811 k = 0.2657 0.3232-0.0628 ( 14099 PWs) bands (ev): -37.8012 -37.8012 -15.5239 -15.5239 -14.7701 -14.7688 -13.1649 -13.1576 -12.8282 -12.8150 -12.6754 -12.6667 -12.5372 -12.5292 -12.3337 -12.3195 -5.4033 -5.3994 -3.3161 -3.3090 -1.5367 -1.4983 -0.9578 -0.9055 -0.8174 -0.7744 -0.0365 0.0072 0.1757 0.2175 0.8089 0.8152 1.6111 1.6207 1.8573 1.8592 2.0079 2.0134 2.2593 2.2719 2.8669 2.8695 2.9362 2.9385 3.3098 3.3118 3.4227 3.4249 3.6639 3.6703 3.9713 3.9830 4.1405 4.1525 4.2777 4.2835 4.5113 4.5125 9.9750 9.9764 10.6323 10.6447 12.1176 12.1287 12.7288 12.7488 13.1325 13.1695 13.4591 13.5621 k = 0.2759 0.3356-0.0653 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.5120 -15.5119 -14.7788 -14.7775 -13.1674 -13.1604 -12.8478 -12.8353 -12.6716 -12.6632 -12.5301 -12.5223 -12.3310 -12.3169 -5.3984 -5.3945 -3.2814 -3.2743 -1.5701 -1.5280 -0.9573 -0.9077 -0.8250 -0.7917 -0.0438 -0.0012 0.1908 0.2323 0.8199 0.8278 1.6260 1.6360 1.8661 1.8687 2.0044 2.0094 2.2220 2.2344 2.8886 2.8912 2.9500 2.9520 3.3062 3.3077 3.4222 3.4241 3.6733 3.6796 3.9501 3.9617 4.1313 4.1432 4.2618 4.2675 4.5173 4.5187 10.0484 10.0498 10.5862 10.5992 12.1238 12.1377 12.7268 12.7461 13.1340 13.1697 13.4435 13.5452 k = 0.2861 0.3480-0.0677 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.5021 -15.5020 -14.7836 -14.7824 -13.1706 -13.1638 -12.8687 -12.8569 -12.6678 -12.6596 -12.5234 -12.5160 -12.3281 -12.3140 -5.3909 -5.3870 -3.2488 -3.2418 -1.6033 -1.5578 -0.9618 -0.9152 -0.8245 -0.8045 -0.0506 -0.0092 0.2051 0.2460 0.8299 0.8394 1.6406 1.6508 1.8719 1.8752 2.0036 2.0080 2.1857 2.1978 2.9111 2.9138 2.9647 2.9665 3.3012 3.3023 3.4232 3.4249 3.6836 3.6896 3.9273 3.9388 4.1217 4.1334 4.2461 4.2517 4.5230 4.5247 10.1204 10.1218 10.5412 10.5547 12.1314 12.1479 12.7245 12.7436 13.1343 13.1683 13.4298 13.5301 k = 0.2964 0.3605-0.0701 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.4943 -15.4942 -14.7844 -14.7832 -13.1742 -13.1678 -12.8909 -12.8798 -12.6641 -12.6560 -12.5173 -12.5104 -12.3250 -12.3111 -5.3811 -5.3771 -3.2185 -3.2116 -1.6360 -1.5874 -0.9723 -0.9262 -0.8182 -0.8115 -0.0567 -0.0167 0.2186 0.2589 0.8389 0.8500 1.6541 1.6646 1.8736 1.8773 2.0044 2.0085 2.1542 2.1657 2.9339 2.9366 2.9804 2.9820 3.2954 3.2959 3.4251 3.4270 3.6942 3.6998 3.9032 3.9145 4.1120 4.1236 4.2306 4.2361 4.5287 4.5304 10.1907 10.1922 10.4975 10.5115 12.1403 12.1592 12.7217 12.7412 13.1341 13.1659 13.4176 13.5164 k = 0.3066 0.3729-0.0725 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.4889 -15.4886 -14.7812 -14.7800 -13.1784 -13.1722 -12.9143 -12.9038 -12.6604 -12.6523 -12.5119 -12.5054 -12.3217 -12.3081 -5.3689 -5.3649 -3.1906 -3.1839 -1.6679 -1.6164 -0.9875 -0.9399 -0.8125 -0.8087 -0.0621 -0.0235 0.2311 0.2708 0.8467 0.8593 1.6657 1.6766 1.8709 1.8748 2.0030 2.0076 2.1334 2.1433 2.9562 2.9592 2.9971 2.9982 3.2890 3.2894 3.4272 3.4297 3.7045 3.7097 3.8779 3.8891 4.1026 4.1138 4.2153 4.2206 4.5341 4.5360 10.2589 10.2606 10.4557 10.4698 12.1502 12.1710 12.7186 12.7389 13.1336 13.1629 13.4063 13.5036 k = 0.3168 0.3853-0.0749 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.4856 -15.4853 -14.7740 -14.7728 -13.1830 -13.1771 -12.9388 -12.9289 -12.6568 -12.6487 -12.5071 -12.5011 -12.3182 -12.3050 -5.3546 -5.3506 -3.1655 -3.1589 -1.6986 -1.6444 -1.0056 -0.9559 -0.8084 -0.7975 -0.0668 -0.0297 0.2429 0.2818 0.8529 0.8670 1.6743 1.6854 1.8644 1.8683 1.9947 2.0009 2.1290 2.1366 2.9776 2.9808 3.0146 3.0153 3.2828 3.2836 3.4293 3.4325 3.7139 3.7184 3.8518 3.8629 4.0937 4.1046 4.2001 4.2053 4.5393 4.5414 10.3236 10.3262 10.4169 10.4304 12.1609 12.1833 12.7152 12.7369 13.1332 13.1598 13.3955 13.4911 k = 0.3270 0.3978-0.0773 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.4844 -15.4841 -14.7631 -14.7618 -13.1880 -13.1824 -12.9641 -12.9547 -12.6532 -12.6450 -12.5030 -12.4973 -12.3147 -12.3018 -5.3383 -5.3343 -3.1433 -3.1369 -1.7278 -1.6712 -1.0250 -0.9737 -0.8009 -0.7853 -0.0706 -0.0352 0.2540 0.2921 0.8574 0.8730 1.6784 1.6894 1.8557 1.8595 1.9801 1.9881 2.1406 2.1464 2.9975 3.0010 3.0328 3.0330 3.2775 3.2788 3.4309 3.4350 3.7216 3.7254 3.8252 3.8360 4.0857 4.0961 4.1853 4.1902 4.5443 4.5465 10.3615 10.3747 10.4041 10.4075 12.1722 12.1958 12.7117 12.7353 13.1330 13.1569 13.3849 13.4786 k = 0.3372 0.4102-0.0798 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.4851 -15.4848 -14.7487 -14.7474 -13.1936 -13.1881 -12.9900 -12.9813 -12.6497 -12.6414 -12.4995 -12.4943 -12.3110 -12.2986 -5.3201 -5.3161 -3.1242 -3.1179 -1.7550 -1.6964 -1.0451 -0.9924 -0.7910 -0.7724 -0.0736 -0.0401 0.2645 0.3018 0.8599 0.8769 1.6760 1.6865 1.8476 1.8512 1.9640 1.9730 2.1633 2.1685 3.0157 3.0195 3.0512 3.0515 3.2738 3.2756 3.4318 3.4367 3.7269 3.7296 3.7986 3.8089 4.0790 4.0887 4.1707 4.1754 4.5491 4.5513 10.3326 10.3485 10.4576 10.4584 12.1841 12.2083 12.7081 12.7344 13.1328 13.1545 13.3743 13.4656 k = 0.3475 0.4226-0.0822 ( 14096 PWs) bands (ev): -37.8012 -37.8012 -15.4875 -15.4872 -14.7312 -14.7299 -13.1996 -13.1943 -13.0164 -13.0081 -12.6463 -12.6379 -12.4966 -12.4917 -12.3072 -12.2954 -5.3002 -5.2962 -3.1085 -3.1024 -1.7801 -1.7196 -1.0654 -1.0117 -0.7796 -0.7592 -0.0761 -0.0444 0.2747 0.3110 0.8601 0.8785 1.6661 1.6754 1.8428 1.8460 1.9497 1.9589 2.1930 2.1983 3.0319 3.0362 3.0694 3.0703 3.2721 3.2744 3.4317 3.4374 3.7281 3.7293 3.7740 3.7830 4.0737 4.0826 4.1566 4.1611 4.5536 4.5559 10.2979 10.3136 10.5161 10.5170 12.1962 12.2204 12.7048 12.7343 13.1321 13.1530 13.3639 13.4518 k = 0.3577 0.4350-0.0846 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.4912 -15.4909 -14.7110 -14.7097 -13.2064 -13.2012 -13.0429 -13.0350 -12.6430 -12.6344 -12.4943 -12.4898 -12.3035 -12.2921 -5.2788 -5.2749 -3.0962 -3.0903 -1.8026 -1.7404 -1.0857 -1.0312 -0.7673 -0.7458 -0.0780 -0.0484 0.2847 0.3201 0.8578 0.8775 1.6488 1.6565 1.8425 1.8452 1.9380 1.9470 2.2275 2.2330 3.0462 3.0509 3.0872 3.0886 3.2729 3.2757 3.4302 3.4368 3.7183 3.7228 3.7565 3.7620 4.0700 4.0777 4.1431 4.1473 4.5579 4.5603 10.2642 10.2796 10.5725 10.5736 12.2084 12.2322 12.7020 12.7354 13.1301 13.1525 13.3539 13.4372 k = 0.3679 0.4475-0.0870 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.4960 -15.4956 -14.6886 -14.6873 -13.2141 -13.2088 -13.0690 -13.0615 -12.6397 -12.6311 -12.4926 -12.4883 -12.2997 -12.2890 -5.2562 -5.2524 -3.0876 -3.0818 -1.8221 -1.7587 -1.1058 -1.0506 -0.7544 -0.7322 -0.0796 -0.0522 0.2948 0.3291 0.8527 0.8736 1.6262 1.6323 1.8461 1.8483 1.9290 1.9375 2.2653 2.2711 3.0585 3.0637 3.1044 3.1062 3.2764 3.2798 3.4273 3.4347 3.6963 3.7046 3.7479 3.7505 4.0677 4.0739 4.1305 4.1344 4.5620 4.5643 10.2321 10.2471 10.6263 10.6274 12.2205 12.2434 12.7000 12.7380 13.1260 13.1530 13.3446 13.4218 k = 0.3781 0.4599-0.0894 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.5015 -15.5011 -14.6644 -14.6632 -13.2230 -13.2177 -13.0941 -13.0869 -12.6365 -12.6279 -12.4914 -12.4874 -12.2960 -12.2858 -5.2326 -5.2289 -3.0826 -3.0770 -1.8385 -1.7741 -1.1256 -1.0698 -0.7411 -0.7185 -0.0811 -0.0561 0.3052 0.3384 0.8448 0.8668 1.6007 1.6054 1.8518 1.8540 1.9226 1.9304 2.3057 2.3118 3.0689 3.0746 3.1207 3.1227 3.2827 3.2865 3.4225 3.4308 3.6694 3.6789 3.7425 3.7440 4.0665 4.0709 4.1191 4.1229 4.5657 4.5680 10.2016 10.2163 10.6772 10.6782 12.2324 12.2539 12.6992 12.7423 13.1192 13.1539 13.3367 13.4059 k = 0.3883 0.4723-0.0918 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.5075 -15.5071 -14.6390 -14.6378 -13.2337 -13.2282 -13.1175 -13.1105 -12.6335 -12.6249 -12.4906 -12.4868 -12.2923 -12.2828 -5.2083 -5.2046 -3.0813 -3.0760 -1.8516 -1.7865 -1.1451 -1.0888 -0.7274 -0.7047 -0.0828 -0.0602 0.3161 0.3481 0.8339 0.8569 1.5742 1.5778 1.8582 1.8605 1.9189 1.9257 2.3479 2.3542 3.0777 3.0839 3.1359 3.1381 3.2916 3.2955 3.4157 3.4250 3.6411 3.6510 3.7372 3.7379 4.0661 4.0682 4.1090 4.1132 4.5691 4.5714 10.1730 10.1872 10.7248 10.7258 12.2438 12.2636 12.6998 12.7485 13.1096 13.1543 13.3306 13.3898 k = 0.3985 0.4848-0.0943 ( 14107 PWs) bands (ev): -37.8012 -37.8012 -15.5137 -15.5133 -14.6128 -14.6116 -13.2466 -13.2411 -13.1382 -13.1315 -12.6306 -12.6221 -12.4901 -12.4866 -12.2887 -12.2798 -5.1834 -5.1799 -3.0835 -3.0785 -1.8612 -1.7957 -1.1642 -1.1074 -0.7135 -0.6907 -0.0851 -0.0648 0.3276 0.3584 0.8200 0.8439 1.5482 1.5511 1.8641 1.8666 1.9183 1.9239 2.3914 2.3979 3.0853 3.0918 3.1500 3.1523 3.3024 3.3064 3.4068 3.4171 3.6129 3.6228 3.7308 3.7311 4.0648 4.0658 4.1009 4.1062 4.5721 4.5745 10.1461 10.1597 10.7691 10.7701 12.2545 12.2723 12.7021 12.7565 13.0972 13.1532 13.3266 13.3744 k = 0.4088 0.4972-0.0967 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.5199 -15.5196 -14.5863 -14.5851 -13.2620 -13.2566 -13.1556 -13.1492 -12.6280 -12.6195 -12.4900 -12.4868 -12.2852 -12.2770 -5.1583 -5.1550 -3.0891 -3.0846 -1.8673 -1.8018 -1.1828 -1.1256 -0.6993 -0.6766 -0.0880 -0.0702 0.3400 0.3695 0.8032 0.8279 1.5234 1.5261 1.8684 1.8710 1.9211 1.9254 2.4357 2.4422 3.0921 3.0989 3.1627 3.1652 3.3144 3.3185 3.3956 3.4071 3.5854 3.5952 3.7232 3.7240 4.0608 4.0640 4.0958 4.1021 4.5748 4.5771 10.1211 10.1340 10.8100 10.8110 12.2642 12.2800 12.7064 12.7663 13.0823 13.1498 13.3248 13.3603 k = 0.4190 0.5096-0.0991 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5260 -15.5257 -14.5600 -14.5587 -13.2797 -13.2747 -13.1695 -13.1635 -12.6255 -12.6171 -12.4902 -12.4873 -12.2819 -12.2743 -5.1333 -5.1302 -3.0979 -3.0938 -1.8700 -1.8047 -1.2010 -1.1433 -0.6849 -0.6623 -0.0919 -0.0764 0.3531 0.3814 0.7840 0.8091 1.5005 1.5032 1.8708 1.8735 1.9270 1.9300 2.4803 2.4869 3.0987 3.1057 3.1739 3.1765 3.3269 3.3308 3.3822 3.3953 3.5594 3.5689 3.7151 3.7164 4.0559 4.0603 4.0942 4.1008 4.5769 4.5792 10.0979 10.1101 10.8474 10.8483 12.2726 12.2866 12.7130 12.7775 13.0655 13.1430 13.3249 13.3484 k = 0.4190 0.5096-0.0991 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5260 -15.5257 -14.5600 -14.5587 -13.2797 -13.2747 -13.1695 -13.1635 -12.6255 -12.6171 -12.4902 -12.4873 -12.2819 -12.2743 -5.1333 -5.1302 -3.0979 -3.0938 -1.8700 -1.8047 -1.2010 -1.1433 -0.6849 -0.6623 -0.0919 -0.0764 0.3531 0.3814 0.7840 0.8091 1.5005 1.5032 1.8708 1.8735 1.9270 1.9300 2.4803 2.4869 3.0987 3.1057 3.1739 3.1765 3.3269 3.3308 3.3822 3.3953 3.5594 3.5689 3.7151 3.7164 4.0559 4.0603 4.0942 4.1008 4.5769 4.5792 10.0979 10.1101 10.8474 10.8483 12.2726 12.2866 12.7130 12.7775 13.0655 13.1430 13.3249 13.3484 k = 0.4215 0.5127-0.0832 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.5242 -15.5239 -14.5564 -14.5552 -13.2807 -13.2757 -13.1669 -13.1598 -12.6281 -12.6187 -12.4936 -12.4909 -12.2879 -12.2800 -5.1395 -5.1363 -3.0684 -3.0645 -1.9153 -1.8509 -1.1641 -1.1054 -0.7248 -0.7000 -0.0579 -0.0411 0.3562 0.3840 0.7820 0.8082 1.4983 1.5020 1.8714 1.8736 1.9394 1.9422 2.4767 2.4826 3.0810 3.0874 3.1709 3.1732 3.3267 3.3306 3.3865 3.3981 3.5563 3.5652 3.7227 3.7245 4.0630 4.0678 4.0914 4.0981 4.5785 4.5811 10.0918 10.1042 10.8592 10.8602 12.2845 12.2969 12.7278 12.7927 13.0529 13.1314 13.3312 13.3483 k = 0.4241 0.5158-0.0673 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.5221 -15.5218 -14.5522 -14.5510 -13.2815 -13.2763 -13.1642 -13.1561 -12.6317 -12.6213 -12.4978 -12.4951 -12.2945 -12.2863 -5.1437 -5.1405 -3.0400 -3.0363 -1.9596 -1.8962 -1.1264 -1.0669 -0.7637 -0.7368 -0.0251 -0.0071 0.3573 0.3847 0.7781 0.8052 1.4956 1.5004 1.8735 1.8753 1.9535 1.9560 2.4735 2.4788 3.0630 3.0688 3.1681 3.1702 3.3244 3.3285 3.3923 3.4022 3.5515 3.5598 3.7332 3.7353 4.0682 4.0725 4.0943 4.0996 4.5789 4.5818 10.0834 10.0959 10.8728 10.8742 12.2955 12.3071 12.7436 12.8080 13.0430 13.1219 13.3380 13.3487 k = 0.4266 0.5189-0.0514 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.5196 -15.5193 -14.5474 -14.5461 -13.2819 -13.2768 -13.1615 -13.1522 -12.6361 -12.6247 -12.5028 -12.5000 -12.3017 -12.2932 -5.1460 -5.1428 -3.0130 -3.0095 -2.0028 -1.9406 -1.0881 -1.0280 -0.8013 -0.7722 0.0066 0.0255 0.3565 0.3834 0.7722 0.7999 1.4927 1.4985 1.8768 1.8785 1.9686 1.9712 2.4708 2.4751 3.0451 3.0503 3.1659 3.1678 3.3206 3.3248 3.3990 3.4074 3.5456 3.5533 3.7459 3.7484 4.0693 4.0729 4.1044 4.1072 4.5782 4.5814 10.0731 10.0857 10.8878 10.8895 12.3057 12.3175 12.7601 12.8231 13.0363 13.1145 13.3446 13.3499 k = 0.4292 0.5220-0.0354 ( 14127 PWs) bands (ev): -37.8012 -37.8012 -15.5168 -15.5164 -14.5419 -14.5406 -13.2821 -13.2770 -13.1586 -13.1483 -12.6414 -12.6289 -12.5085 -12.5056 -12.3094 -12.3006 -5.1463 -5.1430 -2.9877 -2.9843 -2.0448 -1.9840 -1.0492 -0.9891 -0.8371 -0.8057 0.0370 0.0566 0.3539 0.3802 0.7644 0.7924 1.4900 1.4968 1.8813 1.8830 1.9843 1.9871 2.4683 2.4716 3.0276 3.0322 3.1644 3.1661 3.3157 3.3199 3.4061 3.4132 3.5391 3.5462 3.7603 3.7630 4.0675 4.0713 4.1183 4.1200 4.5762 4.5797 10.0617 10.0742 10.9033 10.9054 12.3151 12.3279 12.7772 12.8374 13.0331 13.1094 13.3483 13.3542 k = 0.4317 0.5251-0.0195 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.5136 -15.5133 -14.5357 -14.5344 -13.2821 -13.2769 -13.1557 -13.1444 -12.6473 -12.6339 -12.5151 -12.5118 -12.3176 -12.3086 -5.1446 -5.1414 -2.9642 -2.9611 -2.0855 -2.0262 -1.0102 -0.9516 -0.8696 -0.8361 0.0660 0.0861 0.3496 0.3751 0.7549 0.7829 1.4879 1.4953 1.8866 1.8886 1.9996 2.0031 2.4662 2.4683 3.0107 3.0150 3.1637 3.1653 3.3099 3.3142 3.4134 3.4194 3.5327 3.5393 3.7758 3.7788 4.0649 4.0689 4.1341 4.1359 4.5732 4.5770 10.0495 10.0619 10.9188 10.9212 12.3241 12.3382 12.7944 12.8504 13.0337 13.1069 13.3494 13.3611 k = 0.4343 0.5282-0.0036 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.5102 -15.5098 -14.5290 -14.5277 -13.2817 -13.2766 -13.1529 -13.1405 -12.6538 -12.6395 -12.5223 -12.5187 -12.3263 -12.3170 -5.1411 -5.1378 -2.9428 -2.9399 -2.1249 -2.0673 -0.9733 -0.9255 -0.8916 -0.8584 0.0936 0.1138 0.3437 0.3683 0.7437 0.7714 1.4864 1.4944 1.8927 1.8951 2.0138 2.0182 2.4646 2.4653 2.9948 2.9990 3.1638 3.1654 3.3036 3.3079 3.4208 3.4257 3.5269 3.5330 3.7920 3.7952 4.0622 4.0664 4.1513 4.1534 4.5690 4.5730 10.0372 10.0494 10.9336 10.9363 12.3328 12.3483 12.8116 12.8618 13.0386 13.1070 13.3497 13.3682 k = 0.4368 0.5313 0.0123 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.5065 -15.5061 -14.5217 -14.5204 -13.2811 -13.2760 -13.1500 -13.1367 -12.6608 -12.6455 -12.5302 -12.5263 -12.3354 -12.3260 -5.1356 -5.1324 -2.9238 -2.9212 -2.1630 -2.1071 -0.9541 -0.9308 -0.8915 -0.8478 0.1198 0.1399 0.3363 0.3597 0.7313 0.7583 1.4857 1.4940 1.8994 1.9023 2.0260 2.0315 2.4630 2.4638 2.9801 2.9846 3.1649 3.1665 3.2969 3.3012 3.4280 3.4318 3.5225 3.5282 3.8084 3.8118 4.0596 4.0640 4.1694 4.1719 4.5637 4.5680 10.0251 10.0370 10.9472 10.9501 12.3412 12.3583 12.8282 12.8713 13.0476 13.1101 13.3496 13.3749 k = 0.4393 0.5344 0.0282 ( 14097 PWs) bands (ev): -37.8012 -37.8012 -15.5025 -15.5022 -14.5139 -14.5126 -13.2803 -13.2752 -13.1472 -13.1330 -12.6680 -12.6520 -12.5388 -12.5345 -12.3450 -12.3354 -5.1285 -5.1252 -2.9074 -2.9050 -2.1997 -2.1457 -0.9727 -0.9413 -0.8681 -0.8115 0.1445 0.1640 0.3275 0.3495 0.7178 0.7440 1.4858 1.4944 1.9065 1.9099 2.0352 2.0420 2.4620 2.4643 2.9668 2.9717 3.1668 3.1685 3.2900 3.2943 3.4345 3.4374 3.5200 3.5254 3.8246 3.8281 4.0574 4.0619 4.1880 4.1908 4.5573 4.5619 10.0136 10.0252 10.9591 10.9623 12.3495 12.3681 12.8439 12.8790 13.0606 13.1164 13.3489 13.3809 k = 0.4419 0.5375 0.0441 ( 14093 PWs) bands (ev): -37.8012 -37.8012 -15.4984 -15.4981 -14.5056 -14.5043 -13.2792 -13.2741 -13.1446 -13.1295 -12.6754 -12.6587 -12.5479 -12.5432 -12.3550 -12.3452 -5.1196 -5.1164 -2.8936 -2.8914 -2.2350 -2.1830 -0.9964 -0.9608 -0.8292 -0.7704 0.1680 0.1861 0.3178 0.3376 0.7037 0.7288 1.4867 1.4954 1.9137 1.9176 2.0406 2.0488 2.4627 2.4666 2.9550 2.9605 3.1695 3.1713 3.2833 3.2877 3.4400 3.4420 3.5203 3.5253 3.8401 3.8437 4.0557 4.0603 4.2068 4.2098 4.5500 4.5547 10.0031 10.0144 10.9688 10.9722 12.3579 12.3778 12.8582 12.8853 13.0769 13.1258 13.3474 13.3859 k = 0.4444 0.5406 0.0601 ( 14099 PWs) bands (ev): -37.8012 -37.8012 -15.4941 -15.4938 -14.4970 -14.4956 -13.2779 -13.2728 -13.1421 -13.1261 -12.6829 -12.6656 -12.5576 -12.5523 -12.3654 -12.3554 -5.1091 -5.1059 -2.8827 -2.8807 -2.2689 -2.2190 -1.0184 -0.9805 -0.7869 -0.7280 0.1903 0.2056 0.3079 0.3243 0.6892 0.7130 1.4884 1.4970 1.9204 1.9249 2.0419 2.0513 2.4658 2.4710 2.9448 2.9509 3.1728 3.1749 3.2771 3.2815 3.4441 3.4456 3.5237 3.5284 3.8545 3.8581 4.0548 4.0594 4.2253 4.2285 4.5417 4.5466 9.9939 10.0049 10.9760 10.9795 12.3662 12.3874 12.8709 12.8907 13.0959 13.1385 13.3451 13.3897 k = 0.4470 0.5437 0.0760 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.4896 -15.4893 -14.4879 -14.4866 -13.2763 -13.2713 -13.1399 -13.1231 -12.6904 -12.6725 -12.5676 -12.5619 -12.3762 -12.3660 -5.0972 -5.0940 -2.8746 -2.8728 -2.3014 -2.2536 -1.0378 -0.9982 -0.7434 -0.6850 0.2114 0.2210 0.2994 0.3095 0.6746 0.6970 1.4906 1.4991 1.9259 1.9308 2.0395 2.0499 2.4715 2.4776 2.9361 2.9427 3.1766 3.1789 3.2716 3.2763 3.4468 3.4484 3.5304 3.5348 3.8671 3.8706 4.0551 4.0596 4.2433 4.2467 4.5327 4.5376 9.9862 9.9969 10.9803 10.9840 12.3747 12.3968 12.8814 12.8960 13.1169 13.1542 13.3420 13.3922 k = 0.4495 0.5468 0.0919 ( 14109 PWs) bands (ev): -37.8012 -37.8012 -15.4851 -15.4848 -14.4786 -14.4772 -13.2746 -13.2695 -13.1380 -13.1204 -12.6976 -12.6794 -12.5779 -12.5716 -12.3873 -12.3769 -5.0839 -5.0808 -2.8693 -2.8677 -2.3325 -2.2870 -1.0544 -1.0136 -0.6994 -0.6419 0.2284 0.2321 0.2930 0.2967 0.6603 0.6812 1.4934 1.5017 1.9287 1.9338 2.0349 2.0457 2.4796 2.4864 2.9287 2.9357 3.1804 3.1831 3.2675 3.2724 3.4489 3.4507 3.5400 3.5442 3.8775 3.8807 4.0568 4.0612 4.2605 4.2640 4.5229 4.5279 9.9804 9.9907 10.9815 10.9853 12.3832 12.4062 12.8896 12.9015 13.1393 13.1726 13.3381 13.3934 k = 0.4521 0.5498 0.1078 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.4805 -15.4802 -14.4689 -14.4676 -13.2726 -13.2674 -13.1364 -13.1182 -12.7046 -12.6863 -12.5883 -12.5814 -12.3987 -12.3881 -5.0694 -5.0664 -2.8667 -2.8653 -2.3623 -2.3190 -1.0681 -1.0264 -0.6554 -0.5990 0.2260 0.2497 0.2778 0.3017 0.6464 0.6658 1.4966 1.5045 1.9264 1.9312 2.0308 2.0414 2.4898 2.4970 2.9223 2.9296 3.1840 3.1872 3.2650 3.2702 3.4510 3.4530 3.5522 3.5562 3.8849 3.8878 4.0603 4.0646 4.2766 4.2802 4.5127 4.5177 9.9766 9.9866 10.9793 10.9832 12.3919 12.4154 12.8957 12.9073 13.1624 13.1933 13.3336 13.3937 k = 0.4546 0.5529 0.1237 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.4759 -15.4756 -14.4592 -14.4579 -13.2704 -13.2652 -13.1352 -13.1165 -12.7113 -12.6930 -12.5986 -12.5911 -12.4105 -12.3997 -5.0540 -5.0510 -2.8668 -2.8655 -2.3907 -2.3496 -1.0789 -1.0367 -0.6116 -0.5565 0.2148 0.2510 0.2774 0.3141 0.6332 0.6510 1.5000 1.5076 1.9166 1.9203 2.0305 2.0398 2.5014 2.5087 2.9168 2.9242 3.1871 3.1906 3.2648 3.2701 3.4537 3.4559 3.5664 3.5702 3.8891 3.8917 4.0657 4.0700 4.2911 4.2949 4.5022 4.5070 9.9749 9.9846 10.9736 10.9777 12.4006 12.4245 12.9005 12.9129 13.1853 13.2157 13.3287 13.3937 k = 0.4572 0.5560 0.1396 ( 14123 PWs) bands (ev): -37.8012 -37.8012 -15.4713 -15.4710 -14.4493 -14.4480 -13.2681 -13.2627 -13.1345 -13.1153 -12.7176 -12.6995 -12.6087 -12.6004 -12.4225 -12.4114 -5.0376 -5.0347 -2.8693 -2.8681 -2.4176 -2.3789 -1.0870 -1.0445 -0.5685 -0.5149 0.1990 0.2336 0.2949 0.3299 0.6208 0.6369 1.5037 1.5108 1.8983 1.9009 2.0348 2.0427 2.5137 2.5208 2.9119 2.9193 3.1894 3.1933 3.2669 3.2722 3.4575 3.4597 3.5824 3.5861 3.8899 3.8922 4.0728 4.0772 4.3039 4.3080 4.4917 4.4962 9.9755 9.9848 10.9644 10.9686 12.4095 12.4335 12.9048 12.9180 13.2068 13.2396 13.3237 13.3943 k = 0.4597 0.5591 0.1555 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.4668 -15.4665 -14.4394 -14.4381 -13.2656 -13.2601 -13.1342 -13.1148 -12.7234 -12.7059 -12.6184 -12.6092 -12.4347 -12.4234 -5.0206 -5.0178 -2.8741 -2.8729 -2.4432 -2.4068 -1.0923 -1.0500 -0.5263 -0.4745 0.1810 0.2134 0.3146 0.3476 0.6092 0.6237 1.5074 1.5140 1.8723 1.8745 2.0430 2.0497 2.5259 2.5328 2.9074 2.9146 3.1911 3.1952 3.2712 3.2763 3.4626 3.4648 3.5999 3.6035 3.8873 3.8897 4.0813 4.0860 4.3145 4.3191 4.4815 4.4856 9.9785 9.9875 10.9517 10.9559 12.4184 12.4423 12.9088 12.9222 13.2257 13.2647 13.3190 13.3970 k = 0.4622 0.5622 0.1715 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.4624 -15.4621 -14.4296 -14.4283 -13.2630 -13.2574 -13.1344 -13.1148 -12.7289 -12.7123 -12.6273 -12.6170 -12.4471 -12.4356 -5.0032 -5.0005 -2.8807 -2.8795 -2.4673 -2.4332 -1.0953 -1.0534 -0.4854 -0.4356 0.1618 0.1923 0.3353 0.3665 0.5985 0.6115 1.5112 1.5171 1.8407 1.8431 2.0537 2.0596 2.5375 2.5440 2.9032 2.9101 3.1925 3.1967 3.2774 3.2821 3.4692 3.4714 3.6188 3.6223 3.8818 3.8843 4.0905 4.0958 4.3225 4.3279 4.4721 4.4757 9.9839 9.9926 10.9355 10.9399 12.4273 12.4509 12.9126 12.9258 13.2405 13.2896 13.3159 13.4030 k = 0.4648 0.5653 0.1874 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.4581 -15.4578 -14.4199 -14.4187 -13.2603 -13.2545 -13.1350 -13.1156 -12.7341 -12.7187 -12.6352 -12.6238 -12.4597 -12.4479 -4.9855 -4.9830 -2.8889 -2.8877 -2.4898 -2.4581 -1.0960 -1.0551 -0.4463 -0.3987 0.1420 0.1707 0.3570 0.3865 0.5887 0.6002 1.5148 1.5201 1.8052 1.8081 2.0659 2.0713 2.5479 2.5541 2.8992 2.9057 3.1938 3.1980 3.2848 3.2891 3.4772 3.4794 3.6390 3.6424 3.8738 3.8765 4.1001 4.1058 4.3276 4.3341 4.4639 4.4669 9.9917 10.0002 10.9162 10.9207 12.4362 12.4592 12.9163 12.9289 13.2508 13.3030 13.3253 13.4133 k = 0.4673 0.5684 0.2033 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.4540 -15.4537 -14.4104 -14.4093 -13.2574 -13.2516 -13.1361 -13.1169 -12.7391 -12.7251 -12.6418 -12.6292 -12.4724 -12.4603 -4.9678 -4.9654 -2.8984 -2.8971 -2.5108 -2.4814 -1.0948 -1.0551 -0.4092 -0.3640 0.1221 0.1491 0.3798 0.4076 0.5798 0.5899 1.5183 1.5230 1.7672 1.7707 2.0790 2.0840 2.5569 2.5626 2.8954 2.9014 3.1954 3.1996 3.2930 3.2967 3.4867 3.4889 3.6601 3.6636 3.8638 3.8667 4.1093 4.1156 4.3295 4.3374 4.4570 4.4599 10.0019 10.0101 10.8939 10.8985 12.4449 12.4670 12.9199 12.9315 13.2571 13.3010 13.3506 13.4277 k = 0.4699 0.5715 0.2192 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.4501 -15.4498 -14.4013 -14.4002 -13.2545 -13.2486 -13.1375 -13.1188 -12.7441 -12.7316 -12.6469 -12.6330 -12.4851 -12.4728 -4.9504 -4.9481 -2.9088 -2.9076 -2.5301 -2.5032 -1.0920 -1.0540 -0.3746 -0.3320 0.1025 0.1277 0.4037 0.4298 0.5718 0.5805 1.5214 1.5255 1.7277 1.7318 2.0925 2.0973 2.5641 2.5694 2.8917 2.8973 3.1974 3.2014 3.3014 3.3046 3.4977 3.4999 3.6820 3.6856 3.8521 3.8553 4.1178 4.1246 4.3285 4.3377 4.4519 4.4550 10.0143 10.0222 10.8692 10.8739 12.4534 12.4745 12.9234 12.9337 13.2607 13.2970 13.3780 13.4454 k = 0.4724 0.5746 0.2351 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.4464 -15.4462 -14.3926 -14.3915 -13.2516 -13.2457 -13.1392 -13.1213 -12.7490 -12.7382 -12.6502 -12.6352 -12.4979 -12.4852 -4.9334 -4.9313 -2.9198 -2.9186 -2.5476 -2.5232 -1.0878 -1.0519 -0.3426 -0.3029 0.0837 0.1068 0.4285 0.4530 0.5649 0.5721 1.5239 1.5278 1.6876 1.6926 2.1061 2.1107 2.5697 2.5745 2.8883 2.8933 3.1998 3.2037 3.3097 3.3125 3.5099 3.5122 3.7043 3.7080 3.8393 3.8425 4.1248 4.1321 4.3250 4.3353 4.4485 4.4521 10.0287 10.0363 10.8424 10.8471 12.4617 12.4813 12.9266 12.9357 13.2626 13.2929 13.4054 13.4649 k = 0.4750 0.5777 0.2510 ( 14130 PWs) bands (ev): -37.8012 -37.8012 -15.4431 -15.4429 -14.3844 -14.3834 -13.2488 -13.2429 -13.1412 -13.1242 -12.7540 -12.7448 -12.6517 -12.6357 -12.5106 -12.4976 -4.9171 -4.9152 -2.9310 -2.9299 -2.5633 -2.5414 -1.0826 -1.0492 -0.3135 -0.2769 0.0658 0.0868 0.4539 0.4767 0.5590 0.5648 1.5254 1.5298 1.6477 1.6542 2.1196 2.1239 2.5736 2.5780 2.8852 2.8897 3.2027 3.2063 3.3177 3.3200 3.5233 3.5258 3.7263 3.7302 3.8259 3.8293 4.1301 4.1376 4.3199 4.3308 4.4467 4.4506 10.0449 10.0522 10.8142 10.8189 12.4695 12.4876 12.9296 12.9375 13.2637 13.2890 13.4321 13.4851 k = 0.4775 0.5808 0.2669 ( 14137 PWs) bands (ev): -37.8012 -37.8012 -15.4400 -15.4399 -14.3768 -14.3759 -13.2460 -13.2403 -13.1432 -13.1274 -12.7589 -12.7513 -12.6512 -12.6346 -12.5232 -12.5100 -4.9019 -4.9001 -2.9421 -2.9412 -2.5771 -2.5577 -1.0767 -1.0463 -0.2875 -0.2542 0.0492 0.0678 0.4791 0.5003 0.5546 0.5587 1.5249 1.5314 1.6092 1.6181 2.1326 2.1366 2.5760 2.5799 2.8824 2.8863 3.2058 3.2092 3.3250 3.3271 3.5378 3.5404 3.7460 3.7504 3.8137 3.8170 4.1332 4.1407 4.3142 4.3252 4.4460 4.4500 10.0624 10.0693 10.7853 10.7900 12.4769 12.4931 12.9324 12.9391 13.2645 13.2856 13.4577 13.5049 k = 0.4800 0.5839 0.2829 ( 14141 PWs) bands (ev): -37.8012 -37.8012 -15.4374 -15.4372 -14.3698 -14.3690 -13.2433 -13.2380 -13.1451 -13.1309 -12.7636 -12.7574 -12.6490 -12.6321 -12.5357 -12.5221 -4.8878 -4.8862 -2.9528 -2.9520 -2.5889 -2.5722 -1.0704 -1.0433 -0.2646 -0.2348 0.0342 0.0503 0.5021 0.5219 0.5530 0.5553 1.5206 1.5315 1.5740 1.5872 2.1447 2.1484 2.5772 2.5807 2.8800 2.8834 3.2092 3.2122 3.3317 3.3334 3.5532 3.5559 3.7582 3.7634 3.8079 3.8107 4.1338 4.1410 4.3088 4.3193 4.4462 4.4500 10.0807 10.0871 10.7565 10.7611 12.4838 12.4979 12.9349 12.9406 13.2653 13.2827 13.4819 13.5236 k = 0.4826 0.5870 0.2988 ( 14139 PWs) bands (ev): -37.8012 -37.8012 -15.4351 -15.4349 -14.3637 -14.3630 -13.2409 -13.2360 -13.1468 -13.1344 -12.7679 -12.7630 -12.6453 -12.6283 -12.5478 -12.5340 -4.8752 -4.8738 -2.9627 -2.9621 -2.5988 -2.5847 -1.0639 -1.0405 -0.2448 -0.2189 0.0210 0.0345 0.5188 0.5343 0.5582 0.5597 1.5091 1.5231 1.5498 1.5659 2.1558 2.1590 2.5776 2.5806 2.8780 2.8809 3.2125 3.2151 3.3375 3.3389 3.5694 3.5722 3.7553 3.7604 3.8164 3.8178 4.1321 4.1386 4.3044 4.3139 4.4468 4.4502 10.0990 10.1049 10.7290 10.7333 12.4900 12.5018 12.9370 12.9419 13.2662 13.2802 13.5042 13.5402 k = 0.4851 0.5901 0.3147 ( 14149 PWs) bands (ev): -37.8012 -37.8012 -15.4332 -15.4331 -14.3583 -14.3578 -13.2387 -13.2345 -13.1482 -13.1379 -12.7717 -12.7679 -12.6401 -12.6235 -12.5593 -12.5455 -4.8642 -4.8631 -2.9715 -2.9711 -2.6065 -2.5952 -1.0576 -1.0383 -0.2280 -0.2062 0.0099 0.0207 0.5254 0.5347 0.5712 0.5758 1.4903 1.4997 1.5443 1.5555 2.1655 2.1681 2.5775 2.5799 2.8764 2.8789 3.2156 3.2178 3.3424 3.3436 3.5862 3.5892 3.7423 3.7470 3.8327 3.8332 4.1283 4.1339 4.3012 4.3092 4.4476 4.4505 10.1165 10.1216 10.7039 10.7078 12.4955 12.5048 12.9388 12.9430 13.2672 13.2781 13.5243 13.5543 k = 0.4877 0.5932 0.3306 ( 14141 PWs) bands (ev): -37.8012 -37.8012 -15.4317 -15.4316 -14.3539 -14.3534 -13.2368 -13.2336 -13.1491 -13.1413 -12.7747 -12.7720 -12.6339 -12.6181 -12.5700 -12.5565 -4.8551 -4.8542 -2.9791 -2.9789 -2.6123 -2.6036 -1.0517 -1.0367 -0.2143 -0.1969 0.0010 0.0091 0.5262 0.5321 0.5875 0.5922 1.4703 1.4759 1.5442 1.5512 2.1735 2.1755 2.5773 2.5792 2.8754 2.8773 3.2184 3.2201 3.3464 3.3474 3.6035 3.6067 3.7258 3.7301 3.8491 3.8495 4.1233 4.1277 4.2992 4.3054 4.4486 4.4508 10.1321 10.1362 10.6825 10.6857 12.5003 12.5069 12.9402 12.9439 13.2682 13.2763 13.5418 13.5652 k = 0.4902 0.5963 0.3465 ( 14136 PWs) bands (ev): -37.8012 -37.8012 -15.4307 -15.4306 -14.3504 -14.3501 -13.2354 -13.2334 -13.1494 -13.1443 -12.7768 -12.7751 -12.6268 -12.6133 -12.5788 -12.5667 -4.8480 -4.8473 -2.9853 -2.9850 -2.6159 -2.6099 -1.0464 -1.0361 -0.2035 -0.1908 -0.0055 -0.0000 0.5256 0.5293 0.6015 0.6049 1.4542 1.4574 1.5448 1.5490 2.1795 2.1809 2.5774 2.5786 2.8748 2.8762 3.2206 3.2217 3.3494 3.3501 3.6213 3.6247 3.7079 3.7121 3.8629 3.8632 4.1181 4.1212 4.2982 4.3024 4.4497 4.4512 10.1444 10.1474 10.6663 10.6687 12.5041 12.5080 12.9412 12.9445 13.2693 13.2749 13.5564 13.5725 k = 0.4928 0.5994 0.3624 ( 14146 PWs) bands (ev): -37.8012 -37.8012 -15.4301 -15.4300 -14.3480 -14.3478 -13.2346 -13.2337 -13.1491 -13.1469 -12.7779 -12.7772 -12.6197 -12.6115 -12.5831 -12.5756 -4.8431 -4.8426 -2.9899 -2.9893 -2.6176 -2.6141 -1.0419 -1.0363 -0.1956 -0.1879 -0.0093 -0.0065 0.5248 0.5269 0.6107 0.6123 1.4444 1.4459 1.5455 1.5475 2.1833 2.1840 2.5780 2.5786 2.8747 2.8757 3.2221 3.2227 3.3513 3.3518 3.6393 3.6428 3.6895 3.6935 3.8722 3.8725 4.1142 4.1160 4.2978 4.3000 4.4508 4.4515 10.1523 10.1540 10.6567 10.6580 12.5070 12.5082 12.9417 12.9447 13.2701 13.2740 13.5676 13.5761 k = 0.4953 0.6025 0.3783 ( 14142 PWs) bands (ev): -37.8012 -37.8012 -15.4299 -15.4299 -14.3465 -14.3464 -13.2349 -13.2341 -13.1489 -13.1481 -12.7782 -12.7779 -12.6153 -12.6138 -12.5819 -12.5805 -4.8404 -4.8402 -2.9927 -2.9919 -2.6177 -2.6156 -1.0384 -1.0376 -0.1905 -0.1881 -0.0106 -0.0103 0.5244 0.5250 0.6134 0.6140 1.4422 1.4423 1.5461 1.5462 2.1847 2.1847 2.5791 2.5793 2.8751 2.8757 3.2228 3.2229 3.3522 3.3525 3.6569 3.6598 3.6722 3.6753 3.8758 3.8760 4.1127 4.1131 4.2979 4.2981 4.4518 4.4520 10.1547 10.1552 10.6544 10.6548 12.5073 12.5091 12.9418 12.9446 13.2702 13.2740 13.5734 13.5775 k = 0.4953 0.6025 0.3783 ( 14142 PWs) bands (ev): -37.8012 -37.8012 -15.4299 -15.4299 -14.3465 -14.3464 -13.2349 -13.2341 -13.1489 -13.1481 -12.7782 -12.7779 -12.6153 -12.6138 -12.5819 -12.5805 -4.8404 -4.8402 -2.9927 -2.9919 -2.6177 -2.6156 -1.0384 -1.0376 -0.1905 -0.1881 -0.0106 -0.0103 0.5244 0.5250 0.6134 0.6140 1.4422 1.4423 1.5461 1.5462 2.1847 2.1847 2.5791 2.5793 2.8751 2.8757 3.2228 3.2229 3.3522 3.3525 3.6569 3.6598 3.6722 3.6753 3.8758 3.8760 4.1127 4.1131 4.2979 4.2981 4.4518 4.4520 10.1547 10.1552 10.6544 10.6548 12.5073 12.5091 12.9418 12.9446 13.2702 13.2740 13.5734 13.5775 k = 0.4873 0.5927 0.3888 ( 14142 PWs) bands (ev): -37.8012 -37.8012 -15.4297 -15.4296 -14.3478 -14.3476 -13.2357 -13.2327 -13.1506 -13.1463 -12.7786 -12.7771 -12.6219 -12.6123 -12.5822 -12.5736 -4.8396 -4.8391 -3.0006 -2.9981 -2.6152 -2.6088 -1.0365 -1.0353 -0.1937 -0.1898 -0.0122 -0.0108 0.5270 0.5277 0.6082 0.6113 1.4465 1.4478 1.5458 1.5472 2.1823 2.1828 2.5816 2.5824 2.8717 2.8732 3.2248 3.2254 3.3501 3.3510 3.6568 3.6597 3.6722 3.6752 3.8763 3.8767 4.1133 4.1137 4.2954 4.2961 4.4531 4.4541 10.1510 10.1523 10.6577 10.6590 12.5016 12.5090 12.9398 12.9483 13.2656 13.2778 13.5684 13.5832 k = 0.4792 0.5829 0.3992 ( 14134 PWs) bands (ev): -37.8012 -37.8012 -15.4294 -15.4293 -14.3499 -14.3497 -13.2368 -13.2316 -13.1521 -13.1444 -12.7785 -12.7758 -12.6295 -12.6160 -12.5763 -12.5646 -4.8374 -4.8367 -3.0157 -3.0119 -2.6078 -2.5974 -1.0330 -1.0299 -0.1994 -0.1940 -0.0154 -0.0124 0.5316 0.5324 0.5974 0.6032 1.4575 1.4606 1.5457 1.5487 2.1773 2.1782 2.5878 2.5893 2.8660 2.8683 3.2289 3.2299 3.3462 3.3477 3.6567 3.6597 3.6717 3.6747 3.8763 3.8769 4.1147 4.1152 4.2903 4.2918 4.4566 4.4583 10.1422 10.1445 10.6670 10.6692 12.4930 12.5058 12.9384 12.9524 13.2607 13.2811 13.5642 13.5896 k = 0.4712 0.5731 0.4096 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.4290 -15.4288 -14.3530 -14.3526 -13.2380 -13.2308 -13.1535 -13.1428 -12.7779 -12.7740 -12.6372 -12.6222 -12.5671 -12.5545 -4.8339 -4.8330 -3.0369 -3.0322 -2.5963 -2.5823 -1.0273 -1.0224 -0.2077 -0.2005 -0.0199 -0.0152 0.5375 0.5381 0.5822 0.5911 1.4739 1.4795 1.5460 1.5516 2.1698 2.1712 2.5973 2.5995 2.8584 2.8613 3.2345 3.2359 3.3406 3.3428 3.6569 3.6597 3.6706 3.6734 3.8758 3.8767 4.1169 4.1175 4.2831 4.2854 4.4619 4.4641 10.1290 10.1322 10.6816 10.6847 12.4815 12.4994 12.9376 12.9568 13.2560 13.2840 13.5610 13.5963 k = 0.4632 0.5634 0.4201 ( 14131 PWs) bands (ev): -37.8012 -37.8012 -15.4285 -15.4283 -14.3568 -14.3564 -13.2393 -13.2305 -13.1546 -13.1413 -12.7766 -12.7715 -12.6446 -12.6289 -12.5565 -12.5439 -4.8291 -4.8280 -3.0630 -3.0579 -2.5816 -2.5646 -1.0195 -1.0128 -0.2184 -0.2093 -0.0258 -0.0192 0.5399 0.5422 0.5676 0.5790 1.4925 1.5025 1.5482 1.5583 2.1602 2.1620 2.6094 2.6122 2.8493 2.8527 3.2412 3.2430 3.3338 3.3367 3.6574 3.6598 3.6688 3.6712 3.8750 3.8762 4.1199 4.1205 4.2743 4.2773 4.4685 4.4712 10.1121 10.1161 10.7009 10.7049 12.4672 12.4900 12.9371 12.9613 13.2517 13.2867 13.5592 13.6034 k = 0.4551 0.5536 0.4305 ( 14133 PWs) bands (ev): -37.8012 -37.8012 -15.4279 -15.4277 -14.3615 -14.3610 -13.2406 -13.2305 -13.1556 -13.1403 -12.7746 -12.7684 -12.6516 -12.6357 -12.5451 -12.5328 -4.8232 -4.8218 -3.0930 -3.0877 -2.5646 -2.5449 -1.0099 -1.0013 -0.2314 -0.2204 -0.0330 -0.0242 0.5267 0.5339 0.5680 0.5770 1.5082 1.5224 1.5585 1.5730 2.1490 2.1511 2.6232 2.6266 2.8396 2.8434 3.2478 3.2502 3.3262 3.3302 3.6581 3.6592 3.6669 3.6682 3.8739 3.8754 4.1235 4.1242 4.2643 4.2679 4.4762 4.4792 10.0923 10.0970 10.7240 10.7288 12.4504 12.4775 12.9369 12.9654 13.2481 13.2894 13.5587 13.6109 k = 0.4471 0.5438 0.4409 ( 14135 PWs) bands (ev): -37.8012 -37.8012 -15.4273 -15.4271 -14.3670 -14.3664 -13.2420 -13.2309 -13.1563 -13.1396 -12.7719 -12.7646 -12.6581 -12.6422 -12.5332 -12.5213 -4.8162 -4.8147 -3.1259 -3.1208 -2.5459 -2.5239 -0.9987 -0.9882 -0.2467 -0.2337 -0.0415 -0.0301 0.5022 0.5140 0.5791 0.5860 1.5172 1.5304 1.5849 1.5986 2.1363 2.1388 2.6374 2.6415 2.8303 2.8342 3.2529 3.2562 3.3192 3.3245 3.6565 3.6583 3.6645 3.6668 3.8727 3.8746 4.1276 4.1285 4.2536 4.2577 4.4845 4.4878 10.0705 10.0756 10.7501 10.7557 12.4311 12.4621 12.9365 12.9690 13.2456 13.2926 13.5598 13.6187 k = 0.4391 0.5340 0.4514 ( 14129 PWs) bands (ev): -37.8012 -37.8012 -15.4266 -15.4263 -14.3733 -14.3726 -13.2433 -13.2316 -13.1569 -13.1395 -12.7682 -12.7600 -12.6642 -12.6485 -12.5210 -12.5096 -4.8085 -4.8067 -3.1611 -3.1562 -2.5261 -2.5019 -0.9861 -0.9737 -0.2643 -0.2491 -0.0510 -0.0370 0.4745 0.4897 0.5934 0.5996 1.5213 1.5321 1.6209 1.6326 2.1225 2.1253 2.6502 2.6551 2.8229 2.8269 3.2540 3.2583 3.3153 3.3217 3.6513 3.6549 3.6641 3.6681 3.8714 3.8736 4.1323 4.1334 4.2424 4.2471 4.4933 4.4968 10.0471 10.0526 10.7786 10.7850 12.4095 12.4439 12.9356 12.9717 13.2446 13.2966 13.5625 13.6270 k = 0.4310 0.5243 0.4618 ( 14134 PWs) bands (ev): -37.8012 -37.8012 -15.4258 -15.4255 -14.3804 -14.3796 -13.2447 -13.2325 -13.1574 -13.1398 -12.7637 -12.7546 -12.6698 -12.6544 -12.5086 -12.4977 -4.8001 -4.7982 -3.1977 -3.1933 -2.5053 -2.4792 -0.9726 -0.9582 -0.2839 -0.2667 -0.0613 -0.0445 0.4454 0.4638 0.6095 0.6153 1.5232 1.5325 1.6611 1.6715 2.1078 2.1109 2.6594 2.6651 2.8196 2.8234 3.2494 3.2539 3.3169 3.3235 3.6442 3.6480 3.6664 3.6707 3.8700 3.8727 4.1373 4.1387 4.2310 4.2363 4.5023 4.5059 10.0227 10.0285 10.8088 10.8159 12.3858 12.4232 12.9339 12.9729 13.2453 13.3020 13.5669 13.6358 k = 0.4230 0.5145 0.4722 ( 14127 PWs) bands (ev): -37.8012 -37.8012 -15.4250 -15.4247 -14.3881 -14.3874 -13.2462 -13.2338 -13.1576 -13.1404 -12.7582 -12.7483 -12.6749 -12.6600 -12.4961 -12.4858 -4.7912 -4.7892 -3.2353 -3.2313 -2.4837 -2.4558 -0.9586 -0.9420 -0.3056 -0.2863 -0.0723 -0.0525 0.4162 0.4374 0.6269 0.6325 1.5244 1.5327 1.7035 1.7134 2.0924 2.0958 2.6626 2.6693 2.8223 2.8262 3.2393 3.2433 3.3235 3.3296 3.6357 3.6394 3.6698 3.6742 3.8686 3.8717 4.1426 4.1444 4.2196 4.2257 4.5114 4.5151 9.9979 10.0039 10.8403 10.8480 12.3602 12.4000 12.9311 12.9725 13.2481 13.3091 13.5731 13.6454 k = 0.4150 0.5047 0.4827 ( 14129 PWs) bands (ev): -37.8012 -37.8012 -15.4242 -15.4238 -14.3966 -14.3958 -13.2479 -13.2353 -13.1575 -13.1413 -12.7519 -12.7412 -12.6795 -12.6652 -12.4835 -12.4738 -4.7823 -4.7801 -3.2734 -3.2698 -2.4614 -2.4319 -0.9444 -0.9256 -0.3290 -0.3079 -0.0835 -0.0610 0.3873 0.4113 0.6451 0.6507 1.5254 1.5331 1.7473 1.7571 2.0766 2.0803 2.6587 2.6662 2.8320 2.8361 3.2252 3.2286 3.3328 3.3382 3.6259 3.6295 3.6741 3.6786 3.8670 3.8706 4.1479 4.1504 4.2086 4.2155 4.5205 4.5243 9.9729 9.9790 10.8724 10.8806 12.3327 12.3748 12.9269 12.9701 13.2531 13.3182 13.5811 13.6559 k = 0.4069 0.4950 0.4931 ( 14137 PWs) bands (ev): -37.8012 -37.8012 -15.4233 -15.4230 -14.4056 -14.4048 -13.2500 -13.2370 -13.1570 -13.1423 -12.7447 -12.7333 -12.6835 -12.6700 -12.4711 -12.4618 -4.7734 -4.7711 -3.3112 -3.3081 -2.4383 -2.4073 -0.9307 -0.9095 -0.3540 -0.3311 -0.0947 -0.0696 0.3594 0.3861 0.6640 0.6695 1.5268 1.5340 1.7915 1.8018 2.0604 2.0644 2.6486 2.6566 2.8478 2.8523 3.2085 3.2113 3.3432 3.3478 3.6153 3.6188 3.6794 3.6839 3.8651 3.8693 4.1532 4.1565 4.1980 4.2061 4.5294 4.5333 9.9481 9.9542 10.9048 10.9135 12.3038 12.3476 12.9211 12.9655 13.2603 13.3296 13.5911 13.6676 k = 0.3989 0.4852 0.5035 ( 14132 PWs) bands (ev): -37.8012 -37.8012 -15.4225 -15.4221 -14.4153 -14.4145 -13.2524 -13.2390 -13.1560 -13.1432 -12.7370 -12.7248 -12.6868 -12.6745 -12.4587 -12.4500 -4.7650 -4.7626 -3.3485 -3.3458 -2.4146 -2.3821 -0.9181 -0.8942 -0.3801 -0.3555 -0.1057 -0.0781 0.3328 0.3621 0.6832 0.6887 1.5286 1.5355 1.8356 1.8466 2.0442 2.0484 2.6338 2.6422 2.8678 2.8727 3.1900 3.1924 3.3534 3.3576 3.6043 3.6076 3.6858 3.6903 3.8629 3.8676 4.1581 4.1627 4.1881 4.1978 4.5382 4.5422 9.9238 9.9299 10.9371 10.9461 12.2735 12.3188 12.9137 12.9587 13.2696 13.3432 13.6033 13.6806 k = 0.3909 0.4754 0.5140 ( 14126 PWs) bands (ev): -37.8012 -37.8012 -15.4216 -15.4213 -14.4254 -14.4246 -13.2555 -13.2414 -13.1545 -13.1438 -12.7291 -12.7159 -12.6890 -12.6783 -12.4465 -12.4383 -4.7574 -4.7550 -3.3847 -3.3823 -2.3900 -2.3561 -0.9074 -0.8806 -0.4067 -0.3805 -0.1163 -0.0864 0.3080 0.3395 0.7024 0.7080 1.5312 1.5378 1.8785 1.8908 2.0281 2.0327 2.6161 2.6247 2.8902 2.8955 3.1702 3.1723 3.3630 3.3667 3.5933 3.5964 3.6932 3.6977 3.8600 3.8653 4.1621 4.1688 4.1792 4.1913 4.5468 4.5508 9.9002 9.9062 10.9688 10.9780 12.2422 12.2886 12.9045 12.9496 13.2807 13.3589 13.6178 13.6953 k = 0.3828 0.4656 0.5244 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.4209 -15.4205 -14.4359 -14.4352 -13.2590 -13.2441 -13.1523 -13.1437 -12.7220 -12.7075 -12.6890 -12.6812 -12.4346 -12.4268 -4.7508 -4.7484 -3.4193 -3.4172 -2.3647 -2.3294 -0.8996 -0.8697 -0.4330 -0.4053 -0.1261 -0.0943 0.2851 0.3187 0.7215 0.7271 1.5344 1.5409 1.9184 1.9334 2.0131 2.0184 2.5964 2.6052 2.9135 2.9191 3.1496 3.1515 3.3712 3.3747 3.5830 3.5859 3.7019 3.7064 3.8564 3.8622 4.1641 4.1702 4.1758 4.1877 4.5552 4.5591 9.8775 9.8834 10.9996 11.0088 12.2102 12.2574 12.8936 12.9385 13.2934 13.3763 13.6350 13.7121 k = 0.3748 0.4559 0.5348 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.4202 -15.4198 -14.4468 -14.4461 -13.2631 -13.2474 -13.1495 -13.1429 -12.7171 -12.7011 -12.6859 -12.6812 -12.4229 -12.4155 -4.7457 -4.7434 -3.4519 -3.4500 -2.3383 -2.3018 -0.8957 -0.8627 -0.4580 -0.4288 -0.1351 -0.1015 0.2643 0.2997 0.7402 0.7459 1.5384 1.5447 1.9499 1.9697 2.0031 2.0105 2.5756 2.5847 2.9366 2.9425 3.1286 3.1304 3.3776 3.3810 3.5741 3.5768 3.7117 3.7162 3.8519 3.8583 4.1629 4.1642 4.1815 4.1876 4.5632 4.5671 9.8560 9.8618 11.0289 11.0381 12.1777 12.2255 12.8812 12.9255 13.3072 13.3949 13.6549 13.7315 k = 0.3668 0.4461 0.5452 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.4196 -15.4192 -14.4580 -14.4573 -13.2677 -13.2512 -13.1460 -13.1412 -12.7153 -12.6987 -12.6804 -12.6747 -12.4116 -12.4046 -4.7425 -4.7402 -3.4820 -3.4804 -2.3110 -2.2733 -0.8969 -0.8610 -0.4804 -0.4499 -0.1430 -0.1078 0.2458 0.2828 0.7583 0.7641 1.5430 1.5493 1.9582 1.9739 2.0224 2.0244 2.5546 2.5638 2.9581 2.9641 3.1081 3.1099 3.3817 3.3852 3.5673 3.5699 3.7228 3.7272 3.8464 3.8534 4.1576 4.1615 4.1873 4.1904 4.5709 4.5748 9.8357 9.8414 11.0565 11.0654 12.1451 12.1933 12.8674 12.9108 13.3215 13.4140 13.6781 13.7537 k = 0.3587 0.4363 0.5557 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.4193 -15.4189 -14.4693 -14.4686 -13.2727 -13.2555 -13.1418 -13.1385 -12.7157 -12.6996 -12.6718 -12.6644 -12.4006 -12.3940 -4.7413 -4.7392 -3.5094 -3.5079 -2.2827 -2.2438 -0.9043 -0.8660 -0.4990 -0.4675 -0.1497 -0.1128 0.2296 0.2679 0.7757 0.7816 1.5482 1.5544 1.9486 1.9607 2.0522 2.0576 2.5341 2.5433 2.9758 2.9819 3.0896 3.0917 3.3834 3.3869 3.5633 3.5659 3.7348 3.7392 3.8402 3.8478 4.1528 4.1589 4.1929 4.1945 4.5782 4.5820 9.8169 9.8225 11.0818 11.0904 12.1128 12.1611 12.8524 12.8948 13.3360 13.4330 13.7045 13.7791 k = 0.3507 0.4265 0.5661 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.4191 -15.4187 -14.4806 -14.4799 -13.2779 -13.2603 -13.1370 -13.1348 -12.7171 -12.7017 -12.6612 -12.6528 -12.3900 -12.3838 -4.7424 -4.7405 -3.5336 -3.5322 -2.2533 -2.2133 -0.9185 -0.8787 -0.5130 -0.4810 -0.1548 -0.1164 0.2157 0.2551 0.7923 0.7984 1.5538 1.5600 1.9347 1.9461 2.0818 2.0896 2.5148 2.5241 2.9861 2.9917 3.0766 3.0793 3.3827 3.3863 3.5624 3.5651 3.7472 3.7520 3.8335 3.8420 4.1490 4.1567 4.1979 4.1997 4.5851 4.5889 9.7997 9.8053 11.1045 11.1126 12.0810 12.1293 12.8364 12.8777 13.3501 13.4512 13.7343 13.8081 k = 0.3427 0.4168 0.5765 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.4193 -15.4188 -14.4919 -14.4912 -13.2834 -13.2655 -13.1317 -13.1302 -12.7188 -12.7041 -12.6495 -12.6406 -12.3800 -12.3741 -4.7462 -4.7444 -3.5545 -3.5531 -2.2227 -2.1817 -0.9396 -0.8993 -0.5221 -0.4903 -0.1582 -0.1183 0.2043 0.2446 0.8079 0.8141 1.5593 1.5657 1.9202 1.9317 2.1076 2.1170 2.4979 2.5071 2.9841 2.9885 3.0736 3.0771 3.3801 3.3836 3.5648 3.5676 3.7588 3.7648 3.8273 3.8371 4.1460 4.1551 4.2025 4.2051 4.5915 4.5953 9.7842 9.7897 11.1240 11.1316 12.0504 12.0984 12.8197 12.8598 13.3635 13.4677 13.7674 13.8405 k = 0.3427 0.4168 0.5765 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.4193 -15.4188 -14.4919 -14.4912 -13.2834 -13.2655 -13.1317 -13.1302 -12.7188 -12.7041 -12.6495 -12.6406 -12.3800 -12.3741 -4.7462 -4.7444 -3.5545 -3.5531 -2.2227 -2.1817 -0.9396 -0.8993 -0.5221 -0.4903 -0.1582 -0.1183 0.2043 0.2446 0.8079 0.8141 1.5593 1.5657 1.9202 1.9317 2.1076 2.1170 2.4979 2.5071 2.9841 2.9885 3.0736 3.0771 3.3801 3.3836 3.5648 3.5676 3.7588 3.7648 3.8273 3.8371 4.1460 4.1551 4.2025 4.2051 4.5915 4.5953 9.7842 9.7897 11.1240 11.1316 12.0504 12.0984 12.8197 12.8598 13.3635 13.4677 13.7674 13.8405 k = 0.3323 0.4041 0.5765 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.4162 -15.4158 -14.5055 -14.5049 -13.2880 -13.2704 -13.1207 -13.1194 -12.7168 -12.7029 -12.6436 -12.6344 -12.3763 -12.3706 -4.7624 -4.7607 -3.5625 -3.5610 -2.2060 -2.1639 -0.9537 -0.9136 -0.5402 -0.5061 -0.1605 -0.1211 0.2151 0.2538 0.8364 0.8438 1.5723 1.5790 1.9021 1.9136 2.1143 2.1252 2.4768 2.4855 2.9651 2.9688 3.0700 3.0742 3.3778 3.3811 3.5793 3.5818 3.7663 3.7727 3.8410 3.8510 4.1376 4.1487 4.2130 4.2172 4.5976 4.6013 9.7819 9.7876 11.1252 11.1326 12.0214 12.0679 12.8219 12.8612 13.3745 13.4795 13.7838 13.8501 k = 0.3219 0.3915 0.5765 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.4140 -15.4136 -14.5176 -14.5170 -13.2932 -13.2760 -13.1103 -13.1088 -12.7147 -12.7015 -12.6370 -12.6275 -12.3729 -12.3674 -4.7816 -4.7799 -3.5662 -3.5647 -2.1890 -2.1459 -0.9714 -0.9318 -0.5576 -0.5219 -0.1610 -0.1220 0.2280 0.2650 0.8648 0.8736 1.5840 1.5910 1.8828 1.8945 2.1204 2.1327 2.4577 2.4658 2.9429 2.9461 3.0677 3.0726 3.3733 3.3764 3.5956 3.5978 3.7747 3.7816 3.8541 3.8642 4.1297 4.1420 4.2244 4.2294 4.6035 4.6070 9.7809 9.7868 11.1248 11.1319 11.9942 12.0389 12.8248 12.8633 13.3840 13.4897 13.8007 13.8525 k = 0.3115 0.3789 0.5765 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.4127 -15.4123 -14.5279 -14.5274 -13.2988 -13.2821 -13.1006 -13.0989 -12.7124 -12.7000 -12.6297 -12.6201 -12.3698 -12.3645 -4.8034 -4.8018 -3.5660 -3.5643 -2.1718 -2.1277 -0.9927 -0.9538 -0.5746 -0.5378 -0.1595 -0.1208 0.2430 0.2781 0.8930 0.9032 1.5934 1.6005 1.8630 1.8752 2.1258 2.1393 2.4409 2.4482 2.9190 2.9218 3.0659 3.0712 3.3675 3.3702 3.6129 3.6149 3.7839 3.7913 3.8668 3.8769 4.1228 4.1357 4.2356 4.2412 4.6090 4.6125 9.7813 9.7873 11.1226 11.1292 11.9694 12.0118 12.8284 12.8661 13.3916 13.4978 13.8182 13.8407 k = 0.3011 0.3663 0.5765 ( 14127 PWs) bands (ev): -37.8012 -37.8012 -15.4125 -15.4121 -14.5362 -14.5357 -13.3046 -13.2884 -13.0918 -13.0899 -12.7100 -12.6983 -12.6220 -12.6123 -12.3671 -12.3619 -4.8275 -4.8259 -3.5619 -3.5601 -2.1542 -2.1091 -1.0172 -0.9791 -0.5915 -0.5539 -0.1558 -0.1172 0.2596 0.2929 0.9208 0.9324 1.5990 1.6062 1.8436 1.8565 2.1305 2.1448 2.4268 2.4332 2.8943 2.8967 3.0638 3.0697 3.3608 3.3632 3.6307 3.6324 3.7936 3.8016 3.8792 3.8894 4.1169 4.1303 4.2464 4.2522 4.6144 4.6177 9.7831 9.7892 11.1182 11.1241 11.9474 11.9873 12.8328 12.8695 13.3969 13.5034 13.8193 13.8368 k = 0.2907 0.3536 0.5765 ( 14137 PWs) bands (ev): -37.8012 -37.8012 -15.4135 -15.4131 -14.5422 -14.5418 -13.3105 -13.2950 -13.0840 -13.0819 -12.7073 -12.6964 -12.6138 -12.6040 -12.3649 -12.3598 -4.8534 -4.8519 -3.5542 -3.5522 -2.1363 -2.0901 -1.0446 -1.0075 -0.6086 -0.5705 -0.1497 -0.1111 0.2777 0.3091 0.9480 0.9611 1.5995 1.6066 1.8260 1.8395 2.1343 2.1491 2.4159 2.4211 2.8692 2.8715 3.0615 3.0677 3.3537 3.3557 3.6485 3.6500 3.8036 3.8122 3.8918 3.9020 4.1120 4.1256 4.2562 4.2623 4.6196 4.6227 9.7862 9.7924 11.1113 11.1164 11.9289 11.9659 12.8377 12.8735 13.3997 13.5064 13.7942 13.8561 k = 0.2804 0.3410 0.5765 ( 14138 PWs) bands (ev): -37.8012 -37.8012 -15.4158 -15.4154 -14.5459 -14.5455 -13.3165 -13.3017 -13.0772 -13.0749 -12.7044 -12.6942 -12.6054 -12.5955 -12.3631 -12.3581 -4.8807 -4.8794 -3.5431 -3.5410 -2.1179 -2.0708 -1.0746 -1.0386 -0.6263 -0.5876 -0.1410 -0.1023 0.2970 0.3265 0.9743 0.9889 1.5934 1.6002 1.8113 1.8252 2.1371 2.1519 2.4084 2.4121 2.8444 2.8464 3.0587 3.0654 3.3465 3.3482 3.6657 3.6669 3.8141 3.8231 3.9048 3.9150 4.1080 4.1217 4.2650 4.2713 4.6246 4.6276 9.7908 9.7970 11.1017 11.1059 11.9143 11.9482 12.8433 12.8780 13.3999 13.5065 13.7673 13.8521 k = 0.2700 0.3284 0.5765 ( 14148 PWs) bands (ev): -37.8012 -37.8012 -15.4193 -15.4190 -14.5471 -14.5467 -13.3225 -13.3084 -13.0716 -13.0691 -12.7012 -12.6918 -12.5969 -12.5869 -12.3618 -12.3570 -4.9091 -4.9078 -3.5291 -3.5268 -2.0991 -2.0511 -1.1069 -1.0720 -0.6446 -0.6054 -0.1296 -0.0908 0.3173 0.3450 0.9995 1.0155 1.5798 1.5860 1.8005 1.8144 2.1386 2.1529 2.4047 2.4067 2.8201 2.8218 3.0556 3.0627 3.3397 3.3410 3.6816 3.6825 3.8252 3.8345 3.9183 3.9284 4.1048 4.1184 4.2725 4.2790 4.6296 4.6324 9.7967 9.8028 11.0892 11.0923 11.9041 11.9347 12.8493 12.8830 13.3974 13.5036 13.7394 13.8261 k = 0.2596 0.3157 0.5765 ( 14153 PWs) bands (ev): -37.8012 -37.8012 -15.4242 -15.4239 -14.5457 -14.5454 -13.3284 -13.3152 -13.0672 -13.0644 -12.6978 -12.6892 -12.5884 -12.5781 -12.3612 -12.3564 -4.9383 -4.9370 -3.5122 -3.5097 -2.0798 -2.0308 -1.1413 -1.1074 -0.6636 -0.6239 -0.1157 -0.0768 0.3384 0.3644 1.0231 1.0405 1.5591 1.5645 1.7932 1.8068 2.1385 2.1520 2.4048 2.4053 2.7967 2.7982 3.0522 3.0597 3.3333 3.3344 3.6955 3.6964 3.8373 3.8465 3.9324 3.9424 4.1020 4.1155 4.2788 4.2853 4.6346 4.6371 9.8039 9.8099 11.0737 11.0757 11.8985 11.9256 12.8559 12.8883 13.3923 13.4979 13.7106 13.7991 k = 0.2492 0.3031 0.5765 ( 14143 PWs) bands (ev): -37.8012 -37.8012 -15.4303 -15.4300 -14.5419 -14.5416 -13.3342 -13.3218 -13.0640 -13.0608 -12.6941 -12.6863 -12.5799 -12.5694 -12.3611 -12.3563 -4.9677 -4.9665 -3.4927 -3.4900 -2.0598 -2.0100 -1.1774 -1.1446 -0.6832 -0.6431 -0.0994 -0.0604 0.3603 0.3845 1.0447 1.0635 1.5324 1.5369 1.7884 1.8013 2.1366 2.1489 2.4072 2.4095 2.7744 2.7757 3.0488 3.0567 3.3278 3.3287 3.7069 3.7081 3.8508 3.8597 3.9471 3.9569 4.0997 4.1128 4.2837 4.2902 4.6395 4.6418 9.8124 9.8182 11.0549 11.0561 11.8977 11.9212 12.8629 12.8940 13.3849 13.4896 13.6812 13.7714 k = 0.2388 0.2905 0.5765 ( 14137 PWs) bands (ev): -37.8012 -37.8012 -15.4376 -15.4374 -14.5357 -14.5354 -13.3398 -13.3282 -13.0619 -13.0583 -12.6902 -12.6832 -12.5715 -12.5608 -12.3617 -12.3568 -4.9972 -4.9961 -3.4709 -3.4679 -2.0392 -1.9886 -1.2149 -1.1832 -0.7036 -0.6629 -0.0808 -0.0418 0.3827 0.4053 1.0636 1.0837 1.5013 1.5051 1.7848 1.7968 2.1326 2.1437 2.4133 2.4178 2.7534 2.7547 3.0453 3.0537 3.3231 3.3241 3.7157 3.7172 3.8660 3.8742 3.9621 3.9716 4.0975 4.1101 4.2872 4.2937 4.6445 4.6466 9.8221 9.8277 11.0327 11.0341 11.9018 11.9217 12.8703 12.8999 13.3752 13.4788 13.6513 13.7431 k = 0.2284 0.2779 0.5765 ( 14140 PWs) bands (ev): -37.8012 -37.8012 -15.4460 -15.4458 -14.5271 -14.5269 -13.3452 -13.3345 -13.0610 -13.0571 -12.6860 -12.6799 -12.5634 -12.5523 -12.3629 -12.3580 -5.0266 -5.0255 -3.4470 -3.4437 -2.0178 -1.9665 -1.2538 -1.2232 -0.7244 -0.6832 -0.0603 -0.0213 0.4057 0.4267 1.0790 1.1003 1.4677 1.4712 1.7813 1.7923 2.1266 2.1364 2.4233 2.4298 2.7340 2.7352 3.0421 3.0508 3.3195 3.3206 3.7220 3.7239 3.8828 3.8900 3.9771 3.9863 4.0954 4.1075 4.2895 4.2958 4.6495 4.6513 9.8330 9.8384 11.0075 11.0097 11.9107 11.9270 12.8780 12.9061 13.3636 13.4659 13.6209 13.7143 k = 0.2181 0.2652 0.5765 ( 14130 PWs) bands (ev): -37.8012 -37.8012 -15.4553 -15.4551 -14.5165 -14.5162 -13.3502 -13.3404 -13.0612 -13.0569 -12.6816 -12.6764 -12.5556 -12.5440 -12.3648 -12.3597 -5.0555 -5.0544 -3.4211 -3.4175 -1.9957 -1.9437 -1.2936 -1.2641 -0.7456 -0.7039 -0.0382 0.0008 0.4290 0.4486 1.0897 1.1119 1.4336 1.4372 1.7772 1.7873 2.1186 2.1272 2.4366 2.4449 2.7162 2.7176 3.0391 3.0483 3.3171 3.3184 3.7261 3.7284 3.9007 3.9068 3.9919 4.0006 4.0935 4.1051 4.2904 4.2966 4.6544 4.6561 9.8450 9.8500 10.9798 10.9830 11.9242 11.9371 12.8860 12.9125 13.3503 13.4511 13.5900 13.6851 k = 0.2077 0.2526 0.5765 ( 14134 PWs) bands (ev): -37.8012 -37.8012 -15.4654 -15.4652 -14.5039 -14.5036 -13.3549 -13.3460 -13.0626 -13.0579 -12.6770 -12.6726 -12.5481 -12.5360 -12.3674 -12.3620 -5.0837 -5.0827 -3.3934 -3.3895 -1.9727 -1.9201 -1.3343 -1.3060 -0.7672 -0.7249 -0.0147 0.0241 0.4527 0.4710 1.0941 1.1168 1.4011 1.4055 1.7720 1.7811 2.1089 2.1165 2.4530 2.4628 2.7002 2.7018 3.0367 3.0463 3.3160 3.3174 3.7284 3.7310 3.9193 3.9239 4.0059 4.0138 4.0922 4.1031 4.2903 4.2962 4.6594 4.6609 9.8579 9.8627 10.9501 10.9541 11.9421 11.9516 12.8943 12.9190 13.3356 13.4349 13.5588 13.6554 k = 0.1973 0.2400 0.5765 ( 14137 PWs) bands (ev): -37.8012 -37.8012 -15.4761 -15.4758 -14.4896 -14.4892 -13.3592 -13.3512 -13.0651 -13.0600 -12.6723 -12.6686 -12.5411 -12.5283 -12.3706 -12.3649 -5.1112 -5.1102 -3.3642 -3.3599 -1.9489 -1.8957 -1.3755 -1.3485 -0.7889 -0.7460 0.0096 0.0483 0.4768 0.4938 1.0906 1.1132 1.3727 1.3783 1.7653 1.7736 2.0977 2.1045 2.4718 2.4828 2.6860 2.6879 3.0349 3.0449 3.3162 3.3178 3.7294 3.7322 3.9376 3.9406 4.0188 4.0254 4.0921 4.1025 4.2891 4.2947 4.6642 4.6656 9.8719 9.8762 10.9188 10.9234 11.9640 11.9704 12.9026 12.9255 13.3198 13.4175 13.5272 13.6254 k = 0.1869 0.2273 0.5765 ( 14127 PWs) bands (ev): -37.8012 -37.8012 -15.4872 -15.4870 -14.4738 -14.4733 -13.3630 -13.3559 -13.0688 -13.0633 -12.6673 -12.6644 -12.5345 -12.5211 -12.3744 -12.3683 -5.1377 -5.1368 -3.3337 -3.3289 -1.9242 -1.8705 -1.4170 -1.3916 -0.8107 -0.7672 0.0345 0.0730 0.5011 0.5170 1.0778 1.0995 1.3502 1.3577 1.7572 1.7647 2.0856 2.0917 2.4924 2.5044 2.6735 2.6757 3.0340 3.0443 3.3177 3.3195 3.7296 3.7324 3.9543 3.9557 4.0299 4.0349 4.0941 4.1040 4.2871 4.2923 4.6690 4.6702 9.8866 9.8906 10.8862 10.8914 11.9896 11.9934 12.9110 12.9320 13.3030 13.3993 13.4954 13.5952 k = 0.1765 0.2147 0.5765 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.4986 -15.4984 -14.4567 -14.4562 -13.3662 -13.3600 -13.0735 -13.0676 -12.6622 -12.6600 -12.5284 -12.5142 -12.3787 -12.3721 -5.1631 -5.1623 -3.3019 -3.2967 -1.8987 -1.8446 -1.4585 -1.4349 -0.8324 -0.7884 0.0595 0.0977 0.5257 0.5406 1.0554 1.0760 1.3341 1.3439 1.7474 1.7543 2.0730 2.0785 2.5144 2.5271 2.6627 2.6653 3.0342 3.0448 3.3205 3.3224 3.7290 3.7318 3.9663 3.9689 4.0393 4.0437 4.0990 4.1086 4.2844 4.2892 4.6737 4.6747 9.9021 9.9057 10.8527 10.8583 12.0179 12.0208 12.9193 12.9383 13.2856 13.3805 13.4633 13.5648 k = 0.1661 0.2021 0.5765 ( 14123 PWs) bands (ev): -37.8012 -37.8012 -15.5101 -15.5099 -14.4387 -14.4381 -13.3689 -13.3636 -13.0793 -13.0731 -12.6571 -12.6553 -12.5230 -12.5079 -12.3835 -12.3763 -5.1874 -5.1866 -3.2691 -3.2634 -1.8725 -1.8180 -1.4995 -1.4784 -0.8541 -0.8095 0.0841 0.1219 0.5506 0.5646 1.0252 1.0447 1.3234 1.3354 1.7361 1.7424 2.0604 2.0654 2.5369 2.5503 2.6535 2.6565 3.0356 3.0464 3.3245 3.3264 3.7279 3.7306 3.9724 3.9771 4.0481 4.0543 4.1065 4.1160 4.2811 4.2855 4.6781 4.6790 9.9183 9.9215 10.8186 10.8245 12.0481 12.0528 12.9274 12.9443 13.2678 13.3614 13.4310 13.5342 k = 0.1558 0.1894 0.5765 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.5216 -15.5214 -14.4199 -14.4193 -13.3709 -13.3665 -13.0861 -13.0796 -12.6520 -12.6503 -12.5182 -12.5021 -12.3885 -12.3807 -5.2104 -5.2096 -3.2355 -3.2293 -1.8459 -1.7911 -1.5395 -1.5216 -0.8757 -0.8305 0.1077 0.1451 0.5757 0.5889 0.9896 1.0083 1.3162 1.3300 1.7233 1.7291 2.0481 2.0527 2.5595 2.5734 2.6459 2.6494 3.0386 3.0495 3.3296 3.3314 3.7264 3.7289 3.9726 3.9781 4.0594 4.0672 4.1156 4.1253 4.2775 4.2814 4.6823 4.6831 9.9351 9.9379 10.7843 10.7903 12.0808 12.0881 12.9351 12.9499 13.2498 13.3423 13.3987 13.5037 k = 0.1454 0.1768 0.5765 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.5329 -15.5327 -14.4007 -14.4000 -13.3722 -13.3686 -13.0939 -13.0872 -12.6470 -12.6449 -12.5141 -12.4969 -12.3938 -12.3853 -5.2321 -5.2314 -3.2012 -3.1945 -1.8195 -1.7645 -1.5771 -1.5642 -0.8972 -0.8514 0.1299 0.1667 0.6009 0.6135 0.9513 0.9697 1.3107 1.3257 1.7091 1.7146 2.0366 2.0408 2.5812 2.5955 2.6401 2.6443 3.0432 3.0542 3.3356 3.3374 3.7244 3.7268 3.9679 3.9730 4.0735 4.0817 4.1254 4.1353 4.2737 4.2772 4.6863 4.6869 9.9524 9.9549 10.7500 10.7560 12.1160 12.1261 12.9422 12.9549 13.2318 13.3235 13.3664 13.4734 k = 0.1350 0.1642 0.5765 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.5439 -15.5437 -14.3812 -14.3805 -13.3727 -13.3699 -13.1028 -13.0957 -12.6420 -12.6393 -12.5108 -12.4925 -12.3991 -12.3899 -5.2524 -5.2517 -3.1666 -3.1594 -1.7951 -1.7401 -1.6099 -1.6046 -0.9185 -0.8722 0.1499 0.1859 0.6261 0.6384 0.9124 0.9309 1.3054 1.3212 1.6936 1.6989 2.0262 2.0300 2.6001 2.6142 2.6377 2.6427 3.0496 3.0606 3.3423 3.3440 3.7217 3.7240 3.9600 3.9639 4.0892 4.0969 4.1351 4.1453 4.2699 4.2731 4.6900 4.6905 9.9701 9.9723 10.7159 10.7219 12.1536 12.1663 12.9485 12.9589 13.2140 13.3052 13.3344 13.4433 k = 0.1246 0.1516 0.5765 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5545 -15.5543 -14.3618 -14.3610 -13.3724 -13.3704 -13.1125 -13.1052 -12.6369 -12.6336 -12.5084 -12.4889 -12.4044 -12.3944 -5.2713 -5.2707 -3.1318 -3.1242 -1.7774 -1.7227 -1.6431 -1.6279 -0.9396 -0.8928 0.1671 0.2021 0.6511 0.6636 0.8750 0.8938 1.2993 1.3155 1.6772 1.6823 2.0169 2.0203 2.6122 2.6216 2.6444 2.6495 3.0582 3.0690 3.3495 3.3511 3.7182 3.7206 3.9499 3.9528 4.1049 4.1118 4.1445 4.1546 4.2664 4.2693 4.6934 4.6938 9.9882 9.9901 10.6823 10.6881 12.1931 12.2085 12.9536 12.9619 13.1966 13.2872 13.3033 13.4137 k = 0.1142 0.1389 0.5765 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.5646 -15.5645 -14.3427 -14.3419 -13.3713 -13.3698 -13.1231 -13.1156 -12.6318 -12.6278 -12.5068 -12.4863 -12.4092 -12.3986 -5.2888 -5.2882 -3.0972 -3.0891 -1.7765 -1.7236 -1.6636 -1.6257 -0.9607 -0.9134 0.1809 0.2145 0.6757 0.6889 0.8406 0.8602 1.2920 1.3083 1.6601 1.6651 2.0089 2.0120 2.6154 2.6204 2.6582 2.6654 3.0688 3.0794 3.3570 3.3585 3.7135 3.7162 3.9387 3.9414 4.1199 4.1251 4.1536 4.1631 4.2635 4.2662 4.6964 4.6968 10.0066 10.0083 10.6494 10.6550 12.2342 12.2522 12.9571 12.9635 13.1798 13.2669 13.2764 13.3848 k = 0.1038 0.1263 0.5765 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.5741 -15.5740 -14.3242 -14.3233 -13.3694 -13.3681 -13.1344 -13.1268 -12.6266 -12.6220 -12.5061 -12.4849 -12.4135 -12.4024 -5.3048 -5.3042 -3.0629 -3.0545 -1.7950 -1.7499 -1.6534 -1.6056 -0.9816 -0.9340 0.1907 0.2224 0.6989 0.7143 0.8105 0.8319 1.2831 1.2991 1.6428 1.6477 2.0021 2.0049 2.6146 2.6179 2.6743 2.6823 3.0817 3.0919 3.3644 3.3659 3.7073 3.7107 3.9271 3.9307 4.1331 4.1358 4.1630 4.1708 4.2615 4.2641 4.6992 4.6995 10.0251 10.0267 10.6173 10.6227 12.2768 12.2972 12.9583 12.9634 13.1639 13.2394 13.2589 13.3569 k = 0.0935 0.1137 0.5765 ( 14107 PWs) bands (ev): -37.8012 -37.8012 -15.5829 -15.5828 -14.3065 -14.3056 -13.3668 -13.3653 -13.1463 -13.1387 -12.6214 -12.6161 -12.5063 -12.4847 -12.4170 -12.4058 -5.3193 -5.3188 -3.0294 -3.0208 -1.8233 -1.7852 -1.6282 -1.5780 -1.0024 -0.9546 0.1962 0.2256 0.7190 0.7395 0.7860 0.8115 1.2726 1.2881 1.6257 1.6305 1.9965 1.9990 2.6129 2.6154 2.6898 2.6978 3.0966 3.1063 3.3715 3.3730 3.6995 3.7036 3.9164 3.9213 4.1423 4.1437 4.1731 4.1784 4.2605 4.2631 4.7016 4.7019 10.0436 10.0452 10.5862 10.5914 12.3203 12.3430 12.9567 12.9609 13.1489 13.2116 13.2451 13.3303 k = 0.0831 0.1010 0.5765 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.5910 -15.5908 -14.2898 -14.2889 -13.3634 -13.3613 -13.1587 -13.1512 -12.6163 -12.6104 -12.5072 -12.4858 -12.4196 -12.4086 -5.3323 -5.3318 -2.9969 -2.9883 -1.8544 -1.8214 -1.5982 -1.5477 -1.0230 -0.9754 0.1973 0.2239 0.7319 0.7602 0.7714 0.8033 1.2604 1.2752 1.6091 1.6138 1.9920 1.9942 2.6110 2.6131 2.7040 2.7114 3.1134 3.1225 3.3780 3.3795 3.6900 3.6947 3.9073 3.9133 4.1457 4.1499 4.1835 4.1868 4.2608 4.2632 4.7037 4.7040 10.0621 10.0637 10.5564 10.5612 12.3645 12.3892 12.9517 12.9555 13.1351 13.1858 13.2333 13.3055 k = 0.0727 0.0884 0.5765 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.5982 -15.5981 -14.2744 -14.2736 -13.3590 -13.3564 -13.1715 -13.1640 -12.6111 -12.6048 -12.5089 -12.4882 -12.4212 -12.4110 -5.3437 -5.3434 -2.9661 -2.9575 -1.8851 -1.8564 -1.5665 -1.5167 -1.0434 -0.9963 0.1944 0.2179 0.7345 0.7515 0.7911 0.8104 1.2469 1.2608 1.5935 1.5980 1.9884 1.9903 2.6094 2.6112 2.7164 2.7231 3.1318 3.1402 3.3835 3.3852 3.6791 3.6842 3.9004 3.9071 4.1462 4.1523 4.1934 4.1962 4.2620 4.2642 4.7056 4.7057 10.0804 10.0820 10.5281 10.5325 12.4090 12.4356 12.9427 12.9464 13.1228 13.1629 13.2233 13.2829 k = 0.0623 0.0758 0.5765 ( 14102 PWs) bands (ev): -37.8012 -37.8012 -15.6046 -15.6045 -14.2606 -14.2598 -13.3538 -13.3507 -13.1843 -13.1770 -12.6060 -12.5995 -12.5110 -12.4916 -12.4220 -12.4128 -5.3537 -5.3533 -2.9373 -2.9291 -1.9141 -1.8891 -1.5344 -1.4861 -1.0632 -1.0173 0.1885 0.2086 0.7321 0.7425 0.8150 0.8269 1.2325 1.2452 1.5793 1.5834 1.9856 1.9872 2.6079 2.6095 2.7270 2.7328 3.1511 3.1588 3.3879 3.3896 3.6671 3.6723 3.8956 3.9026 4.1448 4.1515 4.2028 4.2055 4.2640 4.2659 4.7071 4.7073 10.0982 10.0999 10.5015 10.5056 12.4535 12.4815 12.9288 12.9335 13.1124 13.1436 13.2152 13.2629 k = 0.0519 0.0631 0.5765 ( 14091 PWs) bands (ev): -37.8012 -37.8012 -15.6101 -15.6100 -14.2485 -14.2478 -13.3477 -13.3443 -13.1969 -13.1900 -12.6011 -12.5945 -12.5133 -12.4958 -12.4222 -12.4144 -5.3621 -5.3618 -2.9111 -2.9035 -1.9402 -1.9189 -1.5028 -1.4571 -1.0821 -1.0384 0.1807 0.1973 0.7297 0.7369 0.8379 0.8465 1.2176 1.2290 1.5668 1.5705 1.9835 1.9848 2.6067 2.6080 2.7358 2.7406 3.1708 3.1776 3.3908 3.3927 3.6547 3.6597 3.8929 3.8997 4.1425 4.1489 4.2113 4.2139 4.2663 4.2679 4.7084 4.7085 10.1153 10.1169 10.4770 10.4807 12.4975 12.5264 12.9098 12.9172 13.1039 13.1278 13.2090 13.2458 k = 0.0415 0.0505 0.5765 ( 14097 PWs) bands (ev): -37.8012 -37.8012 -15.6146 -15.6145 -14.2383 -14.2377 -13.3411 -13.3375 -13.2089 -13.2025 -12.5965 -12.5902 -12.5155 -12.5004 -12.4219 -12.4156 -5.3690 -5.3688 -2.8881 -2.8815 -1.9625 -1.9451 -1.4725 -1.4309 -1.0993 -1.0591 0.1724 0.1854 0.7287 0.7338 0.8591 0.8658 1.2031 1.2129 1.5563 1.5594 1.9819 1.9830 2.6058 2.6069 2.7428 2.7467 3.1899 3.1958 3.3923 3.3942 3.6429 3.6473 3.8919 3.8980 4.1397 4.1454 4.2187 4.2210 4.2685 4.2698 4.7094 4.7095 10.1312 10.1327 10.4552 10.4584 12.5405 12.5695 12.8864 12.8973 13.0975 13.1154 13.2045 13.2318 k = 0.0312 0.0379 0.5765 ( 14101 PWs) bands (ev): -37.8012 -37.8012 -15.6181 -15.6181 -14.2302 -14.2297 -13.3343 -13.3309 -13.2197 -13.2141 -12.5922 -12.5868 -12.5172 -12.5050 -12.4214 -12.4166 -5.3743 -5.3742 -2.8690 -2.8636 -1.9804 -1.9670 -1.4446 -1.4091 -1.1135 -1.0791 0.1647 0.1744 0.7289 0.7324 0.8779 0.8830 1.1900 1.1979 1.5479 1.5504 1.9808 1.9816 2.6051 2.6059 2.7483 2.7512 3.2073 3.2122 3.3924 3.3941 3.6326 3.6361 3.8920 3.8970 4.1371 4.1418 4.2247 4.2266 4.2706 4.2715 4.7102 4.7103 10.1451 10.1465 10.4368 10.4393 12.5818 12.6095 12.8605 12.8746 13.0931 13.1059 13.2016 13.2208 k = 0.0208 0.0253 0.5765 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.6207 -15.6206 -14.2242 -14.2239 -13.3280 -13.3251 -13.2284 -13.2241 -12.5885 -12.5844 -12.5180 -12.5094 -12.4207 -12.4175 -5.3781 -5.3780 -2.8545 -2.8507 -1.9930 -1.9839 -1.4203 -1.3938 -1.1232 -1.0974 0.1588 0.1652 0.7297 0.7320 0.8930 0.8966 1.1795 1.1851 1.5420 1.5437 1.9801 1.9807 2.6047 2.6052 2.7522 2.7542 3.2218 3.2253 3.3916 3.3930 3.6247 3.6272 3.8928 3.8963 4.1352 4.1385 4.2292 4.2305 4.2722 4.2728 4.7108 4.7108 10.1564 10.1574 10.4226 10.4244 12.6198 12.6440 12.8352 12.8503 13.0906 13.0988 13.2004 13.2125 k = 0.0104 0.0126 0.5765 ( 14098 PWs) bands (ev): -37.8012 -37.8012 -15.6222 -15.6222 -14.2206 -14.2205 -13.3230 -13.3213 -13.2338 -13.2314 -12.5857 -12.5834 -12.5177 -12.5132 -12.4199 -12.4183 -5.3804 -5.3804 -2.8451 -2.8431 -1.9999 -1.9953 -1.4014 -1.3870 -1.1266 -1.1126 0.1555 0.1587 0.7307 0.7317 0.9032 0.9052 1.1731 1.1761 1.5385 1.5394 1.9798 1.9801 2.6045 2.6047 2.7548 2.7557 3.2319 3.2337 3.3907 3.3916 3.6199 3.6212 3.8938 3.8957 4.1343 4.1360 4.2321 4.2328 4.2732 4.2736 4.7111 4.7111 10.1638 10.1644 10.4137 10.4146 12.6516 12.6673 12.8163 12.8275 13.0899 13.0939 13.2008 13.2066 k = 0.0000 0.0000 0.5765 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.6227 -15.6227 -14.2193 -14.2193 -13.3205 -13.3205 -13.2349 -13.2349 -12.5839 -12.5839 -12.5160 -12.5160 -12.4191 -12.4191 -5.3811 -5.3811 -2.8412 -2.8412 -2.0007 -2.0007 -1.3897 -1.3897 -1.1229 -1.1229 0.1555 0.1555 0.7314 0.7314 0.9075 0.9075 1.1719 1.1719 1.5377 1.5377 1.9798 1.9798 2.6045 2.6045 2.7559 2.7559 3.2361 3.2361 3.3906 3.3906 3.6187 3.6187 3.8948 3.8948 4.1345 4.1345 4.2333 4.2333 4.2737 4.2737 4.7112 4.7112 10.1666 10.1666 10.4109 10.4109 12.6704 12.6704 12.8132 12.8132 13.0910 13.0910 13.2028 13.2028 k = 0.0000 0.0000 0.5765 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.6227 -15.6227 -14.2193 -14.2193 -13.3205 -13.3205 -13.2349 -13.2349 -12.5839 -12.5839 -12.5160 -12.5160 -12.4191 -12.4191 -5.3811 -5.3811 -2.8412 -2.8412 -2.0007 -2.0007 -1.3897 -1.3897 -1.1229 -1.1229 0.1555 0.1555 0.7314 0.7314 0.9075 0.9075 1.1719 1.1719 1.5377 1.5377 1.9798 1.9798 2.6045 2.6045 2.7559 2.7559 3.2361 3.2361 3.3906 3.3906 3.6187 3.6187 3.8948 3.8948 4.1345 4.1345 4.2333 4.2333 4.2737 4.2737 4.7112 4.7112 10.1666 10.1666 10.4109 10.4109 12.6704 12.6704 12.8132 12.8132 13.0910 13.0910 13.2028 13.2028 k = 0.0125-0.0103 0.5765 ( 14092 PWs) bands (ev): -37.8012 -37.8012 -15.6224 -15.6224 -14.2195 -14.2195 -13.3206 -13.3202 -13.2350 -13.2349 -12.5847 -12.5839 -12.5161 -12.5158 -12.4196 -12.4189 -5.3805 -5.3804 -2.8419 -2.8418 -2.0052 -1.9998 -1.3921 -1.3843 -1.1214 -1.1210 0.1556 0.1558 0.7311 0.7323 0.9060 0.9073 1.1734 1.1735 1.5356 1.5357 1.9802 1.9810 2.6061 2.6066 2.7533 2.7536 3.2366 3.2371 3.3911 3.3916 3.6186 3.6188 3.8945 3.8947 4.1346 4.1347 4.2327 4.2328 4.2728 4.2729 4.7101 4.7103 10.1665 10.1670 10.4111 10.4115 12.6695 12.6711 12.8130 12.8152 13.0901 13.0931 13.2029 13.2034 k = 0.0250-0.0206 0.5765 ( 14086 PWs) bands (ev): -37.8012 -37.8012 -15.6216 -15.6216 -14.2201 -14.2199 -13.3205 -13.3198 -13.2351 -13.2348 -12.5865 -12.5848 -12.5161 -12.5153 -12.4203 -12.4188 -5.3786 -5.3784 -2.8440 -2.8438 -2.0133 -2.0027 -1.3914 -1.3761 -1.1165 -1.1156 0.1561 0.1566 0.7315 0.7339 0.9027 0.9054 1.1781 1.1782 1.5296 1.5297 1.9823 1.9838 2.6114 2.6124 2.7459 2.7465 3.2385 3.2395 3.3929 3.3939 3.6185 3.6191 3.8936 3.8942 4.1348 4.1349 4.2311 4.2314 4.2702 4.2704 4.7070 4.7075 10.1664 10.1674 10.4122 10.4130 12.6687 12.6718 12.8145 12.8190 13.0904 13.0966 13.2040 13.2051 k = 0.0375-0.0308 0.5765 ( 14094 PWs) bands (ev): -37.8012 -37.8012 -15.6202 -15.6202 -14.2209 -14.2207 -13.3203 -13.3192 -13.2353 -13.2348 -12.5891 -12.5866 -12.5159 -12.5148 -12.4211 -12.4190 -5.3754 -5.3751 -2.8475 -2.8472 -2.0246 -2.0092 -1.3878 -1.3653 -1.1082 -1.1069 0.1571 0.1578 0.7325 0.7362 0.8977 0.9017 1.1858 1.1859 1.5200 1.5201 1.9860 1.9882 2.6202 2.6216 2.7338 2.7348 3.2418 3.2433 3.3961 3.3975 3.6185 3.6193 3.8923 3.8931 4.1351 4.1354 4.2285 4.2289 4.2659 4.2662 4.7020 4.7028 10.1665 10.1680 10.4141 10.4152 12.6677 12.6723 12.8177 12.8246 13.0917 13.1013 13.2061 13.2081 k = 0.0500-0.0411 0.5765 ( 14092 PWs) bands (ev): -37.8012 -37.8012 -15.6183 -15.6183 -14.2221 -14.2218 -13.3200 -13.3185 -13.2355 -13.2349 -12.5924 -12.5893 -12.5155 -12.5141 -12.4223 -12.4195 -5.3708 -5.3705 -2.8521 -2.8517 -2.0388 -2.0192 -1.3814 -1.3525 -1.0967 -1.0949 0.1585 0.1594 0.7341 0.7391 0.8908 0.8961 1.1965 1.1967 1.5074 1.5074 1.9910 1.9940 2.6322 2.6339 2.7175 2.7187 3.2462 3.2481 3.4006 3.4025 3.6185 3.6195 3.8906 3.8916 4.1356 4.1360 4.2249 4.2254 4.2600 4.2605 4.6952 4.6962 10.1667 10.1687 10.4168 10.4183 12.6665 12.6727 12.8224 12.8318 13.0935 13.1070 13.2097 13.2128 k = 0.0625-0.0514 0.5765 ( 14098 PWs) bands (ev): -37.8012 -37.8012 -15.6159 -15.6158 -14.2236 -14.2233 -13.3194 -13.3176 -13.2357 -13.2349 -12.5966 -12.5927 -12.5151 -12.5134 -12.4236 -12.4202 -5.3650 -5.3646 -2.8578 -2.8573 -2.0553 -2.0321 -1.3726 -1.3380 -1.0822 -1.0797 0.1604 0.1615 0.7363 0.7425 0.8818 0.8885 1.2102 1.2105 1.4924 1.4925 1.9973 2.0009 2.6468 2.6490 2.6971 2.6988 3.2514 3.2538 3.4065 3.4088 3.6185 3.6198 3.8883 3.8895 4.1363 4.1368 4.2202 4.2208 4.2527 4.2533 4.6865 4.6879 10.1671 10.1695 10.4202 10.4222 12.6651 12.6728 12.8285 12.8406 13.0955 13.1131 13.2153 13.2197 k = 0.0750-0.0617 0.5765 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.6130 -15.6129 -14.2254 -14.2250 -13.3186 -13.3164 -13.2360 -13.2350 -12.6014 -12.5968 -12.5146 -12.5126 -12.4253 -12.4213 -5.3579 -5.3574 -2.8645 -2.8639 -2.0739 -2.0478 -1.3618 -1.3221 -1.0647 -1.0615 0.1629 0.1642 0.7388 0.7465 0.8707 0.8788 1.2268 1.2271 1.4757 1.4760 2.0046 2.0089 2.6620 2.6651 2.6746 2.6770 3.2571 3.2599 3.4136 3.4164 3.6185 3.6200 3.8855 3.8869 4.1370 4.1377 4.2145 4.2152 4.2442 4.2449 4.6763 4.6779 10.1676 10.1704 10.4244 10.4268 12.6635 12.6726 12.8358 12.8509 13.0972 13.1193 13.2235 13.2293 k = 0.0875-0.0719 0.5765 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.6095 -15.6094 -14.2275 -14.2271 -13.3176 -13.3151 -13.2362 -13.2352 -12.6068 -12.6016 -12.5140 -12.5117 -12.4273 -12.4228 -5.3495 -5.3489 -2.8720 -2.8714 -2.0942 -2.0657 -1.3494 -1.3054 -1.0445 -1.0406 0.1659 0.1673 0.7416 0.7509 0.8572 0.8666 1.2461 1.2465 1.4581 1.4588 2.0129 2.0177 2.6452 2.6464 2.6846 2.6866 3.2631 3.2664 3.4219 3.4251 3.6183 3.6201 3.8821 3.8837 4.1379 4.1386 4.2077 4.2085 4.2346 4.2354 4.6645 4.6664 10.1683 10.1715 10.4294 10.4321 12.6614 12.6720 12.8442 12.8625 13.0984 13.1251 13.2348 13.2420 k = 0.1000-0.0822 0.5765 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.6056 -15.6055 -14.2300 -14.2295 -13.3162 -13.3134 -13.2365 -13.2353 -12.6128 -12.6071 -12.5135 -12.5109 -12.4296 -12.4246 -5.3399 -5.3392 -2.8802 -2.8794 -2.1158 -2.0854 -1.3357 -1.2881 -1.0217 -1.0170 0.1695 0.1710 0.7445 0.7555 0.8414 0.8519 1.2680 1.2685 1.4405 1.4415 2.0220 2.0273 2.6151 2.6169 2.7047 2.7073 3.2693 3.2730 3.4313 3.4350 3.6181 3.6200 3.8782 3.8799 4.1387 4.1396 4.1999 4.2008 4.2242 4.2252 4.6515 4.6536 10.1691 10.1727 10.4350 10.4380 12.6590 12.6709 12.8533 12.8752 13.0991 13.1304 13.2494 13.2579 k = 0.1125-0.0925 0.5765 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.6012 -15.6011 -14.2327 -14.2322 -13.3146 -13.3115 -13.2368 -13.2355 -12.6192 -12.6130 -12.5130 -12.5102 -12.4324 -12.4270 -5.3291 -5.3284 -2.8888 -2.8880 -2.1383 -2.1065 -1.3213 -1.2706 -0.9966 -0.9910 0.1738 0.1753 0.7468 0.7600 0.8234 0.8348 1.2925 1.2929 1.4235 1.4250 2.0318 2.0377 2.5824 2.5844 2.7261 2.7291 3.2753 3.2794 3.4418 3.4459 3.6176 3.6197 3.8737 3.8755 4.1393 4.1404 4.1910 4.1920 4.2135 4.2145 4.6372 4.6397 10.1700 10.1739 10.4412 10.4446 12.6561 12.6693 12.8629 12.8887 13.0994 13.1354 13.2675 13.2769 k = 0.1250-0.1028 0.5765 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.5963 -15.5962 -14.2358 -14.2352 -13.3126 -13.3093 -13.2371 -13.2356 -12.6261 -12.6194 -12.5125 -12.5095 -12.4356 -12.4297 -5.3171 -5.3163 -2.8978 -2.8969 -2.1616 -2.1288 -1.3063 -1.2531 -0.9694 -0.9628 0.1787 0.1803 0.7474 0.7636 0.8044 0.8157 1.3192 1.3197 1.4077 1.4097 2.0424 2.0487 2.5474 2.5495 2.7482 2.7514 3.2811 3.2856 3.4532 3.4577 3.6168 3.6191 3.8686 3.8705 4.1395 4.1409 4.1812 4.1822 4.2030 4.2041 4.6220 4.6247 10.1710 10.1752 10.4480 10.4517 12.6528 12.6671 12.8726 12.9026 13.0997 13.1403 13.2886 13.2987 k = 0.1375-0.1130 0.5765 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.5911 -15.5910 -14.2391 -14.2386 -13.3103 -13.3066 -13.2374 -13.2358 -12.6333 -12.6262 -12.5122 -12.5090 -12.4392 -12.4330 -5.3040 -5.3031 -2.9069 -2.9059 -2.1853 -2.1519 -1.2911 -1.2359 -0.9402 -0.9326 0.1842 0.1859 0.7423 0.7628 0.7879 0.7978 1.3480 1.3483 1.3938 1.3964 2.0536 2.0603 2.5104 2.5126 2.7704 2.7739 3.2865 3.2914 3.4654 3.4703 3.6156 3.6180 3.8628 3.8648 4.1387 4.1404 4.1704 4.1716 4.1935 4.1946 4.6060 4.6090 10.1721 10.1766 10.4553 10.4594 12.6490 12.6644 12.8821 12.9164 13.1006 13.1457 13.3123 13.3231 k = 0.1500-0.1233 0.5765 ( 14128 PWs) bands (ev): -37.8012 -37.8012 -15.5854 -15.5853 -14.2427 -14.2421 -13.3076 -13.3037 -13.2378 -13.2359 -12.6408 -12.6333 -12.5121 -12.5086 -12.4433 -12.4368 -5.2898 -5.2888 -2.9160 -2.9149 -2.2094 -2.1756 -1.2759 -1.2190 -0.9093 -0.9007 0.1905 0.1922 0.7256 0.7486 0.7801 0.7903 1.3763 1.3773 1.3834 1.3877 2.0655 2.0725 2.4717 2.4739 2.7925 2.7963 3.2915 3.2967 3.4783 3.4835 3.6139 3.6164 3.8563 3.8583 4.1362 4.1382 4.1587 4.1600 4.1861 4.1871 4.5894 4.5927 10.1733 10.1780 10.4631 10.4675 12.6448 12.6611 12.8912 12.9297 13.1026 13.1520 13.3382 13.3497 k = 0.1625-0.1336 0.5765 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5794 -15.5793 -14.2466 -14.2460 -13.3044 -13.3003 -13.2381 -13.2361 -12.6485 -12.6406 -12.5121 -12.5085 -12.4479 -12.4410 -5.2745 -5.2734 -2.9250 -2.9238 -2.2335 -2.1996 -1.2610 -1.2027 -0.8769 -0.8672 0.1976 0.1992 0.6986 0.7220 0.7794 0.7919 1.3717 1.3740 1.4119 1.4132 2.0781 2.0854 2.4315 2.4338 2.8141 2.8181 3.2960 3.3015 3.4916 3.4971 3.6115 3.6140 3.8492 3.8512 4.1312 4.1334 4.1464 4.1479 4.1819 4.1828 4.5724 4.5760 10.1744 10.1794 10.4713 10.4760 12.6402 12.6573 12.8996 12.9418 13.1065 13.1595 13.3659 13.3779 k = 0.1750-0.1439 0.5765 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.5731 -15.5729 -14.2507 -14.2501 -13.3008 -13.2965 -13.2383 -13.2362 -12.6563 -12.6482 -12.5124 -12.5086 -12.4529 -12.4458 -5.2582 -5.2571 -2.9337 -2.9324 -2.2575 -2.2237 -1.2463 -1.1871 -0.8432 -0.8323 0.2054 0.2070 0.6658 0.6897 0.7814 0.7960 1.3644 1.3672 1.4459 1.4470 2.0913 2.0989 2.3902 2.3924 2.8350 2.8392 3.2999 3.3058 3.5052 3.5110 3.6084 3.6108 3.8414 3.8433 4.1239 4.1258 4.1335 4.1357 4.1810 4.1819 4.5551 4.5591 10.1756 10.1807 10.4798 10.4849 12.6352 12.6530 12.9070 12.9520 13.1128 13.1685 13.3947 13.4075 k = 0.1875-0.1542 0.5765 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.5665 -15.5663 -14.2550 -14.2544 -13.2968 -13.2923 -13.2386 -13.2363 -12.6643 -12.6558 -12.5129 -12.5090 -12.4584 -12.4511 -5.2410 -5.2398 -2.9420 -2.9407 -2.2814 -2.2478 -1.2322 -1.1722 -0.8082 -0.7963 0.2140 0.2156 0.6295 0.6540 0.7841 0.8006 1.3594 1.3623 1.4813 1.4823 2.1053 2.1131 2.3480 2.3501 2.8548 2.8592 3.3032 3.3093 3.5189 3.5249 3.6042 3.6065 3.8329 3.8347 4.1144 4.1152 4.1210 4.1246 4.1827 4.1838 4.5379 4.5421 10.1768 10.1820 10.4887 10.4940 12.6299 12.6482 12.9133 12.9601 13.1218 13.1790 13.4243 13.4378 k = 0.2000-0.1644 0.5765 ( 14128 PWs) bands (ev): -37.8012 -37.8012 -15.5596 -15.5594 -14.2596 -14.2589 -13.2924 -13.2876 -13.2388 -13.2364 -12.6723 -12.6635 -12.5138 -12.5097 -12.4644 -12.4569 -5.2229 -5.2217 -2.9499 -2.9485 -2.3049 -2.2718 -1.2186 -1.1582 -0.7723 -0.7593 0.2233 0.2249 0.5904 0.6155 0.7869 0.8050 1.3564 1.3594 1.5178 1.5188 2.1199 2.1279 2.3052 2.3071 2.8734 2.8781 3.3058 3.3122 3.5324 3.5385 3.5990 3.6010 3.8237 3.8254 4.1020 4.1020 4.1109 4.1154 4.1865 4.1878 4.5207 4.5251 10.1778 10.1831 10.4977 10.5034 12.6243 12.6430 12.9187 12.9658 13.1336 13.1908 13.4541 13.4685 k = 0.2125-0.1747 0.5765 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.5525 -15.5523 -14.2643 -14.2636 -13.2875 -13.2825 -13.2390 -13.2364 -12.6802 -12.6712 -12.5150 -12.5108 -12.4708 -12.4631 -5.2041 -5.2028 -2.9572 -2.9558 -2.3281 -2.2954 -1.2057 -1.1450 -0.7355 -0.7214 0.2335 0.2350 0.5492 0.5749 0.7894 0.8090 1.3554 1.3584 1.5551 1.5560 2.1351 2.1435 2.2621 2.2636 2.8908 2.8956 3.3078 3.3143 3.5457 3.5516 3.5926 3.5942 3.8140 3.8154 4.0875 4.0878 4.1030 4.1078 4.1920 4.1934 4.5037 4.5084 10.1787 10.1841 10.5070 10.5128 12.6184 12.6373 12.9230 12.9695 13.1477 13.2038 13.4837 13.4990 k = 0.2250-0.1850 0.5765 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.5452 -15.5450 -14.2691 -14.2684 -13.2822 -13.2770 -13.2391 -13.2363 -12.6881 -12.6789 -12.5165 -12.5122 -12.4776 -12.4698 -5.1845 -5.1832 -2.9639 -2.9625 -2.3507 -2.3187 -1.1933 -1.1326 -0.6980 -0.6829 0.2444 0.2459 0.5064 0.5326 0.7912 0.8123 1.3561 1.3590 1.5928 1.5937 2.1506 2.1597 2.2194 2.2200 2.9066 2.9117 3.3090 3.3157 3.5585 3.5635 3.5855 3.5860 3.8037 3.8049 4.0724 4.0729 4.0966 4.1016 4.1988 4.2005 4.4871 4.4920 10.1795 10.1849 10.5164 10.5224 12.6124 12.6314 12.9266 12.9715 13.1635 13.2175 13.5125 13.5289 k = 0.2375-0.1953 0.5765 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.5378 -15.5376 -14.2741 -14.2734 -13.2765 -13.2712 -13.2392 -13.2362 -12.6959 -12.6865 -12.5184 -12.5141 -12.4848 -12.4768 -5.1644 -5.1630 -2.9700 -2.9685 -2.3728 -2.3415 -1.1817 -1.1212 -0.6600 -0.6438 0.2560 0.2575 0.4624 0.4891 0.7922 0.8146 1.3582 1.3610 1.6307 1.6315 2.1610 2.1735 2.1797 2.1827 2.9209 2.9261 3.3094 3.3162 3.5694 3.5706 3.5764 3.5823 3.7930 3.7940 4.0572 4.0579 4.0917 4.0967 4.2070 4.2089 4.4709 4.4759 10.1800 10.1854 10.5258 10.5320 12.6061 12.6251 12.9296 12.9723 13.1803 13.2314 13.5400 13.5575 k = 0.2500-0.2055 0.5765 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.5302 -15.5300 -14.2791 -14.2784 -13.2705 -13.2649 -13.2392 -13.2359 -12.7035 -12.6939 -12.5207 -12.5163 -12.4923 -12.4842 -5.1437 -5.1423 -2.9754 -2.9739 -2.3942 -2.3638 -1.1706 -1.1105 -0.6215 -0.6044 0.2681 0.2697 0.4178 0.4448 0.7923 0.8159 1.3615 1.3642 1.6683 1.6690 2.1297 2.1331 2.1891 2.1948 2.9335 2.9390 3.3091 3.3158 3.5617 3.5649 3.5824 3.5903 3.7821 3.7827 4.0420 4.0430 4.0882 4.0933 4.2166 4.2187 4.4552 4.4604 10.1804 10.1857 10.5352 10.5416 12.5998 12.6185 12.9322 12.9723 13.1974 13.2451 13.5656 13.5843 k = 0.2625-0.2158 0.5765 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.5227 -15.5225 -14.2842 -14.2835 -13.2642 -13.2584 -13.2390 -13.2355 -12.7109 -12.7012 -12.5234 -12.5189 -12.5000 -12.4919 -5.1227 -5.1213 -2.9801 -2.9787 -2.4149 -2.3854 -1.1602 -1.1007 -0.5828 -0.5647 0.2803 0.2824 0.3734 0.4002 0.7912 0.8160 1.3657 1.3683 1.7052 1.7058 2.0889 2.0912 2.2068 2.2134 2.9444 2.9501 3.3079 3.3146 3.5500 3.5524 3.5930 3.6002 3.7710 3.7713 4.0270 4.0282 4.0861 4.0912 4.2274 4.2297 4.4401 4.4453 10.1804 10.1857 10.5446 10.5511 12.5933 12.6117 12.9344 12.9719 13.2140 13.2581 13.5888 13.6087 k = 0.2750-0.2261 0.5765 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.5151 -15.5149 -14.2893 -14.2886 -13.2579 -13.2519 -13.2385 -13.2348 -12.7181 -12.7083 -12.5265 -12.5220 -12.5079 -12.4998 -5.1014 -5.0999 -2.9842 -2.9827 -2.4348 -2.4064 -1.1504 -1.0917 -0.5438 -0.5249 0.2899 0.2944 0.3322 0.3567 0.7889 0.8147 1.3707 1.3731 1.7405 1.7409 2.0493 2.0509 2.2259 2.2327 2.9536 2.9594 3.3058 3.3124 3.5367 3.5387 3.6028 3.6095 3.7599 3.7600 4.0123 4.0138 4.0853 4.0902 4.2395 4.2420 4.4256 4.4309 10.1802 10.1854 10.5538 10.5605 12.5867 12.6047 12.9365 12.9712 13.2296 13.2697 13.6091 13.6301 k = 0.2875-0.2364 0.5765 ( 14102 PWs) bands (ev): -37.8012 -37.8012 -15.5076 -15.5074 -14.2943 -14.2937 -13.2517 -13.2458 -13.2372 -13.2335 -12.7250 -12.7151 -12.5301 -12.5255 -12.5159 -12.5078 -5.0799 -5.0785 -2.9876 -2.9862 -2.4540 -2.4266 -1.1412 -1.0834 -0.5049 -0.4851 0.2728 0.2946 0.3185 0.3259 0.7852 0.8119 1.3763 1.3784 1.7728 1.7732 2.0127 2.0138 2.2461 2.2529 2.9609 2.9669 3.3028 3.3092 3.5224 3.5240 3.6118 3.6180 3.7488 3.7492 3.9981 3.9998 4.0855 4.0902 4.2528 4.2555 4.4117 4.4171 10.1797 10.1847 10.5629 10.5696 12.5801 12.5975 12.9386 12.9703 13.2437 13.2797 13.6259 13.6478 k = 0.3000-0.2466 0.5765 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.5002 -15.5000 -14.2993 -14.2987 -13.2463 -13.2420 -13.2334 -13.2312 -12.7315 -12.7216 -12.5343 -12.5295 -12.5236 -12.5157 -5.0584 -5.0570 -2.9903 -2.9890 -2.4723 -2.4460 -1.1325 -1.0759 -0.4660 -0.4455 0.2317 0.2589 0.3300 0.3319 0.7800 0.8075 1.3821 1.3841 1.7995 1.7996 1.9819 1.9826 2.2671 2.2738 2.9664 2.9725 3.2990 3.3052 3.5072 3.5087 3.6200 3.6257 3.7381 3.7388 3.9844 3.9863 4.0865 4.0909 4.2671 4.2699 4.3986 4.4039 10.1788 10.1837 10.5718 10.5785 12.5736 12.5903 12.9406 12.9694 13.2560 13.2876 13.6390 13.6613 k = 0.3125-0.2569 0.5765 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.4929 -15.4927 -14.3042 -14.3037 -13.2425 -13.2406 -13.2270 -13.2269 -12.7377 -12.7279 -12.5395 -12.5342 -12.5306 -12.5234 -5.0371 -5.0357 -2.9925 -2.9912 -2.4896 -2.4646 -1.1242 -1.0690 -0.4273 -0.4062 0.1887 0.2161 0.3447 0.3463 0.7733 0.8013 1.3882 1.3900 1.8147 1.8147 1.9627 1.9629 2.2888 2.2955 2.9701 2.9762 3.2945 3.3003 3.4916 3.4929 3.6273 3.6326 3.7280 3.7290 3.9714 3.9734 4.0880 4.0921 4.2823 4.2852 4.3862 4.3915 10.1777 10.1825 10.5805 10.5871 12.5671 12.5830 12.9425 12.9685 13.2660 13.2932 13.6480 13.6703 k = 0.3250-0.2672 0.5765 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.4858 -15.4856 -14.3090 -14.3085 -13.2403 -13.2400 -13.2212 -13.2196 -12.7435 -12.7338 -12.5459 -12.5399 -12.5366 -12.5304 -5.0160 -5.0147 -2.9941 -2.9928 -2.5061 -2.4824 -1.1163 -1.0628 -0.3889 -0.3673 0.1462 0.1734 0.3604 0.3620 0.7650 0.7935 1.3942 1.3959 1.8118 1.8120 1.9613 1.9614 2.3113 2.3177 2.9718 2.9779 3.2891 3.2946 3.4759 3.4770 3.6339 3.6387 3.7185 3.7199 3.9590 3.9612 4.0900 4.0938 4.2981 4.3011 4.3745 4.3798 10.1763 10.1809 10.5888 10.5954 12.5606 12.5757 12.9444 12.9675 13.2738 13.2966 13.6530 13.6746 k = 0.3375-0.2775 0.5765 ( 14102 PWs) bands (ev): -37.8012 -37.8012 -15.4789 -15.4788 -14.3136 -14.3131 -13.2395 -13.2390 -13.2143 -13.2120 -12.7490 -12.7394 -12.5532 -12.5466 -12.5418 -12.5364 -4.9955 -4.9941 -2.9953 -2.9940 -2.5215 -2.4992 -1.1088 -1.0572 -0.3510 -0.3291 0.1051 0.1316 0.3766 0.3783 0.7552 0.7838 1.4002 1.4017 1.7931 1.7932 1.9758 1.9760 2.3343 2.3406 2.9716 2.9777 3.2832 3.2883 3.4603 3.4613 3.6397 3.6441 3.7099 3.7115 3.9474 3.9496 4.0922 4.0957 4.3142 4.3173 4.3637 4.3689 10.1747 10.1790 10.5968 10.6033 12.5543 12.5685 12.9461 12.9663 13.2794 13.2979 13.6540 13.6745 k = 0.3500-0.2878 0.5765 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.4724 -15.4722 -14.3180 -14.3176 -13.2390 -13.2381 -13.2070 -13.2043 -12.7540 -12.7446 -12.5608 -12.5539 -12.5466 -12.5418 -4.9755 -4.9742 -2.9960 -2.9948 -2.5359 -2.5150 -1.1016 -1.0521 -0.3137 -0.2917 0.0656 0.0913 0.3930 0.3949 0.7439 0.7724 1.4060 1.4073 1.7667 1.7667 1.9982 1.9985 2.3578 2.3639 2.9694 2.9756 3.2769 3.2815 3.4451 3.4460 3.6449 3.6488 3.7021 3.7039 3.9365 3.9388 4.0946 4.0977 4.3303 4.3335 4.3537 4.3589 10.1729 10.1770 10.6044 10.6107 12.5482 12.5614 12.9475 12.9650 13.2829 13.2973 13.6517 13.6705 k = 0.3625-0.2980 0.5765 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.4661 -15.4660 -14.3222 -14.3218 -13.2386 -13.2375 -13.1996 -13.1968 -12.7585 -12.7494 -12.5684 -12.5616 -12.5512 -12.5469 -4.9563 -4.9550 -2.9963 -2.9951 -2.5493 -2.5298 -1.0947 -1.0477 -0.2772 -0.2554 0.0283 0.0528 0.4094 0.4116 0.7313 0.7595 1.4114 1.4126 1.7376 1.7378 2.0232 2.0234 2.3817 2.3876 2.9654 2.9715 3.2702 3.2744 3.4307 3.4315 3.6495 3.6529 3.6951 3.6971 3.9265 3.9288 4.0970 4.0998 4.3437 4.3439 4.3502 4.3522 10.1709 10.1747 10.6117 10.6177 12.5423 12.5544 12.9487 12.9635 13.2846 13.2953 13.6466 13.6634 k = 0.3750-0.3083 0.5765 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.4603 -15.4601 -14.3261 -14.3257 -13.2382 -13.2369 -13.1923 -13.1895 -12.7626 -12.7539 -12.5758 -12.5691 -12.5557 -12.5517 -4.9380 -4.9368 -2.9963 -2.9952 -2.5615 -2.5437 -1.0881 -1.0437 -0.2417 -0.2206 -0.0066 0.0164 0.4255 0.4281 0.7176 0.7450 1.4166 1.4176 1.7085 1.7088 2.0483 2.0484 2.4058 2.4114 2.9596 2.9655 3.2634 3.2671 3.4172 3.4179 3.6535 3.6564 3.6890 3.6910 3.9173 3.9195 4.0993 4.1018 4.3359 4.3395 4.3636 4.3655 10.1688 10.1723 10.6184 10.6241 12.5367 12.5477 12.9494 12.9618 13.2849 13.2923 13.6393 13.6540 k = 0.3875-0.3186 0.5765 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.4548 -15.4547 -14.3298 -14.3294 -13.2377 -13.2364 -13.1852 -13.1825 -12.7662 -12.7580 -12.5828 -12.5764 -12.5600 -12.5563 -4.9209 -4.9197 -2.9960 -2.9951 -2.5727 -2.5564 -1.0816 -1.0404 -0.2076 -0.1877 -0.0383 -0.0176 0.4413 0.4443 0.7031 0.7294 1.4213 1.4222 1.6806 1.6809 2.0724 2.0725 2.4298 2.4352 2.9521 2.9578 3.2566 3.2599 3.4048 3.4054 3.6569 3.6595 3.6836 3.6856 3.9090 3.9112 4.1016 4.1038 4.3284 4.3320 4.3784 4.3804 10.1666 10.1698 10.6247 10.6300 12.5314 12.5414 12.9498 12.9597 13.2843 13.2888 13.6307 13.6433 k = 0.4000-0.3289 0.5765 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.4498 -15.4497 -14.3331 -14.3328 -13.2373 -13.2360 -13.1785 -13.1759 -12.7693 -12.7617 -12.5893 -12.5833 -12.5641 -12.5608 -4.9050 -4.9040 -2.9956 -2.9947 -2.5827 -2.5680 -1.0755 -1.0376 -0.1753 -0.1582 -0.0656 -0.0488 0.4563 0.4598 0.6881 0.7128 1.4256 1.4264 1.6544 1.6547 2.0948 2.0948 2.4536 2.4587 2.9431 2.9486 3.2502 3.2530 3.3936 3.3942 3.6599 3.6620 3.6789 3.6808 3.9017 3.9037 4.1037 4.1056 4.3217 4.3251 4.3924 4.3944 10.1645 10.1674 10.6305 10.6354 12.5265 12.5354 12.9496 12.9575 13.2829 13.2852 13.6214 13.6320 k = 0.4125-0.3391 0.5765 ( 14134 PWs) bands (ev): -37.8012 -37.8012 -15.4453 -15.4452 -14.3361 -14.3358 -13.2368 -13.2356 -13.1722 -13.1698 -12.7720 -12.7650 -12.5953 -12.5898 -12.5680 -12.5649 -4.8906 -4.8896 -2.9950 -2.9942 -2.5914 -2.5785 -1.0695 -1.0354 -0.1458 -0.1370 -0.0836 -0.0760 0.4703 0.4743 0.6732 0.6957 1.4294 1.4301 1.6304 1.6307 2.1152 2.1152 2.4769 2.4816 2.9329 2.9381 3.2441 3.2465 3.3838 3.3843 3.6624 3.6640 3.6749 3.6766 3.8953 3.8971 4.1056 4.1073 4.3159 4.3190 4.4054 4.4072 10.1624 10.1650 10.6357 10.6401 12.5221 12.5299 12.9490 12.9550 13.2812 13.2817 13.6120 13.6208 k = 0.4250-0.3494 0.5765 ( 14130 PWs) bands (ev): -37.8012 -37.8012 -15.4414 -15.4413 -14.3387 -14.3385 -13.2364 -13.2353 -13.1664 -13.1643 -12.7742 -12.7680 -12.6005 -12.5956 -12.5714 -12.5688 -4.8777 -4.8769 -2.9944 -2.9937 -2.5990 -2.5878 -1.0639 -1.0338 -0.1370 -0.1258 -0.0929 -0.0797 0.4831 0.4876 0.6587 0.6787 1.4328 1.4334 1.6089 1.6092 2.1332 2.1332 2.4991 2.5036 2.9219 2.9267 3.2386 3.2406 3.3753 3.3758 3.6644 3.6655 3.6718 3.6730 3.8899 3.8914 4.1074 4.1087 4.3109 4.3136 4.4171 4.4187 10.1605 10.1627 10.6403 10.6442 12.5182 12.5249 12.9481 12.9525 13.2787 13.2794 13.6031 13.6102 k = 0.4375-0.3597 0.5765 ( 14136 PWs) bands (ev): -37.8012 -37.8012 -15.4380 -15.4379 -14.3410 -14.3408 -13.2360 -13.2350 -13.1614 -13.1595 -12.7759 -12.7706 -12.6051 -12.6008 -12.5745 -12.5722 -4.8665 -4.8658 -2.9938 -2.9932 -2.6053 -2.5959 -1.0585 -1.0328 -0.1508 -0.1341 -0.0809 -0.0616 0.4944 0.4994 0.6454 0.6623 1.4356 1.4361 1.5903 1.5905 2.1487 2.1488 2.5200 2.5240 2.9106 2.9149 3.2338 3.2354 3.3682 3.3686 3.6657 3.6659 3.6700 3.6701 3.8854 3.8867 4.1089 4.1100 4.3067 4.3091 4.4273 4.4286 10.1587 10.1606 10.6443 10.6477 12.5149 12.5205 12.9470 12.9501 13.2762 13.2777 13.5949 13.6005 k = 0.4500-0.3700 0.5765 ( 14142 PWs) bands (ev): -37.8012 -37.8012 -15.4351 -15.4351 -14.3429 -14.3427 -13.2356 -13.2348 -13.1570 -13.1555 -12.7772 -12.7728 -12.6088 -12.6053 -12.5770 -12.5752 -4.8572 -4.8566 -2.9932 -2.9927 -2.6103 -2.6027 -1.0535 -1.0325 -0.1650 -0.1509 -0.0599 -0.0431 0.5040 0.5092 0.6337 0.6471 1.4379 1.4384 1.5746 1.5749 2.1616 2.1616 2.5389 2.5423 2.8996 2.9034 3.2297 3.2310 3.3625 3.3628 3.6645 3.6657 3.6690 3.6699 3.8817 3.8828 4.1102 4.1110 4.3034 4.3053 4.4359 4.4370 10.1573 10.1588 10.6477 10.6504 12.5122 12.5167 12.9457 12.9479 13.2743 13.2761 13.5879 13.5922 k = 0.4625-0.3802 0.5765 ( 14142 PWs) bands (ev): -37.8012 -37.8012 -15.4329 -15.4328 -14.3443 -14.3442 -13.2353 -13.2347 -13.1535 -13.1524 -12.7780 -12.7747 -12.6116 -12.6089 -12.5790 -12.5776 -4.8498 -4.8494 -2.9926 -2.9923 -2.6140 -2.6083 -1.0489 -1.0329 -0.1766 -0.1658 -0.0410 -0.0277 0.5118 0.5168 0.6243 0.6341 1.4397 1.4401 1.5623 1.5624 2.1717 2.1718 2.5551 2.5579 2.8898 2.8928 3.2265 3.2274 3.3581 3.3583 3.6629 3.6641 3.6695 3.6704 3.8790 3.8798 4.1112 4.1118 4.3009 4.3024 4.4427 4.4435 10.1561 10.1573 10.6505 10.6525 12.5102 12.5135 12.9446 12.9460 13.2730 13.2747 13.5824 13.5855 k = 0.4750-0.3905 0.5765 ( 14150 PWs) bands (ev): -37.8012 -37.8012 -15.4313 -15.4312 -14.3454 -14.3453 -13.2351 -13.2346 -13.1509 -13.1502 -12.7785 -12.7762 -12.6135 -12.6117 -12.5804 -12.5795 -4.8445 -4.8442 -2.9922 -2.9920 -2.6164 -2.6125 -1.0448 -1.0340 -0.1846 -0.1773 -0.0260 -0.0167 0.5177 0.5218 0.6177 0.6239 1.4410 1.4413 1.5533 1.5534 2.1790 2.1791 2.5677 2.5697 2.8821 2.8842 3.2242 3.2249 3.3550 3.3552 3.6618 3.6626 3.6702 3.6708 3.8771 3.8777 4.1120 4.1124 4.2992 4.3002 4.4477 4.4482 10.1553 10.1561 10.6526 10.6539 12.5089 12.5111 12.9437 12.9445 13.2723 13.2736 13.5784 13.5804 k = 0.4875-0.4008 0.5765 ( 14152 PWs) bands (ev): -37.8012 -37.8012 -15.4303 -15.4303 -14.3460 -14.3459 -13.2348 -13.2346 -13.1493 -13.1489 -12.7785 -12.7773 -12.6145 -12.6136 -12.5812 -12.5807 -4.8412 -4.8411 -2.9919 -2.9918 -2.6174 -2.6155 -1.0411 -1.0357 -0.1887 -0.1850 -0.0156 -0.0109 0.5219 0.5242 0.6141 0.6170 1.4418 1.4420 1.5479 1.5479 2.1834 2.1835 2.5760 2.5770 2.8772 2.8783 3.2229 3.2232 3.3532 3.3533 3.6611 3.6615 3.6707 3.6710 3.8760 3.8763 4.1125 4.1127 4.2983 4.2988 4.4507 4.4510 10.1549 10.1553 10.6539 10.6546 12.5083 12.5094 12.9431 12.9435 13.2720 13.2727 13.5762 13.5771 k = 0.5000-0.4111 0.5765 ( 14148 PWs) bands (ev): -37.8012 -37.8012 -15.4300 -15.4300 -14.3462 -14.3462 -13.2347 -13.2347 -13.1486 -13.1486 -12.7781 -12.7781 -12.6145 -12.6145 -12.5813 -12.5813 -4.8401 -4.8401 -2.9918 -2.9918 -2.6171 -2.6171 -1.0381 -1.0381 -0.1888 -0.1888 -0.0105 -0.0105 0.5241 0.5241 0.6138 0.6138 1.4422 1.4422 1.5461 1.5461 2.1849 2.1849 2.5792 2.5792 2.8759 2.8759 3.2226 3.2226 3.3526 3.3526 3.6610 3.6610 3.6710 3.6710 3.8758 3.8758 4.1127 4.1127 4.2981 4.2981 4.4518 4.4518 10.1549 10.1549 10.6546 10.6546 12.5085 12.5085 12.9430 12.9430 13.2722 13.2722 13.5757 13.5757 k = 0.5000-0.4111 0.5765 ( 14148 PWs) bands (ev): -37.8012 -37.8012 -15.4300 -15.4300 -14.3462 -14.3462 -13.2347 -13.2347 -13.1486 -13.1486 -12.7781 -12.7781 -12.6145 -12.6145 -12.5813 -12.5813 -4.8401 -4.8401 -2.9918 -2.9918 -2.6171 -2.6171 -1.0381 -1.0381 -0.1888 -0.1888 -0.0105 -0.0105 0.5241 0.5241 0.6138 0.6138 1.4422 1.4422 1.5461 1.5461 2.1849 2.1849 2.5792 2.5792 2.8759 2.8759 3.2226 3.2226 3.3526 3.3526 3.6610 3.6610 3.6710 3.6710 3.8758 3.8758 4.1127 4.1127 4.2981 4.2981 4.4518 4.4518 10.1549 10.1549 10.6546 10.6546 12.5085 12.5085 12.9430 12.9430 13.2722 13.2722 13.5757 13.5757 k = 0.5047-0.4054 0.5765 ( 14142 PWs) bands (ev): -37.8012 -37.8012 -15.4299 -15.4299 -14.3465 -14.3464 -13.2349 -13.2341 -13.1489 -13.1481 -12.7782 -12.7779 -12.6153 -12.6138 -12.5819 -12.5805 -4.8404 -4.8402 -2.9927 -2.9919 -2.6177 -2.6156 -1.0384 -1.0376 -0.1905 -0.1881 -0.0106 -0.0103 0.5244 0.5250 0.6134 0.6140 1.4422 1.4423 1.5461 1.5462 2.1847 2.1847 2.5791 2.5793 2.8751 2.8757 3.2228 3.2229 3.3522 3.3525 3.6569 3.6598 3.6722 3.6753 3.8758 3.8760 4.1127 4.1131 4.2979 4.2981 4.4518 4.4520 10.1547 10.1552 10.6544 10.6548 12.5073 12.5091 12.9418 12.9446 13.2702 13.2740 13.5734 13.5775 k = 0.6573-0.2197 0.3783 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.4193 -15.4188 -14.4919 -14.4912 -13.2834 -13.2655 -13.1317 -13.1302 -12.7188 -12.7041 -12.6495 -12.6406 -12.3800 -12.3741 -4.7462 -4.7444 -3.5545 -3.5531 -2.2227 -2.1817 -0.9396 -0.8993 -0.5221 -0.4903 -0.1582 -0.1183 0.2043 0.2446 0.8079 0.8141 1.5593 1.5657 1.9202 1.9317 2.1076 2.1170 2.4979 2.5071 2.9841 2.9885 3.0736 3.0771 3.3801 3.3836 3.5648 3.5676 3.7588 3.7648 3.8273 3.8371 4.1460 4.1551 4.2025 4.2051 4.5915 4.5953 9.7842 9.7897 11.1240 11.1316 12.0504 12.0984 12.8197 12.8598 13.3635 13.4677 13.7674 13.8405 k = 0.6548-0.2228 0.3624 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.4247 -15.4242 -14.4891 -14.4885 -13.2848 -13.2665 -13.1391 -13.1379 -12.7238 -12.7091 -12.6391 -12.6301 -12.3703 -12.3647 -4.7345 -4.7331 -3.5683 -3.5670 -2.1975 -2.1566 -0.9595 -0.9193 -0.5062 -0.4790 -0.1571 -0.1140 0.1748 0.2184 0.7911 0.7960 1.5487 1.5549 1.9225 1.9346 2.1307 2.1395 2.5075 2.5169 2.9921 2.9954 3.0864 3.0899 3.3767 3.3803 3.5514 3.5549 3.7588 3.7683 3.8047 3.8175 4.1536 4.1594 4.1962 4.1981 4.5913 4.5952 9.7675 9.7727 11.1463 11.1532 12.0470 12.0965 12.7921 12.8317 13.3655 13.4718 13.7942 13.8750 k = 0.6523-0.2259 0.3465 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.4303 -15.4298 -14.4876 -14.4869 -13.2850 -13.2663 -13.1463 -13.1454 -12.7280 -12.7134 -12.6287 -12.6195 -12.3609 -12.3556 -4.7259 -4.7248 -3.5801 -3.5789 -2.1702 -2.1292 -0.9790 -0.9393 -0.4904 -0.4685 -0.1550 -0.1092 0.1455 0.1921 0.7755 0.7794 1.5382 1.5444 1.9235 1.9362 2.1488 2.1568 2.5204 2.5299 2.9950 2.9971 3.1027 3.1061 3.3735 3.3772 3.5382 3.5424 3.7416 3.7509 3.8042 3.8155 4.1584 4.1591 4.1904 4.1968 4.5895 4.5934 9.7541 9.7590 11.1644 11.1707 12.0440 12.0947 12.7661 12.8053 13.3657 13.4727 13.8134 13.9019 k = 0.6497-0.2290 0.3306 ( 14109 PWs) bands (ev): -37.8012 -37.8012 -15.4360 -15.4356 -14.4872 -14.4864 -13.2839 -13.2649 -13.1535 -13.1528 -12.7315 -12.7168 -12.6183 -12.6090 -12.3516 -12.3466 -4.7204 -4.7196 -3.5897 -3.5886 -2.1408 -2.0999 -0.9978 -0.9589 -0.4759 -0.4595 -0.1516 -0.1035 0.1166 0.1659 0.7612 0.7646 1.5282 1.5345 1.9234 1.9366 2.1615 2.1689 2.5366 2.5459 2.9941 2.9952 3.1208 3.1241 3.3705 3.3743 3.5253 3.5301 3.7145 3.7228 3.8152 3.8243 4.1524 4.1570 4.1901 4.2010 4.5862 4.5901 9.7438 9.7484 11.1779 11.1838 12.0415 12.0932 12.7421 12.7809 13.3645 13.4709 13.8217 13.9081 k = 0.6472-0.2321 0.3147 ( 14107 PWs) bands (ev): -37.8012 -37.8012 -15.4419 -15.4415 -14.4878 -14.4870 -13.2816 -13.2625 -13.1606 -13.1599 -12.7340 -12.7195 -12.6080 -12.5986 -12.3425 -12.3378 -4.7180 -4.7175 -3.5971 -3.5960 -2.1095 -2.0687 -1.0154 -0.9778 -0.4643 -0.4524 -0.1465 -0.0969 0.0886 0.1402 0.7484 0.7517 1.5186 1.5252 1.9222 1.9358 2.1693 2.1759 2.5553 2.5644 2.9907 2.9909 3.1395 3.1426 3.3681 3.3718 3.5128 3.5181 3.6851 3.6930 3.8286 3.8365 4.1421 4.1484 4.1960 4.2082 4.5813 4.5852 9.7369 9.7411 11.1869 11.1926 12.0395 12.0921 12.7202 12.7588 13.3620 13.4670 13.8181 13.8967 k = 0.6446-0.2352 0.2988 ( 14101 PWs) bands (ev): -37.8012 -37.8012 -15.4479 -15.4475 -14.4894 -14.4886 -13.2784 -13.2591 -13.1677 -13.1668 -12.7355 -12.7212 -12.5979 -12.5884 -12.3337 -12.3292 -4.7189 -4.7186 -3.6021 -3.6008 -2.0766 -2.0360 -1.0319 -0.9957 -0.4579 -0.4463 -0.1392 -0.0890 0.0620 0.1151 0.7371 0.7405 1.5097 1.5166 1.9201 1.9340 2.1726 2.1784 2.5758 2.5845 2.9849 2.9857 3.1580 3.1609 3.3663 3.3698 3.5008 3.5065 3.6557 3.6636 3.8425 3.8497 4.1297 4.1364 4.2045 4.2167 4.5749 4.5789 9.7331 9.7372 11.1912 11.1970 12.0383 12.0914 12.7005 12.7390 13.3586 13.4615 13.8044 13.8766 k = 0.6421-0.2383 0.2829 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.4539 -15.4535 -14.4919 -14.4911 -13.2744 -13.2551 -13.1748 -13.1735 -12.7361 -12.7221 -12.5879 -12.5784 -12.3251 -12.3210 -4.7229 -4.7226 -3.6046 -3.6032 -2.0424 -2.0020 -1.0471 -1.0127 -0.4578 -0.4415 -0.1294 -0.0791 0.0370 0.0910 0.7275 0.7311 1.5014 1.5086 1.9172 1.9313 2.1719 2.1771 2.5970 2.6053 2.9780 2.9798 3.1757 3.1785 3.3653 3.3685 3.4893 3.4953 3.6272 3.6351 3.8562 3.8628 4.1161 4.1228 4.2139 4.2258 4.5672 4.5712 9.7326 9.7364 11.1909 11.1970 12.0378 12.0914 12.6832 12.7215 13.3544 13.4548 13.7832 13.8514 k = 0.6395-0.2414 0.2669 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.4599 -15.4595 -14.4951 -14.4943 -13.2698 -13.2505 -13.1817 -13.1798 -12.7356 -12.7220 -12.5782 -12.5687 -12.3169 -12.3131 -4.7300 -4.7294 -3.6046 -3.6030 -2.0070 -1.9670 -1.0613 -1.0287 -0.4628 -0.4399 -0.1171 -0.0671 0.0139 0.0678 0.7196 0.7233 1.4939 1.5015 1.9136 1.9279 2.1681 2.1727 2.6178 2.6257 2.9708 2.9736 3.1922 3.1949 3.3652 3.3680 3.4782 3.4845 3.6002 3.6080 3.8692 3.8752 4.1018 4.1086 4.2236 4.2350 4.5583 4.5623 9.7353 9.7389 11.1864 11.1928 12.0382 12.0922 12.6682 12.7065 13.3497 13.4472 13.7567 13.8227 k = 0.6370-0.2445 0.2510 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.4659 -15.4655 -14.4990 -14.4982 -13.2647 -13.2456 -13.1884 -13.1860 -12.7341 -12.7209 -12.5687 -12.5593 -12.3091 -12.3055 -4.7399 -4.7391 -3.6020 -3.6002 -1.9708 -1.9312 -1.0747 -1.0440 -0.4715 -0.4424 -0.1025 -0.0526 -0.0070 0.0459 0.7134 0.7171 1.4871 1.4951 1.9095 1.9239 2.1615 2.1656 2.6371 2.6447 2.9642 2.9680 3.2069 3.2099 3.3662 3.3686 3.4675 3.4738 3.5750 3.5828 3.8808 3.8862 4.0874 4.0942 4.2331 4.2441 4.5485 4.5524 9.7411 9.7446 11.1778 11.1846 12.0395 12.0937 12.6554 12.6937 13.3447 13.4392 13.7264 13.7917 k = 0.6344-0.2475 0.2351 ( 14128 PWs) bands (ev): -37.8012 -37.8012 -15.4717 -15.4713 -14.5035 -14.5026 -13.2594 -13.2405 -13.1950 -13.1918 -12.7316 -12.7189 -12.5596 -12.5503 -12.3016 -12.2984 -4.7523 -4.7513 -3.5969 -3.5948 -1.9341 -1.8948 -1.0878 -1.0588 -0.4827 -0.4488 -0.0873 -0.0376 -0.0236 0.0257 0.7089 0.7125 1.4812 1.4895 1.9050 1.9194 2.1528 2.1564 2.6536 2.6610 2.9591 2.9639 3.2195 3.2231 3.3682 3.3707 3.4570 3.4631 3.5520 3.5598 3.8904 3.8950 4.0733 4.0802 4.2423 4.2528 4.5380 4.5418 9.7498 9.7532 11.1656 11.1728 12.0419 12.0961 12.6447 12.6831 13.3394 13.4308 13.6936 13.7590 k = 0.6319-0.2506 0.2192 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.4775 -15.4771 -14.5083 -14.5075 -13.2540 -13.2355 -13.2014 -13.1972 -12.7281 -12.7160 -12.5508 -12.5417 -12.2946 -12.2916 -4.7671 -4.7658 -3.5893 -3.5870 -1.8969 -1.8582 -1.1012 -1.0736 -0.4950 -0.4581 -0.0760 -0.0432 -0.0132 0.0092 0.7060 0.7093 1.4761 1.4848 1.9002 1.9146 2.1423 2.1456 2.6662 2.6735 2.9567 2.9624 3.2296 3.2341 3.3714 3.3744 3.4464 3.4520 3.5319 3.5394 3.8971 3.9009 4.0604 4.0674 4.2509 4.2608 4.5273 4.5309 9.7614 9.7648 11.1501 11.1576 12.0452 12.0994 12.6360 12.6746 13.3341 13.4222 13.6591 13.7252 k = 0.6294-0.2537 0.2033 ( 14127 PWs) bands (ev): -37.8012 -37.8012 -15.4830 -15.4826 -14.5135 -14.5127 -13.2488 -13.2306 -13.2075 -13.2020 -12.7236 -12.7122 -12.5425 -12.5336 -12.2881 -12.2853 -4.7839 -4.7823 -3.5794 -3.5767 -1.8597 -1.8215 -1.1160 -1.0888 -0.5070 -0.4690 -0.0796 -0.0509 0.0017 0.0095 0.7046 0.7075 1.4718 1.4809 1.8954 1.9096 2.1304 2.1333 2.6739 2.6812 2.9579 2.9644 3.2371 3.2427 3.3755 3.3796 3.4356 3.4401 3.5151 3.5221 3.9004 3.9032 4.0493 4.0564 4.2583 4.2677 4.5168 4.5202 9.7755 9.7790 11.1317 11.1395 12.0496 12.1037 12.6290 12.6680 13.3289 13.4135 13.6234 13.6908 k = 0.6268-0.2568 0.1874 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.4884 -15.4880 -14.5189 -14.5180 -13.2440 -13.2264 -13.2134 -13.2060 -12.7182 -12.7075 -12.5346 -12.5259 -12.2820 -12.2795 -4.8025 -4.8007 -3.5671 -3.5642 -1.8226 -1.7848 -1.1330 -1.1050 -0.5170 -0.4798 -0.0948 -0.0636 0.0129 0.0327 0.7048 0.7071 1.4684 1.4778 1.8905 1.9046 2.1173 2.1199 2.6762 2.6836 2.9634 2.9706 3.2421 3.2486 3.3802 3.3857 3.4247 3.4274 3.5018 3.5084 3.8993 3.9013 4.0408 4.0480 4.2641 4.2729 4.5071 4.5104 9.7922 9.7957 11.1110 11.1190 12.0551 12.1089 12.6237 12.6631 13.3238 13.4048 13.5871 13.6562 k = 0.6243-0.2599 0.1715 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.4935 -15.4931 -14.5244 -14.5235 -13.2402 -13.2234 -13.2185 -13.2083 -12.7120 -12.7022 -12.5272 -12.5187 -12.2765 -12.2742 -4.8225 -4.8205 -3.5526 -3.5495 -1.7859 -1.7483 -1.1531 -1.1228 -0.5239 -0.4891 -0.1136 -0.0832 0.0336 0.0579 0.7062 0.7079 1.4659 1.4756 1.8858 1.8997 2.1031 2.1056 2.6732 2.6808 2.9735 2.9810 3.2448 3.2521 3.3835 3.3909 3.4147 3.4161 3.4920 3.4982 3.8938 3.8950 4.0352 4.0423 4.2677 4.2759 4.4991 4.5020 9.8110 9.8147 11.0884 11.0966 12.0617 12.1150 12.6199 12.6598 13.3189 13.3962 13.5504 13.6217 k = 0.6217-0.2630 0.1555 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.4984 -15.4980 -14.5298 -14.5289 -13.2381 -13.2258 -13.2190 -13.2083 -12.7051 -12.6961 -12.5203 -12.5121 -12.2716 -12.2694 -4.8436 -4.8415 -3.5360 -3.5327 -1.7495 -1.7122 -1.1768 -1.1429 -0.5265 -0.4952 -0.1341 -0.1062 0.0581 0.0840 0.7088 0.7100 1.4643 1.4742 1.8814 1.8951 2.0882 2.0904 2.6655 2.6734 2.9875 2.9953 3.2455 3.2534 3.3804 3.3896 3.4077 3.4138 3.4853 3.4914 3.8840 3.8849 4.0322 4.0390 4.2685 4.2759 4.4933 4.4958 9.8318 9.8356 11.0644 11.0726 12.0693 12.1219 12.6173 12.6579 13.3143 13.3875 13.5138 13.5876 k = 0.6192-0.2661 0.1396 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.5030 -15.5026 -14.5352 -14.5343 -13.2382 -13.2307 -13.2167 -13.2063 -12.6976 -12.6896 -12.5140 -12.5061 -12.2673 -12.2651 -4.8656 -4.8633 -3.5175 -3.5139 -1.7138 -1.6763 -1.2045 -1.1661 -0.5241 -0.4972 -0.1562 -0.1314 0.0841 0.1106 0.7122 0.7135 1.4635 1.4736 1.8774 1.8908 2.0726 2.0747 2.6543 2.6624 3.0047 3.0126 3.2447 3.2529 3.3702 3.3782 3.4103 3.4176 3.4814 3.4880 3.8709 3.8721 4.0311 4.0376 4.2660 4.2727 4.4903 4.4924 9.8542 9.8582 11.0393 11.0475 12.0780 12.1297 12.6160 12.6573 13.3101 13.3788 13.4774 13.5543 k = 0.6166-0.2692 0.1237 ( 14109 PWs) bands (ev): -37.8012 -37.8012 -15.5073 -15.5069 -14.5403 -14.5394 -13.2402 -13.2357 -13.2136 -13.2035 -12.6897 -12.6826 -12.5082 -12.5006 -12.2637 -12.2613 -4.8881 -4.8857 -3.4971 -3.4933 -1.6786 -1.6408 -1.2360 -1.1928 -0.5165 -0.4943 -0.1800 -0.1583 0.1105 0.1374 0.7162 0.7183 1.4637 1.4739 1.8739 1.8869 2.0565 2.0584 2.6405 2.6488 3.0242 3.0320 3.2427 3.2509 3.3573 3.3642 3.4148 3.4225 3.4804 3.4877 3.8557 3.8572 4.0311 4.0373 4.2600 4.2660 4.4902 4.4919 9.8779 9.8823 11.0137 11.0219 12.0876 12.1381 12.6157 12.6579 13.3061 13.3700 13.4414 13.5220 k = 0.6141-0.2723 0.1078 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.5112 -15.5108 -14.5452 -14.5443 -13.2432 -13.2403 -13.2100 -13.2005 -12.6815 -12.6754 -12.5030 -12.4957 -12.2607 -12.2581 -4.9110 -4.9084 -3.4750 -3.4710 -1.6441 -1.6057 -1.2712 -1.2233 -0.5037 -0.4862 -0.2055 -0.1869 0.1369 0.1639 0.7209 0.7242 1.4646 1.4749 1.8709 1.8835 2.0399 2.0418 2.6250 2.6336 3.0452 3.0529 3.2397 3.2477 3.3440 3.3500 3.4181 3.4260 3.4823 3.4905 3.8393 3.8411 4.0316 4.0375 4.2507 4.2562 4.4929 4.4943 9.9026 9.9073 10.9881 10.9961 12.0982 12.1473 12.6164 12.6597 13.3026 13.3608 13.4062 13.4914 k = 0.6115-0.2754 0.0919 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.5148 -15.5144 -14.5497 -14.5488 -13.2468 -13.2447 -13.2062 -13.1976 -12.6733 -12.6681 -12.4984 -12.4914 -12.2583 -12.2555 -4.9338 -4.9311 -3.4513 -3.4472 -1.6102 -1.5709 -1.3095 -1.2573 -0.4861 -0.4731 -0.2326 -0.2169 0.1628 0.1900 0.7262 0.7309 1.4664 1.4766 1.8686 1.8808 2.0231 2.0249 2.6088 2.6175 3.0669 3.0745 3.2359 3.2435 3.3311 3.3364 3.4193 3.4274 3.4868 3.4958 3.8224 3.8244 4.0323 4.0379 4.2388 4.2439 4.4979 4.4990 9.9278 9.9329 10.9628 10.9707 12.1096 12.1571 12.6180 12.6625 13.2993 13.3509 13.3719 13.4628 k = 0.6090-0.2785 0.0760 ( 14135 PWs) bands (ev): -37.8012 -37.8012 -15.5180 -15.5176 -14.5538 -14.5529 -13.2506 -13.2486 -13.2024 -13.1948 -12.6651 -12.6609 -12.4944 -12.4877 -12.2567 -12.2535 -4.9564 -4.9536 -3.4261 -3.4219 -1.5769 -1.5366 -1.3504 -1.2946 -0.4644 -0.4552 -0.2614 -0.2482 0.1878 0.2152 0.7321 0.7383 1.4690 1.4790 1.8669 1.8787 2.0061 2.0079 2.5925 2.6013 3.0886 3.0961 3.2312 3.2384 3.3192 3.3238 3.4185 3.4270 3.4935 3.5030 3.8056 3.8077 4.0329 4.0382 4.2249 4.2297 4.5046 4.5055 9.9531 9.9587 10.9384 10.9460 12.1217 12.1673 12.6205 12.6665 13.2960 13.3386 13.3401 13.4370 k = 0.6065-0.2816 0.0601 ( 14146 PWs) bands (ev): -37.8012 -37.8012 -15.5208 -15.5205 -14.5575 -14.5565 -13.2544 -13.2521 -13.1987 -13.1922 -12.6571 -12.6538 -12.4910 -12.4847 -12.2557 -12.2521 -4.9784 -4.9756 -3.3997 -3.3953 -1.5442 -1.5030 -1.3929 -1.3346 -0.4403 -0.4329 -0.2915 -0.2800 0.2117 0.2393 0.7384 0.7462 1.4722 1.4819 1.8660 1.8774 1.9892 1.9910 2.5765 2.5854 3.1097 3.1170 3.2255 3.2325 3.3087 3.3127 3.4160 3.4250 3.5014 3.5113 3.7893 3.7914 4.0333 4.0383 4.2097 4.2145 4.5124 4.5132 9.9781 9.9841 10.9153 10.9225 12.1346 12.1779 12.6239 12.6714 13.2909 13.3084 13.3278 13.4149 k = 0.6039-0.2847 0.0441 ( 14136 PWs) bands (ev): -37.8012 -37.8012 -15.5232 -15.5229 -14.5606 -14.5596 -13.2581 -13.2555 -13.1952 -13.1897 -12.6497 -12.6471 -12.4882 -12.4822 -12.2553 -12.2514 -4.9998 -4.9970 -3.3720 -3.3675 -1.5124 -1.4742 -1.4325 -1.3762 -0.4171 -0.4065 -0.3223 -0.3105 0.2343 0.2621 0.7450 0.7545 1.4760 1.4853 1.8659 1.8767 1.9726 1.9744 2.5613 2.5701 3.1293 3.1365 3.2187 3.2257 3.3004 3.3038 3.4123 3.4219 3.5099 3.5201 3.7738 3.7758 4.0335 4.0383 4.1940 4.1988 4.5208 4.5215 10.0021 10.0087 10.8939 10.9007 12.1480 12.1889 12.6282 12.6774 13.2714 13.2920 13.3153 13.3970 k = 0.6014-0.2878 0.0282 ( 14126 PWs) bands (ev): -37.8012 -37.8012 -15.5252 -15.5249 -14.5631 -14.5621 -13.2616 -13.2585 -13.1917 -13.1874 -12.6429 -12.6408 -12.4861 -12.4804 -12.2556 -12.2513 -5.0203 -5.0174 -3.3433 -3.3388 -1.4939 -1.4814 -1.4286 -1.4154 -0.4032 -0.3836 -0.3472 -0.3312 0.2553 0.2833 0.7517 0.7630 1.4802 1.4890 1.8665 1.8769 1.9566 1.9583 2.5471 2.5559 3.1467 3.1536 3.2105 3.2177 3.2948 3.2978 3.4077 3.4181 3.5187 3.5290 3.7593 3.7613 4.0337 4.0382 4.1784 4.1833 4.5294 4.5300 10.0247 10.0319 10.8749 10.8812 12.1618 12.2000 12.6334 12.6844 13.2428 13.2809 13.3065 13.3833 k = 0.5988-0.2909 0.0123 ( 14136 PWs) bands (ev): -37.8012 -37.8012 -15.5268 -15.5265 -14.5651 -14.5640 -13.2648 -13.2614 -13.1883 -13.1851 -12.6370 -12.6348 -12.4845 -12.4791 -12.2567 -12.2519 -5.0397 -5.0367 -3.3137 -3.3091 -1.5376 -1.4809 -1.4330 -1.3938 -0.4158 -0.3999 -0.3320 -0.3244 0.2745 0.3028 0.7583 0.7714 1.4847 1.4927 1.8679 1.8778 1.9416 1.9433 2.5341 2.5428 3.1609 3.1674 3.2008 3.2085 3.2926 3.2952 3.4025 3.4137 3.5273 3.5378 3.7462 3.7480 4.0339 4.0382 4.1634 4.1685 4.5379 4.5385 10.0453 10.0532 10.8587 10.8643 12.1760 12.2112 12.6396 12.6925 13.2147 13.2644 13.3032 13.3731 k = 0.5963-0.2940-0.0036 ( 14128 PWs) bands (ev): -37.8012 -37.8012 -15.5280 -15.5277 -14.5664 -14.5653 -13.2678 -13.2640 -13.1850 -13.1828 -12.6322 -12.6295 -12.4835 -12.4785 -12.2583 -12.2531 -5.0579 -5.0548 -3.2834 -3.2788 -1.5849 -1.5212 -1.4066 -1.3598 -0.4471 -0.4339 -0.2992 -0.2977 0.2919 0.3204 0.7646 0.7796 1.4891 1.4962 1.8699 1.8793 1.9282 1.9296 2.5225 2.5311 3.1711 3.1772 3.1896 3.1978 3.2943 3.2963 3.3971 3.4092 3.5356 3.5461 3.7347 3.7361 4.0343 4.0384 4.1493 4.1546 4.5459 4.5466 10.0633 10.0718 10.8457 10.8506 12.1903 12.2225 12.6468 12.7017 13.1879 13.2453 13.3029 13.3655 k = 0.5937-0.2971-0.0195 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.5287 -15.5284 -14.5670 -14.5660 -13.2705 -13.2664 -13.1820 -13.1802 -12.6284 -12.6249 -12.4830 -12.4784 -12.2607 -12.2550 -5.0746 -5.0716 -3.2526 -3.2480 -1.6330 -1.5675 -1.3746 -1.3250 -0.4840 -0.4705 -0.2667 -0.2620 0.3073 0.3359 0.7705 0.7874 1.4933 1.4994 1.8724 1.8810 1.9171 1.9182 2.5124 2.5207 3.1764 3.1770 3.1831 3.1863 3.2992 3.3010 3.3916 3.4047 3.5432 3.5538 3.7250 3.7260 4.0352 4.0392 4.1364 4.1420 4.5533 4.5542 10.0781 10.0874 10.8363 10.8405 12.2047 12.2336 12.6550 12.7119 13.1627 13.2257 13.3041 13.3598 k = 0.5912-0.3002-0.0354 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.5290 -15.5287 -14.5670 -14.5659 -13.2729 -13.2686 -13.1793 -13.1773 -12.6256 -12.6213 -12.4832 -12.4790 -12.2636 -12.2576 -5.0898 -5.0867 -3.2215 -3.2169 -1.6812 -1.6149 -1.3414 -1.2897 -0.5230 -0.5082 -0.2325 -0.2247 0.3206 0.3494 0.7756 0.7943 1.4970 1.5018 1.8744 1.8820 1.9095 1.9104 2.5036 2.5117 3.1631 3.1704 3.1816 3.1851 3.3061 3.3081 3.3867 3.4005 3.5499 3.5605 3.7174 3.7180 4.0369 4.0407 4.1250 4.1307 4.5599 4.5611 10.0895 10.0995 10.8308 10.8342 12.2190 12.2446 12.6643 12.7232 13.1393 13.2066 13.3066 13.3556 k = 0.5886-0.3033-0.0514 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.5289 -15.5286 -14.5663 -14.5652 -13.2750 -13.2705 -13.1769 -13.1741 -12.6240 -12.6186 -12.4840 -12.4801 -12.2673 -12.2608 -5.1034 -5.1003 -3.1902 -3.1857 -1.7292 -1.6627 -1.3074 -1.2539 -0.5632 -0.5466 -0.1973 -0.1871 0.3319 0.3606 0.7797 0.8003 1.4998 1.5034 1.8749 1.8808 1.9068 1.9086 2.4961 2.5040 3.1483 3.1561 3.1812 3.1848 3.3134 3.3160 3.3827 3.3971 3.5553 3.5658 3.7123 3.7126 4.0397 4.0434 4.1151 4.1210 4.5657 4.5671 10.0971 10.1078 10.8294 10.8320 12.2331 12.2554 12.6748 12.7355 13.1177 13.1885 13.3099 13.3526 k = 0.5861-0.3063-0.0673 ( 14109 PWs) bands (ev): -37.8012 -37.8012 -15.5283 -15.5280 -14.5649 -14.5637 -13.2768 -13.2721 -13.1745 -13.1707 -12.6234 -12.6171 -12.4854 -12.4819 -12.2715 -12.2647 -5.1152 -5.1121 -3.1590 -3.1547 -1.7768 -1.7104 -1.2727 -1.2176 -0.6038 -0.5853 -0.1619 -0.1496 0.3410 0.3697 0.7827 0.8049 1.5014 1.5040 1.8735 1.8778 1.9096 1.9124 2.4899 2.4973 3.1326 3.1403 3.1795 3.1828 3.3199 3.3232 3.3802 3.3949 3.5589 3.5692 3.7098 3.7104 4.0437 4.0475 4.1066 4.1127 4.5705 4.5722 10.1010 10.1122 10.8320 10.8338 12.2468 12.2660 12.6864 12.7487 13.0981 13.1717 13.3142 13.3504 k = 0.5836-0.3094-0.0832 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.5274 -15.5270 -14.5628 -14.5616 -13.2784 -13.2735 -13.1720 -13.1672 -12.6239 -12.6166 -12.4874 -12.4843 -12.2764 -12.2692 -5.1252 -5.1221 -3.1282 -3.1239 -1.8238 -1.7578 -1.2372 -1.1807 -0.6445 -0.6239 -0.1266 -0.1126 0.3481 0.3766 0.7841 0.8079 1.5017 1.5038 1.8717 1.8750 1.9168 1.9199 2.4847 2.4917 3.1160 3.1234 3.1769 3.1798 3.3246 3.3284 3.3800 3.3942 3.5603 3.5703 3.7107 3.7117 4.0492 4.0531 4.0995 4.1060 4.5743 4.5762 10.1011 10.1129 10.8381 10.8394 12.2600 12.2764 12.6991 12.7628 13.0806 13.1565 13.3192 13.3491 k = 0.5810-0.3125-0.0991 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5260 -15.5257 -14.5600 -14.5587 -13.2797 -13.2747 -13.1695 -13.1635 -12.6255 -12.6171 -12.4902 -12.4873 -12.2819 -12.2743 -5.1333 -5.1302 -3.0979 -3.0938 -1.8700 -1.8047 -1.2010 -1.1433 -0.6849 -0.6623 -0.0919 -0.0764 0.3531 0.3814 0.7840 0.8091 1.5005 1.5032 1.8708 1.8735 1.9270 1.9300 2.4803 2.4869 3.0987 3.1057 3.1739 3.1765 3.3269 3.3308 3.3822 3.3953 3.5594 3.5689 3.7151 3.7164 4.0559 4.0603 4.0942 4.1008 4.5769 4.5792 10.0979 10.1101 10.8474 10.8483 12.2726 12.2866 12.7130 12.7775 13.0655 13.1430 13.3249 13.3485 k = 0.5810-0.3125-0.0991 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5260 -15.5257 -14.5600 -14.5587 -13.2797 -13.2747 -13.1695 -13.1635 -12.6255 -12.6171 -12.4902 -12.4873 -12.2819 -12.2743 -5.1333 -5.1302 -3.0979 -3.0938 -1.8700 -1.8047 -1.2010 -1.1433 -0.6849 -0.6623 -0.0919 -0.0764 0.3531 0.3814 0.7840 0.8091 1.5005 1.5032 1.8708 1.8735 1.9270 1.9300 2.4803 2.4869 3.0987 3.1057 3.1739 3.1765 3.3269 3.3308 3.3822 3.3953 3.5594 3.5689 3.7151 3.7164 4.0559 4.0603 4.0942 4.1008 4.5769 4.5792 10.0979 10.1101 10.8474 10.8483 12.2726 12.2866 12.7130 12.7775 13.0655 13.1430 13.3249 13.3485 k = 0.5729-0.3224-0.0892 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5320 -15.5317 -14.5380 -14.5368 -13.2966 -13.2922 -13.1808 -13.1758 -12.6224 -12.6147 -12.4890 -12.4863 -12.2763 -12.2694 -5.1076 -5.1046 -3.1217 -3.1180 -1.8474 -1.7822 -1.2356 -1.1779 -0.6522 -0.6307 -0.1129 -0.1001 0.3641 0.3913 0.7656 0.7904 1.4823 1.4846 1.8716 1.8744 1.9288 1.9310 2.5226 2.5294 3.1127 3.1199 3.1840 3.1869 3.3361 3.3400 3.3685 3.3840 3.5379 3.5474 3.7049 3.7064 4.0479 4.0523 4.0967 4.1030 4.5776 4.5797 10.0804 10.0917 10.8737 10.8746 12.2736 12.2869 12.7140 12.7817 13.0555 13.1398 13.3234 13.3398 k = 0.5648-0.3322-0.0793 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.5375 -15.5373 -14.5168 -14.5157 -13.3140 -13.3102 -13.1899 -13.1858 -12.6194 -12.6125 -12.4881 -12.4856 -12.2711 -12.2651 -5.0831 -5.0804 -3.1451 -3.1418 -1.8226 -1.7575 -1.2709 -1.2131 -0.6194 -0.5992 -0.1346 -0.1244 0.3761 0.4022 0.7469 0.7713 1.4657 1.4678 1.8713 1.8741 1.9319 1.9335 2.5640 2.5707 3.1255 3.1327 3.1921 3.1954 3.3385 3.3397 3.3643 3.3785 3.5176 3.5269 3.6953 3.6970 4.0407 4.0449 4.0996 4.1052 4.5782 4.5801 10.0644 10.0746 10.8977 10.8985 12.2741 12.2866 12.7170 12.7871 13.0442 13.1334 13.3227 13.3331 k = 0.5567-0.3421-0.0694 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.5426 -15.5423 -14.4969 -14.4959 -13.3313 -13.3280 -13.1973 -13.1940 -12.6167 -12.6104 -12.4874 -12.4851 -12.2665 -12.2612 -5.0602 -5.0577 -3.1675 -3.1647 -1.7957 -1.7309 -1.3068 -1.2487 -0.5868 -0.5679 -0.1571 -0.1494 0.3890 0.4139 0.7281 0.7519 1.4509 1.4527 1.8704 1.8730 1.9357 1.9367 2.6039 2.6106 3.1372 3.1442 3.1981 3.2018 3.3268 3.3318 3.3719 3.3816 3.4990 3.5079 3.6867 3.6883 4.0345 4.0383 4.1022 4.1072 4.5787 4.5804 10.0498 10.0589 10.9191 10.9199 12.2743 12.2858 12.7219 12.7930 13.0323 13.1237 13.3228 13.3286 k = 0.5486-0.3520-0.0595 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.5471 -15.5469 -14.4785 -14.4776 -13.3478 -13.3451 -13.2032 -13.2006 -12.6141 -12.6087 -12.4869 -12.4848 -12.2624 -12.2578 -5.0393 -5.0370 -3.1883 -3.1859 -1.7670 -1.7026 -1.3430 -1.2847 -0.5544 -0.5370 -0.1804 -0.1750 0.4026 0.4261 0.7098 0.7326 1.4379 1.4395 1.8692 1.8715 1.9396 1.9403 2.6419 2.6483 3.1473 3.1540 3.2015 3.2057 3.3130 3.3203 3.3811 3.3885 3.4826 3.4908 3.6789 3.6805 4.0292 4.0326 4.1047 4.1089 4.5791 4.5806 10.0370 10.0449 10.9379 10.9387 12.2744 12.2847 12.7286 12.7990 13.0209 13.1111 13.3232 13.3263 k = 0.5405-0.3618-0.0495 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.5510 -15.5508 -14.4621 -14.4613 -13.3630 -13.3607 -13.2079 -13.2059 -12.6119 -12.6073 -12.4864 -12.4846 -12.2588 -12.2550 -5.0207 -5.0188 -3.2069 -3.2050 -1.7368 -1.6730 -1.3795 -1.3209 -0.5225 -0.5066 -0.2044 -0.2009 0.4165 0.4384 0.6922 0.7137 1.4269 1.4282 1.8680 1.8700 1.9433 1.9438 2.6773 2.6834 3.1552 3.1613 3.2026 3.2074 3.3013 3.3089 3.3888 3.3949 3.4692 3.4764 3.6722 3.6737 4.0250 4.0279 4.1068 4.1103 4.5795 4.5807 10.0260 10.0327 10.9540 10.9547 12.2745 12.2833 12.7370 12.8042 13.0109 13.0962 13.3236 13.3259 k = 0.5324-0.3717-0.0396 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.5542 -15.5540 -14.4481 -14.4474 -13.3761 -13.3743 -13.2115 -13.2100 -12.6099 -12.6061 -12.4861 -12.4846 -12.2557 -12.2527 -5.0048 -5.0033 -3.2229 -3.2214 -1.7053 -1.6423 -1.4157 -1.3571 -0.4912 -0.4771 -0.2291 -0.2268 0.4305 0.4502 0.6762 0.6957 1.4178 1.4188 1.8670 1.8686 1.9466 1.9470 2.7094 2.7148 3.1592 3.1642 3.2032 3.2083 3.2929 3.2996 3.3936 3.3988 3.4596 3.4654 3.6666 3.6678 4.0217 4.0240 4.1085 4.1114 4.5798 4.5808 10.0170 10.0224 10.9673 10.9678 12.2746 12.2819 12.7468 12.8075 13.0036 13.0799 13.3241 13.3265 k = 0.5243-0.3815-0.0297 ( 14132 PWs) bands (ev): -37.8012 -37.8012 -15.5567 -15.5566 -14.4367 -14.4362 -13.3868 -13.3855 -13.2142 -13.2132 -12.6082 -12.6053 -12.4858 -12.4846 -12.2532 -12.2510 -4.9921 -4.9909 -3.2358 -3.2347 -1.6728 -1.6111 -1.4514 -1.3930 -0.4611 -0.4489 -0.2543 -0.2519 0.4438 0.4604 0.6626 0.6791 1.4108 1.4115 1.8662 1.8674 1.9494 1.9496 2.7370 2.7415 3.1585 3.1618 3.2056 3.2103 3.2876 3.2928 3.3951 3.3996 3.4544 3.4585 3.6622 3.6632 4.0192 4.0210 4.1099 4.1121 4.5801 4.5808 10.0100 10.0141 10.9777 10.9781 12.2748 12.2804 12.7576 12.8081 13.0003 13.0630 13.3250 13.3272 k = 0.5162-0.3914-0.0198 ( 14136 PWs) bands (ev): -37.8012 -37.8012 -15.5585 -15.5585 -14.4283 -14.4279 -13.3947 -13.3938 -13.2161 -13.2154 -12.6068 -12.6049 -12.4855 -12.4847 -12.2514 -12.2499 -4.9827 -4.9818 -3.2453 -3.2446 -1.6396 -1.5811 -1.4848 -1.4285 -0.4331 -0.4233 -0.2786 -0.2755 0.4557 0.4681 0.6526 0.6649 1.4057 1.4062 1.8657 1.8665 1.9514 1.9515 2.7587 2.7619 3.1544 3.1561 3.2096 3.2131 3.2847 3.2882 3.3944 3.3978 3.4527 3.4552 3.6591 3.6597 4.0176 4.0188 4.1110 4.1124 4.5803 4.5808 10.0051 10.0079 10.9852 10.9855 12.2753 12.2790 12.7689 12.8054 13.0017 13.0464 13.3260 13.3277 k = 0.5081-0.4012-0.0099 ( 14140 PWs) bands (ev): -37.8012 -37.8012 -15.5596 -15.5596 -14.4231 -14.4229 -13.3995 -13.3990 -13.2171 -13.2168 -12.6058 -12.6048 -12.4853 -12.4849 -12.2501 -12.2493 -4.9768 -4.9764 -3.2510 -3.2506 -1.6064 -1.5612 -1.5069 -1.4628 -0.4098 -0.4036 -0.2982 -0.2955 0.4651 0.4718 0.6475 0.6541 1.4028 1.4030 1.8654 1.8658 1.9526 1.9527 2.7730 2.7747 3.1502 3.1508 3.2135 3.2153 3.2834 3.2852 3.3933 3.3952 3.4527 3.4538 3.6572 3.6576 4.0168 4.0174 4.1118 4.1125 4.5805 4.5808 10.0025 10.0039 10.9897 10.9898 12.2759 12.2778 12.7801 12.7993 13.0077 13.0310 13.3270 13.3279 k = 0.5000-0.4111-0.0000 ( 14132 PWs) bands (ev): -37.8012 -37.8012 -15.5600 -15.5600 -14.4213 -14.4213 -13.4009 -13.4009 -13.2173 -13.2173 -12.6051 -12.6051 -12.4851 -12.4851 -12.2494 -12.2494 -4.9748 -4.9748 -3.2528 -3.2528 -1.5756 -1.5756 -1.4936 -1.4936 -0.3975 -0.3975 -0.3055 -0.3055 0.4708 0.4708 0.6480 0.6480 1.4018 1.4018 1.8655 1.8655 1.9531 1.9531 2.7785 2.7785 3.1486 3.1486 3.2156 3.2156 3.2836 3.2836 3.3935 3.3935 3.4532 3.4532 3.6567 3.6567 4.0168 4.0168 4.1123 4.1123 4.5807 4.5807 10.0021 10.0021 10.9913 10.9913 12.2767 12.2767 12.7906 12.7906 13.0178 13.0178 13.3276 13.3276 k = 0.5000-0.4111-0.0000 ( 14132 PWs) bands (ev): -37.8012 -37.8012 -15.5600 -15.5600 -14.4213 -14.4213 -13.4009 -13.4009 -13.2173 -13.2173 -12.6051 -12.6051 -12.4851 -12.4851 -12.2494 -12.2494 -4.9748 -4.9748 -3.2528 -3.2528 -1.5756 -1.5756 -1.4936 -1.4936 -0.3975 -0.3975 -0.3055 -0.3055 0.4708 0.4708 0.6480 0.6480 1.4018 1.4018 1.8655 1.8655 1.9531 1.9531 2.7785 2.7785 3.1486 3.1486 3.2156 3.2156 3.2836 3.2836 3.3935 3.3935 3.4532 3.4532 3.6567 3.6567 4.0168 4.0168 4.1123 4.1123 4.5807 4.5807 10.0021 10.0021 10.9913 10.9913 12.2767 12.2767 12.7906 12.7906 13.0178 13.0178 13.3276 13.3276 k = 0.4875-0.4008-0.0000 ( 14128 PWs) bands (ev): -37.8012 -37.8012 -15.5605 -15.5605 -14.4209 -14.4208 -13.4021 -13.4014 -13.2159 -13.2153 -12.6054 -12.6052 -12.4850 -12.4849 -12.2499 -12.2499 -4.9746 -4.9746 -3.2556 -3.2554 -1.5748 -1.5727 -1.4933 -1.4928 -0.3979 -0.3966 -0.3071 -0.3053 0.4687 0.4713 0.6477 0.6487 1.4038 1.4041 1.8646 1.8652 1.9537 1.9544 2.7780 2.7784 3.1487 3.1488 3.2144 3.2148 3.2804 3.2823 3.3941 3.3945 3.4531 3.4549 3.6553 3.6565 4.0172 4.0182 4.1124 4.1126 4.5807 4.5808 10.0000 10.0002 10.9914 10.9921 12.2735 12.2780 12.7892 12.7921 13.0155 13.0216 13.3296 13.3322 k = 0.4750-0.3905-0.0000 ( 14126 PWs) bands (ev): -37.8012 -37.8012 -15.5621 -15.5620 -14.4196 -14.4195 -13.4048 -13.4034 -13.2112 -13.2101 -12.6060 -12.6057 -12.4847 -12.4845 -12.2514 -12.2513 -4.9741 -4.9740 -3.2637 -3.2635 -1.5704 -1.5662 -1.4917 -1.4905 -0.3978 -0.3952 -0.3101 -0.3066 0.4650 0.4702 0.6479 0.6498 1.4099 1.4105 1.8626 1.8637 1.9561 1.9575 2.7769 2.7777 3.1493 3.1495 3.2112 3.2119 3.2730 3.2766 3.3964 3.3969 3.4545 3.4580 3.6522 3.6546 4.0193 4.0213 4.1128 4.1133 4.5808 4.5811 9.9940 9.9944 10.9926 10.9939 12.2683 12.2772 12.7881 12.7937 13.0149 13.0268 13.3381 13.3432 k = 0.4625-0.3802-0.0000 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.5647 -15.5646 -14.4174 -14.4173 -13.4086 -13.4067 -13.2035 -13.2019 -12.6070 -12.6066 -12.4842 -12.4838 -12.2539 -12.2537 -4.9733 -4.9731 -3.2771 -3.2767 -1.5629 -1.5565 -1.4886 -1.4868 -0.3972 -0.3932 -0.3143 -0.3092 0.4597 0.4675 0.6484 0.6513 1.4199 1.4208 1.8596 1.8612 1.9603 1.9623 2.7752 2.7764 3.1501 3.1504 3.2059 3.2071 3.2623 3.2671 3.3999 3.4004 3.4573 3.4622 3.6477 3.6512 4.0233 4.0262 4.1136 4.1143 4.5810 4.5815 9.9840 9.9846 10.9948 10.9967 12.2615 12.2746 12.7871 12.7953 13.0159 13.0332 13.3530 13.3602 k = 0.4500-0.3700-0.0000 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.5683 -15.5682 -14.4144 -14.4143 -13.4134 -13.4111 -13.1931 -13.1911 -12.6083 -12.6079 -12.4835 -12.4830 -12.2573 -12.2571 -4.9721 -4.9719 -3.2953 -3.2948 -1.5529 -1.5442 -1.4838 -1.4811 -0.3962 -0.3908 -0.3197 -0.3129 0.4529 0.4633 0.6493 0.6530 1.4336 1.4348 1.8557 1.8579 1.9659 1.9686 2.7730 2.7746 3.1511 3.1514 3.1988 3.2005 3.2490 3.2545 3.4041 3.4044 3.4613 3.4674 3.6419 3.6464 4.0288 4.0325 4.1149 4.1157 4.5813 4.5819 9.9703 9.9710 10.9980 11.0005 12.2535 12.2706 12.7863 12.7968 13.0185 13.0406 13.3739 13.3827 k = 0.4375-0.3597-0.0000 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.5728 -15.5727 -14.4105 -14.4104 -13.4188 -13.4160 -13.1804 -13.1782 -12.6100 -12.6095 -12.4825 -12.4819 -12.2617 -12.2614 -4.9706 -4.9704 -3.3180 -3.3175 -1.5414 -1.5304 -1.4764 -1.4729 -0.3946 -0.3880 -0.3258 -0.3176 0.4448 0.4577 0.6504 0.6548 1.4505 1.4519 1.8515 1.8542 1.9728 1.9760 2.7703 2.7723 3.1521 3.1522 3.1901 3.1922 3.2338 3.2397 3.4088 3.4089 3.4663 3.4731 3.6351 3.6405 4.0358 4.0403 4.1165 4.1175 4.5816 4.5824 9.9527 9.9536 11.0021 11.0053 12.2449 12.2656 12.7855 12.7983 13.0226 13.0490 13.4002 13.4102 k = 0.4250-0.3494-0.0000 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.5783 -15.5782 -14.4058 -14.4056 -13.4244 -13.4214 -13.1658 -13.1634 -12.6121 -12.6114 -12.4813 -12.4806 -12.2671 -12.2666 -4.9688 -4.9685 -3.3449 -3.3443 -1.5294 -1.5168 -1.4652 -1.4614 -0.3927 -0.3847 -0.3325 -0.3229 0.4354 0.4509 0.6516 0.6566 1.4699 1.4715 1.8473 1.8506 1.9806 1.9843 2.7672 2.7695 3.1519 3.1521 3.1805 3.1833 3.2173 3.2232 3.4136 3.4136 3.4721 3.4794 3.6277 3.6338 4.0442 4.0492 4.1186 4.1198 4.5820 4.5829 9.9314 9.9325 11.0073 11.0111 12.2361 12.2602 12.7847 12.7995 13.0281 13.0582 13.4312 13.4419 k = 0.4125-0.3391-0.0000 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.5847 -15.5845 -14.4002 -14.4001 -13.4300 -13.4268 -13.1495 -13.1470 -12.6145 -12.6137 -12.4798 -12.4790 -12.2733 -12.2728 -4.9667 -4.9663 -3.3753 -3.3747 -1.5179 -1.5047 -1.4495 -1.4463 -0.3905 -0.3812 -0.3392 -0.3285 0.4248 0.4428 0.6528 0.6582 1.4909 1.4926 1.8441 1.8479 1.9889 1.9930 2.7637 2.7662 3.1481 3.1486 3.1724 3.1756 3.2001 3.2056 3.4185 3.4185 3.4785 3.4860 3.6200 3.6266 4.0537 4.0592 4.1211 4.1224 4.5823 4.5833 9.9065 9.9076 11.0135 11.0179 12.2277 12.2548 12.7839 12.8004 13.0348 13.0681 13.4662 13.4773 k = 0.4000-0.3289-0.0000 ( 14102 PWs) bands (ev): -37.8012 -37.8012 -15.5918 -15.5917 -14.3939 -14.3937 -13.4355 -13.4322 -13.1320 -13.1294 -12.6172 -12.6162 -12.4782 -12.4772 -12.2805 -12.2799 -4.9643 -4.9639 -3.4090 -3.4084 -1.5073 -1.4944 -1.4292 -1.4275 -0.3879 -0.3776 -0.3456 -0.3341 0.4133 0.4338 0.6539 0.6596 1.5123 1.5139 1.8427 1.8470 1.9974 2.0018 2.7596 2.7623 3.1382 3.1382 3.1691 3.1710 3.1837 3.1877 3.4235 3.4235 3.4855 3.4929 3.6123 3.6194 4.0641 4.0700 4.1239 4.1254 4.5826 4.5837 9.8781 9.8793 11.0207 11.0257 12.2200 12.2499 12.7829 12.8011 13.0426 13.0786 13.5043 13.5156 k = 0.3875-0.3186-0.0000 ( 14088 PWs) bands (ev): -37.8012 -37.8012 -15.5997 -15.5996 -14.3867 -14.3865 -13.4408 -13.4374 -13.1133 -13.1107 -12.6202 -12.6191 -12.4763 -12.4752 -12.2885 -12.2879 -4.9616 -4.9611 -3.4453 -3.4447 -1.4975 -1.4852 -1.4057 -1.4056 -0.3853 -0.3744 -0.3508 -0.3393 0.4010 0.4239 0.6548 0.6607 1.5323 1.5338 1.8447 1.8494 2.0055 2.0101 2.7550 2.7578 3.1222 3.1227 3.1607 3.1658 3.1734 3.1764 3.4285 3.4285 3.4930 3.5002 3.6051 3.6126 4.0753 4.0815 4.1272 4.1288 4.5828 4.5840 9.8463 9.8476 11.0289 11.0344 12.2134 12.2459 12.7818 12.8014 13.0511 13.0896 13.5447 13.5560 k = 0.3750-0.3083-0.0000 ( 14086 PWs) bands (ev): -37.8012 -37.8012 -15.6083 -15.6082 -14.3788 -14.3786 -13.4458 -13.4423 -13.0937 -13.0912 -12.6234 -12.6223 -12.4741 -12.4730 -12.2974 -12.2967 -4.9586 -4.9581 -3.4839 -3.4834 -1.4881 -1.4763 -1.3816 -1.3801 -0.3826 -0.3728 -0.3535 -0.3436 0.3880 0.4132 0.6554 0.6614 1.5493 1.5504 1.8516 1.8565 2.0128 2.0176 2.7496 2.7525 3.1027 3.1035 3.1441 3.1499 3.1734 3.1774 3.4336 3.4337 3.5011 3.5081 3.5987 3.6065 4.0872 4.0936 4.1309 4.1326 4.5829 4.5841 9.8113 9.8126 11.0381 11.0442 12.2082 12.2431 12.7804 12.8014 13.0603 13.1010 13.5867 13.5978 k = 0.3625-0.2980-0.0000 ( 14088 PWs) bands (ev): -37.8012 -37.8012 -15.6176 -15.6174 -14.3702 -14.3700 -13.4505 -13.4469 -13.0734 -13.0709 -12.6269 -12.6257 -12.4717 -12.4705 -12.3071 -12.3063 -4.9554 -4.9549 -3.5243 -3.5239 -1.4786 -1.4673 -1.3563 -1.3534 -0.3801 -0.3736 -0.3525 -0.3467 0.3744 0.4020 0.6556 0.6616 1.5616 1.5621 1.8648 1.8697 2.0191 2.0239 2.7432 2.7460 3.0805 3.0815 3.1276 3.1329 3.1761 3.1801 3.4388 3.4389 3.5097 3.5165 3.5936 3.6015 4.0995 4.1060 4.1349 4.1368 4.5829 4.5841 9.7732 9.7746 11.0484 11.0550 12.2047 12.2419 12.7787 12.8009 13.0699 13.1127 13.6294 13.6404 k = 0.3500-0.2878-0.0000 ( 14088 PWs) bands (ev): -37.8012 -37.8012 -15.6273 -15.6271 -14.3609 -14.3606 -13.4547 -13.4512 -13.0525 -13.0501 -12.6307 -12.6293 -12.4691 -12.4678 -12.3176 -12.3167 -4.9520 -4.9514 -3.5662 -3.5658 -1.4688 -1.4579 -1.3302 -1.3262 -0.3780 -0.3757 -0.3488 -0.3482 0.3604 0.3902 0.6555 0.6614 1.5678 1.5681 1.8849 1.8897 2.0240 2.0287 2.7354 2.7380 3.0558 3.0569 3.1122 3.1170 3.1795 3.1836 3.4443 3.4444 3.5190 3.5256 3.5899 3.5980 4.1122 4.1188 4.1392 4.1413 4.5827 4.5840 9.7323 9.7336 11.0596 11.0667 12.2030 12.2422 12.7768 12.8000 13.0797 13.1244 13.6723 13.6829 k = 0.3375-0.2775-0.0000 ( 14098 PWs) bands (ev): -37.8012 -37.8012 -15.6375 -15.6373 -14.3509 -14.3506 -13.4586 -13.4550 -13.0312 -13.0289 -12.6346 -12.6331 -12.4663 -12.4648 -12.3288 -12.3279 -4.9483 -4.9477 -3.6091 -3.6087 -1.4585 -1.4479 -1.3040 -1.2990 -0.3775 -0.3762 -0.3478 -0.3437 0.3461 0.3781 0.6549 0.6606 1.5675 1.5688 1.9117 1.9162 2.0273 2.0318 2.7258 2.7282 3.0288 3.0300 3.0983 3.1027 3.1835 3.1878 3.4502 3.4502 3.5289 3.5356 3.5880 3.5960 4.1250 4.1316 4.1438 4.1461 4.5825 4.5837 9.6886 9.6900 11.0718 11.0794 12.2032 12.2444 12.7746 12.7987 13.0895 13.1359 13.7146 13.7250 k = 0.3250-0.2672-0.0000 ( 14102 PWs) bands (ev): -37.8012 -37.8012 -15.6481 -15.6479 -14.3403 -14.3400 -13.4620 -13.4585 -13.0096 -13.0074 -12.6387 -12.6371 -12.4632 -12.4617 -12.3407 -12.3397 -4.9445 -4.9439 -3.6527 -3.6524 -1.4475 -1.4372 -1.2781 -1.2723 -0.3782 -0.3745 -0.3458 -0.3380 0.3316 0.3658 0.6539 0.6593 1.5622 1.5644 1.9439 1.9480 2.0288 2.0331 2.7140 2.7162 2.9996 3.0008 3.0864 3.0904 3.1882 3.1926 3.4564 3.4566 3.5397 3.5464 3.5879 3.5959 4.1380 4.1441 4.1490 4.1512 4.5822 4.5833 9.6425 9.6439 11.0849 11.0930 12.2054 12.2485 12.7720 12.7969 13.0990 13.1471 13.7557 13.7658 k = 0.3125-0.2569-0.0000 ( 14094 PWs) bands (ev): -37.8012 -37.8012 -15.6590 -15.6588 -14.3291 -14.3288 -13.4651 -13.4616 -12.9879 -12.9858 -12.6429 -12.6413 -12.4599 -12.4583 -12.3532 -12.3522 -4.9405 -4.9399 -3.6967 -3.6965 -1.4359 -1.4258 -1.2528 -1.2465 -0.3774 -0.3723 -0.3424 -0.3319 0.3171 0.3533 0.6523 0.6573 1.5529 1.5561 1.9797 1.9837 2.0286 2.0325 2.6999 2.7017 2.9684 2.9695 3.0764 3.0800 3.1939 3.1984 3.4630 3.4635 3.5514 3.5584 3.5898 3.5977 4.1508 4.1526 4.1566 4.1585 4.5818 4.5828 9.5942 9.5955 11.0989 11.1074 12.2095 12.2544 12.7691 12.7947 13.1079 13.1576 13.7952 13.8051 k = 0.3000-0.2466-0.0000 ( 14102 PWs) bands (ev): -37.8012 -37.8012 -15.6702 -15.6700 -14.3174 -14.3171 -13.4677 -13.4644 -12.9662 -12.9642 -12.6473 -12.6455 -12.4565 -12.4548 -12.3663 -12.3652 -4.9364 -4.9357 -3.7408 -3.7407 -1.4236 -1.4136 -1.2285 -1.2217 -0.3749 -0.3693 -0.3381 -0.3255 0.3026 0.3408 0.6502 0.6548 1.5408 1.5450 2.0156 2.0204 2.0290 2.0314 2.6832 2.6846 2.9352 2.9364 3.0683 3.0716 3.2006 3.2053 3.4701 3.4710 3.5641 3.5715 3.5936 3.6013 4.1580 4.1612 4.1647 4.1711 4.5814 4.5823 9.5438 9.5451 11.1138 11.1227 12.2157 12.2623 12.7658 12.7919 13.1162 13.1674 13.8328 13.8425 k = 0.2875-0.2364-0.0000 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.6815 -15.6813 -14.3052 -14.3048 -13.4701 -13.4668 -12.9446 -12.9428 -12.6517 -12.6499 -12.4528 -12.4511 -12.3798 -12.3787 -4.9322 -4.9315 -3.7848 -3.7847 -1.4105 -1.4007 -1.2053 -1.1983 -0.3705 -0.3653 -0.3329 -0.3191 0.2881 0.3282 0.6474 0.6517 1.5268 1.5319 2.0207 2.0247 2.0595 2.0621 2.6641 2.6651 2.9005 2.9016 3.0619 3.0649 3.2089 3.2136 3.4776 3.4789 3.5781 3.5861 3.5994 3.6068 4.1632 4.1673 4.1773 4.1838 4.5811 4.5818 9.4917 9.4929 11.1295 11.1388 12.2238 12.2719 12.7622 12.7887 13.1234 13.1761 13.8680 13.8777 k = 0.2750-0.2261-0.0000 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.6929 -15.6927 -14.2925 -14.2922 -13.4720 -13.4688 -12.9233 -12.9215 -12.6562 -12.6543 -12.4491 -12.4475 -12.3935 -12.3925 -4.9279 -4.9272 -3.8284 -3.8283 -1.3967 -1.3870 -1.1835 -1.1764 -0.3643 -0.3603 -0.3271 -0.3126 0.2738 0.3157 0.6441 0.6479 1.5118 1.5176 2.0156 2.0189 2.0985 2.1011 2.6427 2.6432 2.8643 2.8654 3.0568 3.0595 3.2189 3.2237 3.4853 3.4870 3.5937 3.6019 3.6071 3.6139 4.1684 4.1732 4.1900 4.1965 4.5809 4.5814 9.4380 9.4392 11.1460 11.1556 12.2337 12.2834 12.7582 12.7850 13.1295 13.1835 13.9009 13.9105 k = 0.2625-0.2158-0.0000 ( 14100 PWs) bands (ev): -37.8012 -37.8012 -15.7042 -15.7040 -14.2795 -14.2791 -13.4737 -13.4706 -12.9023 -12.9007 -12.6608 -12.6588 -12.4457 -12.4443 -12.4070 -12.4061 -4.9235 -4.9228 -3.8714 -3.8713 -1.3821 -1.3726 -1.1631 -1.1559 -0.3563 -0.3543 -0.3204 -0.3061 0.2597 0.3032 0.6401 0.6434 1.4962 1.5028 2.0088 2.0116 2.1368 2.1391 2.6193 2.6194 2.8270 2.8280 3.0526 3.0551 3.2310 3.2358 3.4929 3.4950 3.6108 3.6150 3.6207 3.6226 4.1737 4.1792 4.2026 4.2090 4.5808 4.5811 9.3830 9.3842 11.1631 11.1730 12.2454 12.2965 12.7539 12.7808 13.1342 13.1895 13.9314 13.9411 k = 0.2500-0.2055-0.0000 ( 14092 PWs) bands (ev): -37.8012 -37.8012 -15.7156 -15.7154 -14.2662 -14.2658 -13.4751 -13.4721 -12.8818 -12.8804 -12.6653 -12.6632 -12.4437 -12.4430 -12.4186 -12.4185 -4.9191 -4.9184 -3.9136 -3.9134 -1.3668 -1.3575 -1.1442 -1.1371 -0.3478 -0.3467 -0.3128 -0.2997 0.2458 0.2909 0.6353 0.6382 1.4807 1.4879 2.0008 2.0031 2.1732 2.1753 2.5938 2.5942 2.7890 2.7899 3.0489 3.0511 3.2454 3.2503 3.5003 3.5027 3.6256 3.6296 3.6326 3.6400 4.1792 4.1854 4.2151 4.2213 4.5810 4.5810 9.3271 9.3282 11.1808 11.1910 12.2588 12.3112 12.7493 12.7761 13.1375 13.1938 13.9594 13.9694 k = 0.2375-0.1953-0.0000 ( 14084 PWs) bands (ev): -37.8012 -37.8012 -15.7268 -15.7266 -14.2526 -14.2522 -13.4762 -13.4733 -12.8620 -12.8606 -12.6698 -12.6676 -12.4483 -12.4473 -12.4252 -12.4237 -4.9147 -4.9140 -3.9548 -3.9545 -1.3509 -1.3418 -1.1268 -1.1199 -0.3410 -0.3355 -0.3039 -0.2934 0.2322 0.2786 0.6299 0.6323 1.4654 1.4733 1.9919 1.9937 2.2071 2.2089 2.5669 2.5678 2.7504 2.7512 3.0453 3.0474 3.2624 3.2672 3.5073 3.5099 3.6371 3.6437 3.6501 3.6610 4.1847 4.1918 4.2274 4.2335 4.5812 4.5815 9.2705 9.2715 11.1991 11.2094 12.2737 12.3273 12.7444 12.7711 13.1392 13.1965 13.9852 13.9955 k = 0.2250-0.1850-0.0000 ( 14082 PWs) bands (ev): -37.8012 -37.8012 -15.7378 -15.7376 -14.2389 -14.2385 -13.4771 -13.4743 -12.8428 -12.8416 -12.6742 -12.6719 -12.4603 -12.4586 -12.4242 -12.4221 -4.9104 -4.9096 -3.9948 -3.9945 -1.3344 -1.3256 -1.1108 -1.1041 -0.3345 -0.3232 -0.2937 -0.2870 0.2189 0.2665 0.6238 0.6258 1.4509 1.4593 1.9824 1.9837 2.2378 2.2392 2.5391 2.5403 2.7118 2.7125 3.0418 3.0437 3.2821 3.2867 3.5136 3.5164 3.6495 3.6557 3.6719 3.6833 4.1905 4.1984 4.2396 4.2455 4.5818 4.5823 9.2134 9.2144 11.2176 11.2281 12.2900 12.3447 12.7393 12.7657 13.1393 13.1975 14.0086 14.0195 k = 0.2125-0.1747-0.0000 ( 14097 PWs) bands (ev): -37.8012 -37.8012 -15.7485 -15.7483 -14.2251 -14.2247 -13.4778 -13.4751 -12.8245 -12.8234 -12.6785 -12.6762 -12.4747 -12.4728 -12.4202 -12.4180 -4.9061 -4.9053 -4.0335 -4.0331 -1.3174 -1.3089 -1.0962 -1.0898 -0.3283 -0.3101 -0.2821 -0.2805 0.2060 0.2546 0.6169 0.6185 1.4374 1.4462 1.9725 1.9734 2.2648 2.2658 2.5105 2.5122 2.6735 2.6740 3.0380 3.0399 3.3044 3.3089 3.5193 3.5222 3.6626 3.6684 3.6947 3.7065 4.1965 4.2053 4.2517 4.2573 4.5827 4.5836 9.1563 9.1572 11.2365 11.2471 12.3075 12.3633 12.7341 12.7601 13.1378 13.1967 14.0298 14.0414 k = 0.2000-0.1644-0.0000 ( 14089 PWs) bands (ev): -37.8012 -37.8012 -15.7589 -15.7588 -14.2113 -14.2109 -13.4783 -13.4757 -12.8071 -12.8061 -12.6826 -12.6803 -12.4897 -12.4877 -12.4153 -12.4130 -4.9018 -4.9011 -4.0707 -4.0702 -1.3000 -1.2919 -1.0828 -1.0768 -0.3227 -0.2970 -0.2734 -0.2691 0.1935 0.2427 0.6094 0.6106 1.4250 1.4342 1.9626 1.9630 2.2879 2.2882 2.4816 2.4837 2.6360 2.6362 3.0341 3.0358 3.3291 3.3334 3.5243 3.5271 3.6762 3.6816 3.7180 3.7303 4.2028 4.2125 4.2637 4.2691 4.5841 4.5852 9.0995 9.1003 11.2554 11.2660 12.3261 12.3828 12.7287 12.7542 13.1349 13.1942 14.0483 14.0611 k = 0.1875-0.1542-0.0000 ( 14097 PWs) bands (ev): -37.8012 -37.8012 -15.7690 -15.7688 -14.1976 -14.1972 -13.4786 -13.4762 -12.7907 -12.7897 -12.6866 -12.6842 -12.5049 -12.5028 -12.4100 -12.4077 -4.8977 -4.8970 -4.1062 -4.1058 -1.2824 -1.2746 -1.0707 -1.0650 -0.3176 -0.2854 -0.2645 -0.2552 0.1813 0.2310 0.6012 0.6020 1.4139 1.4234 1.9528 1.9529 2.3063 2.3066 2.4526 2.4550 2.5997 2.5999 3.0299 3.0316 3.3560 3.3600 3.5285 3.5312 3.6900 3.6950 3.7414 3.7540 4.2096 4.2200 4.2757 4.2808 4.5859 4.5873 9.0432 9.0440 11.2743 11.2849 12.3456 12.4031 12.7233 12.7483 13.1305 13.1902 14.0636 14.0782 k = 0.1750-0.1439-0.0000 ( 14101 PWs) bands (ev): -37.8012 -37.8012 -15.7787 -15.7785 -14.1840 -14.1836 -13.4788 -13.4765 -12.7753 -12.7745 -12.6903 -12.6879 -12.5200 -12.5179 -12.4043 -12.4021 -4.8937 -4.8930 -4.1400 -4.1396 -1.2646 -1.2572 -1.0596 -1.0543 -0.3130 -0.2766 -0.2527 -0.2406 0.1696 0.2193 0.5923 0.5929 1.4042 1.4139 1.9431 1.9435 2.3196 2.3207 2.4237 2.4265 2.5651 2.5659 3.0256 3.0271 3.3847 3.3883 3.5320 3.5345 3.7037 3.7083 3.7644 3.7771 4.2168 4.2278 4.2876 4.2924 4.5882 4.5898 8.9879 8.9886 11.2931 11.3035 12.3659 12.4239 12.7181 12.7423 13.1250 13.1847 14.0745 14.0915 k = 0.1625-0.1336-0.0000 ( 14107 PWs) bands (ev): -37.8012 -37.8012 -15.7879 -15.7877 -14.1708 -14.1704 -13.4788 -13.4767 -12.7612 -12.7604 -12.6937 -12.6914 -12.5349 -12.5327 -12.3986 -12.3964 -4.8898 -4.8892 -4.1720 -4.1715 -1.2468 -1.2399 -1.0494 -1.0446 -0.3087 -0.2704 -0.2385 -0.2255 0.1583 0.2078 0.5830 0.5834 1.3960 1.4057 1.9340 1.9348 2.3277 2.3297 2.3952 2.3983 2.5334 2.5348 3.0211 3.0225 3.4146 3.4178 3.5349 3.5371 3.7173 3.7215 3.7866 3.7993 4.2245 4.2360 4.2996 4.3041 4.5909 4.5928 8.9339 8.9346 11.3115 11.3218 12.3866 12.4450 12.7130 12.7364 13.1184 13.1778 14.0784 14.0983 k = 0.1500-0.1233-0.0000 ( 14107 PWs) bands (ev): -37.8012 -37.8012 -15.7965 -15.7964 -14.1579 -14.1575 -13.4788 -13.4768 -12.7485 -12.7476 -12.6967 -12.6944 -12.5494 -12.5471 -12.3928 -12.3907 -4.8862 -4.8855 -4.2020 -4.2015 -1.2292 -1.2227 -1.0402 -1.0357 -0.3046 -0.2658 -0.2233 -0.2104 0.1476 0.1963 0.5733 0.5735 1.3892 1.3989 1.9257 1.9269 2.3299 2.3331 2.3673 2.3708 2.5056 2.5078 3.0165 3.0178 3.4453 3.4480 3.5373 3.5391 3.7304 3.7341 3.8076 3.8202 4.2327 4.2446 4.3116 4.3158 4.5941 4.5961 8.8816 8.8822 11.3294 11.3394 12.4077 12.4661 12.7082 12.7307 13.1110 13.1699 14.0728 14.0944 k = 0.1375-0.1130-0.0000 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.8047 -15.8045 -14.1455 -14.1451 -13.4787 -13.4768 -12.7373 -12.7362 -12.6989 -12.6969 -12.5633 -12.5610 -12.3870 -12.3850 -4.8827 -4.8821 -4.2299 -4.2294 -1.2120 -1.2060 -1.0318 -1.0277 -0.3008 -0.2621 -0.2079 -0.1955 0.1374 0.1850 0.5634 0.5635 1.3839 1.3934 1.9184 1.9199 2.3256 2.3298 2.3405 2.3443 2.4832 2.4860 3.0120 3.0132 3.4760 3.4781 3.5393 3.5406 3.7427 3.7459 3.8270 3.8393 4.2414 4.2533 4.3236 4.3275 4.5977 4.5998 8.8315 8.8320 11.3466 11.3563 12.4288 12.4869 12.7038 12.7253 13.1030 13.1610 14.0586 14.0789 k = 0.1250-0.1028-0.0000 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.8122 -15.8121 -14.1337 -14.1334 -13.4785 -13.4768 -12.7282 -12.7267 -12.7000 -12.6983 -12.5766 -12.5742 -12.3814 -12.3795 -4.8794 -4.8789 -4.2557 -4.2552 -1.1953 -1.1898 -1.0241 -1.0204 -0.2972 -0.2591 -0.1928 -0.1811 0.1279 0.1739 0.5534 0.5534 1.3800 1.3891 1.9121 1.9139 2.3128 2.3130 2.3213 2.3220 2.4666 2.4699 3.0075 3.0086 3.5063 3.5071 3.5413 3.5417 3.7541 3.7569 3.8447 3.8565 4.2503 4.2621 4.3356 4.3391 4.6017 4.6038 8.7838 8.7843 11.3630 11.3723 12.4498 12.5070 12.7001 12.7204 13.0946 13.1512 14.0396 14.0576 k = 0.1125-0.0925-0.0000 ( 14135 PWs) bands (ev): -37.8013 -37.8013 -15.8191 -15.8190 -14.1226 -14.1223 -13.4783 -13.4768 -12.7221 -12.7200 -12.6989 -12.6980 -12.5891 -12.5867 -12.3759 -12.3741 -4.8764 -4.8759 -4.2792 -4.2788 -1.1794 -1.1744 -1.0171 -1.0138 -0.2936 -0.2568 -0.1783 -0.1673 0.1192 0.1629 0.5435 0.5435 1.3772 1.3859 1.9070 1.9091 2.2884 2.2908 2.3038 2.3070 2.4556 2.4589 3.0032 3.0042 3.5310 3.5343 3.5436 3.5473 3.7644 3.7667 3.8606 3.8717 4.2595 4.2709 4.3474 4.3506 4.6059 4.6080 8.7391 8.7395 11.3785 11.3872 12.4703 12.5260 12.6971 12.7161 13.0862 13.1409 14.0193 14.0349 k = 0.1000-0.0822-0.0000 ( 14139 PWs) bands (ev): -37.8013 -37.8013 -15.8254 -15.8253 -14.1123 -14.1120 -13.4781 -13.4767 -12.7194 -12.7168 -12.6952 -12.6949 -12.6007 -12.5983 -12.3707 -12.3691 -4.8737 -4.8732 -4.3005 -4.3001 -1.1644 -1.1600 -1.0108 -1.0078 -0.2901 -0.2552 -0.1646 -0.1545 0.1113 0.1523 0.5339 0.5339 1.3756 1.3837 1.9031 1.9053 2.2650 2.2678 2.2856 2.2892 2.4487 2.4517 2.9992 3.0001 3.5380 3.5413 3.5649 3.5684 3.7733 3.7752 3.8746 3.8848 4.2686 4.2793 4.3590 4.3618 4.6102 4.6123 8.6977 8.6981 11.3928 11.4009 12.4900 12.5434 12.6951 12.7125 13.0780 13.1302 13.9994 14.0130 k = 0.0875-0.0719-0.0000 ( 14137 PWs) bands (ev): -37.8013 -37.8013 -15.8310 -15.8309 -14.1029 -14.1027 -13.4778 -13.4766 -12.7190 -12.7163 -12.6901 -12.6900 -12.6113 -12.6090 -12.3659 -12.3644 -4.8712 -4.8708 -4.3194 -4.3190 -1.1506 -1.1468 -1.0051 -1.0025 -0.2866 -0.2541 -0.1520 -0.1427 0.1045 0.1420 0.5248 0.5249 1.3749 1.3823 1.9003 1.9025 2.2433 2.2461 2.2668 2.2701 2.4443 2.4470 2.9955 2.9963 3.5393 3.5415 3.5909 3.5932 3.7807 3.7822 3.8867 3.8959 4.2775 4.2873 4.3701 4.3725 4.6146 4.6165 8.6600 8.6604 11.4059 11.4132 12.5087 12.5587 12.6942 12.7096 13.0703 13.1192 13.9809 13.9925 k = 0.0750-0.0617-0.0000 ( 14133 PWs) bands (ev): -37.8013 -37.8013 -15.8359 -15.8358 -14.0946 -14.0943 -13.4776 -13.4765 -12.7196 -12.7170 -12.6848 -12.6847 -12.6207 -12.6185 -12.3615 -12.3602 -4.8690 -4.8687 -4.3359 -4.3356 -1.1381 -1.1349 -1.0001 -0.9979 -0.2830 -0.2536 -0.1405 -0.1323 0.0987 0.1323 0.5165 0.5165 1.3749 1.3815 1.8985 1.9007 2.2235 2.2262 2.2486 2.2515 2.4414 2.4437 2.9921 2.9928 3.5396 3.5413 3.6149 3.6165 3.7866 3.7877 3.8970 3.9051 4.2858 4.2945 4.3805 4.3826 4.6188 4.6205 8.6264 8.6267 11.4176 11.4240 12.5260 12.5714 12.6945 12.7075 13.0634 13.1082 13.9643 13.9741 k = 0.0625-0.0514-0.0000 ( 14127 PWs) bands (ev): -37.8013 -37.8013 -15.8401 -15.8400 -14.0873 -14.0871 -13.4773 -13.4764 -12.7204 -12.7180 -12.6799 -12.6799 -12.6288 -12.6268 -12.3576 -12.3566 -4.8671 -4.8668 -4.3499 -4.3496 -1.1271 -1.1245 -0.9958 -0.9939 -0.2795 -0.2538 -0.1304 -0.1233 0.0941 0.1232 0.5090 0.5090 1.3754 1.3812 1.8976 1.8998 2.2060 2.2085 2.2319 2.2344 2.4394 2.4413 2.9892 2.9898 3.5397 3.5410 3.6364 3.6376 3.7909 3.7917 3.9055 3.9124 4.2934 4.3009 4.3900 4.3917 4.6227 4.6242 8.5974 8.5976 11.4277 11.4333 12.5417 12.5812 12.6961 12.7063 13.0577 13.0974 13.9500 13.9580 k = 0.0500-0.0411-0.0000 ( 14131 PWs) bands (ev): -37.8013 -37.8013 -15.8435 -15.8435 -14.0812 -14.0811 -13.4771 -13.4764 -12.7212 -12.7191 -12.6758 -12.6758 -12.6356 -12.6338 -12.3543 -12.3535 -4.8656 -4.8653 -4.3614 -4.3612 -1.1179 -1.1158 -0.9921 -0.9906 -0.2760 -0.2545 -0.1218 -0.1159 0.0909 0.1148 0.5026 0.5027 1.3763 1.3811 1.8975 1.8994 2.1911 2.1933 2.2175 2.2195 2.4380 2.4394 2.9868 2.9873 3.5396 3.5406 3.6550 3.6558 3.7938 3.7943 3.9125 3.9181 4.3001 4.3062 4.3983 4.3996 4.6263 4.6275 8.5731 8.5733 11.4363 11.4409 12.5554 12.5880 12.6985 12.7059 13.0535 13.0870 13.9381 13.9445 k = 0.0375-0.0308-0.0000 ( 14133 PWs) bands (ev): -37.8013 -37.8013 -15.8462 -15.8462 -14.0764 -14.0763 -13.4769 -13.4763 -12.7217 -12.7201 -12.6726 -12.6726 -12.6408 -12.6394 -12.3517 -12.3510 -4.8644 -4.8642 -4.3704 -4.3702 -1.1105 -1.1090 -0.9892 -0.9881 -0.2725 -0.2559 -0.1148 -0.1103 0.0890 0.1074 0.4975 0.4975 1.3774 1.3810 1.8978 1.8994 2.1792 2.1809 2.2059 2.2074 2.4370 2.4381 2.9849 2.9852 3.5395 3.5402 3.6703 3.6708 3.7954 3.7957 3.9180 3.9222 4.3056 4.3102 4.4050 4.4061 4.6292 4.6302 8.5539 8.5540 11.4432 11.4467 12.5671 12.5919 12.7012 12.7060 13.0511 13.0774 13.9289 13.9337 k = 0.0250-0.0206-0.0000 ( 14125 PWs) bands (ev): -37.8013 -37.8013 -15.8481 -15.8481 -14.0729 -14.0729 -13.4767 -13.4763 -12.7220 -12.7209 -12.6703 -12.6703 -12.6446 -12.6436 -12.3498 -12.3493 -4.8635 -4.8633 -4.3768 -4.3767 -1.1051 -1.1041 -0.9870 -0.9863 -0.2691 -0.2577 -0.1095 -0.1064 0.0886 0.1011 0.4937 0.4938 1.3784 1.3809 1.8984 1.8995 2.1705 2.1717 2.1975 2.1985 2.4363 2.4370 2.9835 2.9837 3.5394 3.5399 3.6817 3.6820 3.7960 3.7962 3.9220 3.9248 4.3098 4.3130 4.4101 4.4108 4.6315 4.6321 8.5400 8.5401 11.4484 11.4507 12.5766 12.5932 12.7037 12.7064 13.0506 13.0688 13.9224 13.9256 k = 0.0125-0.0103-0.0000 ( 14115 PWs) bands (ev): -37.8013 -37.8013 -15.8493 -15.8493 -14.0708 -14.0708 -13.4765 -13.4764 -12.7221 -12.7215 -12.6689 -12.6689 -12.6467 -12.6462 -12.3485 -12.3483 -4.8629 -4.8629 -4.3807 -4.3806 -1.1017 -1.1012 -0.9856 -0.9852 -0.2658 -0.2600 -0.1060 -0.1044 0.0896 0.0959 0.4914 0.4915 1.3794 1.3806 1.8989 1.8995 2.1653 2.1659 2.1924 2.1929 2.4360 2.4364 2.9827 2.9828 3.5393 3.5396 3.6889 3.6890 3.7962 3.7962 3.9247 3.9261 4.3128 4.3143 4.4133 4.4137 4.6329 4.6333 8.5316 8.5317 11.4517 11.4529 12.5839 12.5922 12.7056 12.7068 13.0523 13.0615 13.9188 13.9204 k = 0.0000 0.0000 0.0000 ( 14119 PWs) bands (ev): -37.8013 -37.8013 -15.8497 -15.8497 -14.0701 -14.0701 -13.4764 -13.4764 -12.7219 -12.7219 -12.6684 -12.6684 -12.6473 -12.6473 -12.3480 -12.3480 -4.8627 -4.8627 -4.3820 -4.3820 -1.1004 -1.1004 -0.9850 -0.9850 -0.2628 -0.2628 -0.1042 -0.1042 0.0921 0.0921 0.4907 0.4907 1.3801 1.3801 1.8993 1.8993 2.1637 2.1637 2.1909 2.1909 2.4360 2.4360 2.9825 2.9825 3.5394 3.5394 3.6914 3.6914 3.7962 3.7962 3.9260 3.9260 4.3143 4.3143 4.4145 4.4145 4.6335 4.6335 8.5288 8.5288 11.4532 11.4532 12.5891 12.5891 12.7066 12.7066 13.0559 13.0559 13.9182 13.9182 k = 0.0000 0.0000 0.0000 ( 14119 PWs) bands (ev): -37.8013 -37.8013 -15.8497 -15.8497 -14.0701 -14.0701 -13.4764 -13.4764 -12.7219 -12.7219 -12.6684 -12.6684 -12.6473 -12.6473 -12.3480 -12.3480 -4.8627 -4.8627 -4.3820 -4.3820 -1.1004 -1.1004 -0.9850 -0.9850 -0.2628 -0.2628 -0.1042 -0.1042 0.0921 0.0921 0.4907 0.4907 1.3801 1.3801 1.8993 1.8993 2.1637 2.1637 2.1909 2.1909 2.4360 2.4360 2.9825 2.9825 3.5394 3.5394 3.6914 3.6914 3.7962 3.7962 3.9260 3.9260 4.3143 4.3143 4.4145 4.4145 4.6335 4.6335 8.5288 8.5288 11.4532 11.4532 12.5891 12.5891 12.7066 12.7066 13.0559 13.0559 13.9182 13.9182 k = 0.0156 0.0031-0.0031 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.8492 -15.8491 -14.0725 -14.0723 -13.4752 -13.4744 -12.7231 -12.7210 -12.6692 -12.6677 -12.6472 -12.6467 -12.3485 -12.3478 -4.8657 -4.8654 -4.3785 -4.3780 -1.1061 -1.0973 -0.9881 -0.9810 -0.2656 -0.2613 -0.1063 -0.1030 0.0893 0.0950 0.4908 0.4925 1.3795 1.3818 1.8981 1.8987 2.1595 2.1638 2.1934 2.1977 2.4365 2.4368 2.9813 2.9817 3.5386 3.5398 3.6898 3.6920 3.7967 3.7972 3.9240 3.9250 4.3134 4.3144 4.4139 4.4142 4.6327 4.6329 8.5318 8.5320 11.4513 11.4524 12.5723 12.6024 12.6918 12.7224 13.0514 13.0587 13.9108 13.9283 k = 0.0312 0.0062-0.0062 ( 14117 PWs) bands (ev): -37.8013 -37.8013 -15.8476 -15.8475 -14.0793 -14.0791 -13.4708 -13.4693 -12.7244 -12.7203 -12.6699 -12.6670 -12.6465 -12.6454 -12.3491 -12.3479 -4.8741 -4.8734 -4.3679 -4.3669 -1.1139 -1.0971 -0.9899 -0.9766 -0.2699 -0.2613 -0.1089 -0.1027 0.0868 0.0978 0.4929 0.4964 1.3800 1.3845 1.8949 1.8960 2.1552 2.1612 2.2037 2.2094 2.4381 2.4387 2.9783 2.9790 3.5373 3.5397 3.6872 3.6916 3.7986 3.7997 3.9191 3.9210 4.3117 4.3137 4.4125 4.4129 4.6304 4.6309 8.5410 8.5412 11.4466 11.4488 12.5535 12.6095 12.6810 12.7381 13.0452 13.0596 13.9064 13.9409 k = 0.0469 0.0092-0.0093 ( 14117 PWs) bands (ev): -37.8013 -37.8013 -15.8449 -15.8448 -14.0903 -14.0900 -13.4636 -13.4614 -12.7258 -12.7198 -12.6705 -12.6664 -12.6453 -12.6436 -12.3500 -12.3482 -4.8872 -4.8862 -4.3510 -4.3495 -1.1234 -1.1001 -0.9902 -0.9721 -0.2754 -0.2627 -0.1122 -0.1033 0.0847 0.1005 0.4969 0.5021 1.3817 1.3882 1.8900 1.8915 2.1534 2.1600 2.2174 2.2235 2.4411 2.4420 2.9735 2.9746 3.5354 3.5390 3.6833 3.6899 3.8020 3.8037 3.9116 3.9143 4.3092 4.3120 4.4102 4.4108 4.6268 4.6276 8.5561 8.5565 11.4391 11.4424 12.5332 12.6059 12.6786 12.7530 13.0378 13.0588 13.9045 13.9550 k = 0.0625 0.0123-0.0124 ( 14118 PWs) bands (ev): -37.8013 -37.8013 -15.8412 -15.8411 -14.1053 -14.1049 -13.4537 -13.4509 -12.7272 -12.7194 -12.6711 -12.6659 -12.6435 -12.6412 -12.3512 -12.3488 -4.9040 -4.9027 -4.3285 -4.3267 -1.1343 -1.1061 -0.9890 -0.9678 -0.2822 -0.2655 -0.1159 -0.1046 0.0827 0.1027 0.5029 0.5096 1.3846 1.3929 1.8835 1.8853 2.1547 2.1615 2.2323 2.2386 2.4458 2.4471 2.9672 2.9686 3.5325 3.5374 3.6780 3.6867 3.8066 3.8089 3.9022 3.9055 4.3058 4.3094 4.4072 4.4081 4.6219 4.6229 8.5771 8.5777 11.4290 11.4332 12.5115 12.5919 12.6844 12.7670 13.0297 13.0567 13.9047 13.9695 k = 0.0781 0.0154-0.0155 ( 14121 PWs) bands (ev): -37.8013 -37.8013 -15.8364 -15.8363 -14.1236 -14.1232 -13.4418 -13.4383 -12.7286 -12.7193 -12.6716 -12.6653 -12.6412 -12.6384 -12.3526 -12.3496 -4.9235 -4.9221 -4.3016 -4.2995 -1.1463 -1.1147 -0.9869 -0.9641 -0.2899 -0.2694 -0.1199 -0.1067 0.0810 0.1044 0.5108 0.5189 1.3888 1.3988 1.8756 1.8777 2.1591 2.1660 2.2476 2.2539 2.4525 2.4541 2.9597 2.9613 3.5284 3.5346 3.6709 3.6816 3.8122 3.8150 3.8918 3.8954 4.3012 4.3054 4.4037 4.4048 4.6160 4.6172 8.6038 8.6045 11.4163 11.4214 12.4886 12.5718 12.6943 12.7798 13.0213 13.0536 13.9063 13.9830 k = 0.0938 0.0185-0.0186 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.8306 -15.8304 -14.1449 -14.1445 -13.4281 -13.4241 -12.7299 -12.7192 -12.6719 -12.6648 -12.6386 -12.6352 -12.3542 -12.3506 -4.9449 -4.9434 -4.2712 -4.2688 -1.1593 -1.1256 -0.9841 -0.9609 -0.2985 -0.2745 -0.1241 -0.1094 0.0794 0.1055 0.5204 0.5297 1.3944 1.4057 1.8669 1.8691 2.1663 2.1732 2.2624 2.2687 2.4616 2.4637 2.9512 2.9531 3.5224 3.5298 3.6620 3.6745 3.8178 3.8212 3.8819 3.8854 4.2954 4.3001 4.3999 4.4011 4.6091 4.6105 8.6358 8.6366 11.4010 11.4069 12.4648 12.5482 12.7055 12.7916 13.0132 13.0499 13.9085 13.9942 k = 0.1094 0.0216-0.0217 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.8237 -15.8236 -14.1687 -14.1684 -13.4132 -13.4086 -12.7310 -12.7192 -12.6722 -12.6643 -12.6356 -12.6316 -12.3561 -12.3520 -4.9675 -4.9659 -4.2380 -4.2353 -1.1732 -1.1383 -0.9810 -0.9584 -0.3077 -0.2805 -0.1287 -0.1126 0.0778 0.1060 0.5316 0.5420 1.4013 1.4136 1.8578 1.8601 2.1757 2.1826 2.2763 2.2824 2.4735 2.4760 2.9420 2.9441 3.5140 3.5223 3.6513 3.6652 3.8219 3.8262 3.8744 3.8775 4.2881 4.2932 4.3960 4.3974 4.6015 4.6031 8.6728 8.6738 11.3834 11.3900 12.4400 12.5226 12.7172 12.8023 13.0057 13.0459 13.9107 14.0024 k = 0.1250 0.0246-0.0248 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.8159 -15.8157 -14.1947 -14.1944 -13.3974 -13.3923 -12.7320 -12.7191 -12.6724 -12.6638 -12.6324 -12.6277 -12.3582 -12.3535 -4.9908 -4.9891 -4.2026 -4.1998 -1.1879 -1.1525 -0.9779 -0.9565 -0.3176 -0.2874 -0.1334 -0.1162 0.0763 0.1059 0.5442 0.5556 1.4095 1.4226 1.8487 1.8512 2.1866 2.1933 2.2892 2.2951 2.4884 2.4913 2.9324 2.9347 3.5024 3.5113 3.6393 3.6541 3.8226 3.8277 3.8716 3.8742 4.2791 4.2845 4.3923 4.3939 4.5934 4.5951 8.7146 8.7156 11.3634 11.3705 12.4146 12.4956 12.7288 12.8120 12.9992 13.0419 13.9122 14.0072 k = 0.1406 0.0277-0.0279 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.8071 -15.8069 -14.2224 -14.2221 -13.3810 -13.3755 -12.7327 -12.7190 -12.6726 -12.6632 -12.6289 -12.6236 -12.3606 -12.3554 -5.0143 -5.0126 -4.1656 -4.1627 -1.2034 -1.1680 -0.9750 -0.9551 -0.3278 -0.2950 -0.1384 -0.1202 0.0749 0.1053 0.5582 0.5704 1.4188 1.4323 1.8402 1.8429 2.1982 2.2046 2.3012 2.3067 2.5063 2.5096 2.9228 2.9252 3.4870 3.4959 3.6266 3.6413 3.8195 3.8248 3.8743 3.8766 4.2685 4.2739 4.3890 4.3907 4.5850 4.5868 8.7606 8.7618 11.3412 11.3487 12.3885 12.4675 12.7405 12.8211 12.9935 13.0380 13.9124 14.0088 k = 0.1562 0.0308-0.0310 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.7973 -15.7971 -14.2516 -14.2513 -13.3644 -13.3585 -12.7331 -12.7187 -12.6727 -12.6627 -12.6253 -12.6193 -12.3631 -12.3575 -5.0377 -5.0360 -4.1274 -4.1243 -1.2195 -1.1846 -0.9724 -0.9540 -0.3385 -0.3034 -0.1436 -0.1245 0.0737 0.1045 0.5733 0.5860 1.4290 1.4426 1.8328 1.8358 2.2095 2.2156 2.3128 2.3178 2.5270 2.5307 2.9133 2.9158 3.4672 3.4755 3.6137 3.6276 3.8143 3.8193 3.8806 3.8828 4.2560 4.2614 4.3863 4.3881 4.5765 4.5783 8.8106 8.8119 11.3169 11.3246 12.3622 12.4389 12.7523 12.8297 12.9889 13.0343 13.9108 14.0072 k = 0.1719 0.0339-0.0341 ( 14116 PWs) bands (ev): -37.8012 -37.8012 -15.7867 -15.7865 -14.2819 -14.2817 -13.3477 -13.3415 -12.7332 -12.7183 -12.6727 -12.6621 -12.6215 -12.6148 -12.3660 -12.3598 -5.0608 -5.0590 -4.0884 -4.0852 -1.2362 -1.2022 -0.9702 -0.9531 -0.3497 -0.3125 -0.1489 -0.1291 0.0728 0.1036 0.5894 0.6026 1.4398 1.4532 1.8269 1.8304 2.2198 2.2254 2.3245 2.3291 2.5501 2.5541 2.9042 2.9068 3.4430 3.4501 3.6009 3.6132 3.8089 3.8133 3.8884 3.8907 4.2416 4.2469 4.3845 4.3864 4.5679 4.5699 8.8641 8.8655 11.2905 11.2983 12.3358 12.4100 12.7642 12.8382 12.9850 13.0305 13.9071 14.0028 k = 0.1875 0.0370-0.0372 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.7751 -15.7749 -14.3131 -14.3129 -13.3312 -13.3247 -12.7330 -12.7176 -12.6727 -12.6615 -12.6175 -12.6102 -12.3690 -12.3625 -5.0834 -5.0815 -4.0489 -4.0455 -1.2536 -1.2206 -0.9684 -0.9521 -0.3613 -0.3225 -0.1541 -0.1339 0.0721 0.1028 0.6063 0.6197 1.4508 1.4637 1.8230 1.8271 2.2282 2.2333 2.3370 2.3411 2.5751 2.5795 2.8956 2.8982 3.4146 3.4204 3.5880 3.5985 3.8039 3.8078 3.8963 3.8989 4.2254 4.2306 4.3836 4.3856 4.5596 4.5616 8.9208 8.9224 11.2621 11.2699 12.3096 12.3813 12.7765 12.8467 12.9818 13.0268 13.9008 13.9953 k = 0.2031 0.0400-0.0403 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.7628 -15.7626 -14.3449 -14.3448 -13.3151 -13.3084 -12.7324 -12.7166 -12.6727 -12.6609 -12.6134 -12.6055 -12.3723 -12.3654 -5.1052 -5.1033 -4.0090 -4.0056 -1.2716 -1.2398 -0.9670 -0.9507 -0.3736 -0.3334 -0.1591 -0.1386 0.0718 0.1021 0.6239 0.6375 1.4616 1.4737 1.8215 1.8264 2.2344 2.2391 2.3506 2.3543 2.6016 2.6063 2.8877 2.8904 3.3827 3.3873 3.5749 3.5835 3.7995 3.8029 3.9038 3.9067 4.2076 4.2125 4.3838 4.3858 4.5515 4.5537 8.9802 8.9819 11.2317 11.2394 12.2839 12.3530 12.7893 12.8557 12.9789 13.0228 13.8918 13.9848 k = 0.2188 0.0431-0.0434 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.7497 -15.7494 -14.3772 -14.3771 -13.2995 -13.2926 -12.7315 -12.7154 -12.6727 -12.6604 -12.6093 -12.6008 -12.3759 -12.3686 -5.1262 -5.1244 -3.9692 -3.9658 -1.2900 -1.2596 -0.9658 -0.9488 -0.3866 -0.3455 -0.1636 -0.1432 0.0719 0.1016 0.6422 0.6556 1.4717 1.4828 1.8229 1.8286 2.2384 2.2427 2.3651 2.3685 2.6292 2.6342 2.8805 2.8832 3.3484 3.3521 3.5611 3.5680 3.7954 3.7986 3.9104 3.9137 4.1883 4.1928 4.3851 4.3870 4.5438 4.5461 9.0420 9.0439 11.1995 11.2068 12.2591 12.3256 12.8027 12.8651 12.9764 13.0185 13.8798 13.9712 k = 0.2344 0.0462-0.0465 ( 14107 PWs) bands (ev): -37.8012 -37.8012 -15.7359 -15.7356 -14.4098 -14.4096 -13.2844 -13.2774 -12.7301 -12.7139 -12.6727 -12.6599 -12.6050 -12.5960 -12.3796 -12.3720 -5.1464 -5.1445 -3.9297 -3.9262 -1.3088 -1.2799 -0.9647 -0.9464 -0.4006 -0.3589 -0.1674 -0.1473 0.0723 0.1013 0.6609 0.6741 1.4806 1.4906 1.8274 1.8340 2.2405 2.2443 2.3803 2.3834 2.6573 2.6627 2.8741 2.8769 3.3125 3.3160 3.5465 3.5519 3.7915 3.7947 3.9158 3.9196 4.1678 4.1720 4.3875 4.3894 4.5366 4.5391 9.1059 9.1080 11.1654 11.1723 12.2354 12.2993 12.8167 12.8750 12.9742 13.0138 13.8651 13.9546 k = 0.2500 0.0493-0.0495 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.7214 -15.7212 -14.4424 -14.4422 -13.2701 -13.2630 -12.7284 -12.7122 -12.6726 -12.6593 -12.6007 -12.5911 -12.3836 -12.3756 -5.1656 -5.1637 -3.8906 -3.8871 -1.3279 -1.3005 -0.9634 -0.9434 -0.4156 -0.3736 -0.1703 -0.1508 0.0730 0.1013 0.6800 0.6930 1.4881 1.4969 1.8351 1.8425 2.2408 2.2444 2.3956 2.3985 2.6857 2.6914 2.8685 2.8715 3.2763 3.2800 3.5308 3.5350 3.7875 3.7909 3.9197 3.9240 4.1467 4.1504 4.3910 4.3928 4.5298 4.5325 9.1714 9.1737 11.1294 11.1359 12.2131 12.2744 12.8313 12.8852 12.9725 13.0085 13.8475 13.9350 k = 0.2656 0.0523-0.0526 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.7064 -15.7061 -14.4748 -14.4746 -13.2565 -13.2495 -12.7264 -12.7101 -12.6726 -12.6589 -12.5963 -12.5863 -12.3878 -12.3796 -5.1837 -5.1819 -3.8522 -3.8487 -1.3473 -1.3214 -0.9616 -0.9397 -0.4317 -0.3898 -0.1723 -0.1535 0.0740 0.1014 0.6995 0.7120 1.4939 1.5015 1.8459 1.8541 2.2399 2.2432 2.4107 2.4132 2.7140 2.7199 2.8638 2.8669 3.2408 3.2450 3.5140 3.5172 3.7833 3.7870 3.9218 3.9265 4.1254 4.1287 4.3953 4.3970 4.5236 4.5265 9.2383 9.2408 11.0916 11.0976 12.1923 12.2510 12.8463 12.8954 12.9717 13.0027 13.8273 13.9127 k = 0.2812 0.0554-0.0557 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.6910 -15.6907 -14.5070 -14.5067 -13.2438 -13.2368 -12.7241 -12.7078 -12.6726 -12.6585 -12.5918 -12.5814 -12.3922 -12.3837 -5.2008 -5.1990 -3.8148 -3.8113 -1.3666 -1.3423 -0.9591 -0.9353 -0.4490 -0.4073 -0.1733 -0.1553 0.0750 0.1015 0.7193 0.7312 1.4980 1.5045 1.8596 1.8684 2.2380 2.2411 2.4250 2.4271 2.7418 2.7479 2.8601 2.8633 3.2072 3.2120 3.4962 3.4986 3.7788 3.7829 3.9214 3.9266 4.1049 4.1077 4.4004 4.4021 4.5178 4.5210 9.3063 9.3090 11.0521 11.0575 12.1734 12.2295 12.8614 12.9050 12.9726 12.9966 13.8048 13.8879 k = 0.2969 0.0585-0.0588 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.6752 -15.6749 -14.5386 -14.5383 -13.2319 -13.2251 -12.7214 -12.7053 -12.6726 -12.6581 -12.5872 -12.5766 -12.3967 -12.3881 -5.2167 -5.2150 -3.7785 -3.7751 -1.3858 -1.3632 -0.9559 -0.9302 -0.4674 -0.4261 -0.1732 -0.1561 0.0761 0.1017 0.7393 0.7505 1.5004 1.5059 1.8755 1.8850 2.2353 2.2382 2.4379 2.4397 2.7685 2.7748 2.8575 2.8609 3.1764 3.1816 3.4772 3.4791 3.7740 3.7784 3.9180 3.9236 4.0859 4.0886 4.4060 4.4077 4.5126 4.5161 9.3749 9.3779 11.0108 11.0156 12.1565 12.2099 12.8756 12.9134 12.9758 12.9910 13.7803 13.8609 k = 0.3125 0.0616-0.0619 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.6592 -15.6589 -14.5695 -14.5691 -13.2209 -13.2143 -12.7186 -12.7026 -12.6727 -12.6579 -12.5826 -12.5717 -12.4014 -12.3926 -5.2316 -5.2299 -3.7436 -3.7403 -1.4047 -1.3837 -0.9517 -0.9243 -0.4867 -0.4459 -0.1723 -0.1559 0.0771 0.1017 0.7594 0.7698 1.5013 1.5060 1.8932 1.9031 2.2321 2.2349 2.4492 2.4506 2.7936 2.7997 2.8567 2.8602 3.1491 3.1548 3.4573 3.4589 3.7688 3.7735 3.9109 3.9168 4.0695 4.0723 4.4120 4.4137 4.5080 4.5117 9.4441 9.4473 10.9677 10.9721 12.1416 12.1922 12.8869 12.9211 12.9781 12.9905 13.7542 13.8321 k = 0.3281 0.0647-0.0650 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.6431 -15.6428 -14.5995 -14.5991 -13.2108 -13.2045 -12.7156 -12.6998 -12.6727 -12.6577 -12.5779 -12.5669 -12.4062 -12.3973 -5.2452 -5.2437 -3.7104 -3.7071 -1.4231 -1.4037 -0.9464 -0.9176 -0.5067 -0.4666 -0.1705 -0.1549 0.0780 0.1015 0.7795 0.7892 1.5009 1.5049 1.9120 1.9221 2.2284 2.2314 2.4584 2.4596 2.8159 2.8211 2.8590 2.8621 3.1261 3.1320 3.4366 3.4381 3.7632 3.7682 3.8997 3.9057 4.0565 4.0598 4.4181 4.4200 4.5038 4.5077 9.5134 9.5168 10.9230 10.9270 12.1288 12.1765 12.8928 12.9291 12.9761 13.0001 13.7269 13.8019 k = 0.3438 0.0677-0.0681 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.6271 -15.6268 -14.6283 -14.6279 -13.2016 -13.1956 -12.7124 -12.6969 -12.6728 -12.6576 -12.5732 -12.5622 -12.4110 -12.4022 -5.2578 -5.2563 -3.6790 -3.6758 -1.4408 -1.4231 -0.9402 -0.9102 -0.5273 -0.4879 -0.1680 -0.1532 0.0787 0.1011 0.7995 0.8083 1.4994 1.5028 1.9310 1.9413 2.2246 2.2277 2.4653 2.4665 2.8333 2.8361 2.8667 2.8691 3.1078 3.1138 3.4153 3.4168 3.7573 3.7625 3.8846 3.8907 4.0473 4.0509 4.4243 4.4264 4.5001 4.5043 9.5825 9.5862 10.8767 10.8805 12.1181 12.1627 12.8934 12.9343 12.9782 13.0144 13.6989 13.7708 k = 0.3594 0.0708-0.0712 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.6114 -15.6111 -14.6557 -14.6554 -13.1933 -13.1877 -12.7092 -12.6939 -12.6728 -12.6576 -12.5684 -12.5575 -12.4159 -12.4071 -5.2691 -5.2677 -3.6496 -3.6467 -1.4576 -1.4415 -0.9328 -0.9020 -0.5482 -0.5095 -0.1650 -0.1509 0.0793 0.1003 0.8192 0.8271 1.4970 1.5000 1.9496 1.9600 2.2207 2.2241 2.4699 2.4714 2.8433 2.8462 2.8784 2.8827 3.0945 3.1003 3.3936 3.3952 3.7510 3.7564 3.8669 3.8728 4.0413 4.0451 4.4304 4.4326 4.4970 4.5013 9.6513 9.6552 10.8290 10.8326 12.1094 12.1508 12.8906 12.9325 12.9890 13.0309 13.6708 13.7392 k = 0.3750 0.0739-0.0743 ( 14109 PWs) bands (ev): -37.8012 -37.8012 -15.5962 -15.5959 -14.6815 -14.6812 -13.1859 -13.1808 -12.7060 -12.6911 -12.6729 -12.6577 -12.5636 -12.5530 -12.4207 -12.4121 -5.2792 -5.2780 -3.6226 -3.6198 -1.4732 -1.4589 -0.9245 -0.8932 -0.5690 -0.5313 -0.1616 -0.1483 0.0798 0.0993 0.8384 0.8453 1.4940 1.4966 1.9671 1.9773 2.2171 2.2208 2.4725 2.4743 2.8498 2.8543 2.8918 2.8975 3.0863 3.0918 3.3718 3.3737 3.7442 3.7497 3.8479 3.8535 4.0377 4.0416 4.4361 4.4387 4.4942 4.4988 9.7194 9.7235 10.7799 10.7837 12.1027 12.1405 12.8862 12.9258 13.0056 13.0486 13.6429 13.7075 k = 0.3906 0.0770-0.0774 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.5818 -15.5815 -14.7054 -14.7050 -13.1793 -13.1748 -12.7028 -12.6885 -12.6728 -12.6580 -12.5589 -12.5487 -12.4253 -12.4170 -5.2882 -5.2870 -3.5981 -3.5956 -1.4875 -1.4749 -0.9151 -0.8840 -0.5893 -0.5530 -0.1578 -0.1456 0.0801 0.0979 0.8567 0.8627 1.4904 1.4927 1.9828 1.9927 2.2140 2.2180 2.4735 2.4755 2.8565 2.8621 2.9039 2.9101 3.0831 3.0880 3.3505 3.3524 3.7368 3.7423 3.8292 3.8344 4.0358 4.0395 4.4416 4.4443 4.4919 4.4965 9.7865 9.7907 10.7299 10.7337 12.0978 12.1318 12.8813 12.9172 13.0248 13.0667 13.6160 13.6763 k = 0.4062 0.0801-0.0805 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.5684 -15.5682 -14.7270 -14.7267 -13.1737 -13.1697 -12.6998 -12.6862 -12.6726 -12.6584 -12.5543 -12.5447 -12.4297 -12.4219 -5.2959 -5.2949 -3.5763 -3.5741 -1.5002 -1.4893 -0.9050 -0.8745 -0.6087 -0.5742 -0.1540 -0.1429 0.0804 0.0962 0.8739 0.8790 1.4866 1.4886 1.9963 2.0057 2.2117 2.2158 2.4735 2.4757 2.8643 2.8705 2.9133 2.9194 3.0844 3.0886 3.3298 3.3318 3.7285 3.7337 3.8123 3.8169 4.0349 4.0384 4.4466 4.4495 4.4899 4.4946 9.8520 9.8564 10.6793 10.6832 12.0945 12.1244 12.8763 12.9080 13.0449 13.0845 13.5906 13.6460 k = 0.4219 0.0831-0.0836 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.5564 -15.5562 -14.7460 -14.7457 -13.1689 -13.1655 -12.6969 -12.6845 -12.6720 -12.6590 -12.5498 -12.5411 -12.4337 -12.4265 -5.3024 -5.3016 -3.5574 -3.5555 -1.5112 -1.5021 -0.8942 -0.8652 -0.6267 -0.5945 -0.1502 -0.1405 0.0807 0.0944 0.8896 0.8938 1.4828 1.4845 2.0073 2.0158 2.2104 2.2144 2.4729 2.4751 2.8729 2.8794 2.9196 2.9255 3.0892 3.0925 3.3105 3.3124 3.7193 3.7241 3.7983 3.8022 4.0347 4.0377 4.4511 4.4542 4.4883 4.4928 9.9155 9.9199 10.6286 10.6326 12.0926 12.1181 12.8719 12.8989 13.0649 13.1012 13.5677 13.6172 k = 0.4375 0.0862-0.0867 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.5460 -15.5458 -14.7622 -14.7619 -13.1649 -13.1622 -12.6942 -12.6835 -12.6710 -12.6598 -12.5456 -12.5381 -12.4371 -12.4308 -5.3078 -5.3071 -3.5417 -3.5401 -1.5203 -1.5130 -0.8831 -0.8566 -0.6425 -0.6137 -0.1466 -0.1385 0.0810 0.0924 0.9033 0.9066 1.4792 1.4806 2.0159 2.0231 2.2100 2.2136 2.4723 2.4743 2.8818 2.8882 2.9234 2.9289 3.0959 3.0985 3.2930 3.2948 3.7096 3.7136 3.7878 3.7908 4.0348 4.0373 4.4550 4.4581 4.4870 4.4912 9.9759 9.9803 10.5788 10.5828 12.0920 12.1127 12.8683 12.8903 13.0841 13.1160 13.5480 13.5905 k = 0.4531 0.0893-0.0898 ( 14105 PWs) bands (ev): -37.8012 -37.8012 -15.5375 -15.5373 -14.7751 -14.7750 -13.1618 -13.1597 -12.6917 -12.6833 -12.6697 -12.6607 -12.5418 -12.5358 -12.4398 -12.4347 -5.3119 -5.3114 -3.5292 -3.5280 -1.5274 -1.5218 -0.8721 -0.8497 -0.6552 -0.6311 -0.1434 -0.1370 0.0816 0.0903 0.9146 0.9170 1.4760 1.4771 2.0221 2.0279 2.2104 2.2132 2.4717 2.4734 2.8903 2.8963 2.9253 2.9302 3.1033 3.1052 3.2781 3.2798 3.7004 3.7035 3.7805 3.7827 4.0350 4.0370 4.4584 4.4612 4.4861 4.4898 10.0316 10.0356 10.5317 10.5355 12.0923 12.1082 12.8659 12.8826 13.1018 13.1278 13.5327 13.5667 k = 0.4688 0.0924-0.0929 ( 14103 PWs) bands (ev): -37.8012 -37.8012 -15.5312 -15.5311 -14.7846 -14.7845 -13.1594 -13.1580 -12.6895 -12.6837 -12.6680 -12.6619 -12.5386 -12.5343 -12.4415 -12.4379 -5.3148 -5.3145 -3.5202 -3.5193 -1.5322 -1.5285 -0.8619 -0.8453 -0.6637 -0.6460 -0.1406 -0.1363 0.0824 0.0883 0.9231 0.9247 1.4736 1.4744 2.0265 2.0304 2.2111 2.2131 2.4715 2.4727 2.8978 2.9027 2.9261 2.9301 3.1098 3.1112 3.2667 3.2679 3.6928 3.6949 3.7759 3.7773 4.0354 4.0367 4.4612 4.4634 4.4856 4.4884 10.0796 10.0829 10.4903 10.4935 12.0936 12.1042 12.8648 12.8761 13.1170 13.1356 13.5228 13.5467 k = 0.4844 0.0955-0.0960 ( 14099 PWs) bands (ev): -37.8012 -37.8012 -15.5273 -15.5272 -14.7904 -14.7903 -13.1579 -13.1572 -12.6876 -12.6846 -12.6663 -12.6632 -12.5361 -12.5339 -12.4422 -12.4404 -5.3165 -5.3164 -3.5146 -3.5142 -1.5348 -1.5329 -0.8532 -0.8442 -0.6671 -0.6577 -0.1384 -0.1362 0.0835 0.0865 0.9285 0.9294 1.4722 1.4725 2.0293 2.0313 2.2120 2.2130 2.4715 2.4721 2.9035 2.9064 2.9268 2.9292 3.1144 3.1152 3.2596 3.2602 3.6880 3.6891 3.7735 3.7742 4.0357 4.0364 4.4632 4.4644 4.4857 4.4872 10.1144 10.1164 10.4604 10.4623 12.0954 12.1008 12.8653 12.8710 13.1288 13.1385 13.5191 13.5315 k = 0.5000 0.0985-0.0991 ( 14098 PWs) bands (ev): -37.8012 -37.8012 -15.5259 -15.5259 -14.7923 -14.7923 -13.1571 -13.1571 -12.6859 -12.6859 -12.6647 -12.6647 -12.5345 -12.5345 -12.4418 -12.4418 -5.3170 -5.3170 -3.5126 -3.5126 -1.5350 -1.5350 -0.8470 -0.8470 -0.6650 -0.6650 -0.1369 -0.1369 0.0849 0.0849 0.9307 0.9307 1.4718 1.4718 2.0309 2.0309 2.2126 2.2126 2.4717 2.4717 2.9066 2.9066 2.9279 2.9279 3.1163 3.1163 3.2573 3.2573 3.6867 3.6867 3.7729 3.7729 4.0361 4.0361 4.4643 4.4643 4.4862 4.4862 10.1282 10.1282 10.4497 10.4497 12.0979 12.0979 12.8673 12.8673 13.1362 13.1362 13.5221 13.5221 k = 0.5000 0.0985 0.4774 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.4109 -15.4109 -14.5793 -14.5793 -13.2664 -13.2664 -13.0185 -13.0185 -12.7379 -12.7379 -12.6074 -12.6074 -12.3682 -12.3682 -5.0454 -5.0454 -3.4984 -3.4984 -2.2073 -2.2073 -0.8205 -0.8205 -0.5671 -0.5671 -0.0302 -0.0302 0.3433 0.3433 0.9830 0.9830 1.5528 1.5528 1.8915 1.8915 2.0413 2.0413 2.3345 2.3345 2.7350 2.7350 3.1982 3.1982 3.3778 3.3778 3.5946 3.5946 3.7640 3.7640 4.0024 4.0024 4.1944 4.1944 4.2968 4.2968 4.4229 4.4229 10.0012 10.0012 10.9045 10.9045 11.9055 11.9055 13.1385 13.1385 13.3792 13.3792 13.6550 13.6550 k = 0.4884 0.0962 0.4663 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.4115 -15.4115 -14.5790 -14.5790 -13.2656 -13.2655 -13.0188 -13.0183 -12.7380 -12.7376 -12.6075 -12.6069 -12.3690 -12.3681 -5.0466 -5.0462 -3.4984 -3.4979 -2.2075 -2.2042 -0.8265 -0.8169 -0.5701 -0.5613 -0.0345 -0.0283 0.3415 0.3463 0.9825 0.9831 1.5513 1.5525 1.8892 1.8920 2.0406 2.0425 2.3344 2.3351 2.7353 2.7360 3.1982 3.1993 3.3759 3.3768 3.5942 3.5948 3.7636 3.7654 4.0025 4.0033 4.1935 4.1941 4.2964 4.2967 4.4230 4.4234 10.0013 10.0019 10.9034 10.9038 11.9042 11.9077 13.1342 13.1413 13.3702 13.3855 13.6469 13.6606 k = 0.4767 0.0940 0.4552 ( 14103 PWs) bands (ev): -37.8012 -37.8012 -15.4136 -15.4135 -14.5782 -14.5781 -13.2633 -13.2630 -13.0193 -13.0182 -12.7380 -12.7373 -12.6072 -12.6061 -12.3703 -12.3685 -5.0496 -5.0488 -3.4979 -3.4971 -2.2047 -2.1980 -0.8347 -0.8161 -0.5701 -0.5532 -0.0410 -0.0287 0.3408 0.3502 0.9817 0.9829 1.5480 1.5505 1.8855 1.8908 2.0405 2.0440 2.3348 2.3362 2.7369 2.7383 3.1994 3.2016 3.3713 3.3730 3.5936 3.5948 3.7644 3.7678 4.0038 4.0054 4.1913 4.1924 4.2955 4.2961 4.4236 4.4245 10.0021 10.0032 10.9005 10.9013 11.9038 11.9107 13.1287 13.1427 13.3587 13.3887 13.6367 13.6636 k = 0.4651 0.0917 0.4441 ( 14104 PWs) bands (ev): -37.8012 -37.8012 -15.4169 -15.4168 -14.5768 -14.5767 -13.2595 -13.2590 -13.0198 -13.0182 -12.7378 -12.7367 -12.6066 -12.6049 -12.3722 -12.3695 -5.0545 -5.0533 -3.4972 -3.4959 -2.1989 -2.1889 -0.8447 -0.8181 -0.5672 -0.5432 -0.0493 -0.0315 0.3413 0.3548 0.9804 0.9823 1.5432 1.5467 1.8805 1.8880 2.0406 2.0454 2.3358 2.3379 2.7397 2.7418 3.2015 3.2048 3.3646 3.3671 3.5927 3.5944 3.7660 3.7709 4.0062 4.0086 4.1880 4.1895 4.2941 4.2950 4.4247 4.4260 10.0034 10.0050 10.8960 10.8972 11.9042 11.9146 13.1220 13.1424 13.3446 13.3883 13.6257 13.6647 k = 0.4535 0.0894 0.4330 ( 14110 PWs) bands (ev): -37.8012 -37.8012 -15.4215 -15.4214 -14.5748 -14.5746 -13.2542 -13.2536 -13.0203 -13.0182 -12.7374 -12.7361 -12.6056 -12.6034 -12.3746 -12.3711 -5.0611 -5.0596 -3.4962 -3.4945 -2.1902 -2.1769 -0.8559 -0.8226 -0.5615 -0.5318 -0.0590 -0.0364 0.3428 0.3597 0.9787 0.9812 1.5368 1.5414 1.8748 1.8841 2.0408 2.0465 2.3378 2.3405 2.7437 2.7465 3.2038 3.2083 3.3566 3.3597 3.5912 3.5934 3.7683 3.7745 4.0099 4.0128 4.1835 4.1855 4.2924 4.2935 4.4263 4.4280 10.0050 10.0070 10.8901 10.8916 11.9055 11.9194 13.1145 13.1404 13.3281 13.3835 13.6153 13.6648 k = 0.4419 0.0871 0.4219 ( 14115 PWs) bands (ev): -37.8012 -37.8012 -15.4274 -15.4273 -14.5721 -14.5719 -13.2478 -13.2469 -13.0208 -13.0183 -12.7369 -12.7353 -12.6042 -12.6015 -12.3776 -12.3732 -5.0693 -5.0674 -3.4950 -3.4930 -2.1786 -2.1621 -0.8679 -0.8292 -0.5535 -0.5194 -0.0699 -0.0432 0.3450 0.3646 0.9763 0.9794 1.5291 1.5346 1.8687 1.8793 2.0405 2.0467 2.3408 2.3441 2.7489 2.7523 3.2057 3.2112 3.3484 3.3521 3.5891 3.5917 3.7709 3.7781 4.0148 4.0181 4.1781 4.1805 4.2904 4.2916 4.4282 4.4302 10.0065 10.0090 10.8831 10.8848 11.9078 11.9251 13.1061 13.1368 13.3092 13.3738 13.6069 13.6650 k = 0.4302 0.0848 0.4108 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.4346 -15.4344 -14.5688 -14.5685 -13.2402 -13.2392 -13.0212 -13.0182 -12.7363 -12.7343 -12.6026 -12.5993 -12.3811 -12.3758 -5.0789 -5.0766 -3.4939 -3.4915 -2.1642 -2.1447 -0.8806 -0.8376 -0.5437 -0.5065 -0.0815 -0.0514 0.3477 0.3693 0.9731 0.9769 1.5202 1.5265 1.8626 1.8742 2.0395 2.0460 2.3454 2.3490 2.7550 2.7590 3.2059 3.2123 3.3416 3.3456 3.5861 3.5892 3.7736 3.7815 4.0208 4.0243 4.1719 4.1745 4.2882 4.2895 4.4304 4.4327 10.0075 10.0105 10.8754 10.8773 11.9112 11.9318 13.0972 13.1313 13.2882 13.3591 13.6017 13.6660 k = 0.4186 0.0825 0.3997 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.4429 -15.4427 -14.5647 -14.5644 -13.2319 -13.2306 -13.0214 -13.0179 -12.7354 -12.7332 -12.6006 -12.5968 -12.3851 -12.3789 -5.0896 -5.0871 -3.4930 -3.4902 -2.1471 -2.1246 -0.8935 -0.8471 -0.5326 -0.4934 -0.0934 -0.0607 0.3505 0.3735 0.9689 0.9733 1.5104 1.5174 1.8567 1.8691 2.0374 2.0440 2.3517 2.3556 2.7619 2.7666 3.2032 3.2101 3.3376 3.3415 3.5824 3.5859 3.7759 3.7842 4.0277 4.0312 4.1651 4.1680 4.2859 4.2872 4.4328 4.4353 10.0075 10.0108 10.8676 10.8695 11.9156 11.9395 13.0877 13.1239 13.2657 13.3398 13.5999 13.6684 k = 0.4070 0.0802 0.3886 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.4523 -15.4522 -14.5599 -14.5595 -13.2232 -13.2215 -13.0211 -13.0173 -12.7344 -12.7320 -12.5983 -12.5940 -12.3895 -12.3825 -5.1013 -5.0985 -3.4925 -3.4894 -2.1275 -2.1022 -0.9064 -0.8575 -0.5208 -0.4805 -0.1052 -0.0706 0.3533 0.3770 0.9634 0.9686 1.4998 1.5074 1.8512 1.8641 2.0342 2.0407 2.3602 2.3643 2.7695 2.7747 3.1966 3.2036 3.3376 3.3410 3.5780 3.5819 3.7776 3.7861 4.0352 4.0385 4.1578 4.1610 4.2836 4.2850 4.4354 4.4381 10.0058 10.0094 10.8602 10.8620 11.9211 11.9483 13.0777 13.1142 13.2426 13.3170 13.6013 13.6725 k = 0.3953 0.0779 0.3775 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.4628 -15.4626 -14.5542 -14.5538 -13.2144 -13.2124 -13.0203 -13.0160 -12.7332 -12.7307 -12.5958 -12.5910 -12.3942 -12.3864 -5.1137 -5.1106 -3.4925 -3.4891 -2.1054 -2.0774 -0.9192 -0.8683 -0.5088 -0.4681 -0.1166 -0.0807 0.3558 0.3797 0.9566 0.9624 1.4886 1.4967 1.8462 1.8596 2.0298 2.0361 2.3711 2.3752 2.7775 2.7833 3.1859 3.1926 3.3415 3.3443 3.5731 3.5774 3.7786 3.7870 4.0426 4.0458 4.1504 4.1542 4.2814 4.2829 4.4381 4.4409 10.0017 10.0056 10.8538 10.8555 11.9279 11.9583 13.0673 13.1020 13.2198 13.2918 13.6056 13.6783 k = 0.3837 0.0756 0.3664 ( 14124 PWs) bands (ev): -37.8012 -37.8012 -15.4743 -15.4741 -14.5476 -14.5472 -13.2060 -13.2034 -13.0186 -13.0139 -12.7319 -12.7292 -12.5931 -12.5877 -12.3993 -12.3907 -5.1265 -5.1232 -3.4934 -3.4896 -2.0811 -2.0505 -0.9316 -0.8792 -0.4968 -0.4566 -0.1271 -0.0906 0.3578 0.3815 0.9481 0.9547 1.4771 1.4856 1.8416 1.8553 2.0244 2.0304 2.3848 2.3888 2.7858 2.7922 3.1714 3.1777 3.3485 3.3509 3.5680 3.5726 3.7788 3.7869 4.0489 4.0523 4.1435 4.1481 4.2796 4.2812 4.4408 4.4439 9.9945 9.9985 10.8491 10.8506 11.9360 11.9695 13.0564 13.0867 13.1982 13.2652 13.6122 13.6858 k = 0.3721 0.0733 0.3553 ( 14127 PWs) bands (ev): -37.8012 -37.8012 -15.4867 -15.4865 -14.5402 -14.5397 -13.1983 -13.1953 -13.0157 -13.0106 -12.7304 -12.7275 -12.5902 -12.5843 -12.4047 -12.3952 -5.1395 -5.1361 -3.4953 -3.4912 -2.0547 -2.0218 -0.9435 -0.8901 -0.4855 -0.4464 -0.1366 -0.0998 0.3594 0.3825 0.9380 0.9453 1.4653 1.4743 1.8374 1.8515 2.0180 2.0238 2.4014 2.4052 2.7942 2.8010 3.1539 3.1599 3.3572 3.3599 3.5629 3.5680 3.7781 3.7858 4.0528 4.0570 4.1378 4.1436 4.2782 4.2800 4.4437 4.4469 9.9834 9.9876 10.8467 10.8481 11.9456 11.9822 13.0450 13.0681 13.1788 13.2383 13.6208 13.6948 k = 0.3605 0.0710 0.3442 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.4999 -15.4997 -14.5318 -14.5313 -13.1920 -13.1883 -13.0114 -13.0059 -12.7287 -12.7257 -12.5872 -12.5808 -12.4102 -12.3998 -5.1525 -5.1489 -3.4985 -3.4941 -2.0264 -1.9912 -0.9548 -0.9006 -0.4752 -0.4376 -0.1446 -0.1079 0.3604 0.3826 0.9261 0.9342 1.4535 1.4628 1.8334 1.8478 2.0109 2.0164 2.4212 2.4247 2.8024 2.8096 3.1341 3.1397 3.3667 3.3700 3.5582 3.5638 3.7766 3.7837 4.0532 4.0583 4.1348 4.1416 4.2774 4.2795 4.4468 4.4501 9.9680 9.9721 10.8470 10.8487 11.9565 11.9962 13.0330 13.0465 13.1614 13.2121 13.6310 13.7052 k = 0.3488 0.0687 0.3331 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.5138 -15.5136 -14.5225 -14.5220 -13.1873 -13.1830 -13.0054 -12.9996 -12.7269 -12.7239 -12.5842 -12.5773 -12.4157 -12.4046 -5.1651 -5.1614 -3.5031 -3.4984 -1.9963 -1.9592 -0.9652 -0.9106 -0.4662 -0.4305 -0.1511 -0.1145 0.3608 0.3821 0.9124 0.9213 1.4417 1.4513 1.8295 1.8441 2.0035 2.0087 2.4442 2.4474 2.8102 2.8178 3.1125 3.1179 3.3761 3.3803 3.5545 3.5605 3.7743 3.7808 4.0495 4.0552 4.1351 4.1424 4.2774 4.2798 4.4500 4.4535 9.9475 9.9515 10.8505 10.8528 11.9691 12.0117 13.0197 13.0230 13.1455 13.1876 13.6426 13.7169 k = 0.3372 0.0665 0.3220 ( 14129 PWs) bands (ev): -37.8012 -37.8012 -15.5283 -15.5281 -14.5123 -14.5118 -13.1846 -13.1796 -12.9976 -12.9914 -12.7249 -12.7218 -12.5812 -12.5738 -12.4211 -12.4092 -5.1772 -5.1733 -3.5093 -3.5044 -1.9647 -1.9258 -0.9746 -0.9198 -0.4590 -0.4253 -0.1557 -0.1193 0.3608 0.3809 0.8970 0.9066 1.4300 1.4400 1.8254 1.8402 1.9961 2.0009 2.4703 2.4732 2.8174 2.8253 3.0895 3.0947 3.3846 3.3896 3.5523 3.5587 3.7713 3.7773 4.0421 4.0477 4.1382 4.1453 4.2784 4.2812 4.4534 4.4570 9.9218 9.9256 10.8575 10.8606 11.9833 12.0288 12.9967 13.0069 13.1301 13.1657 13.6555 13.7298 k = 0.3256 0.0642 0.3109 ( 14132 PWs) bands (ev): -37.8012 -37.8012 -15.5434 -15.5432 -14.5011 -14.5006 -13.1839 -13.1784 -12.9880 -12.9815 -12.7227 -12.7197 -12.5785 -12.5707 -12.4262 -12.4136 -5.1885 -5.1845 -3.5174 -3.5122 -1.9318 -1.8912 -0.9829 -0.9281 -0.4539 -0.4221 -0.1585 -0.1220 0.3604 0.3793 0.8800 0.8903 1.4185 1.4288 1.8210 1.8358 1.9891 1.9933 2.4995 2.5021 2.8238 2.8320 3.0656 3.0706 3.3914 3.3971 3.5520 3.5588 3.7678 3.7732 4.0319 4.0369 4.1429 4.1493 4.2807 4.2838 4.4571 4.4608 9.8908 9.8943 10.8681 10.8723 11.9991 12.0475 12.9706 12.9922 13.1142 13.1473 13.6695 13.7438 k = 0.3140 0.0619 0.2998 ( 14134 PWs) bands (ev): -37.8012 -37.8012 -15.5589 -15.5586 -14.4890 -14.4884 -13.1853 -13.1792 -12.9768 -12.9700 -12.7205 -12.7175 -12.5762 -12.5679 -12.4309 -12.4175 -5.1987 -5.1947 -3.5275 -3.5221 -1.8978 -1.8558 -0.9899 -0.9352 -0.4511 -0.4208 -0.1595 -0.1225 0.3595 0.3773 0.8615 0.8725 1.4073 1.4179 1.8162 1.8308 1.9827 1.9863 2.5313 2.5337 2.8293 2.8377 3.0408 3.0456 3.3960 3.4022 3.5542 3.5612 3.7638 3.7687 4.0198 4.0241 4.1479 4.1536 4.2842 4.2876 4.4611 4.4648 9.8543 9.8576 10.8823 10.8876 12.0166 12.0678 12.9444 12.9766 13.0979 13.1324 13.6846 13.7588 k = 0.3023 0.0596 0.2887 ( 14130 PWs) bands (ev): -37.8012 -37.8012 -15.5747 -15.5745 -14.4760 -14.4754 -13.1885 -13.1821 -12.9643 -12.9572 -12.7181 -12.7152 -12.5743 -12.5657 -12.4349 -12.4209 -5.2078 -5.2037 -3.5398 -3.5341 -1.8629 -1.8197 -0.9954 -0.9411 -0.4505 -0.4213 -0.1588 -0.1210 0.3584 0.3751 0.8418 0.8534 1.3965 1.4074 1.8108 1.8250 1.9772 1.9802 2.5651 2.5674 2.8337 2.8423 3.0157 3.0202 3.3981 3.4045 3.5588 3.5661 3.7595 3.7639 4.0064 4.0101 4.1524 4.1576 4.2891 4.2928 4.4655 4.4692 9.8128 9.8158 10.8998 10.9062 12.0358 12.0897 12.9186 12.9600 13.0817 13.1201 13.7005 13.7748 k = 0.2907 0.0573 0.2776 ( 14123 PWs) bands (ev): -37.8012 -37.8012 -15.5907 -15.5905 -14.4621 -14.4615 -13.1935 -13.1868 -12.9506 -12.9433 -12.7157 -12.7128 -12.5731 -12.5643 -12.4380 -12.4236 -5.2154 -5.2113 -3.5544 -3.5486 -1.8272 -1.7831 -0.9994 -0.9456 -0.4520 -0.4234 -0.1565 -0.1178 0.3570 0.3727 0.8210 0.8332 1.3861 1.3972 1.8048 1.8184 1.9730 1.9752 2.6000 2.6024 2.8373 2.8459 2.9905 2.9947 3.3979 3.4042 3.5658 3.5730 3.7550 3.7591 3.9923 3.9955 4.1560 4.1608 4.2952 4.2991 4.4701 4.4738 9.7666 9.7693 10.9203 10.9279 12.0567 12.1132 12.8935 12.9427 13.0666 13.1095 13.7173 13.7916 k = 0.2791 0.0550 0.2665 ( 14120 PWs) bands (ev): -37.8012 -37.8012 -15.6069 -15.6066 -14.4473 -14.4467 -13.2001 -13.1932 -12.9362 -12.9287 -12.7132 -12.7103 -12.5728 -12.5639 -12.4399 -12.4253 -5.2214 -5.2174 -3.5714 -3.5654 -1.7911 -1.7463 -1.0015 -0.9485 -0.4554 -0.4270 -0.1528 -0.1130 0.3552 0.3704 0.7993 0.8121 1.3762 1.3875 1.7983 1.8112 1.9699 1.9715 2.6346 2.6371 2.8404 2.8486 2.9658 2.9697 3.3956 3.4017 3.5744 3.5817 3.7506 3.7544 3.9781 3.9809 4.1585 4.1633 4.3023 4.3065 4.4751 4.4788 9.7161 9.7186 10.9435 10.9522 12.0791 12.1381 12.8693 12.9250 13.0528 13.0999 13.7349 13.8091 k = 0.2674 0.0527 0.2554 ( 14123 PWs) bands (ev): -37.8012 -37.8012 -15.6230 -15.6228 -14.4317 -14.4311 -13.2079 -13.2010 -12.9213 -12.9137 -12.7106 -12.7078 -12.5734 -12.5646 -12.4407 -12.4259 -5.2257 -5.2216 -3.5909 -3.5849 -1.7548 -1.7094 -1.0019 -0.9497 -0.4602 -0.4320 -0.1478 -0.1072 0.3532 0.3679 0.7771 0.7904 1.3669 1.3784 1.7914 1.8036 1.9680 1.9694 2.6666 2.6693 2.8436 2.8513 2.9427 2.9458 3.3919 3.3975 3.5840 3.5912 3.7464 3.7502 3.9641 3.9666 4.1601 4.1651 4.3103 4.3146 4.4804 4.4840 9.6618 9.6641 10.9688 10.9786 12.1031 12.1644 12.8462 12.9072 13.0405 13.0912 13.7531 13.8273 k = 0.2558 0.0504 0.2443 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.6392 -15.6390 -14.4153 -14.4147 -13.2170 -13.2101 -12.9062 -12.8985 -12.7080 -12.7053 -12.5749 -12.5665 -12.4400 -12.4254 -5.2281 -5.2240 -3.6131 -3.6069 -1.7184 -1.6726 -1.0003 -0.9492 -0.4660 -0.4381 -0.1419 -0.1007 0.3506 0.3654 0.7546 0.7684 1.3582 1.3698 1.7844 1.7957 1.9673 1.9689 2.6923 2.6952 2.8481 2.8550 2.9229 2.9249 3.3874 3.3924 3.5939 3.6011 3.7428 3.7465 3.9507 3.9531 4.1610 4.1664 4.3188 4.3233 4.4859 4.4895 9.6042 9.6063 10.9959 11.0067 12.1284 12.1919 12.8243 12.8896 13.0295 13.0830 13.7718 13.8459 k = 0.2442 0.0481 0.2332 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.6552 -15.6550 -14.3982 -14.3976 -13.2272 -13.2203 -12.8911 -12.8833 -12.7054 -12.7027 -12.5775 -12.5695 -12.4381 -12.4238 -5.2285 -5.2244 -3.6378 -3.6316 -1.6821 -1.6362 -0.9968 -0.9468 -0.4725 -0.4450 -0.1352 -0.0937 0.3474 0.3626 0.7321 0.7462 1.3502 1.3620 1.7775 1.7879 1.9677 1.9699 2.7076 2.7108 2.8513 2.8588 2.9105 2.9130 3.3827 3.3869 3.6034 3.6107 3.7400 3.7439 3.9383 3.9405 4.1615 4.1673 4.3277 4.3323 4.4917 4.4953 9.5439 9.5458 11.0244 11.0360 12.1550 12.2204 12.8037 12.8726 13.0199 13.0756 13.7910 13.8648 k = 0.2326 0.0458 0.2221 ( 14113 PWs) bands (ev): -37.8012 -37.8012 -15.6709 -15.6707 -14.3805 -14.3799 -13.2384 -13.2315 -12.8761 -12.8683 -12.7029 -12.7002 -12.5809 -12.5735 -12.4350 -12.4212 -5.2267 -5.2227 -3.6650 -3.6589 -1.6462 -1.6002 -0.9915 -0.9426 -0.4793 -0.4526 -0.1279 -0.0864 0.3434 0.3593 0.7098 0.7243 1.3430 1.3549 1.7710 1.7805 1.9693 1.9722 2.7102 2.7134 2.8460 2.8544 2.9152 2.9187 3.3784 3.3819 3.6121 3.6192 3.7386 3.7425 3.9271 3.9294 4.1618 4.1681 4.3366 4.3414 4.4977 4.5013 9.4813 9.4830 11.0539 11.0662 12.1826 12.2499 12.7844 12.8562 13.0116 13.0687 13.8105 13.8840 k = 0.2209 0.0435 0.2110 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.6864 -15.6862 -14.3621 -14.3615 -13.2504 -13.2437 -12.8614 -12.8536 -12.7003 -12.6977 -12.5850 -12.5784 -12.4309 -12.4177 -5.2227 -5.2188 -3.6949 -3.6888 -1.6107 -1.5648 -0.9845 -0.9367 -0.4862 -0.4606 -0.1203 -0.0791 0.3383 0.3552 0.6881 0.7028 1.3367 1.3487 1.7651 1.7738 1.9722 1.9757 2.7017 2.7047 2.8321 2.8402 2.9361 2.9389 3.3755 3.3782 3.6193 3.6263 3.7387 3.7427 3.9175 3.9197 4.1623 4.1690 4.3455 4.3504 4.5039 4.5075 9.4169 9.4185 11.0839 11.0969 12.2111 12.2799 12.7665 12.8408 13.0044 13.0625 13.8303 13.9030 k = 0.2093 0.0412 0.1999 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.7014 -15.7013 -14.3433 -14.3426 -13.2632 -13.2567 -12.8471 -12.8393 -12.6978 -12.6952 -12.5897 -12.5838 -12.4260 -12.4135 -5.2165 -5.2126 -3.7272 -3.7212 -1.5759 -1.5302 -0.9760 -0.9291 -0.4926 -0.4684 -0.1125 -0.0718 0.3318 0.3499 0.6672 0.6822 1.3313 1.3434 1.7601 1.7680 1.9764 1.9804 2.6853 2.6879 2.8144 2.8224 2.9621 2.9646 3.3748 3.3768 3.6250 3.6317 3.7407 3.7446 3.9095 3.9118 4.1632 4.1702 4.3541 4.3592 4.5103 4.5139 9.3513 9.3528 11.1142 11.1277 12.2402 12.3103 12.7501 12.8263 12.9985 13.0570 13.8500 13.9218 k = 0.1977 0.0390 0.1888 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.7161 -15.7159 -14.3240 -14.3233 -13.2767 -13.2703 -12.8334 -12.8256 -12.6954 -12.6928 -12.5949 -12.5897 -12.4205 -12.4087 -5.2079 -5.2041 -3.7618 -3.7560 -1.5419 -1.4963 -0.9664 -0.9201 -0.4984 -0.4759 -0.1045 -0.0646 0.3236 0.3430 0.6474 0.6626 1.3271 1.3392 1.7563 1.7634 1.9816 1.9861 2.6640 2.6660 2.7946 2.8028 2.9873 2.9900 3.3771 3.3786 3.6289 3.6353 3.7443 3.7483 3.9034 3.9057 4.1647 4.1720 4.3623 4.3675 4.5169 4.5206 9.2849 9.2864 11.1445 11.1582 12.2696 12.3408 12.7350 12.8129 12.9938 13.0523 13.8696 13.9399 k = 0.1860 0.0367 0.1777 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.7302 -15.7300 -14.3043 -14.3037 -13.2907 -13.2847 -12.8202 -12.8124 -12.6931 -12.6904 -12.6002 -12.5958 -12.4146 -12.4035 -5.1970 -5.1933 -3.7986 -3.7930 -1.5087 -1.4631 -0.9563 -0.9102 -0.5032 -0.4823 -0.0965 -0.0575 0.3134 0.3343 0.6290 0.6442 1.3241 1.3361 1.7537 1.7602 1.9879 1.9928 2.6396 2.6410 2.7728 2.7814 3.0088 3.0118 3.3830 3.3847 3.6316 3.6376 3.7492 3.7532 3.8990 3.9016 4.1671 4.1747 4.3700 4.3753 4.5236 4.5274 9.2182 9.2196 11.1745 11.1883 12.2991 12.3711 12.7214 12.8006 12.9903 13.0485 13.8888 13.9570 k = 0.1744 0.0344 0.1666 ( 14114 PWs) bands (ev): -37.8012 -37.8012 -15.7437 -15.7435 -14.2844 -14.2838 -13.3053 -13.2995 -12.8078 -12.8000 -12.6908 -12.6882 -12.6057 -12.6019 -12.4085 -12.3981 -5.1838 -5.1801 -3.8375 -3.8321 -1.4765 -1.4309 -0.9462 -0.8997 -0.5066 -0.4871 -0.0885 -0.0505 0.3010 0.3233 0.6120 0.6272 1.3224 1.3343 1.7527 1.7585 1.9951 2.0004 2.6132 2.6142 2.7492 2.7582 3.0249 3.0282 3.3931 3.3951 3.6333 3.6389 3.7550 3.7589 3.8965 3.8995 4.1707 4.1785 4.3771 4.3826 4.5306 4.5345 9.1518 9.1532 11.2039 11.2177 12.3284 12.4008 12.7091 12.7894 12.9882 13.0455 13.9073 13.9721 k = 0.1628 0.0321 0.1554 ( 14111 PWs) bands (ev): -37.8012 -37.8012 -15.7566 -15.7564 -14.2644 -14.2638 -13.3203 -13.3148 -12.7960 -12.7882 -12.6887 -12.6861 -12.6111 -12.6080 -12.4022 -12.3925 -5.1682 -5.1646 -3.8781 -3.8730 -1.4451 -1.3994 -0.9369 -0.8893 -0.5082 -0.4895 -0.0807 -0.0437 0.2862 0.3099 0.5965 0.6117 1.3221 1.3337 1.7534 1.7585 2.0033 2.0088 2.5857 2.5864 2.7236 2.7329 3.0353 3.0387 3.4069 3.4094 3.6348 3.6399 3.7610 3.7648 3.8956 3.8992 4.1757 4.1836 4.3836 4.3891 4.5378 4.5419 9.0861 9.0874 11.2324 11.2460 12.3572 12.4297 12.6984 12.7792 12.9873 13.0434 13.9246 13.9840 k = 0.1512 0.0298 0.1443 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.7688 -15.7687 -14.2443 -14.2437 -13.3355 -13.3303 -12.7851 -12.7773 -12.6867 -12.6841 -12.6163 -12.6138 -12.3960 -12.3870 -5.1504 -5.1468 -3.9203 -3.9154 -1.4147 -1.3687 -0.9290 -0.8798 -0.5076 -0.4886 -0.0730 -0.0372 0.2691 0.2942 0.5825 0.5975 1.3230 1.3343 1.7558 1.7604 2.0122 2.0180 2.5575 2.5581 2.6962 2.7059 3.0403 3.0437 3.4236 3.4263 3.6363 3.6411 3.7668 3.7706 3.8963 3.9005 4.1824 4.1902 4.3894 4.3950 4.5453 4.5495 9.0216 9.0229 11.2599 11.2732 12.3852 12.4573 12.6891 12.7702 12.9879 13.0422 13.9402 13.9913 k = 0.1395 0.0275 0.1332 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.7803 -15.7802 -14.2244 -14.2238 -13.3509 -13.3461 -12.7750 -12.7673 -12.6847 -12.6823 -12.6213 -12.6192 -12.3900 -12.3816 -5.1304 -5.1269 -3.9637 -3.9592 -1.3851 -1.3389 -0.9234 -0.8721 -0.5043 -0.4839 -0.0657 -0.0309 0.2498 0.2763 0.5698 0.5845 1.3253 1.3362 1.7602 1.7642 2.0217 2.0277 2.5287 2.5296 2.6675 2.6774 3.0409 3.0441 3.4416 3.4445 3.6384 3.6427 3.7722 3.7758 3.8983 3.9030 4.1907 4.1985 4.3946 4.4000 4.5531 4.5573 8.9589 8.9602 11.2861 11.2989 12.4121 12.4833 12.6813 12.7621 12.9897 13.0419 13.9530 13.9930 k = 0.1279 0.0252 0.1221 ( 14109 PWs) bands (ev): -37.8012 -37.8012 -15.7910 -15.7909 -14.2047 -14.2041 -13.3663 -13.3618 -12.7658 -12.7581 -12.6828 -12.6806 -12.6260 -12.6242 -12.3841 -12.3764 -5.1083 -5.1050 -4.0081 -4.0039 -1.3564 -1.3097 -0.9204 -0.8670 -0.4975 -0.4751 -0.0590 -0.0251 0.2286 0.2566 0.5582 0.5725 1.3288 1.3392 1.7665 1.7700 2.0319 2.0380 2.4997 2.5009 2.6378 2.6479 3.0381 3.0412 3.4595 3.4625 3.6413 3.6451 3.7768 3.7804 3.9012 3.9063 4.2008 4.2084 4.3990 4.4044 4.5612 4.5654 8.8984 8.8997 11.3108 11.3230 12.4376 12.5073 12.6750 12.7550 12.9929 13.0424 13.9617 13.9900 k = 0.1163 0.0229 0.1110 ( 14125 PWs) bands (ev): -37.8012 -37.8012 -15.8009 -15.8008 -14.1855 -14.1850 -13.3816 -13.3775 -12.7576 -12.7499 -12.6810 -12.6791 -12.6302 -12.6286 -12.3785 -12.3715 -5.0844 -5.0812 -4.0531 -4.0492 -1.3284 -1.2813 -0.9204 -0.8651 -0.4867 -0.4622 -0.0532 -0.0199 0.2059 0.2355 0.5475 0.5613 1.3334 1.3432 1.7748 1.7779 2.0424 2.0487 2.4704 2.4718 2.6079 2.6179 3.0331 3.0360 3.4763 3.4792 3.6453 3.6486 3.7808 3.7843 3.9047 3.9100 4.2125 4.2197 4.4027 4.4080 4.5695 4.5736 8.8408 8.8420 11.3340 11.3454 12.4615 12.5289 12.6704 12.7487 12.9973 13.0437 13.9648 13.9846 k = 0.1047 0.0206 0.0999 ( 14122 PWs) bands (ev): -37.8012 -37.8012 -15.8100 -15.8099 -14.1669 -14.1664 -13.3966 -13.3928 -12.7503 -12.7427 -12.6792 -12.6778 -12.6340 -12.6326 -12.3733 -12.3670 -5.0588 -5.0557 -4.0983 -4.0946 -1.3011 -1.2537 -0.9235 -0.8667 -0.4716 -0.4454 -0.0487 -0.0157 0.1823 0.2137 0.5376 0.5507 1.3388 1.3479 1.7852 1.7878 2.0533 2.0598 2.4408 2.4421 2.5785 2.5882 3.0267 3.0293 3.4911 3.4938 3.6503 3.6530 3.7840 3.7875 3.9084 3.9137 4.2254 4.2322 4.4057 4.4109 4.5781 4.5820 8.7865 8.7876 11.3553 11.3659 12.4835 12.5479 12.6676 12.7431 13.0027 13.0455 13.9618 13.9786 k = 0.0930 0.0183 0.0888 ( 14117 PWs) bands (ev): -37.8012 -37.8012 -15.8182 -15.8181 -14.1492 -14.1488 -13.4110 -13.4076 -12.7440 -12.7366 -12.6775 -12.6765 -12.6373 -12.6359 -12.3685 -12.3629 -5.0319 -5.0290 -4.1431 -4.1398 -1.2745 -1.2267 -0.9295 -0.8720 -0.4525 -0.4253 -0.0459 -0.0130 0.1587 0.1918 0.5284 0.5407 1.3448 1.3531 1.7975 1.7998 2.0645 2.0710 2.4107 2.4118 2.5503 2.5595 3.0195 3.0219 3.5035 3.5060 3.6561 3.6582 3.7868 3.7901 3.9119 3.9171 4.2392 4.2455 4.4081 4.4131 4.5867 4.5905 8.7361 8.7371 11.3748 11.3845 12.5034 12.5637 12.6668 12.7382 13.0091 13.0478 13.9549 13.9719 k = 0.0814 0.0160 0.0777 ( 14121 PWs) bands (ev): -37.8012 -37.8012 -15.8255 -15.8254 -14.1327 -14.1322 -13.4246 -13.4216 -12.7387 -12.7317 -12.6760 -12.6751 -12.6400 -12.6388 -12.3641 -12.3592 -5.0042 -5.0014 -4.1871 -4.1841 -1.2487 -1.2007 -0.9381 -0.8805 -0.4299 -0.4025 -0.0457 -0.0128 0.1363 0.1707 0.5199 0.5312 1.3511 1.3585 1.8115 1.8135 2.0757 2.0824 2.3801 2.3806 2.5243 2.5327 3.0121 3.0143 3.5136 3.5157 3.6625 3.6640 3.7890 3.7921 3.9152 3.9199 4.2533 4.2590 4.4099 4.4147 4.5953 4.5988 8.6900 8.6910 11.3923 11.4009 12.5213 12.5760 12.6682 12.7338 13.0159 13.0504 13.9466 13.9641 k = 0.0698 0.0137 0.0666 ( 14122 PWs) bands (ev): -37.8013 -37.8013 -15.8318 -15.8318 -14.1174 -14.1171 -13.4372 -13.4346 -12.7343 -12.7277 -12.6745 -12.6737 -12.6422 -12.6411 -12.3602 -12.3560 -4.9761 -4.9735 -4.2295 -4.2268 -1.2235 -1.1756 -0.9487 -0.8919 -0.4044 -0.3775 -0.0486 -0.0163 0.1167 0.1513 0.5122 0.5222 1.3573 1.3638 1.8269 1.8287 2.0871 2.0939 2.3487 2.3491 2.5011 2.5085 3.0050 3.0069 3.5215 3.5233 3.6690 3.6701 3.7908 3.7936 3.9180 3.9222 4.2670 4.2720 4.4112 4.4157 4.6037 4.6068 8.6489 8.6498 11.4078 11.4152 12.5369 12.5848 12.6716 12.7299 13.0231 13.0530 13.9384 13.9554 k = 0.0581 0.0115 0.0555 ( 14118 PWs) bands (ev): -37.8012 -37.8012 -15.8373 -15.8372 -14.1039 -14.1035 -13.4486 -13.4464 -12.7308 -12.7249 -12.6733 -12.6721 -12.6439 -12.6430 -12.3568 -12.3533 -4.9484 -4.9461 -4.2695 -4.2671 -1.1990 -1.1518 -0.9607 -0.9056 -0.3769 -0.3514 -0.0553 -0.0250 0.1018 0.1344 0.5054 0.5141 1.3632 1.3687 1.8431 1.8448 2.0986 2.1056 2.3165 2.3178 2.4811 2.4873 2.9985 3.0001 3.5275 3.5290 3.6751 3.6759 3.7923 3.7948 3.9203 3.9240 4.2798 4.2841 4.4122 4.4162 4.6116 4.6143 8.6132 8.6139 11.4210 11.4273 12.5503 12.5905 12.6767 12.7262 13.0303 13.0553 13.9311 13.9467 k = 0.0465 0.0092 0.0444 ( 14117 PWs) bands (ev): -37.8013 -37.8013 -15.8417 -15.8417 -14.0922 -14.0919 -13.4583 -13.4565 -12.7279 -12.7230 -12.6720 -12.6707 -12.6452 -12.6445 -12.3540 -12.3511 -4.9221 -4.9202 -4.3057 -4.3037 -1.1755 -1.1299 -0.9732 -0.9211 -0.3485 -0.3251 -0.0659 -0.0394 0.0926 0.1207 0.4996 0.5068 1.3685 1.3730 1.8593 1.8610 2.1103 2.1175 2.2846 2.2869 2.4646 2.4695 2.9928 2.9942 3.5320 3.5332 3.6806 3.6811 3.7936 3.7956 3.9222 3.9252 4.2912 4.2947 4.4128 4.4163 4.6187 4.6209 8.5833 8.5839 11.4320 11.4371 12.5617 12.5936 12.6828 12.7227 13.0371 13.0572 13.9251 13.9385 k = 0.0349 0.0069 0.0333 ( 14108 PWs) bands (ev): -37.8012 -37.8012 -15.8452 -15.8452 -14.0828 -14.0826 -13.4662 -13.4648 -12.7257 -12.7219 -12.6708 -12.6696 -12.6462 -12.6456 -12.3516 -12.3495 -4.8987 -4.8971 -4.3369 -4.3353 -1.1531 -1.1112 -0.9847 -0.9377 -0.3205 -0.3001 -0.0793 -0.0579 0.0883 0.1101 0.4951 0.5007 1.3730 1.3764 1.8745 1.8761 2.1227 2.1300 2.2538 2.2573 2.4517 2.4554 2.9883 2.9893 3.5353 3.5362 3.6852 3.6855 3.7945 3.7961 3.9236 3.9259 4.3006 4.3034 4.4133 4.4160 4.6247 4.6264 8.5597 8.5601 11.4408 11.4446 12.5710 12.5946 12.6893 12.7191 13.0433 13.0584 13.9207 13.9313 k = 0.0233 0.0046 0.0222 ( 14106 PWs) bands (ev): -37.8012 -37.8012 -15.8477 -15.8477 -14.0759 -14.0757 -13.4719 -13.4711 -12.7241 -12.7214 -12.6697 -12.6688 -12.6469 -12.6464 -12.3499 -12.3485 -4.8798 -4.8787 -4.3612 -4.3601 -1.1324 -1.0981 -0.9925 -0.9548 -0.2946 -0.2787 -0.0931 -0.0776 0.0876 0.1022 0.4921 0.4958 1.3765 1.3788 1.8873 1.8885 2.1363 2.1434 2.2254 2.2299 2.4426 2.4451 2.9850 2.9857 3.5375 3.5381 3.6886 3.6888 3.7953 3.7963 3.9247 3.9263 4.3078 4.3097 4.4136 4.4156 4.6293 4.6305 8.5426 8.5429 11.4473 11.4498 12.5786 12.5941 12.6955 12.7153 13.0486 13.0587 13.9180 13.9253 k = 0.0116 0.0023 0.0111 ( 14112 PWs) bands (ev): -37.8012 -37.8012 -15.8492 -15.8492 -14.0716 -14.0715 -13.4754 -13.4750 -12.7228 -12.7215 -12.6689 -12.6684 -12.6472 -12.6470 -12.3487 -12.3480 -4.8673 -4.8667 -4.3768 -4.3762 -1.1142 -1.0941 -0.9930 -0.9712 -0.2739 -0.2648 -0.1032 -0.0946 0.0891 0.0964 0.4905 0.4925 1.3789 1.3801 1.8960 1.8967 2.1512 2.1574 2.2013 2.2061 2.4374 2.4386 2.9830 2.9833 3.5389 3.5392 3.6907 3.6908 3.7958 3.7964 3.9255 3.9263 4.3124 4.3134 4.4140 4.4151 4.6323 4.6329 8.5322 8.5324 11.4514 11.4527 12.5846 12.5922 12.7013 12.7112 13.0528 13.0579 13.9172 13.9209 k = 0.0000 0.0000 0.0000 ( 14119 PWs) bands (ev): -37.8013 -37.8013 -15.8497 -15.8497 -14.0701 -14.0701 -13.4764 -13.4764 -12.7219 -12.7219 -12.6684 -12.6684 -12.6473 -12.6473 -12.3480 -12.3480 -4.8627 -4.8627 -4.3820 -4.3820 -1.1004 -1.1004 -0.9850 -0.9850 -0.2628 -0.2628 -0.1042 -0.1042 0.0921 0.0921 0.4907 0.4907 1.3801 1.3801 1.8993 1.8993 2.1637 2.1637 2.1909 2.1909 2.4360 2.4360 2.9825 2.9825 3.5394 3.5394 3.6914 3.6914 3.7962 3.7962 3.9260 3.9260 4.3143 4.3143 4.4145 4.4145 4.6335 4.6335 8.5288 8.5288 11.4532 11.4532 12.5891 12.5891 12.7066 12.7066 13.0559 13.0559 13.9182 13.9182 Writing output data file LiAlAs2O7.save init_run : 1.48s CPU 0.92s WALL ( 1 calls) electrons : 697.50s CPU 581.19s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.10s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 697.49s CPU 581.17s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.23s CPU 0.13s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.65s CPU 0.71s WALL ( 330 calls) cegterg : 608.99s CPU 526.48s WALL ( 789 calls) Called by sum_band: Called by *egterg: h_psi : 375.87s CPU 277.82s WALL ( 14073 calls) s_psi : 26.06s CPU 21.30s WALL ( 14073 calls) g_psi : 1.52s CPU 1.45s WALL ( 12954 calls) cdiaghg : 150.58s CPU 147.46s WALL ( 13284 calls) cegterg:over : 42.44s CPU 40.66s WALL ( 12954 calls) cegterg:upda : 43.75s CPU 42.46s WALL ( 12954 calls) cegterg:last : 18.79s CPU 18.94s WALL ( 1779 calls) cdiaghg:chol : 8.80s CPU 8.61s WALL ( 13284 calls) cdiaghg:inve : 5.67s CPU 5.77s WALL ( 13284 calls) cdiaghg:para : 9.34s CPU 9.56s WALL ( 26568 calls) Called by h_psi: h_psi:vloc : 314.60s CPU 226.69s WALL ( 14073 calls) h_psi:vnl : 59.30s CPU 49.51s WALL ( 14073 calls) add_vuspsi : 28.72s CPU 23.85s WALL ( 14073 calls) General routines calbec : 30.50s CPU 25.61s WALL ( 14073 calls) fft : 0.02s CPU 0.01s WALL ( 15 calls) fftw : 291.84s CPU 207.48s WALL ( 1450836 calls) davcio : 0.80s CPU 8.23s WALL ( 660 calls) Parallel routines fft_scatter : 139.03s CPU 117.21s WALL ( 1450851 calls) PWSCF : 12m47.95s CPU 11m20.86s WALL This run was terminated on: 6: 1: 8 11Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=