Program PWSCF v.5.4.0 starts on 10Feb2017 at 15:52: 1 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: ./CoCuP2O7.save/ file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per 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 60 59 16 2190 2146 319 Max 61 60 17 2193 2160 323 Sum 2163 2131 595 78895 77449 11563 bravais-lattice index = 14 lattice parameter (alat) = 8.4919 a.u. unit-cell volume = 800.9575 (a.u.)^3 number of atoms/cell = 11 number of atomic types = 4 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.491887 celldm(2)= 1.179552 celldm(3)= 1.182107 celldm(4)= -0.212824 celldm(5)= -0.174615 celldm(6)= -0.176543 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.208242 1.161024 0.000000 ) a(3) = ( -0.206414 -0.292618 1.126563 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.179361 0.229812 ) b(2) = ( 0.000000 0.861308 0.223720 ) b(3) = ( 0.000000 0.000000 0.887656 ) 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 Co read from file: /users/gautes/Pseudo/Co.rel-pbe-oncvpsp.UPF MD5 check sum: 638ceb3e57836b9ea4bada7149e48805 Pseudo is Norm-conserving, Zval = 17.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1388 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 PseudoPot. # 3 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 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 1147 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) Co 17.00 58.93320 Co( 1.00) Cu 11.00 63.54600 Cu( 1.00) P 5.00 30.97380 P( 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= 286 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.4306542 -0.1118598), wk = 0.0034965 k( 2) = ( 0.0000000 -0.4171962 -0.1083642), wk = 0.0034965 k( 3) = ( 0.0000000 -0.4037383 -0.1048686), wk = 0.0034965 k( 4) = ( 0.0000000 -0.3902803 -0.1013729), wk = 0.0034965 k( 5) = ( 0.0000000 -0.3768224 -0.0978773), wk = 0.0034965 k( 6) = ( 0.0000000 -0.3633644 -0.0943817), wk = 0.0034965 k( 7) = ( 0.0000000 -0.3499065 -0.0908861), wk = 0.0034965 k( 8) = ( 0.0000000 -0.3364486 -0.0873905), wk = 0.0034965 k( 9) = ( 0.0000000 -0.3229906 -0.0838948), wk = 0.0034965 k( 10) = ( 0.0000000 -0.3095327 -0.0803992), wk = 0.0034965 k( 11) = ( 0.0000000 -0.2960747 -0.0769036), wk = 0.0034965 k( 12) = ( 0.0000000 -0.2826168 -0.0734080), wk = 0.0034965 k( 13) = ( 0.0000000 -0.2691588 -0.0699124), wk = 0.0034965 k( 14) = ( 0.0000000 -0.2557009 -0.0664167), wk = 0.0034965 k( 15) = ( 0.0000000 -0.2422430 -0.0629211), wk = 0.0034965 k( 16) = ( 0.0000000 -0.2287850 -0.0594255), wk = 0.0034965 k( 17) = ( 0.0000000 -0.2153271 -0.0559299), wk = 0.0034965 k( 18) = ( 0.0000000 -0.2018691 -0.0524343), wk = 0.0034965 k( 19) = ( 0.0000000 -0.1884112 -0.0489387), wk = 0.0034965 k( 20) = ( 0.0000000 -0.1749532 -0.0454430), wk = 0.0034965 k( 21) = ( 0.0000000 -0.1614953 -0.0419474), wk = 0.0034965 k( 22) = ( 0.0000000 -0.1480374 -0.0384518), wk = 0.0034965 k( 23) = ( 0.0000000 -0.1345794 -0.0349562), wk = 0.0034965 k( 24) = ( 0.0000000 -0.1211215 -0.0314606), wk = 0.0034965 k( 25) = ( 0.0000000 -0.1076635 -0.0279649), wk = 0.0034965 k( 26) = ( 0.0000000 -0.0942056 -0.0244693), wk = 0.0034965 k( 27) = ( 0.0000000 -0.0807477 -0.0209737), wk = 0.0034965 k( 28) = ( 0.0000000 -0.0672897 -0.0174781), wk = 0.0034965 k( 29) = ( 0.0000000 -0.0538318 -0.0139825), wk = 0.0034965 k( 30) = ( 0.0000000 -0.0403738 -0.0104869), wk = 0.0034965 k( 31) = ( 0.0000000 -0.0269159 -0.0069912), wk = 0.0034965 k( 32) = ( 0.0000000 -0.0134579 -0.0034956), wk = 0.0034965 k( 33) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 34) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 35) = ( 0.0135135 0.0024238 0.0031056), wk = 0.0034965 k( 36) = ( 0.0270270 0.0048476 0.0062111), wk = 0.0034965 k( 37) = ( 0.0405405 0.0072714 0.0093167), wk = 0.0034965 k( 38) = ( 0.0540540 0.0096952 0.0124223), wk = 0.0034965 k( 39) = ( 0.0675676 0.0121190 0.0155279), wk = 0.0034965 k( 40) = ( 0.0810811 0.0145428 0.0186334), wk = 0.0034965 k( 41) = ( 0.0945946 0.0169666 0.0217390), wk = 0.0034965 k( 42) = ( 0.1081081 0.0193903 0.0248446), wk = 0.0034965 k( 43) = ( 0.1216216 0.0218141 0.0279501), wk = 0.0034965 k( 44) = ( 0.1351351 0.0242379 0.0310557), wk = 0.0034965 k( 45) = ( 0.1486486 0.0266617 0.0341613), wk = 0.0034965 k( 46) = ( 0.1621622 0.0290855 0.0372669), wk = 0.0034965 k( 47) = ( 0.1756757 0.0315093 0.0403724), wk = 0.0034965 k( 48) = ( 0.1891892 0.0339331 0.0434780), wk = 0.0034965 k( 49) = ( 0.2027027 0.0363569 0.0465836), wk = 0.0034965 k( 50) = ( 0.2162162 0.0387807 0.0496891), wk = 0.0034965 k( 51) = ( 0.2297297 0.0412045 0.0527947), wk = 0.0034965 k( 52) = ( 0.2432432 0.0436283 0.0559003), wk = 0.0034965 k( 53) = ( 0.2567568 0.0460521 0.0590059), wk = 0.0034965 k( 54) = ( 0.2702703 0.0484759 0.0621114), wk = 0.0034965 k( 55) = ( 0.2837838 0.0508997 0.0652170), wk = 0.0034965 k( 56) = ( 0.2972973 0.0533235 0.0683226), wk = 0.0034965 k( 57) = ( 0.3108108 0.0557472 0.0714281), wk = 0.0034965 k( 58) = ( 0.3243243 0.0581710 0.0745337), wk = 0.0034965 k( 59) = ( 0.3378378 0.0605948 0.0776393), wk = 0.0034965 k( 60) = ( 0.3513514 0.0630186 0.0807449), wk = 0.0034965 k( 61) = ( 0.3648649 0.0654424 0.0838504), wk = 0.0034965 k( 62) = ( 0.3783784 0.0678662 0.0869560), wk = 0.0034965 k( 63) = ( 0.3918919 0.0702900 0.0900616), wk = 0.0034965 k( 64) = ( 0.4054054 0.0727138 0.0931671), wk = 0.0034965 k( 65) = ( 0.4189189 0.0751376 0.0962727), wk = 0.0034965 k( 66) = ( 0.4324324 0.0775614 0.0993783), wk = 0.0034965 k( 67) = ( 0.4459459 0.0799852 0.1024839), wk = 0.0034965 k( 68) = ( 0.4594595 0.0824090 0.1055894), wk = 0.0034965 k( 69) = ( 0.4729730 0.0848328 0.1086950), wk = 0.0034965 k( 70) = ( 0.4864865 0.0872566 0.1118006), wk = 0.0034965 k( 71) = ( 0.5000000 0.0896804 0.1149061), wk = 0.0034965 k( 72) = ( 0.5000000 -0.3409738 0.0030464), wk = 0.0034965 k( 73) = ( 0.4883721 -0.3330442 0.0029755), wk = 0.0034965 k( 74) = ( 0.4767442 -0.3251146 0.0029047), wk = 0.0034965 k( 75) = ( 0.4651163 -0.3171849 0.0028338), wk = 0.0034965 k( 76) = ( 0.4534884 -0.3092553 0.0027630), wk = 0.0034965 k( 77) = ( 0.4418605 -0.3013257 0.0026921), wk = 0.0034965 k( 78) = ( 0.4302326 -0.2933961 0.0026213), wk = 0.0034965 k( 79) = ( 0.4186047 -0.2854664 0.0025504), wk = 0.0034965 k( 80) = ( 0.4069767 -0.2775368 0.0024796), wk = 0.0034965 k( 81) = ( 0.3953488 -0.2696072 0.0024088), wk = 0.0034965 k( 82) = ( 0.3837209 -0.2616776 0.0023379), wk = 0.0034965 k( 83) = ( 0.3720930 -0.2537479 0.0022671), wk = 0.0034965 k( 84) = ( 0.3604651 -0.2458183 0.0021962), wk = 0.0034965 k( 85) = ( 0.3488372 -0.2378887 0.0021254), wk = 0.0034965 k( 86) = ( 0.3372093 -0.2299591 0.0020545), wk = 0.0034965 k( 87) = ( 0.3255814 -0.2220295 0.0019837), wk = 0.0034965 k( 88) = ( 0.3139535 -0.2140998 0.0019128), wk = 0.0034965 k( 89) = ( 0.3023256 -0.2061702 0.0018420), wk = 0.0034965 k( 90) = ( 0.2906977 -0.1982406 0.0017711), wk = 0.0034965 k( 91) = ( 0.2790698 -0.1903110 0.0017003), wk = 0.0034965 k( 92) = ( 0.2674419 -0.1823813 0.0016294), wk = 0.0034965 k( 93) = ( 0.2558140 -0.1744517 0.0015586), wk = 0.0034965 k( 94) = ( 0.2441860 -0.1665221 0.0014878), wk = 0.0034965 k( 95) = ( 0.2325581 -0.1585925 0.0014169), wk = 0.0034965 k( 96) = ( 0.2209302 -0.1506628 0.0013461), wk = 0.0034965 k( 97) = ( 0.2093023 -0.1427332 0.0012752), wk = 0.0034965 k( 98) = ( 0.1976744 -0.1348036 0.0012044), wk = 0.0034965 k( 99) = ( 0.1860465 -0.1268740 0.0011335), wk = 0.0034965 k( 100) = ( 0.1744186 -0.1189443 0.0010627), wk = 0.0034965 k( 101) = ( 0.1627907 -0.1110147 0.0009918), wk = 0.0034965 k( 102) = ( 0.1511628 -0.1030851 0.0009210), wk = 0.0034965 k( 103) = ( 0.1395349 -0.0951555 0.0008501), wk = 0.0034965 k( 104) = ( 0.1279070 -0.0872259 0.0007793), wk = 0.0034965 k( 105) = ( 0.1162791 -0.0792962 0.0007085), wk = 0.0034965 k( 106) = ( 0.1046512 -0.0713666 0.0006376), wk = 0.0034965 k( 107) = ( 0.0930233 -0.0634370 0.0005668), wk = 0.0034965 k( 108) = ( 0.0813954 -0.0555074 0.0004959), wk = 0.0034965 k( 109) = ( 0.0697674 -0.0475777 0.0004251), wk = 0.0034965 k( 110) = ( 0.0581395 -0.0396481 0.0003542), wk = 0.0034965 k( 111) = ( 0.0465116 -0.0317185 0.0002834), wk = 0.0034965 k( 112) = ( 0.0348837 -0.0237889 0.0002125), wk = 0.0034965 k( 113) = ( 0.0232558 -0.0158592 0.0001417), wk = 0.0034965 k( 114) = ( 0.0116279 -0.0079296 0.0000708), wk = 0.0034965 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 117) = ( -0.0116279 -0.0020856 0.0076493), wk = 0.0034965 k( 118) = ( -0.0232558 -0.0041712 0.0152987), wk = 0.0034965 k( 119) = ( -0.0348837 -0.0062568 0.0229480), wk = 0.0034965 k( 120) = ( -0.0465116 -0.0083424 0.0305974), wk = 0.0034965 k( 121) = ( -0.0581395 -0.0104279 0.0382467), wk = 0.0034965 k( 122) = ( -0.0697674 -0.0125135 0.0458961), wk = 0.0034965 k( 123) = ( -0.0813954 -0.0145991 0.0535454), wk = 0.0034965 k( 124) = ( -0.0930233 -0.0166847 0.0611947), wk = 0.0034965 k( 125) = ( -0.1046512 -0.0187703 0.0688441), wk = 0.0034965 k( 126) = ( -0.1162791 -0.0208559 0.0764934), wk = 0.0034965 k( 127) = ( -0.1279070 -0.0229415 0.0841428), wk = 0.0034965 k( 128) = ( -0.1395349 -0.0250271 0.0917921), wk = 0.0034965 k( 129) = ( -0.1511628 -0.0271127 0.0994414), wk = 0.0034965 k( 130) = ( -0.1627907 -0.0291983 0.1070908), wk = 0.0034965 k( 131) = ( -0.1744186 -0.0312838 0.1147401), wk = 0.0034965 k( 132) = ( -0.1860465 -0.0333694 0.1223895), wk = 0.0034965 k( 133) = ( -0.1976744 -0.0354550 0.1300388), wk = 0.0034965 k( 134) = ( -0.2093023 -0.0375406 0.1376882), wk = 0.0034965 k( 135) = ( -0.2209302 -0.0396262 0.1453375), wk = 0.0034965 k( 136) = ( -0.2325581 -0.0417118 0.1529868), wk = 0.0034965 k( 137) = ( -0.2441860 -0.0437974 0.1606362), wk = 0.0034965 k( 138) = ( -0.2558140 -0.0458830 0.1682855), wk = 0.0034965 k( 139) = ( -0.2674419 -0.0479686 0.1759349), wk = 0.0034965 k( 140) = ( -0.2790698 -0.0500542 0.1835842), wk = 0.0034965 k( 141) = ( -0.2906977 -0.0521397 0.1912335), wk = 0.0034965 k( 142) = ( -0.3023256 -0.0542253 0.1988829), wk = 0.0034965 k( 143) = ( -0.3139535 -0.0563109 0.2065322), wk = 0.0034965 k( 144) = ( -0.3255814 -0.0583965 0.2141816), wk = 0.0034965 k( 145) = ( -0.3372093 -0.0604821 0.2218309), wk = 0.0034965 k( 146) = ( -0.3488372 -0.0625677 0.2294803), wk = 0.0034965 k( 147) = ( -0.3604651 -0.0646533 0.2371296), wk = 0.0034965 k( 148) = ( -0.3720930 -0.0667389 0.2447789), wk = 0.0034965 k( 149) = ( -0.3837209 -0.0688245 0.2524283), wk = 0.0034965 k( 150) = ( -0.3953488 -0.0709100 0.2600776), wk = 0.0034965 k( 151) = ( -0.4069767 -0.0729956 0.2677270), wk = 0.0034965 k( 152) = ( -0.4186047 -0.0750812 0.2753763), wk = 0.0034965 k( 153) = ( -0.4302326 -0.0771668 0.2830257), wk = 0.0034965 k( 154) = ( -0.4418605 -0.0792524 0.2906750), wk = 0.0034965 k( 155) = ( -0.4534884 -0.0813380 0.2983243), wk = 0.0034965 k( 156) = ( -0.4651163 -0.0834236 0.3059737), wk = 0.0034965 k( 157) = ( -0.4767442 -0.0855092 0.3136230), wk = 0.0034965 k( 158) = ( -0.4883721 -0.0875948 0.3212724), wk = 0.0034965 k( 159) = ( -0.5000000 -0.0896804 0.3289217), wk = 0.0034965 k( 160) = ( -0.5000000 -0.5203345 0.2170619), wk = 0.0034965 k( 161) = ( -0.4905660 -0.5105169 0.2129664), wk = 0.0034965 k( 162) = ( -0.4811321 -0.5006992 0.2088709), wk = 0.0034965 k( 163) = ( -0.4716981 -0.4908816 0.2047754), wk = 0.0034965 k( 164) = ( -0.4622641 -0.4810640 0.2006799), wk = 0.0034965 k( 165) = ( -0.4528302 -0.4712463 0.1965844), wk = 0.0034965 k( 166) = ( -0.4433962 -0.4614287 0.1924889), wk = 0.0034965 k( 167) = ( -0.4339623 -0.4516111 0.1883934), wk = 0.0034965 k( 168) = ( -0.4245283 -0.4417934 0.1842979), wk = 0.0034965 k( 169) = ( -0.4150943 -0.4319758 0.1802023), wk = 0.0034965 k( 170) = ( -0.4056604 -0.4221582 0.1761068), wk = 0.0034965 k( 171) = ( -0.3962264 -0.4123406 0.1720113), wk = 0.0034965 k( 172) = ( -0.3867925 -0.4025229 0.1679158), wk = 0.0034965 k( 173) = ( -0.3773585 -0.3927053 0.1638203), wk = 0.0034965 k( 174) = ( -0.3679245 -0.3828877 0.1597248), wk = 0.0034965 k( 175) = ( -0.3584906 -0.3730700 0.1556293), wk = 0.0034965 k( 176) = ( -0.3490566 -0.3632524 0.1515338), wk = 0.0034965 k( 177) = ( -0.3396226 -0.3534348 0.1474383), wk = 0.0034965 k( 178) = ( -0.3301887 -0.3436171 0.1433428), wk = 0.0034965 k( 179) = ( -0.3207547 -0.3337995 0.1392473), wk = 0.0034965 k( 180) = ( -0.3113207 -0.3239819 0.1351518), wk = 0.0034965 k( 181) = ( -0.3018868 -0.3141642 0.1310563), wk = 0.0034965 k( 182) = ( -0.2924528 -0.3043466 0.1269607), wk = 0.0034965 k( 183) = ( -0.2830189 -0.2945290 0.1228652), wk = 0.0034965 k( 184) = ( -0.2735849 -0.2847113 0.1187697), wk = 0.0034965 k( 185) = ( -0.2641509 -0.2748937 0.1146742), wk = 0.0034965 k( 186) = ( -0.2547170 -0.2650761 0.1105787), wk = 0.0034965 k( 187) = ( -0.2452830 -0.2552584 0.1064832), wk = 0.0034965 k( 188) = ( -0.2358491 -0.2454408 0.1023877), wk = 0.0034965 k( 189) = ( -0.2264151 -0.2356232 0.0982922), wk = 0.0034965 k( 190) = ( -0.2169811 -0.2258055 0.0941967), wk = 0.0034965 k( 191) = ( -0.2075472 -0.2159879 0.0901012), wk = 0.0034965 k( 192) = ( -0.1981132 -0.2061703 0.0860057), wk = 0.0034965 k( 193) = ( -0.1886792 -0.1963526 0.0819102), wk = 0.0034965 k( 194) = ( -0.1792453 -0.1865350 0.0778146), wk = 0.0034965 k( 195) = ( -0.1698113 -0.1767174 0.0737191), wk = 0.0034965 k( 196) = ( -0.1603774 -0.1668997 0.0696236), wk = 0.0034965 k( 197) = ( -0.1509434 -0.1570821 0.0655281), wk = 0.0034965 k( 198) = ( -0.1415094 -0.1472645 0.0614326), wk = 0.0034965 k( 199) = ( -0.1320755 -0.1374468 0.0573371), wk = 0.0034965 k( 200) = ( -0.1226415 -0.1276292 0.0532416), wk = 0.0034965 k( 201) = ( -0.1132076 -0.1178116 0.0491461), wk = 0.0034965 k( 202) = ( -0.1037736 -0.1079939 0.0450506), wk = 0.0034965 k( 203) = ( -0.0943396 -0.0981763 0.0409551), wk = 0.0034965 k( 204) = ( -0.0849057 -0.0883587 0.0368596), wk = 0.0034965 k( 205) = ( -0.0754717 -0.0785411 0.0327641), wk = 0.0034965 k( 206) = ( -0.0660377 -0.0687234 0.0286686), wk = 0.0034965 k( 207) = ( -0.0566038 -0.0589058 0.0245730), wk = 0.0034965 k( 208) = ( -0.0471698 -0.0490882 0.0204775), wk = 0.0034965 k( 209) = ( -0.0377359 -0.0392705 0.0163820), wk = 0.0034965 k( 210) = ( -0.0283019 -0.0294529 0.0122865), wk = 0.0034965 k( 211) = ( -0.0188679 -0.0196353 0.0081910), wk = 0.0034965 k( 212) = ( -0.0094340 -0.0098176 0.0040955), wk = 0.0034965 k( 213) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 215) = ( 0.0000000 0.0000000 0.0138696), wk = 0.0034965 k( 216) = ( 0.0000000 0.0000000 0.0277392), wk = 0.0034965 k( 217) = ( 0.0000000 0.0000000 0.0416089), wk = 0.0034965 k( 218) = ( 0.0000000 0.0000000 0.0554785), wk = 0.0034965 k( 219) = ( 0.0000000 0.0000000 0.0693481), wk = 0.0034965 k( 220) = ( 0.0000000 0.0000000 0.0832177), wk = 0.0034965 k( 221) = ( 0.0000000 0.0000000 0.0970873), wk = 0.0034965 k( 222) = ( 0.0000000 0.0000000 0.1109570), wk = 0.0034965 k( 223) = ( 0.0000000 0.0000000 0.1248266), wk = 0.0034965 k( 224) = ( 0.0000000 0.0000000 0.1386962), wk = 0.0034965 k( 225) = ( 0.0000000 0.0000000 0.1525658), wk = 0.0034965 k( 226) = ( 0.0000000 0.0000000 0.1664354), wk = 0.0034965 k( 227) = ( 0.0000000 0.0000000 0.1803051), wk = 0.0034965 k( 228) = ( 0.0000000 0.0000000 0.1941747), wk = 0.0034965 k( 229) = ( 0.0000000 0.0000000 0.2080443), wk = 0.0034965 k( 230) = ( 0.0000000 0.0000000 0.2219139), wk = 0.0034965 k( 231) = ( 0.0000000 0.0000000 0.2357835), wk = 0.0034965 k( 232) = ( 0.0000000 0.0000000 0.2496532), wk = 0.0034965 k( 233) = ( 0.0000000 0.0000000 0.2635228), wk = 0.0034965 k( 234) = ( 0.0000000 0.0000000 0.2773924), wk = 0.0034965 k( 235) = ( 0.0000000 0.0000000 0.2912620), wk = 0.0034965 k( 236) = ( 0.0000000 0.0000000 0.3051316), wk = 0.0034965 k( 237) = ( 0.0000000 0.0000000 0.3190013), wk = 0.0034965 k( 238) = ( 0.0000000 0.0000000 0.3328709), wk = 0.0034965 k( 239) = ( 0.0000000 0.0000000 0.3467405), wk = 0.0034965 k( 240) = ( 0.0000000 0.0000000 0.3606101), wk = 0.0034965 k( 241) = ( 0.0000000 0.0000000 0.3744798), wk = 0.0034965 k( 242) = ( 0.0000000 0.0000000 0.3883494), wk = 0.0034965 k( 243) = ( 0.0000000 0.0000000 0.4022190), wk = 0.0034965 k( 244) = ( 0.0000000 0.0000000 0.4160886), wk = 0.0034965 k( 245) = ( 0.0000000 0.0000000 0.4299582), wk = 0.0034965 k( 246) = ( 0.0000000 0.0000000 0.4438279), wk = 0.0034965 k( 247) = ( 0.0000000 -0.4306542 0.3319681), wk = 0.0034965 k( 248) = ( 0.0000000 -0.4196117 0.3234561), wk = 0.0034965 k( 249) = ( 0.0000000 -0.4085693 0.3149441), wk = 0.0034965 k( 250) = ( 0.0000000 -0.3975269 0.3064321), wk = 0.0034965 k( 251) = ( 0.0000000 -0.3864845 0.2979201), wk = 0.0034965 k( 252) = ( 0.0000000 -0.3754421 0.2894081), wk = 0.0034965 k( 253) = ( 0.0000000 -0.3643997 0.2808961), wk = 0.0034965 k( 254) = ( 0.0000000 -0.3533573 0.2723841), wk = 0.0034965 k( 255) = ( 0.0000000 -0.3423148 0.2638721), wk = 0.0034965 k( 256) = ( 0.0000000 -0.3312724 0.2553600), wk = 0.0034965 k( 257) = ( 0.0000000 -0.3202300 0.2468480), wk = 0.0034965 k( 258) = ( 0.0000000 -0.3091876 0.2383360), wk = 0.0034965 k( 259) = ( 0.0000000 -0.2981452 0.2298240), wk = 0.0034965 k( 260) = ( 0.0000000 -0.2871028 0.2213120), wk = 0.0034965 k( 261) = ( 0.0000000 -0.2760604 0.2128000), wk = 0.0034965 k( 262) = ( 0.0000000 -0.2650179 0.2042880), wk = 0.0034965 k( 263) = ( 0.0000000 -0.2539755 0.1957760), wk = 0.0034965 k( 264) = ( 0.0000000 -0.2429331 0.1872640), wk = 0.0034965 k( 265) = ( 0.0000000 -0.2318907 0.1787520), wk = 0.0034965 k( 266) = ( 0.0000000 -0.2208483 0.1702400), wk = 0.0034965 k( 267) = ( 0.0000000 -0.2098059 0.1617280), wk = 0.0034965 k( 268) = ( 0.0000000 -0.1987635 0.1532160), wk = 0.0034965 k( 269) = ( 0.0000000 -0.1877210 0.1447040), wk = 0.0034965 k( 270) = ( 0.0000000 -0.1766786 0.1361920), wk = 0.0034965 k( 271) = ( 0.0000000 -0.1656362 0.1276800), wk = 0.0034965 k( 272) = ( 0.0000000 -0.1545938 0.1191680), wk = 0.0034965 k( 273) = ( 0.0000000 -0.1435514 0.1106560), wk = 0.0034965 k( 274) = ( 0.0000000 -0.1325090 0.1021440), wk = 0.0034965 k( 275) = ( 0.0000000 -0.1214666 0.0936320), wk = 0.0034965 k( 276) = ( 0.0000000 -0.1104241 0.0851200), wk = 0.0034965 k( 277) = ( 0.0000000 -0.0993817 0.0766080), wk = 0.0034965 k( 278) = ( 0.0000000 -0.0883393 0.0680960), wk = 0.0034965 k( 279) = ( 0.0000000 -0.0772969 0.0595840), wk = 0.0034965 k( 280) = ( 0.0000000 -0.0662545 0.0510720), wk = 0.0034965 k( 281) = ( 0.0000000 -0.0552121 0.0425600), wk = 0.0034965 k( 282) = ( 0.0000000 -0.0441697 0.0340480), wk = 0.0034965 k( 283) = ( 0.0000000 -0.0331272 0.0255360), wk = 0.0034965 k( 284) = ( 0.0000000 -0.0220848 0.0170240), wk = 0.0034965 k( 285) = ( 0.0000000 -0.0110424 0.0085120), wk = 0.0034965 k( 286) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 -0.0000000), wk = 0.0034965 k( 2) = ( 0.0000000 -0.4843750 -0.0000000), wk = 0.0034965 k( 3) = ( 0.0000000 -0.4687500 -0.0000000), wk = 0.0034965 k( 4) = ( 0.0000000 -0.4531250 -0.0000000), wk = 0.0034965 k( 5) = ( 0.0000000 -0.4375000 -0.0000000), wk = 0.0034965 k( 6) = ( 0.0000000 -0.4218750 -0.0000000), wk = 0.0034965 k( 7) = ( 0.0000000 -0.4062500 -0.0000000), wk = 0.0034965 k( 8) = ( 0.0000000 -0.3906250 -0.0000000), wk = 0.0034965 k( 9) = ( 0.0000000 -0.3750000 -0.0000000), wk = 0.0034965 k( 10) = ( 0.0000000 -0.3593750 -0.0000000), wk = 0.0034965 k( 11) = ( 0.0000000 -0.3437500 0.0000000), wk = 0.0034965 k( 12) = ( 0.0000000 -0.3281250 0.0000000), wk = 0.0034965 k( 13) = ( 0.0000000 -0.3125000 0.0000000), wk = 0.0034965 k( 14) = ( 0.0000000 -0.2968750 0.0000000), wk = 0.0034965 k( 15) = ( 0.0000000 -0.2812500 0.0000000), wk = 0.0034965 k( 16) = ( 0.0000000 -0.2656250 -0.0000000), wk = 0.0034965 k( 17) = ( 0.0000000 -0.2500000 -0.0000000), wk = 0.0034965 k( 18) = ( 0.0000000 -0.2343750 -0.0000000), wk = 0.0034965 k( 19) = ( 0.0000000 -0.2187500 -0.0000000), wk = 0.0034965 k( 20) = ( 0.0000000 -0.2031250 -0.0000000), wk = 0.0034965 k( 21) = ( 0.0000000 -0.1875000 -0.0000000), wk = 0.0034965 k( 22) = ( 0.0000000 -0.1718750 0.0000000), wk = 0.0034965 k( 23) = ( 0.0000000 -0.1562500 0.0000000), wk = 0.0034965 k( 24) = ( 0.0000000 -0.1406250 0.0000000), wk = 0.0034965 k( 25) = ( 0.0000000 -0.1250000 -0.0000000), wk = 0.0034965 k( 26) = ( 0.0000000 -0.1093750 -0.0000000), wk = 0.0034965 k( 27) = ( 0.0000000 -0.0937500 -0.0000000), wk = 0.0034965 k( 28) = ( 0.0000000 -0.0781250 0.0000000), wk = 0.0034965 k( 29) = ( 0.0000000 -0.0625000 -0.0000000), wk = 0.0034965 k( 30) = ( 0.0000000 -0.0468750 -0.0000000), wk = 0.0034965 k( 31) = ( 0.0000000 -0.0312500 -0.0000000), wk = 0.0034965 k( 32) = ( 0.0000000 -0.0156250 -0.0000000), wk = 0.0034965 k( 33) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 34) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 35) = ( 0.0135135 0.0000000 -0.0000000), wk = 0.0034965 k( 36) = ( 0.0270270 -0.0000000 -0.0000000), wk = 0.0034965 k( 37) = ( 0.0405405 -0.0000000 -0.0000000), wk = 0.0034965 k( 38) = ( 0.0540540 -0.0000000 -0.0000000), wk = 0.0034965 k( 39) = ( 0.0675676 0.0000000 -0.0000000), wk = 0.0034965 k( 40) = ( 0.0810811 -0.0000000 -0.0000000), wk = 0.0034965 k( 41) = ( 0.0945946 -0.0000000 -0.0000000), wk = 0.0034965 k( 42) = ( 0.1081081 0.0000000 -0.0000000), wk = 0.0034965 k( 43) = ( 0.1216216 0.0000000 0.0000000), wk = 0.0034965 k( 44) = ( 0.1351351 0.0000000 -0.0000000), wk = 0.0034965 k( 45) = ( 0.1486486 -0.0000000 -0.0000000), wk = 0.0034965 k( 46) = ( 0.1621622 -0.0000000 -0.0000000), wk = 0.0034965 k( 47) = ( 0.1756757 0.0000000 -0.0000000), wk = 0.0034965 k( 48) = ( 0.1891892 0.0000000 -0.0000000), wk = 0.0034965 k( 49) = ( 0.2027027 0.0000000 -0.0000000), wk = 0.0034965 k( 50) = ( 0.2162162 0.0000000 -0.0000000), wk = 0.0034965 k( 51) = ( 0.2297297 0.0000000 0.0000000), wk = 0.0034965 k( 52) = ( 0.2432432 0.0000000 0.0000000), wk = 0.0034965 k( 53) = ( 0.2567568 -0.0000000 0.0000000), wk = 0.0034965 k( 54) = ( 0.2702703 0.0000000 -0.0000000), wk = 0.0034965 k( 55) = ( 0.2837838 -0.0000000 -0.0000000), wk = 0.0034965 k( 56) = ( 0.2972973 -0.0000000 -0.0000000), wk = 0.0034965 k( 57) = ( 0.3108108 -0.0000000 -0.0000000), wk = 0.0034965 k( 58) = ( 0.3243243 -0.0000000 -0.0000000), wk = 0.0034965 k( 59) = ( 0.3378378 -0.0000000 -0.0000000), wk = 0.0034965 k( 60) = ( 0.3513514 -0.0000000 0.0000000), wk = 0.0034965 k( 61) = ( 0.3648649 0.0000000 0.0000000), wk = 0.0034965 k( 62) = ( 0.3783784 0.0000000 -0.0000000), wk = 0.0034965 k( 63) = ( 0.3918919 -0.0000000 -0.0000000), wk = 0.0034965 k( 64) = ( 0.4054054 -0.0000000 -0.0000000), wk = 0.0034965 k( 65) = ( 0.4189189 0.0000000 -0.0000000), wk = 0.0034965 k( 66) = ( 0.4324324 0.0000000 -0.0000000), wk = 0.0034965 k( 67) = ( 0.4459459 -0.0000000 -0.0000000), wk = 0.0034965 k( 68) = ( 0.4594595 0.0000000 0.0000000), wk = 0.0034965 k( 69) = ( 0.4729730 0.0000000 -0.0000000), wk = 0.0034965 k( 70) = ( 0.4864865 -0.0000000 -0.0000000), wk = 0.0034965 k( 71) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0034965 k( 72) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0034965 k( 73) = ( 0.4883721 -0.4883721 -0.0000000), wk = 0.0034965 k( 74) = ( 0.4767442 -0.4767442 -0.0000000), wk = 0.0034965 k( 75) = ( 0.4651163 -0.4651163 -0.0000000), wk = 0.0034965 k( 76) = ( 0.4534884 -0.4534884 -0.0000000), wk = 0.0034965 k( 77) = ( 0.4418605 -0.4418605 -0.0000000), wk = 0.0034965 k( 78) = ( 0.4302326 -0.4302326 -0.0000000), wk = 0.0034965 k( 79) = ( 0.4186047 -0.4186046 -0.0000000), wk = 0.0034965 k( 80) = ( 0.4069767 -0.4069767 -0.0000000), wk = 0.0034965 k( 81) = ( 0.3953488 -0.3953488 -0.0000000), wk = 0.0034965 k( 82) = ( 0.3837209 -0.3837209 -0.0000000), wk = 0.0034965 k( 83) = ( 0.3720930 -0.3720930 -0.0000000), wk = 0.0034965 k( 84) = ( 0.3604651 -0.3604651 -0.0000000), wk = 0.0034965 k( 85) = ( 0.3488372 -0.3488372 -0.0000000), wk = 0.0034965 k( 86) = ( 0.3372093 -0.3372093 -0.0000000), wk = 0.0034965 k( 87) = ( 0.3255814 -0.3255814 -0.0000000), wk = 0.0034965 k( 88) = ( 0.3139535 -0.3139535 -0.0000000), wk = 0.0034965 k( 89) = ( 0.3023256 -0.3023256 -0.0000000), wk = 0.0034965 k( 90) = ( 0.2906977 -0.2906977 -0.0000000), wk = 0.0034965 k( 91) = ( 0.2790698 -0.2790698 -0.0000000), wk = 0.0034965 k( 92) = ( 0.2674419 -0.2674419 -0.0000000), wk = 0.0034965 k( 93) = ( 0.2558140 -0.2558140 -0.0000000), wk = 0.0034965 k( 94) = ( 0.2441860 -0.2441860 -0.0000000), wk = 0.0034965 k( 95) = ( 0.2325581 -0.2325581 -0.0000000), wk = 0.0034965 k( 96) = ( 0.2209302 -0.2209302 -0.0000000), wk = 0.0034965 k( 97) = ( 0.2093023 -0.2093023 -0.0000000), wk = 0.0034965 k( 98) = ( 0.1976744 -0.1976744 -0.0000000), wk = 0.0034965 k( 99) = ( 0.1860465 -0.1860465 -0.0000000), wk = 0.0034965 k( 100) = ( 0.1744186 -0.1744186 -0.0000000), wk = 0.0034965 k( 101) = ( 0.1627907 -0.1627907 -0.0000000), wk = 0.0034965 k( 102) = ( 0.1511628 -0.1511628 -0.0000000), wk = 0.0034965 k( 103) = ( 0.1395349 -0.1395349 -0.0000000), wk = 0.0034965 k( 104) = ( 0.1279070 -0.1279070 -0.0000000), wk = 0.0034965 k( 105) = ( 0.1162791 -0.1162791 -0.0000000), wk = 0.0034965 k( 106) = ( 0.1046512 -0.1046512 -0.0000000), wk = 0.0034965 k( 107) = ( 0.0930233 -0.0930233 -0.0000000), wk = 0.0034965 k( 108) = ( 0.0813954 -0.0813954 -0.0000000), wk = 0.0034965 k( 109) = ( 0.0697674 -0.0697674 -0.0000000), wk = 0.0034965 k( 110) = ( 0.0581395 -0.0581395 -0.0000000), wk = 0.0034965 k( 111) = ( 0.0465116 -0.0465116 -0.0000000), wk = 0.0034965 k( 112) = ( 0.0348837 -0.0348837 -0.0000000), wk = 0.0034965 k( 113) = ( 0.0232558 -0.0232558 -0.0000000), wk = 0.0034965 k( 114) = ( 0.0116279 -0.0116279 -0.0000000), wk = 0.0034965 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 117) = ( -0.0116279 0.0000000 0.0116279), wk = 0.0034965 k( 118) = ( -0.0232558 0.0000000 0.0232558), wk = 0.0034965 k( 119) = ( -0.0348837 -0.0000000 0.0348837), wk = 0.0034965 k( 120) = ( -0.0465116 0.0000000 0.0465116), wk = 0.0034965 k( 121) = ( -0.0581395 -0.0000000 0.0581395), wk = 0.0034965 k( 122) = ( -0.0697674 -0.0000000 0.0697674), wk = 0.0034965 k( 123) = ( -0.0813954 -0.0000000 0.0813954), wk = 0.0034965 k( 124) = ( -0.0930233 0.0000000 0.0930233), wk = 0.0034965 k( 125) = ( -0.1046512 -0.0000000 0.1046512), wk = 0.0034965 k( 126) = ( -0.1162791 0.0000000 0.1162791), wk = 0.0034965 k( 127) = ( -0.1279070 0.0000000 0.1279070), wk = 0.0034965 k( 128) = ( -0.1395349 -0.0000000 0.1395349), wk = 0.0034965 k( 129) = ( -0.1511628 -0.0000000 0.1511628), wk = 0.0034965 k( 130) = ( -0.1627907 -0.0000000 0.1627907), wk = 0.0034965 k( 131) = ( -0.1744186 0.0000000 0.1744186), wk = 0.0034965 k( 132) = ( -0.1860465 0.0000000 0.1860465), wk = 0.0034965 k( 133) = ( -0.1976744 0.0000000 0.1976744), wk = 0.0034965 k( 134) = ( -0.2093023 0.0000000 0.2093023), wk = 0.0034965 k( 135) = ( -0.2209302 0.0000000 0.2209302), wk = 0.0034965 k( 136) = ( -0.2325581 0.0000000 0.2325581), wk = 0.0034965 k( 137) = ( -0.2441860 -0.0000000 0.2441861), wk = 0.0034965 k( 138) = ( -0.2558140 0.0000000 0.2558140), wk = 0.0034965 k( 139) = ( -0.2674419 0.0000000 0.2674419), wk = 0.0034965 k( 140) = ( -0.2790698 -0.0000000 0.2790698), wk = 0.0034965 k( 141) = ( -0.2906977 -0.0000000 0.2906977), wk = 0.0034965 k( 142) = ( -0.3023256 -0.0000000 0.3023256), wk = 0.0034965 k( 143) = ( -0.3139535 -0.0000000 0.3139535), wk = 0.0034965 k( 144) = ( -0.3255814 -0.0000000 0.3255814), wk = 0.0034965 k( 145) = ( -0.3372093 -0.0000000 0.3372093), wk = 0.0034965 k( 146) = ( -0.3488372 -0.0000000 0.3488372), wk = 0.0034965 k( 147) = ( -0.3604651 -0.0000000 0.3604651), wk = 0.0034965 k( 148) = ( -0.3720930 0.0000000 0.3720930), wk = 0.0034965 k( 149) = ( -0.3837209 0.0000000 0.3837209), wk = 0.0034965 k( 150) = ( -0.3953488 0.0000000 0.3953488), wk = 0.0034965 k( 151) = ( -0.4069767 -0.0000000 0.4069767), wk = 0.0034965 k( 152) = ( -0.4186047 -0.0000000 0.4186047), wk = 0.0034965 k( 153) = ( -0.4302326 0.0000000 0.4302326), wk = 0.0034965 k( 154) = ( -0.4418605 -0.0000000 0.4418605), wk = 0.0034965 k( 155) = ( -0.4534884 -0.0000000 0.4534884), wk = 0.0034965 k( 156) = ( -0.4651163 0.0000000 0.4651163), wk = 0.0034965 k( 157) = ( -0.4767442 0.0000000 0.4767442), wk = 0.0034965 k( 158) = ( -0.4883721 -0.0000000 0.4883721), wk = 0.0034965 k( 159) = ( -0.5000000 0.0000000 0.5000000), wk = 0.0034965 k( 160) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0034965 k( 161) = ( -0.4905660 -0.4905660 0.4905660), wk = 0.0034965 k( 162) = ( -0.4811321 -0.4811321 0.4811321), wk = 0.0034965 k( 163) = ( -0.4716981 -0.4716981 0.4716981), wk = 0.0034965 k( 164) = ( -0.4622641 -0.4622641 0.4622641), wk = 0.0034965 k( 165) = ( -0.4528302 -0.4528302 0.4528302), wk = 0.0034965 k( 166) = ( -0.4433962 -0.4433962 0.4433962), wk = 0.0034965 k( 167) = ( -0.4339623 -0.4339623 0.4339623), wk = 0.0034965 k( 168) = ( -0.4245283 -0.4245283 0.4245283), wk = 0.0034965 k( 169) = ( -0.4150943 -0.4150943 0.4150943), wk = 0.0034965 k( 170) = ( -0.4056604 -0.4056604 0.4056604), wk = 0.0034965 k( 171) = ( -0.3962264 -0.3962264 0.3962264), wk = 0.0034965 k( 172) = ( -0.3867925 -0.3867925 0.3867925), wk = 0.0034965 k( 173) = ( -0.3773585 -0.3773585 0.3773585), wk = 0.0034965 k( 174) = ( -0.3679245 -0.3679245 0.3679245), wk = 0.0034965 k( 175) = ( -0.3584906 -0.3584906 0.3584906), wk = 0.0034965 k( 176) = ( -0.3490566 -0.3490566 0.3490566), wk = 0.0034965 k( 177) = ( -0.3396226 -0.3396226 0.3396226), wk = 0.0034965 k( 178) = ( -0.3301887 -0.3301887 0.3301887), wk = 0.0034965 k( 179) = ( -0.3207547 -0.3207547 0.3207547), wk = 0.0034965 k( 180) = ( -0.3113207 -0.3113207 0.3113208), wk = 0.0034965 k( 181) = ( -0.3018868 -0.3018868 0.3018868), wk = 0.0034965 k( 182) = ( -0.2924528 -0.2924528 0.2924528), wk = 0.0034965 k( 183) = ( -0.2830189 -0.2830189 0.2830189), wk = 0.0034965 k( 184) = ( -0.2735849 -0.2735849 0.2735849), wk = 0.0034965 k( 185) = ( -0.2641509 -0.2641509 0.2641509), wk = 0.0034965 k( 186) = ( -0.2547170 -0.2547170 0.2547170), wk = 0.0034965 k( 187) = ( -0.2452830 -0.2452830 0.2452830), wk = 0.0034965 k( 188) = ( -0.2358491 -0.2358491 0.2358491), wk = 0.0034965 k( 189) = ( -0.2264151 -0.2264151 0.2264151), wk = 0.0034965 k( 190) = ( -0.2169811 -0.2169811 0.2169811), wk = 0.0034965 k( 191) = ( -0.2075472 -0.2075472 0.2075472), wk = 0.0034965 k( 192) = ( -0.1981132 -0.1981132 0.1981132), wk = 0.0034965 k( 193) = ( -0.1886792 -0.1886792 0.1886792), wk = 0.0034965 k( 194) = ( -0.1792453 -0.1792453 0.1792453), wk = 0.0034965 k( 195) = ( -0.1698113 -0.1698113 0.1698113), wk = 0.0034965 k( 196) = ( -0.1603774 -0.1603774 0.1603774), wk = 0.0034965 k( 197) = ( -0.1509434 -0.1509434 0.1509434), wk = 0.0034965 k( 198) = ( -0.1415094 -0.1415094 0.1415094), wk = 0.0034965 k( 199) = ( -0.1320755 -0.1320755 0.1320755), wk = 0.0034965 k( 200) = ( -0.1226415 -0.1226415 0.1226415), wk = 0.0034965 k( 201) = ( -0.1132076 -0.1132075 0.1132076), wk = 0.0034965 k( 202) = ( -0.1037736 -0.1037736 0.1037736), wk = 0.0034965 k( 203) = ( -0.0943396 -0.0943396 0.0943396), wk = 0.0034965 k( 204) = ( -0.0849057 -0.0849057 0.0849057), wk = 0.0034965 k( 205) = ( -0.0754717 -0.0754717 0.0754717), wk = 0.0034965 k( 206) = ( -0.0660377 -0.0660377 0.0660377), wk = 0.0034965 k( 207) = ( -0.0566038 -0.0566038 0.0566038), wk = 0.0034965 k( 208) = ( -0.0471698 -0.0471698 0.0471698), wk = 0.0034965 k( 209) = ( -0.0377359 -0.0377359 0.0377359), wk = 0.0034965 k( 210) = ( -0.0283019 -0.0283019 0.0283019), wk = 0.0034965 k( 211) = ( -0.0188679 -0.0188679 0.0188679), wk = 0.0034965 k( 212) = ( -0.0094340 -0.0094340 0.0094340), wk = 0.0034965 k( 213) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 214) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 k( 215) = ( 0.0000000 0.0000000 0.0156250), wk = 0.0034965 k( 216) = ( 0.0000000 0.0000000 0.0312500), wk = 0.0034965 k( 217) = ( 0.0000000 0.0000000 0.0468750), wk = 0.0034965 k( 218) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0034965 k( 219) = ( 0.0000000 0.0000000 0.0781250), wk = 0.0034965 k( 220) = ( 0.0000000 0.0000000 0.0937500), wk = 0.0034965 k( 221) = ( 0.0000000 0.0000000 0.1093750), wk = 0.0034965 k( 222) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0034965 k( 223) = ( 0.0000000 0.0000000 0.1406250), wk = 0.0034965 k( 224) = ( 0.0000000 0.0000000 0.1562500), wk = 0.0034965 k( 225) = ( 0.0000000 0.0000000 0.1718750), wk = 0.0034965 k( 226) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0034965 k( 227) = ( 0.0000000 0.0000000 0.2031250), wk = 0.0034965 k( 228) = ( 0.0000000 0.0000000 0.2187500), wk = 0.0034965 k( 229) = ( 0.0000000 0.0000000 0.2343750), wk = 0.0034965 k( 230) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0034965 k( 231) = ( 0.0000000 0.0000000 0.2656250), wk = 0.0034965 k( 232) = ( 0.0000000 0.0000000 0.2812500), wk = 0.0034965 k( 233) = ( 0.0000000 0.0000000 0.2968750), wk = 0.0034965 k( 234) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0034965 k( 235) = ( 0.0000000 0.0000000 0.3281250), wk = 0.0034965 k( 236) = ( 0.0000000 0.0000000 0.3437500), wk = 0.0034965 k( 237) = ( 0.0000000 0.0000000 0.3593750), wk = 0.0034965 k( 238) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0034965 k( 239) = ( 0.0000000 0.0000000 0.3906250), wk = 0.0034965 k( 240) = ( 0.0000000 0.0000000 0.4062500), wk = 0.0034965 k( 241) = ( 0.0000000 0.0000000 0.4218750), wk = 0.0034965 k( 242) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0034965 k( 243) = ( 0.0000000 0.0000000 0.4531250), wk = 0.0034965 k( 244) = ( 0.0000000 0.0000000 0.4687500), wk = 0.0034965 k( 245) = ( 0.0000000 0.0000000 0.4843750), wk = 0.0034965 k( 246) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034965 k( 247) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0034965 k( 248) = ( 0.0000000 -0.4871795 0.4871795), wk = 0.0034965 k( 249) = ( 0.0000000 -0.4743590 0.4743590), wk = 0.0034965 k( 250) = ( 0.0000000 -0.4615385 0.4615385), wk = 0.0034965 k( 251) = ( 0.0000000 -0.4487179 0.4487180), wk = 0.0034965 k( 252) = ( 0.0000000 -0.4358974 0.4358974), wk = 0.0034965 k( 253) = ( 0.0000000 -0.4230769 0.4230769), wk = 0.0034965 k( 254) = ( 0.0000000 -0.4102564 0.4102564), wk = 0.0034965 k( 255) = ( 0.0000000 -0.3974359 0.3974359), wk = 0.0034965 k( 256) = ( 0.0000000 -0.3846154 0.3846154), wk = 0.0034965 k( 257) = ( 0.0000000 -0.3717949 0.3717949), wk = 0.0034965 k( 258) = ( 0.0000000 -0.3589744 0.3589744), wk = 0.0034965 k( 259) = ( 0.0000000 -0.3461538 0.3461538), wk = 0.0034965 k( 260) = ( 0.0000000 -0.3333333 0.3333333), wk = 0.0034965 k( 261) = ( 0.0000000 -0.3205128 0.3205128), wk = 0.0034965 k( 262) = ( 0.0000000 -0.3076923 0.3076923), wk = 0.0034965 k( 263) = ( 0.0000000 -0.2948718 0.2948718), wk = 0.0034965 k( 264) = ( 0.0000000 -0.2820513 0.2820513), wk = 0.0034965 k( 265) = ( 0.0000000 -0.2692308 0.2692308), wk = 0.0034965 k( 266) = ( 0.0000000 -0.2564103 0.2564103), wk = 0.0034965 k( 267) = ( 0.0000000 -0.2435897 0.2435897), wk = 0.0034965 k( 268) = ( 0.0000000 -0.2307692 0.2307692), wk = 0.0034965 k( 269) = ( 0.0000000 -0.2179487 0.2179487), wk = 0.0034965 k( 270) = ( 0.0000000 -0.2051282 0.2051282), wk = 0.0034965 k( 271) = ( 0.0000000 -0.1923077 0.1923077), wk = 0.0034965 k( 272) = ( 0.0000000 -0.1794872 0.1794872), wk = 0.0034965 k( 273) = ( 0.0000000 -0.1666667 0.1666667), wk = 0.0034965 k( 274) = ( 0.0000000 -0.1538461 0.1538461), wk = 0.0034965 k( 275) = ( 0.0000000 -0.1410256 0.1410256), wk = 0.0034965 k( 276) = ( 0.0000000 -0.1282051 0.1282051), wk = 0.0034965 k( 277) = ( 0.0000000 -0.1153846 0.1153846), wk = 0.0034965 k( 278) = ( 0.0000000 -0.1025641 0.1025641), wk = 0.0034965 k( 279) = ( 0.0000000 -0.0897436 0.0897436), wk = 0.0034965 k( 280) = ( 0.0000000 -0.0769231 0.0769231), wk = 0.0034965 k( 281) = ( 0.0000000 -0.0641026 0.0641026), wk = 0.0034965 k( 282) = ( 0.0000000 -0.0512821 0.0512821), wk = 0.0034965 k( 283) = ( 0.0000000 -0.0384615 0.0384615), wk = 0.0034965 k( 284) = ( 0.0000000 -0.0256410 0.0256410), wk = 0.0034965 k( 285) = ( 0.0000000 -0.0128205 0.0128205), wk = 0.0034965 k( 286) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034965 Dense grid: 78895 G-vectors FFT dimensions: ( 50, 60, 60) Smooth grid: 77449 G-vectors FFT dimensions: ( 50, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.81 Mb ( 556, 96) NL pseudopotentials 0.99 Mb ( 278, 234) Each V/rho on FFT grid 0.09 Mb ( 6000) Each G-vector array 0.02 Mb ( 2192) G-vector shells 0.02 Mb ( 2165) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 3.26 Mb ( 556, 384) Each subspace H/S matrix 0.14 Mb ( 96, 96) Each matrix 0.69 Mb ( 234, 2, 96) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./CoCuP2O7.save/charge-density.dat Starting wfc are 110 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.9 secs Computing kpt #: 2 total cpu time spent up to now is 6.8 secs Computing kpt #: 3 total cpu time spent up to now is 8.7 secs Computing kpt #: 4 total cpu time spent up to now is 10.6 secs Computing kpt #: 5 total cpu time spent up to now is 12.5 secs Computing kpt #: 6 total cpu time spent up to now is 14.4 secs Computing kpt #: 7 total cpu time spent up to now is 16.3 secs Computing kpt #: 8 total cpu time spent up to now is 18.2 secs Computing kpt #: 9 total cpu time spent up to now is 20.1 secs Computing kpt #: 10 total cpu time spent up to now is 22.0 secs Computing kpt #: 11 total cpu time spent up to now is 23.9 secs Computing kpt #: 12 total cpu time spent up to now is 25.8 secs Computing kpt #: 13 total cpu time spent up to now is 27.7 secs Computing kpt #: 14 total cpu time spent up to now is 29.6 secs Computing kpt #: 15 total cpu time spent up to now is 31.5 secs Computing kpt #: 16 total cpu time spent up to now is 33.4 secs Computing kpt #: 17 total cpu time spent up to now is 35.3 secs Computing kpt #: 18 total cpu time spent up to now is 37.2 secs Computing kpt #: 19 total cpu time spent up to now is 39.1 secs Computing kpt #: 20 total cpu time spent up to now is 41.0 secs Computing kpt #: 21 total cpu time spent up to now is 42.9 secs Computing kpt #: 22 total cpu time spent up to now is 44.8 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 48.6 secs Computing kpt #: 25 total cpu time spent up to now is 50.4 secs Computing kpt #: 26 total cpu time spent up to now is 52.3 secs Computing kpt #: 27 total cpu time spent up to now is 54.1 secs Computing kpt #: 28 total cpu time spent up to now is 56.0 secs Computing kpt #: 29 total cpu time spent up to now is 57.9 secs Computing kpt #: 30 total cpu time spent up to now is 59.8 secs Computing kpt #: 31 total cpu time spent up to now is 61.6 secs Computing kpt #: 32 total cpu time spent up to now is 63.6 secs Computing kpt #: 33 total cpu time spent up to now is 65.4 secs Computing kpt #: 34 total cpu time spent up to now is 67.3 secs Computing kpt #: 35 total cpu time spent up to now is 69.2 secs Computing kpt #: 36 total cpu time spent up to now is 71.1 secs Computing kpt #: 37 total cpu time spent up to now is 73.0 secs Computing kpt #: 38 total cpu time spent up to now is 74.8 secs Computing kpt #: 39 total cpu time spent up to now is 76.7 secs Computing kpt #: 40 total cpu time spent up to now is 78.6 secs Computing kpt #: 41 total cpu time spent up to now is 80.5 secs Computing kpt #: 42 total cpu time spent up to now is 82.4 secs Computing kpt #: 43 total cpu time spent up to now is 84.3 secs Computing kpt #: 44 total cpu time spent up to now is 86.2 secs Computing kpt #: 45 total cpu time spent up to now is 88.1 secs Computing kpt #: 46 total cpu time spent up to now is 90.0 secs Computing kpt #: 47 total cpu time spent up to now is 91.9 secs Computing kpt #: 48 total cpu time spent up to now is 93.8 secs Computing kpt #: 49 total cpu time spent up to now is 95.8 secs Computing kpt #: 50 total cpu time spent up to now is 97.7 secs Computing kpt #: 51 total cpu time spent up to now is 99.6 secs Computing kpt #: 52 total cpu time spent up to now is 101.5 secs Computing kpt #: 53 total cpu time spent up to now is 103.5 secs Computing kpt #: 54 total cpu time spent up to now is 105.4 secs Computing kpt #: 55 total cpu time spent up to now is 107.3 secs Computing kpt #: 56 total cpu time spent up to now is 109.2 secs Computing kpt #: 57 total cpu time spent up to now is 111.2 secs Computing kpt #: 58 total cpu time spent up to now is 113.1 secs Computing kpt #: 59 total cpu time spent up to now is 115.0 secs Computing kpt #: 60 total cpu time spent up to now is 117.0 secs Computing kpt #: 61 total cpu time spent up to now is 119.0 secs Computing kpt #: 62 total cpu time spent up to now is 121.0 secs Computing kpt #: 63 total cpu time spent up to now is 122.9 secs Computing kpt #: 64 total cpu time spent up to now is 124.9 secs Computing kpt #: 65 total cpu time spent up to now is 126.8 secs Computing kpt #: 66 total cpu time spent up to now is 128.8 secs Computing kpt #: 67 total cpu time spent up to now is 130.8 secs Computing kpt #: 68 total cpu time spent up to now is 132.8 secs Computing kpt #: 69 total cpu time spent up to now is 134.7 secs Computing kpt #: 70 total cpu time spent up to now is 136.9 secs Computing kpt #: 71 total cpu time spent up to now is 139.1 secs Computing kpt #: 72 total cpu time spent up to now is 141.0 secs Computing kpt #: 73 total cpu time spent up to now is 143.0 secs Computing kpt #: 74 total cpu time spent up to now is 145.0 secs Computing kpt #: 75 total cpu time spent up to now is 146.9 secs Computing kpt #: 76 total cpu time spent up to now is 148.9 secs Computing kpt #: 77 total cpu time spent up to now is 150.9 secs Computing kpt #: 78 total cpu time spent up to now is 152.9 secs Computing kpt #: 79 total cpu time spent up to now is 154.8 secs Computing kpt #: 80 total cpu time spent up to now is 156.8 secs Computing kpt #: 81 total cpu time spent up to now is 158.8 secs Computing kpt #: 82 total cpu time spent up to now is 160.7 secs Computing kpt #: 83 total cpu time spent up to now is 162.7 secs Computing kpt #: 84 total cpu time spent up to now is 164.6 secs Computing kpt #: 85 total cpu time spent up to now is 166.6 secs Computing kpt #: 86 total cpu time spent up to now is 168.6 secs Computing kpt #: 87 total cpu time spent up to now is 170.5 secs Computing kpt #: 88 total cpu time spent up to now is 172.4 secs Computing kpt #: 89 total cpu time spent up to now is 174.4 secs Computing kpt #: 90 total cpu time spent up to now is 176.4 secs Computing kpt #: 91 total cpu time spent up to now is 178.3 secs Computing kpt #: 92 total cpu time spent up to now is 180.3 secs Computing kpt #: 93 total cpu time spent up to now is 182.3 secs Computing kpt #: 94 total cpu time spent up to now is 184.2 secs Computing kpt #: 95 total cpu time spent up to now is 186.2 secs Computing kpt #: 96 total cpu time spent up to now is 188.1 secs Computing kpt #: 97 total cpu time spent up to now is 190.0 secs Computing kpt #: 98 total cpu time spent up to now is 192.0 secs Computing kpt #: 99 total cpu time spent up to now is 193.9 secs Computing kpt #: 100 total cpu time spent up to now is 195.8 secs Computing kpt #: 101 total cpu time spent up to now is 197.8 secs Computing kpt #: 102 total cpu time spent up to now is 199.7 secs Computing kpt #: 103 total cpu time spent up to now is 201.6 secs Computing kpt #: 104 total cpu time spent up to now is 203.5 secs Computing kpt #: 105 total cpu time spent up to now is 205.4 secs Computing kpt #: 106 total cpu time spent up to now is 207.4 secs Computing kpt #: 107 total cpu time spent up to now is 209.2 secs Computing kpt #: 108 total cpu time spent up to now is 211.2 secs Computing kpt #: 109 total cpu time spent up to now is 213.1 secs Computing kpt #: 110 total cpu time spent up to now is 215.0 secs Computing kpt #: 111 total cpu time spent up to now is 216.8 secs Computing kpt #: 112 total cpu time spent up to now is 218.7 secs Computing kpt #: 113 total cpu time spent up to now is 220.6 secs Computing kpt #: 114 total cpu time spent up to now is 222.4 secs Computing kpt #: 115 total cpu time spent up to now is 224.3 secs Computing kpt #: 116 total cpu time spent up to now is 226.2 secs Computing kpt #: 117 total cpu time spent up to now is 228.1 secs Computing kpt #: 118 total cpu time spent up to now is 229.9 secs Computing kpt #: 119 total cpu time spent up to now is 231.8 secs Computing kpt #: 120 total cpu time spent up to now is 233.7 secs Computing kpt #: 121 total cpu time spent up to now is 235.6 secs Computing kpt #: 122 total cpu time spent up to now is 237.4 secs Computing kpt #: 123 total cpu time spent up to now is 239.3 secs Computing kpt #: 124 total cpu time spent up to now is 241.1 secs Computing kpt #: 125 total cpu time spent up to now is 243.0 secs Computing kpt #: 126 total cpu time spent up to now is 244.9 secs Computing kpt #: 127 total cpu time spent up to now is 246.8 secs Computing kpt #: 128 total cpu time spent up to now is 248.7 secs Computing kpt #: 129 total cpu time spent up to now is 250.6 secs Computing kpt #: 130 total cpu time spent up to now is 252.5 secs Computing kpt #: 131 total cpu time spent up to now is 254.4 secs Computing kpt #: 132 total cpu time spent up to now is 256.3 secs Computing kpt #: 133 total cpu time spent up to now is 258.2 secs Computing kpt #: 134 total cpu time spent up to now is 260.1 secs Computing kpt #: 135 total cpu time spent up to now is 262.1 secs Computing kpt #: 136 total cpu time spent up to now is 264.0 secs Computing kpt #: 137 total cpu time spent up to now is 265.9 secs Computing kpt #: 138 total cpu time spent up to now is 267.8 secs Computing kpt #: 139 total cpu time spent up to now is 269.7 secs Computing kpt #: 140 total cpu time spent up to now is 271.6 secs Computing kpt #: 141 total cpu time spent up to now is 273.6 secs Computing kpt #: 142 total cpu time spent up to now is 275.5 secs Computing kpt #: 143 total cpu time spent up to now is 277.4 secs Computing kpt #: 144 total cpu time spent up to now is 279.3 secs Computing kpt #: 145 total cpu time spent up to now is 281.3 secs Computing kpt #: 146 total cpu time spent up to now is 283.2 secs Computing kpt #: 147 total cpu time spent up to now is 285.1 secs Computing kpt #: 148 total cpu time spent up to now is 287.1 secs Computing kpt #: 149 total cpu time spent up to now is 289.0 secs Computing kpt #: 150 total cpu time spent up to now is 291.0 secs Computing kpt #: 151 total cpu time spent up to now is 293.0 secs Computing kpt #: 152 total cpu time spent up to now is 294.9 secs Computing kpt #: 153 total cpu time spent up to now is 296.8 secs Computing kpt #: 154 total cpu time spent up to now is 298.7 secs Computing kpt #: 155 total cpu time spent up to now is 300.7 secs Computing kpt #: 156 total cpu time spent up to now is 302.5 secs Computing kpt #: 157 total cpu time spent up to now is 304.4 secs Computing kpt #: 158 total cpu time spent up to now is 306.2 secs Computing kpt #: 159 total cpu time spent up to now is 308.2 secs Computing kpt #: 160 total cpu time spent up to now is 310.0 secs Computing kpt #: 161 total cpu time spent up to now is 311.8 secs Computing kpt #: 162 total cpu time spent up to now is 313.6 secs Computing kpt #: 163 total cpu time spent up to now is 315.5 secs Computing kpt #: 164 total cpu time spent up to now is 317.4 secs Computing kpt #: 165 total cpu time spent up to now is 319.2 secs Computing kpt #: 166 total cpu time spent up to now is 321.1 secs Computing kpt #: 167 total cpu time spent up to now is 323.0 secs Computing kpt #: 168 total cpu time spent up to now is 324.8 secs Computing kpt #: 169 total cpu time spent up to now is 326.7 secs Computing kpt #: 170 total cpu time spent up to now is 328.6 secs Computing kpt #: 171 total cpu time spent up to now is 330.5 secs Computing kpt #: 172 total cpu time spent up to now is 332.4 secs Computing kpt #: 173 total cpu time spent up to now is 334.3 secs Computing kpt #: 174 total cpu time spent up to now is 336.2 secs Computing kpt #: 175 total cpu time spent up to now is 338.2 secs Computing kpt #: 176 total cpu time spent up to now is 340.1 secs Computing kpt #: 177 total cpu time spent up to now is 342.1 secs Computing kpt #: 178 total cpu time spent up to now is 344.0 secs Computing kpt #: 179 total cpu time spent up to now is 345.9 secs Computing kpt #: 180 total cpu time spent up to now is 347.8 secs Computing kpt #: 181 total cpu time spent up to now is 349.7 secs Computing kpt #: 182 total cpu time spent up to now is 351.6 secs Computing kpt #: 183 total cpu time spent up to now is 353.5 secs Computing kpt #: 184 total cpu time spent up to now is 355.3 secs Computing kpt #: 185 total cpu time spent up to now is 357.2 secs Computing kpt #: 186 total cpu time spent up to now is 359.1 secs Computing kpt #: 187 total cpu time spent up to now is 361.0 secs Computing kpt #: 188 total cpu time spent up to now is 362.9 secs Computing kpt #: 189 total cpu time spent up to now is 364.8 secs Computing kpt #: 190 total cpu time spent up to now is 366.7 secs Computing kpt #: 191 total cpu time spent up to now is 368.6 secs Computing kpt #: 192 total cpu time spent up to now is 370.4 secs Computing kpt #: 193 total cpu time spent up to now is 372.3 secs Computing kpt #: 194 total cpu time spent up to now is 374.2 secs Computing kpt #: 195 total cpu time spent up to now is 376.1 secs Computing kpt #: 196 total cpu time spent up to now is 378.0 secs Computing kpt #: 197 total cpu time spent up to now is 379.8 secs Computing kpt #: 198 total cpu time spent up to now is 381.7 secs Computing kpt #: 199 total cpu time spent up to now is 383.7 secs Computing kpt #: 200 total cpu time spent up to now is 385.5 secs Computing kpt #: 201 total cpu time spent up to now is 387.4 secs Computing kpt #: 202 total cpu time spent up to now is 389.3 secs Computing kpt #: 203 total cpu time spent up to now is 391.2 secs Computing kpt #: 204 total cpu time spent up to now is 393.1 secs Computing kpt #: 205 total cpu time spent up to now is 395.0 secs Computing kpt #: 206 total cpu time spent up to now is 396.9 secs Computing kpt #: 207 total cpu time spent up to now is 398.8 secs Computing kpt #: 208 total cpu time spent up to now is 400.7 secs Computing kpt #: 209 total cpu time spent up to now is 402.6 secs Computing kpt #: 210 total cpu time spent up to now is 404.5 secs Computing kpt #: 211 total cpu time spent up to now is 406.4 secs Computing kpt #: 212 total cpu time spent up to now is 408.3 secs Computing kpt #: 213 total cpu time spent up to now is 410.2 secs Computing kpt #: 214 total cpu time spent up to now is 412.1 secs Computing kpt #: 215 total cpu time spent up to now is 413.9 secs Computing kpt #: 216 total cpu time spent up to now is 415.8 secs Computing kpt #: 217 total cpu time spent up to now is 417.7 secs Computing kpt #: 218 total cpu time spent up to now is 419.6 secs Computing kpt #: 219 total cpu time spent up to now is 421.5 secs Computing kpt #: 220 total cpu time spent up to now is 423.3 secs Computing kpt #: 221 total cpu time spent up to now is 425.2 secs Computing kpt #: 222 total cpu time spent up to now is 427.1 secs Computing kpt #: 223 total cpu time spent up to now is 429.1 secs Computing kpt #: 224 total cpu time spent up to now is 431.0 secs Computing kpt #: 225 total cpu time spent up to now is 432.9 secs Computing kpt #: 226 total cpu time spent up to now is 434.7 secs Computing kpt #: 227 total cpu time spent up to now is 436.9 secs Computing kpt #: 228 total cpu time spent up to now is 439.0 secs Computing kpt #: 229 total cpu time spent up to now is 440.9 secs Computing kpt #: 230 total cpu time spent up to now is 442.8 secs Computing kpt #: 231 total cpu time spent up to now is 444.7 secs Computing kpt #: 232 total cpu time spent up to now is 446.7 secs Computing kpt #: 233 total cpu time spent up to now is 448.5 secs Computing kpt #: 234 total cpu time spent up to now is 450.5 secs Computing kpt #: 235 total cpu time spent up to now is 452.3 secs Computing kpt #: 236 total cpu time spent up to now is 454.2 secs Computing kpt #: 237 total cpu time spent up to now is 456.2 secs Computing kpt #: 238 total cpu time spent up to now is 458.1 secs Computing kpt #: 239 total cpu time spent up to now is 459.9 secs Computing kpt #: 240 total cpu time spent up to now is 461.8 secs Computing kpt #: 241 total cpu time spent up to now is 463.7 secs Computing kpt #: 242 total cpu time spent up to now is 465.5 secs Computing kpt #: 243 total cpu time spent up to now is 467.4 secs Computing kpt #: 244 total cpu time spent up to now is 469.3 secs Computing kpt #: 245 total cpu time spent up to now is 471.1 secs Computing kpt #: 246 total cpu time spent up to now is 472.9 secs Computing kpt #: 247 total cpu time spent up to now is 474.9 secs Computing kpt #: 248 total cpu time spent up to now is 477.0 secs Computing kpt #: 249 total cpu time spent up to now is 478.9 secs Computing kpt #: 250 total cpu time spent up to now is 480.9 secs Computing kpt #: 251 total cpu time spent up to now is 482.8 secs Computing kpt #: 252 total cpu time spent up to now is 484.7 secs Computing kpt #: 253 total cpu time spent up to now is 486.7 secs Computing kpt #: 254 total cpu time spent up to now is 488.6 secs Computing kpt #: 255 total cpu time spent up to now is 490.5 secs Computing kpt #: 256 total cpu time spent up to now is 492.5 secs Computing kpt #: 257 total cpu time spent up to now is 494.4 secs Computing kpt #: 258 total cpu time spent up to now is 496.4 secs Computing kpt #: 259 total cpu time spent up to now is 498.3 secs Computing kpt #: 260 total cpu time spent up to now is 500.3 secs Computing kpt #: 261 total cpu time spent up to now is 502.2 secs Computing kpt #: 262 total cpu time spent up to now is 504.2 secs Computing kpt #: 263 total cpu time spent up to now is 506.1 secs Computing kpt #: 264 total cpu time spent up to now is 508.0 secs Computing kpt #: 265 total cpu time spent up to now is 510.0 secs Computing kpt #: 266 total cpu time spent up to now is 511.9 secs Computing kpt #: 267 total cpu time spent up to now is 513.8 secs Computing kpt #: 268 total cpu time spent up to now is 515.8 secs Computing kpt #: 269 total cpu time spent up to now is 517.7 secs Computing kpt #: 270 total cpu time spent up to now is 519.7 secs Computing kpt #: 271 total cpu time spent up to now is 521.6 secs Computing kpt #: 272 total cpu time spent up to now is 523.6 secs Computing kpt #: 273 total cpu time spent up to now is 525.5 secs Computing kpt #: 274 total cpu time spent up to now is 527.4 secs Computing kpt #: 275 total cpu time spent up to now is 529.3 secs Computing kpt #: 276 total cpu time spent up to now is 531.2 secs Computing kpt #: 277 total cpu time spent up to now is 533.1 secs Computing kpt #: 278 total cpu time spent up to now is 535.1 secs Computing kpt #: 279 total cpu time spent up to now is 537.0 secs Computing kpt #: 280 total cpu time spent up to now is 538.9 secs Computing kpt #: 281 total cpu time spent up to now is 540.8 secs Computing kpt #: 282 total cpu time spent up to now is 542.7 secs Computing kpt #: 283 total cpu time spent up to now is 544.6 secs Computing kpt #: 284 total cpu time spent up to now is 546.5 secs Computing kpt #: 285 total cpu time spent up to now is 548.4 secs Computing kpt #: 286 total cpu time spent up to now is 550.3 secs ethr = 1.25E-08, avg # of iterations = 18.0 total cpu time spent up to now is 550.3 secs End of band structure calculation k = 0.0000-0.4307-0.1119 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4513 -15.4513 -14.5252 -14.5252 -12.8134 -12.8134 -12.3875 -12.3875 -12.0746 -12.0746 -12.0347 -12.0347 -11.5741 -11.5741 -3.4823 -3.4823 -1.4414 -1.4414 -0.8712 -0.8712 0.0824 0.0824 0.5242 0.5242 0.7028 0.7028 0.9032 0.9032 1.5660 1.5660 2.1577 2.1577 2.3968 2.3968 2.5446 2.5446 2.7744 2.7744 2.9988 2.9988 3.1546 3.1546 3.6671 3.6671 3.9620 3.9620 4.3091 4.3091 4.5044 4.5044 4.9531 4.9531 5.2915 5.2915 5.4847 5.4847 6.3241 6.3241 6.3901 6.3901 6.5635 6.5635 6.9304 6.9304 7.0203 7.0203 7.1134 7.1134 7.2296 7.2296 7.4669 7.4669 7.6312 7.6312 8.3115 8.3115 11.9910 11.9910 12.6586 12.6586 13.8242 13.8242 14.9071 14.9071 15.2943 15.2943 15.6643 15.6643 k = 0.0000-0.4172-0.1084 ( 9670 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4518 -15.4518 -14.5245 -14.5244 -12.8138 -12.8137 -12.3875 -12.3872 -12.0746 -12.0745 -12.0350 -12.0348 -11.5740 -11.5739 -3.4817 -3.4817 -1.4443 -1.4442 -0.8692 -0.8691 0.0820 0.0822 0.5226 0.5236 0.7016 0.7030 0.9049 0.9054 1.5631 1.5636 2.1582 2.1591 2.3980 2.3986 2.5454 2.5458 2.7727 2.7729 2.9976 3.0001 3.1549 3.1567 3.6664 3.6669 3.9606 3.9621 4.3079 4.3097 4.5068 4.5077 4.9533 4.9544 5.2910 5.2915 5.4838 5.4851 6.3211 6.3269 6.3872 6.3930 6.5618 6.5653 6.9281 6.9324 7.0169 7.0232 7.1113 7.1164 7.2287 7.2309 7.4657 7.4672 7.6298 7.6317 8.3105 8.3114 11.9844 11.9849 12.6619 12.6624 13.8250 13.8257 14.9080 14.9085 15.2906 15.2912 15.6654 15.6663 k = 0.0000-0.4037-0.1049 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4533 -15.4533 -14.5221 -14.5220 -12.8149 -12.8147 -12.3870 -12.3866 -12.0747 -12.0745 -12.0357 -12.0353 -11.5737 -11.5735 -3.4801 -3.4800 -1.4528 -1.4526 -0.8633 -0.8631 0.0808 0.0812 0.5189 0.5210 0.6993 0.7020 0.9105 0.9114 1.5550 1.5560 2.1604 2.1621 2.4020 2.4033 2.5482 2.5491 2.7680 2.7685 2.9964 3.0012 3.1577 3.1611 3.6649 3.6660 3.9581 3.9610 4.3062 4.3098 4.5147 4.5165 4.9549 4.9572 5.2899 5.2909 5.4826 5.4851 6.3180 6.3295 6.3845 6.3959 6.5602 6.5670 6.9256 6.9343 7.0131 7.0253 7.1096 7.1197 7.2279 7.2324 7.4636 7.4665 7.6275 7.6312 8.3085 8.3104 11.9657 11.9667 12.6719 12.6728 13.8281 13.8297 14.9111 14.9120 15.2805 15.2818 15.6690 15.6709 k = 0.0000-0.3903-0.1014 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4557 -15.4557 -14.5182 -14.5181 -12.8167 -12.8164 -12.3862 -12.3856 -12.0747 -12.0745 -12.0368 -12.0362 -11.5731 -11.5728 -3.4772 -3.4772 -1.4665 -1.4661 -0.8538 -0.8535 0.0789 0.0795 0.5137 0.5166 0.6963 0.7000 0.9195 0.9206 1.5424 1.5438 2.1639 2.1663 2.4087 2.4105 2.5531 2.5545 2.7607 2.7613 2.9951 3.0018 3.1629 3.1676 3.6628 3.6643 3.9546 3.9588 4.3046 4.3095 4.5277 4.5300 4.9581 4.9614 5.2882 5.2897 5.4810 5.4848 6.3148 6.3318 6.3821 6.3988 6.5587 6.5689 6.9229 6.9359 7.0091 7.0267 7.1084 7.1229 7.2274 7.2341 7.4605 7.4650 7.6243 7.6298 8.3056 8.3084 11.9361 11.9375 12.6874 12.6887 13.8335 13.8358 14.9164 14.9178 15.2651 15.2669 15.6743 15.6770 k = 0.0000-0.3768-0.0979 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4591 -15.4590 -14.5129 -14.5127 -12.8191 -12.8187 -12.3851 -12.3843 -12.0748 -12.0745 -12.0383 -12.0375 -11.5723 -11.5719 -3.4733 -3.4732 -1.4848 -1.4844 -0.8413 -0.8409 0.0763 0.0771 0.5071 0.5108 0.6927 0.6972 0.9313 0.9326 1.5257 1.5276 2.1681 2.1712 2.4173 2.4197 2.5605 2.5623 2.7513 2.7520 2.9938 3.0019 3.1703 3.1760 3.6603 3.6622 3.9503 3.9554 4.3033 4.3092 4.5451 4.5478 4.9626 4.9671 5.2860 5.2880 5.4790 5.4841 6.3116 6.3337 6.3800 6.4015 6.5572 6.5707 6.9197 6.9369 7.0051 7.0273 7.1080 7.1265 7.2271 7.2360 7.4564 7.4624 7.6203 7.6277 8.3016 8.3053 11.8974 11.8992 12.7069 12.7085 13.8411 13.8441 14.9238 14.9257 15.2457 15.2478 15.6798 15.6833 k = 0.0000-0.3634-0.0944 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4633 -15.4632 -14.5061 -14.5059 -12.8222 -12.8217 -12.3836 -12.3826 -12.0749 -12.0746 -12.0401 -12.0391 -11.5713 -11.5708 -3.4683 -3.4682 -1.5071 -1.5066 -0.8264 -0.8258 0.0730 0.0740 0.4999 0.5041 0.6886 0.6936 0.9450 0.9464 1.5060 1.5083 2.1726 2.1762 2.4272 2.4300 2.5707 2.5729 2.7403 2.7411 2.9922 3.0013 3.1795 3.1858 3.6579 3.6601 3.9452 3.9511 4.3027 4.3093 4.5662 4.5691 4.9684 4.9740 5.2832 5.2858 5.4767 5.4830 6.3084 6.3350 6.3783 6.4042 6.5559 6.5725 6.9162 6.9374 7.0012 7.0272 7.1080 7.1299 7.2270 7.2380 7.4513 7.4589 7.6153 7.6246 8.2968 8.3013 11.8514 11.8535 12.7287 12.7306 13.8505 13.8542 14.9334 14.9358 15.2234 15.2260 15.6844 15.6886 k = 0.0000-0.3499-0.0909 ( 9673 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4683 -15.4682 -14.4979 -14.4978 -12.8259 -12.8253 -12.3818 -12.3806 -12.0751 -12.0747 -12.0421 -12.0410 -11.5700 -11.5695 -3.4622 -3.4621 -1.5327 -1.5321 -0.8096 -0.8090 0.0690 0.0701 0.4924 0.4970 0.6842 0.6895 0.9602 0.9615 1.4838 1.4865 2.1769 2.1809 2.4372 2.4403 2.5838 2.5864 2.7282 2.7292 2.9904 3.0001 3.1901 3.1967 3.6558 3.6582 3.9397 3.9460 4.3031 4.3100 4.5902 4.5931 4.9754 4.9821 5.2801 5.2831 5.4742 5.4817 6.3051 6.3356 6.3773 6.4067 6.5546 6.5743 6.9121 6.9371 6.9979 7.0265 7.1085 7.1332 7.2273 7.2403 7.4452 7.4545 7.6096 7.6207 8.2908 8.2962 11.7995 11.8019 12.7517 12.7538 13.8616 13.8660 14.9450 14.9479 15.1995 15.2024 15.6872 15.6921 k = 0.0000-0.3364-0.0874 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4740 -15.4739 -14.4886 -14.4884 -12.8302 -12.8296 -12.3796 -12.3783 -12.0755 -12.0751 -12.0443 -12.0431 -11.5686 -11.5680 -3.4551 -3.4549 -1.5611 -1.5605 -0.7915 -0.7909 0.0643 0.0656 0.4851 0.4900 0.6795 0.6849 0.9760 0.9773 1.4601 1.4632 2.1809 2.1852 2.4464 2.4499 2.5999 2.6027 2.7158 2.7171 2.9886 2.9985 3.2016 3.2082 3.6545 3.6569 3.9339 3.9404 4.3044 4.3115 4.6166 4.6195 4.9835 4.9913 5.2765 5.2799 5.4715 5.4802 6.3019 6.3354 6.3769 6.4091 6.5534 6.5761 6.9078 6.9360 6.9955 7.0255 7.1095 7.1366 7.2278 7.2426 7.4381 7.4493 7.6033 7.6163 8.2846 8.2908 11.7431 11.7458 12.7748 12.7771 13.8742 13.8792 14.9585 14.9618 15.1748 15.1780 15.6878 15.6933 k = 0.0000-0.3230-0.0839 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4803 -15.4802 -14.4781 -14.4779 -12.8350 -12.8343 -12.3772 -12.3757 -12.0761 -12.0756 -12.0466 -12.0452 -11.5670 -11.5663 -3.4470 -3.4468 -1.5918 -1.5911 -0.7727 -0.7720 0.0591 0.0605 0.4783 0.4834 0.6745 0.6799 0.9918 0.9930 1.4356 1.4389 2.1843 2.1888 2.4542 2.4578 2.6182 2.6211 2.7038 2.7055 2.9869 2.9969 3.2136 3.2201 3.6544 3.6568 3.9280 3.9345 4.3067 4.3138 4.6447 4.6476 4.9925 5.0015 5.2726 5.2765 5.4688 5.4786 6.2986 6.3345 6.3772 6.4113 6.5523 6.5778 6.9029 6.9336 6.9941 7.0242 7.1108 7.1399 7.2285 7.2450 7.4300 7.4431 7.5963 7.6112 8.2773 8.2843 11.6834 11.6862 12.7973 12.7998 13.8879 13.8935 14.9736 14.9773 15.1503 15.1536 15.6861 15.6923 k = 0.0000-0.3095-0.0804 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4871 -15.4871 -14.4667 -14.4664 -12.8404 -12.8397 -12.3745 -12.3729 -12.0771 -12.0766 -12.0488 -12.0474 -11.5652 -11.5645 -3.4379 -3.4376 -1.6242 -1.6235 -0.7534 -0.7527 0.0534 0.0548 0.4722 0.4774 0.6693 0.6747 1.0072 1.0083 1.4107 1.4145 2.1873 2.1919 2.4600 2.4637 2.6365 2.6395 2.6939 2.6962 2.9858 2.9957 3.2255 3.2319 3.6557 3.6580 3.9222 3.9286 4.3100 4.3171 4.6741 4.6769 5.0023 5.0123 5.2685 5.2728 5.4661 5.4770 6.2954 6.3328 6.3781 6.4133 6.5513 6.5795 6.8975 6.9299 6.9937 7.0226 7.1121 7.1429 7.2293 7.2473 7.4209 7.4360 7.5890 7.6057 8.2696 8.2772 11.6211 11.6241 12.8188 12.8214 13.9024 13.9086 14.9899 14.9941 15.1265 15.1299 15.6825 15.6893 k = 0.0000-0.2961-0.0769 ( 9663 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4944 -15.4943 -14.4544 -14.4541 -12.8463 -12.8455 -12.3715 -12.3697 -12.0785 -12.0780 -12.0508 -12.0494 -11.5633 -11.5625 -3.4279 -3.4276 -1.6580 -1.6573 -0.7341 -0.7334 0.0473 0.0489 0.4669 0.4721 0.6640 0.6692 1.0215 1.0225 1.3862 1.3903 2.1899 2.1945 2.4639 2.4676 2.6487 2.6524 2.6910 2.6946 2.9858 2.9956 3.2372 3.2433 3.6587 3.6609 3.9166 3.9228 4.3143 4.3211 4.7043 4.7071 5.0128 5.0238 5.2643 5.2689 5.4635 5.4754 6.2922 6.3304 6.3795 6.4151 6.5504 6.5810 6.8916 6.9252 6.9944 7.0211 7.1136 7.1459 7.2305 7.2498 7.4108 7.4280 7.5811 7.5996 8.2615 8.2697 11.5571 11.5602 12.8390 12.8417 13.9175 13.9242 15.0066 15.0113 15.1046 15.1078 15.6775 15.6848 k = 0.0000-0.2826-0.0734 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5020 -15.5019 -14.4413 -14.4410 -12.8525 -12.8517 -12.3683 -12.3664 -12.0804 -12.0799 -12.0525 -12.0511 -11.5613 -11.5605 -3.4170 -3.4167 -1.6929 -1.6921 -0.7151 -0.7143 0.0411 0.0427 0.4625 0.4677 0.6587 0.6637 1.0344 1.0352 1.3625 1.3670 2.1920 2.1966 2.4658 2.4695 2.6482 2.6525 2.7015 2.7058 2.9877 2.9973 3.2482 3.2542 3.6636 3.6657 3.9115 3.9173 4.3193 4.3260 4.7349 4.7377 5.0238 5.0357 5.2601 5.2650 5.4611 5.4739 6.2890 6.3277 6.3811 6.4167 6.5495 6.5825 6.8853 6.9194 6.9957 7.0196 7.1149 7.1487 7.2316 7.2518 7.3998 7.4191 7.5728 7.5931 8.2528 8.2616 11.4919 11.4951 12.8576 12.8604 13.9328 13.9399 15.0218 15.0269 15.0865 15.0892 15.6717 15.6795 k = 0.0000-0.2692-0.0699 ( 9662 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5098 -15.5098 -14.4276 -14.4273 -12.8592 -12.8584 -12.3649 -12.3629 -12.0829 -12.0824 -12.0538 -12.0524 -11.5592 -11.5584 -3.4053 -3.4049 -1.7285 -1.7277 -0.6964 -0.6956 0.0349 0.0365 0.4589 0.4639 0.6534 0.6582 1.0452 1.0459 1.3401 1.3451 2.1939 2.1984 2.4659 2.4697 2.6407 2.6453 2.7185 2.7229 2.9922 3.0015 3.2585 3.2644 3.6703 3.6724 3.9069 3.9124 4.3250 4.3315 4.7654 4.7683 5.0351 5.0479 5.2561 5.2613 5.4591 5.4727 6.2859 6.3245 6.3830 6.4182 6.5488 6.5839 6.8787 6.9129 6.9977 7.0183 7.1163 7.1514 7.2331 7.2540 7.3880 7.4094 7.5644 7.5865 8.2438 8.2531 11.4262 11.4295 12.8746 12.8775 13.9482 13.9555 15.0294 15.0345 15.0784 15.0798 15.6657 15.6740 k = 0.0000-0.2557-0.0664 ( 9659 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5178 -15.5177 -14.4135 -14.4132 -12.8662 -12.8654 -12.3612 -12.3591 -12.0860 -12.0855 -12.0546 -12.0534 -11.5571 -11.5562 -3.3928 -3.3925 -1.7646 -1.7638 -0.6785 -0.6776 0.0289 0.0305 0.4558 0.4607 0.6485 0.6529 1.0534 1.0542 1.3196 1.3251 2.1955 2.1999 2.4644 2.4683 2.6317 2.6366 2.7350 2.7394 3.0001 3.0092 3.2681 3.2739 3.6787 3.6808 3.9032 3.9083 4.3314 4.3377 4.7954 4.7985 5.0468 5.0603 5.2524 5.2578 5.4574 5.4719 6.2827 6.3211 6.3849 6.4194 6.5482 6.5851 6.8717 6.9057 7.0000 7.0170 7.1177 7.1543 7.2345 7.2557 7.3754 7.3989 7.5559 7.5796 8.2346 8.2442 11.3605 11.3638 12.8900 12.8929 13.9633 13.9709 15.0228 15.0278 15.0847 15.0880 15.6603 15.6690 k = 0.0000-0.2422-0.0629 ( 9657 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5259 -15.5258 -14.3990 -14.3987 -12.8735 -12.8727 -12.3574 -12.3552 -12.0897 -12.0891 -12.0551 -12.0540 -11.5550 -11.5541 -3.3796 -3.3793 -1.8009 -1.8001 -0.6613 -0.6605 0.0233 0.0250 0.4532 0.4578 0.6439 0.6480 1.0585 1.0597 1.3014 1.3074 2.1969 2.2011 2.4618 2.4658 2.6226 2.6277 2.7484 2.7528 3.0120 3.0208 3.2769 3.2827 3.6887 3.6908 3.9003 3.9050 4.3383 4.3444 4.8244 4.8277 5.0587 5.0728 5.2493 5.2548 5.4563 5.4714 6.2795 6.3175 6.3867 6.4204 6.5477 6.5863 6.8644 6.8981 7.0021 7.0160 7.1190 7.1570 7.2360 7.2569 7.3621 7.3877 7.5473 7.5725 8.2254 8.2353 11.2952 11.2985 12.9038 12.9068 13.9779 13.9856 15.0094 15.0144 15.0993 15.1039 15.6560 15.6652 k = 0.0000-0.2288-0.0594 ( 9660 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5340 -15.5339 -14.3843 -14.3840 -12.8810 -12.8802 -12.3534 -12.3512 -12.0939 -12.0931 -12.0552 -12.0543 -11.5528 -11.5519 -3.3659 -3.3655 -1.8372 -1.8364 -0.6451 -0.6443 0.0183 0.0200 0.4506 0.4550 0.6400 0.6437 1.0604 1.0619 1.2859 1.2924 2.1982 2.2022 2.4582 2.4625 2.6137 2.6191 2.7576 2.7622 3.0279 3.0364 3.2851 3.2910 3.6998 3.7020 3.8986 3.9029 4.3456 4.3515 4.8518 4.8555 5.0710 5.0853 5.2470 5.2525 5.4558 5.4715 6.2763 6.3138 6.3885 6.4212 6.5473 6.5873 6.8570 6.8900 7.0040 7.0152 7.1203 7.1595 7.2376 7.2578 7.3483 7.3758 7.5387 7.5652 8.2157 8.2259 11.2307 11.2340 12.9162 12.9191 13.9919 13.9997 14.9954 15.0004 15.1156 15.1208 15.6535 15.6630 k = 0.0000-0.2153-0.0559 ( 9656 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5419 -15.5418 -14.3696 -14.3692 -12.8887 -12.8878 -12.3494 -12.3471 -12.0983 -12.0974 -12.0551 -12.0543 -11.5506 -11.5497 -3.3516 -3.3513 -1.8733 -1.8725 -0.6299 -0.6292 0.0142 0.0159 0.4478 0.4519 0.6371 0.6403 1.0588 1.0609 1.2731 1.2800 2.1995 2.2032 2.4542 2.4587 2.6052 2.6107 2.7629 2.7676 3.0473 3.0555 3.2927 3.2988 3.7119 3.7140 3.8981 3.9020 4.3532 4.3590 4.8771 4.8813 5.0837 5.0979 5.2457 5.2510 5.4560 5.4721 6.2731 6.3100 6.3902 6.4219 6.5472 6.5882 6.8495 6.8818 7.0053 7.0149 7.1216 7.1621 7.2393 7.2580 7.3343 7.3635 7.5303 7.5580 8.2066 8.2168 11.1676 11.1708 12.9271 12.9300 14.0052 14.0130 14.9826 14.9876 15.1311 15.1367 15.6530 15.6628 k = 0.0000-0.2019-0.0524 ( 9657 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5497 -15.5497 -14.3549 -14.3545 -12.8964 -12.8956 -12.3452 -12.3429 -12.1030 -12.1020 -12.0549 -12.0542 -11.5485 -11.5476 -3.3369 -3.3366 -1.9090 -1.9081 -0.6159 -0.6152 0.0110 0.0127 0.4445 0.4482 0.6352 0.6379 1.0541 1.0566 1.2630 1.2703 2.2006 2.2040 2.4501 2.4548 2.5968 2.6025 2.7647 2.7694 3.0693 3.0773 3.3000 3.3063 3.7244 3.7266 3.8989 3.9025 4.3610 4.3666 4.8998 4.9045 5.0970 5.1108 5.2455 5.2505 5.4569 5.4734 6.2698 6.3060 6.3917 6.4223 6.5471 6.5889 6.8419 6.8732 7.0057 7.0149 7.1229 7.1644 7.2408 7.2574 7.3205 7.3512 7.5221 7.5507 8.1975 8.2077 11.1060 11.1092 12.9367 12.9396 14.0176 14.0252 14.9716 14.9765 15.1449 15.1507 15.6549 15.6648 k = 0.0000-0.1884-0.0489 ( 9658 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5573 -15.5572 -14.3404 -14.3400 -12.9042 -12.9034 -12.3409 -12.3386 -12.1079 -12.1067 -12.0546 -12.0539 -11.5464 -11.5456 -3.3220 -3.3216 -1.9439 -1.9431 -0.6031 -0.6024 0.0089 0.0107 0.4404 0.4438 0.6346 0.6369 1.0467 1.0495 1.2552 1.2627 2.2017 2.2048 2.4461 2.4511 2.5886 2.5943 2.7637 2.7684 3.0928 3.1007 3.3070 3.3136 3.7371 3.7392 3.9010 3.9043 4.3689 4.3742 4.9193 4.9245 5.1111 5.1241 5.2464 5.2511 5.4586 5.4754 6.2666 6.3020 6.3930 6.4225 6.5473 6.5895 6.8345 6.8646 7.0054 7.0153 7.1243 7.1665 7.2421 7.2558 7.3071 7.3391 7.5141 7.5434 8.1886 8.1987 11.0465 11.0497 12.9450 12.9479 14.0290 14.0365 14.9625 14.9674 15.1563 15.1623 15.6591 15.6691 k = 0.0000-0.1750-0.0454 ( 9658 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5646 -15.5645 -14.3261 -14.3258 -12.9119 -12.9111 -12.3366 -12.3343 -12.1128 -12.1115 -12.0541 -12.0535 -11.5444 -11.5436 -3.3068 -3.3064 -1.9780 -1.9773 -0.5915 -0.5909 0.0080 0.0097 0.4353 0.4384 0.6353 0.6372 1.0372 1.0403 1.2491 1.2567 2.2029 2.2057 2.4426 2.4478 2.5803 2.5860 2.7606 2.7653 3.1169 3.1247 3.3139 3.3207 3.7498 3.7518 3.9041 3.9074 4.3767 4.3818 4.9354 4.9411 5.1261 5.1381 5.2484 5.2530 5.4612 5.4780 6.2634 6.2979 6.3941 6.4225 6.5476 6.5898 6.8272 6.8560 7.0045 7.0155 7.1259 7.1684 7.2423 7.2536 7.2948 7.3280 7.5063 7.5360 8.1800 8.1898 10.9894 10.9924 12.9523 12.9550 14.0394 14.0466 14.9555 14.9603 15.1652 15.1713 15.6653 15.6753 k = 0.0000-0.1615-0.0419 ( 9659 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5716 -15.5715 -14.3124 -14.3121 -12.9194 -12.9187 -12.3323 -12.3301 -12.1177 -12.1164 -12.0537 -12.0531 -11.5425 -11.5417 -3.2916 -3.2912 -2.0111 -2.0104 -0.5812 -0.5806 0.0083 0.0100 0.4292 0.4321 0.6373 0.6389 1.0263 1.0297 1.2442 1.2518 2.2041 2.2066 2.4398 2.4451 2.5719 2.5776 2.7562 2.7608 3.1408 3.1485 3.3208 3.3278 3.7621 3.7641 3.9083 3.9116 4.3843 4.3893 4.9480 4.9539 5.1419 5.1528 5.2513 5.2561 5.4646 5.4814 6.2603 6.2937 6.3950 6.4223 6.5482 6.5900 6.8202 6.8476 7.0033 7.0153 7.1275 7.1698 7.2393 7.2524 7.2836 7.3183 7.4990 7.5287 8.1718 8.1813 10.9350 10.9379 12.9585 12.9611 14.0488 14.0557 14.9506 14.9554 15.1714 15.1774 15.6731 15.6830 k = 0.0000-0.1480-0.0385 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5782 -15.5781 -14.2992 -14.2989 -12.9268 -12.9260 -12.3281 -12.3258 -12.1226 -12.1212 -12.0532 -12.0527 -11.5407 -11.5399 -3.2765 -3.2761 -2.0428 -2.0421 -0.5721 -0.5715 0.0098 0.0115 0.4221 0.4247 0.6405 0.6419 1.0147 1.0182 1.2400 1.2474 2.2053 2.2076 2.4377 2.4431 2.5635 2.5691 2.7510 2.7554 3.1637 3.1713 3.3277 3.3349 3.7742 3.7762 3.9131 3.9167 4.3916 4.3963 4.9574 4.9634 5.1581 5.1678 5.2550 5.2604 5.4689 5.4855 6.2573 6.2894 6.3958 6.4219 6.5490 6.5899 6.8136 6.8393 7.0020 7.0147 7.1290 7.1706 7.2326 7.2530 7.2735 7.3106 7.4920 7.5215 8.1638 8.1729 10.8837 10.8864 12.9638 12.9663 14.0572 14.0637 14.9477 14.9524 15.1751 15.1811 15.6818 15.6914 k = 0.0000-0.1346-0.0350 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5843 -15.5843 -14.2866 -14.2863 -12.9338 -12.9331 -12.3239 -12.3217 -12.1273 -12.1259 -12.0527 -12.0522 -11.5389 -11.5382 -3.2616 -3.2613 -2.0731 -2.0724 -0.5642 -0.5637 0.0124 0.0141 0.4141 0.4165 0.6447 0.6461 1.0028 1.0064 1.2360 1.2432 2.2067 2.2087 2.4365 2.4419 2.5549 2.5604 2.7452 2.7494 3.1851 3.1926 3.3347 3.3420 3.7860 3.7881 3.9182 3.9222 4.3985 4.4029 4.9640 4.9699 5.1743 5.1828 5.2593 5.2656 5.4740 5.4902 6.2544 6.2851 6.3964 6.4211 6.5501 6.5896 6.8074 6.8312 7.0007 7.0137 7.1303 7.1705 7.2243 7.2541 7.2646 7.3050 7.4855 7.5143 8.1562 8.1648 10.8357 10.8382 12.9683 12.9706 14.0646 14.0706 14.9468 14.9513 15.1766 15.1823 15.6908 15.6999 k = 0.0000-0.1211-0.0315 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5900 -15.5899 -14.2749 -14.2746 -12.9405 -12.9398 -12.3198 -12.3178 -12.1319 -12.1305 -12.0522 -12.0518 -11.5373 -11.5367 -3.2472 -3.2469 -2.1015 -2.1009 -0.5574 -0.5569 0.0160 0.0177 0.4054 0.4077 0.6498 0.6512 0.9912 0.9948 1.2322 1.2390 2.2082 2.2099 2.4361 2.4415 2.5463 2.5516 2.7393 2.7432 3.2046 3.2119 3.3419 3.3491 3.7974 3.7997 3.9234 3.9278 4.4049 4.4089 4.9685 4.9741 5.1898 5.1972 5.2642 5.2714 5.4799 5.4954 6.2518 6.2808 6.3969 6.4201 6.5514 6.5889 6.8017 6.8236 6.9992 7.0123 7.1312 7.1692 7.2163 7.2517 7.2601 7.3010 7.4796 7.5074 8.1495 8.1576 10.7913 10.7937 12.9720 12.9742 14.0710 14.0765 14.9475 14.9519 15.1761 15.1817 15.6991 15.7078 k = 0.0000-0.1077-0.0280 ( 9670 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5952 -15.5951 -14.2640 -14.2638 -12.9467 -12.9461 -12.3159 -12.3140 -12.1362 -12.1349 -12.0517 -12.0514 -11.5359 -11.5353 -3.2335 -3.2332 -2.1280 -2.1274 -0.5517 -0.5512 0.0205 0.0221 0.3963 0.3984 0.6555 0.6570 0.9801 0.9836 1.2284 1.2347 2.2097 2.2113 2.4364 2.4418 2.5378 2.5429 2.7335 2.7371 3.2219 3.2289 3.3491 3.3562 3.8087 3.8113 3.9283 3.9329 4.4106 4.4142 4.9714 4.9765 5.2039 5.2103 5.2698 5.2778 5.4863 5.5010 6.2494 6.2764 6.3973 6.4188 6.5529 6.5880 6.7966 6.8164 6.9978 7.0104 7.1316 7.1661 7.2098 7.2447 7.2612 7.2980 7.4741 7.5004 8.1433 8.1507 10.7509 10.7530 12.9751 12.9771 14.0765 14.0815 14.9498 14.9540 15.1740 15.1793 15.7065 15.7144 k = 0.0000-0.0942-0.0245 ( 9671 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5998 -15.5998 -14.2542 -14.2540 -12.9524 -12.9519 -12.3123 -12.3104 -12.1403 -12.1390 -12.0512 -12.0510 -11.5346 -11.5341 -3.2206 -3.2203 -2.1521 -2.1516 -0.5470 -0.5465 0.0256 0.0271 0.3871 0.3891 0.6615 0.6630 0.9697 0.9731 1.2246 1.2304 2.2114 2.2127 2.4376 2.4428 2.5293 2.5343 2.7279 2.7312 3.2370 3.2434 3.3564 3.3630 3.8199 3.8226 3.9325 3.9373 4.4156 4.4189 4.9732 4.9778 5.2163 5.2218 5.2759 5.2843 5.4932 5.5067 6.2475 6.2721 6.3977 6.4173 6.5546 6.5867 6.7923 6.8098 6.9965 7.0084 7.1313 7.1613 7.2057 7.2378 7.2636 7.2959 7.4696 7.4940 8.1374 8.1440 10.7146 10.7165 12.9777 12.9794 14.0812 14.0856 14.9534 14.9573 15.1708 15.1758 15.7123 15.7195 k = 0.0000-0.0807-0.0210 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6039 -15.6038 -14.2455 -14.2453 -12.9575 -12.9570 -12.3089 -12.3072 -12.1440 -12.1428 -12.0508 -12.0506 -11.5334 -11.5330 -3.2088 -3.2085 -2.1738 -2.1733 -0.5431 -0.5427 0.0310 0.0324 0.3781 0.3799 0.6675 0.6690 0.9604 0.9636 1.2209 1.2261 2.2131 2.2142 2.4393 2.4444 2.5211 2.5259 2.7229 2.7257 3.2496 3.2555 3.3635 3.3695 3.8308 3.8337 3.9359 3.9408 4.4199 4.4227 4.9744 4.9783 5.2266 5.2314 5.2824 5.2908 5.5002 5.5123 6.2460 6.2679 6.3982 6.4156 6.5566 6.5851 6.7887 6.8039 6.9954 7.0061 7.1305 7.1553 7.2039 7.2320 7.2663 7.2943 7.4658 7.4879 8.1325 8.1383 10.6827 10.6843 12.9797 12.9813 14.0851 14.0889 14.9578 14.9615 15.1668 15.1714 15.7167 15.7230 k = 0.0000-0.0673-0.0175 ( 9664 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6073 -15.6073 -14.2379 -14.2377 -12.9619 -12.9615 -12.3058 -12.3044 -12.1472 -12.1462 -12.0505 -12.0503 -11.5324 -11.5320 -3.1982 -3.1980 -2.1927 -2.1923 -0.5400 -0.5396 0.0365 0.0377 0.3696 0.3712 0.6733 0.6747 0.9523 0.9551 1.2175 1.2219 2.2147 2.2157 2.4416 2.4465 2.5134 2.5179 2.7184 2.7208 3.2601 3.2651 3.3702 3.3754 3.8413 3.8442 3.9384 3.9430 4.4234 4.4258 4.9751 4.9784 5.2349 5.2389 5.2891 5.2968 5.5071 5.5176 6.2449 6.2638 6.3988 6.4137 6.5587 6.5833 6.7858 6.7985 6.9944 7.0038 7.1292 7.1488 7.2036 7.2272 7.2693 7.2928 7.4629 7.4822 8.1283 8.1332 10.6554 10.6568 12.9814 12.9827 14.0883 14.0915 14.9629 14.9661 15.1624 15.1665 15.7197 15.7250 k = 0.0000-0.0538-0.0140 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6102 -15.6102 -14.2316 -14.2315 -12.9656 -12.9653 -12.3032 -12.3020 -12.1500 -12.1491 -12.0502 -12.0500 -11.5316 -11.5313 -3.1893 -3.1891 -2.2085 -2.2082 -0.5376 -0.5373 0.0417 0.0428 0.3621 0.3634 0.6785 0.6797 0.9455 0.9479 1.2144 1.2181 2.2163 2.2171 2.4444 2.4489 2.5062 2.5104 2.7146 2.7166 3.2684 3.2725 3.3762 3.3805 3.8510 3.8539 3.9398 3.9441 4.4262 4.4282 4.9755 4.9782 5.2414 5.2445 5.2954 5.3020 5.5136 5.5222 6.2444 6.2600 6.3994 6.4117 6.5609 6.5811 6.7836 6.7939 6.9936 7.0015 7.1276 7.1425 7.2044 7.2232 7.2720 7.2910 7.4608 7.4768 8.1249 8.1289 10.6328 10.6339 12.9827 12.9837 14.0909 14.0935 14.9680 14.9708 15.1580 15.1615 15.7214 15.7257 k = 0.0000-0.0404-0.0105 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6125 -15.6124 -14.2266 -14.2265 -12.9685 -12.9683 -12.3010 -12.3000 -12.1522 -12.1515 -12.0499 -12.0498 -11.5309 -11.5307 -3.1820 -3.1819 -2.2211 -2.2209 -0.5357 -0.5355 0.0462 0.0471 0.3558 0.3568 0.6830 0.6840 0.9401 0.9420 1.2120 1.2149 2.2176 2.2182 2.4473 2.4513 2.5000 2.5037 2.7116 2.7131 3.2748 3.2778 3.3813 3.3846 3.8597 3.8622 3.9405 3.9442 4.4284 4.4299 4.9759 4.9780 5.2462 5.2485 5.3010 5.3062 5.5193 5.5259 6.2444 6.2564 6.4003 6.4097 6.5633 6.5788 6.7822 6.7899 6.9932 6.9993 7.1263 7.1370 7.2058 7.2199 7.2749 7.2894 7.4596 7.4720 8.1223 8.1254 10.6151 10.6160 12.9836 12.9844 14.0929 14.0948 14.9729 14.9751 15.1540 15.1568 15.7225 15.7257 k = 0.0000-0.0269-0.0070 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6141 -15.6141 -14.2230 -14.2229 -12.9706 -12.9705 -12.2993 -12.2987 -12.1537 -12.1533 -12.0498 -12.0497 -11.5304 -11.5303 -3.1767 -3.1766 -2.2303 -2.2301 -0.5345 -0.5344 0.0498 0.0504 0.3510 0.3518 0.6864 0.6871 0.9363 0.9377 1.2103 1.2122 2.2187 2.2191 2.4503 2.4534 2.4952 2.4981 2.7095 2.7105 3.2793 3.2814 3.3853 3.3875 3.8668 3.8688 3.9407 3.9435 4.4300 4.4310 4.9763 4.9776 5.2496 5.2511 5.3055 5.3090 5.5239 5.5284 6.2451 6.2532 6.4014 6.4077 6.5658 6.5763 6.7817 6.7868 6.9933 6.9974 7.1256 7.1325 7.2078 7.2172 7.2777 7.2874 7.4592 7.4677 8.1207 8.1227 10.6024 10.6030 12.9843 12.9849 14.0944 14.0957 14.9769 14.9785 15.1510 15.1529 15.7230 15.7252 k = 0.0000-0.0135-0.0035 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6150 -15.6150 -14.2208 -14.2208 -12.9719 -12.9718 -12.2982 -12.2979 -12.1546 -12.1544 -12.0496 -12.0496 -11.5301 -11.5300 -3.1734 -3.1734 -2.2358 -2.2357 -0.5337 -0.5337 0.0522 0.0525 0.3481 0.3485 0.6886 0.6890 0.9341 0.9348 1.2094 1.2104 2.2194 2.2196 2.4529 2.4547 2.4922 2.4939 2.7083 2.7089 3.2822 3.2832 3.3880 3.3891 3.8717 3.8728 3.9409 3.9424 4.4310 4.4315 4.9766 4.9773 5.2517 5.2525 5.3086 5.3104 5.5273 5.5296 6.2463 6.2504 6.4027 6.4059 6.5684 6.5737 6.7818 6.7844 6.9936 6.9957 7.1256 7.1290 7.2099 7.2146 7.2803 7.2852 7.4602 7.4645 8.1197 8.1207 10.5949 10.5952 12.9848 12.9851 14.0954 14.0961 14.9798 14.9806 15.1492 15.1502 15.7235 15.7246 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 k = 0.0135 0.0024 0.0031 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6151 -15.6151 -14.2202 -14.2201 -12.9722 -12.9722 -12.2980 -12.2979 -12.1549 -12.1549 -12.0500 -12.0499 -11.5301 -11.5299 -3.1727 -3.1726 -2.2361 -2.2361 -0.5350 -0.5346 0.0544 0.0545 0.3464 0.3467 0.6896 0.6899 0.9343 0.9346 1.2091 1.2093 2.2172 2.2179 2.4516 2.4547 2.4930 2.4950 2.7088 2.7097 3.2793 3.2814 3.3902 3.3924 3.8726 3.8735 3.9406 3.9425 4.4301 4.4311 4.9768 4.9782 5.2515 5.2527 5.3100 5.3110 5.5280 5.5286 6.2465 6.2499 6.4011 6.4075 6.5688 6.5732 6.7804 6.7854 6.9926 6.9959 7.1266 7.1284 7.2086 7.2163 7.2820 7.2839 7.4611 7.4636 8.1204 8.1212 10.5949 10.5950 12.9845 12.9850 14.0940 14.0949 14.9815 14.9823 15.1502 15.1505 15.7243 15.7245 k = 0.0270 0.0048 0.0062 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6143 -15.6143 -14.2203 -14.2203 -12.9719 -12.9718 -12.2987 -12.2985 -12.1551 -12.1550 -12.0511 -12.0508 -11.5301 -11.5298 -3.1738 -3.1737 -2.2314 -2.2314 -0.5391 -0.5383 0.0583 0.0585 0.3442 0.3448 0.6902 0.6909 0.9365 0.9371 1.2082 1.2087 2.2108 2.2120 2.4468 2.4519 2.4987 2.5017 2.7117 2.7135 3.2699 3.2735 3.3949 3.3987 3.8702 3.8719 3.9400 3.9435 4.4269 4.4290 4.9778 4.9804 5.2494 5.2517 5.3103 5.3122 5.5251 5.5262 6.2451 6.2519 6.3981 6.4110 6.5663 6.5752 6.7784 6.7883 6.9917 6.9982 7.1276 7.1313 7.2058 7.2211 7.2809 7.2847 7.4606 7.4656 8.1229 8.1244 10.6024 10.6026 12.9832 12.9843 14.0890 14.0908 14.9837 14.9852 15.1545 15.1550 15.7254 15.7259 k = 0.0405 0.0073 0.0093 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6130 -15.6130 -14.2206 -14.2205 -12.9714 -12.9712 -12.2999 -12.2996 -12.1554 -12.1552 -12.0528 -12.0524 -11.5301 -11.5298 -3.1756 -3.1755 -2.2236 -2.2236 -0.5457 -0.5445 0.0646 0.0649 0.3405 0.3415 0.6913 0.6924 0.9401 0.9410 1.2069 1.2077 2.2010 2.2028 2.4403 2.4465 2.5079 2.5111 2.7166 2.7192 3.2570 3.2616 3.4014 3.4063 3.8668 3.8691 3.9395 3.9444 4.4219 4.4250 4.9796 4.9835 5.2464 5.2497 5.3111 5.3138 5.5204 5.5220 6.2441 6.2541 6.3955 6.4146 6.5637 6.5770 6.7767 6.7914 6.9909 7.0005 7.1298 7.1354 7.2037 7.2263 7.2796 7.2855 7.4611 7.4686 8.1272 8.1293 10.6149 10.6152 12.9814 12.9830 14.0812 14.0839 14.9875 14.9898 15.1618 15.1625 15.7274 15.7280 k = 0.0541 0.0097 0.0124 ( 9664 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6111 -15.6111 -14.2209 -14.2209 -12.9706 -12.9703 -12.3015 -12.3012 -12.1558 -12.1556 -12.0551 -12.0546 -11.5302 -11.5297 -3.1781 -3.1779 -2.2127 -2.2127 -0.5545 -0.5529 0.0732 0.0736 0.3357 0.3370 0.6928 0.6943 0.9452 0.9463 1.2053 1.2064 2.1886 2.1908 2.4324 2.4393 2.5196 2.5227 2.7232 2.7263 3.2424 3.2475 3.4081 3.4138 3.8629 3.8653 3.9390 3.9448 4.4152 4.4193 4.9822 4.9871 5.2429 5.2469 5.3126 5.3158 5.5141 5.5163 6.2432 6.2565 6.3930 6.4183 6.5610 6.5785 6.7754 6.7948 6.9909 7.0034 7.1329 7.1405 7.2026 7.2320 7.2784 7.2866 7.4625 7.4723 8.1335 8.1363 10.6323 10.6327 12.9791 12.9812 14.0706 14.0741 14.9927 14.9957 15.1720 15.1729 15.7301 15.7310 k = 0.0676 0.0121 0.0155 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6088 -15.6088 -14.2213 -14.2213 -12.9697 -12.9693 -12.3037 -12.3032 -12.1563 -12.1561 -12.0579 -12.0573 -11.5302 -11.5296 -3.1812 -3.1811 -2.1988 -2.1988 -0.5652 -0.5632 0.0836 0.0841 0.3297 0.3313 0.6947 0.6965 0.9515 0.9528 1.2035 1.2049 2.1743 2.1769 2.4234 2.4306 2.5325 2.5355 2.7309 2.7345 3.2271 3.2325 3.4139 3.4199 3.8586 3.8609 3.9384 3.9448 4.4068 4.4119 4.9852 4.9909 5.2391 5.2435 5.3148 5.3184 5.5063 5.5090 6.2426 6.2590 6.3908 6.4222 6.5582 6.5798 6.7745 6.7983 6.9911 7.0064 7.1368 7.1463 7.2026 7.2380 7.2768 7.2878 7.4645 7.4765 8.1414 8.1449 10.6543 10.6548 12.9763 12.9789 14.0575 14.0618 14.9990 15.0027 15.1852 15.1862 15.7337 15.7348 k = 0.0811 0.0145 0.0186 ( 9662 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6059 -15.6059 -14.2219 -14.2218 -12.9685 -12.9680 -12.3064 -12.3058 -12.1570 -12.1567 -12.0611 -12.0605 -11.5302 -11.5295 -3.1850 -3.1848 -2.1819 -2.1819 -0.5775 -0.5753 0.0955 0.0960 0.3228 0.3247 0.6966 0.6989 0.9588 0.9603 1.2018 1.2035 2.1589 2.1618 2.4134 2.4209 2.5459 2.5489 2.7392 2.7431 3.2120 3.2176 3.4179 3.4241 3.8543 3.8562 3.9374 3.9440 4.3968 4.4029 4.9881 4.9945 5.2353 5.2398 5.3177 5.3216 5.4972 5.5004 6.2422 6.2617 6.3889 6.4261 6.5554 6.5808 6.7739 6.8021 6.9923 7.0101 7.1413 7.1523 7.2042 7.2441 7.2752 7.2896 7.4675 7.4815 8.1514 8.1554 10.6808 10.6815 12.9731 12.9762 14.0421 14.0470 15.0062 15.0106 15.2013 15.2023 15.7380 15.7393 k = 0.0946 0.0170 0.0217 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6026 -15.6026 -14.2225 -14.2225 -12.9671 -12.9665 -12.3096 -12.3089 -12.1579 -12.1575 -12.0646 -12.0639 -11.5303 -11.5295 -3.1894 -3.1892 -2.1621 -2.1621 -0.5912 -0.5886 0.1084 0.1090 0.3153 0.3175 0.6985 0.7013 0.9671 0.9687 1.2003 1.2023 2.1428 2.1460 2.4028 2.4105 2.5592 2.5621 2.7476 2.7517 3.1980 3.2037 3.4197 3.4260 3.8500 3.8513 3.9362 3.9425 4.3853 4.3924 4.9907 4.9974 5.2317 5.2362 5.3215 5.3256 5.4869 5.4906 6.2420 6.2643 6.3871 6.4299 6.5524 6.5816 6.7738 6.8060 6.9936 7.0137 7.1461 7.1580 7.2077 7.2498 7.2741 7.2927 7.4711 7.4871 8.1628 8.1673 10.7116 10.7123 12.9697 12.9732 14.0247 14.0302 15.0141 15.0191 15.2202 15.2213 15.7430 15.7445 k = 0.1081 0.0194 0.0248 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5988 -15.5987 -14.2232 -14.2232 -12.9654 -12.9648 -12.3135 -12.3127 -12.1589 -12.1585 -12.0684 -12.0676 -11.5303 -11.5294 -3.1944 -3.1942 -2.1395 -2.1394 -0.6058 -0.6030 0.1216 0.1224 0.3075 0.3100 0.7001 0.7034 0.9762 0.9778 1.1992 1.2017 2.1263 2.1298 2.3918 2.3998 2.5716 2.5747 2.7557 2.7598 3.1858 3.1914 3.4189 3.4252 3.8453 3.8467 3.9347 3.9404 4.3726 4.3806 4.9923 4.9990 5.2286 5.2327 5.3262 5.3305 5.4760 5.4802 6.2420 6.2671 6.3855 6.4338 6.5494 6.5820 6.7741 6.8101 6.9957 7.0179 7.1510 7.1626 7.2131 7.2543 7.2736 7.2977 7.4756 7.4932 8.1759 8.1809 10.7462 10.7471 12.9661 12.9701 14.0055 14.0115 15.0224 15.0280 15.2418 15.2428 15.7488 15.7504 k = 0.1216 0.0218 0.0280 ( 9662 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5945 -15.5945 -14.2240 -14.2240 -12.9636 -12.9629 -12.3180 -12.3171 -12.1602 -12.1597 -12.0722 -12.0714 -11.5304 -11.5294 -3.1999 -3.1997 -2.1142 -2.1141 -0.6212 -0.6182 0.1345 0.1355 0.3001 0.3029 0.7011 0.7048 0.9859 0.9876 1.1990 1.2018 2.1097 2.1135 2.3807 2.3889 2.5829 2.5861 2.7627 2.7668 3.1759 3.1815 3.4154 3.4216 3.8398 3.8423 3.9332 3.9378 4.3588 4.3677 4.9926 4.9990 5.2258 5.2296 5.3317 5.3362 5.4647 5.4696 6.2421 6.2697 6.3841 6.4375 6.5462 6.5822 6.7747 6.8142 6.9981 7.0223 7.1555 7.1662 7.2200 7.2567 7.2748 7.3049 7.4807 7.4999 8.1909 8.1962 10.7845 10.7855 12.9625 12.9668 13.9847 13.9913 15.0308 15.0369 15.2656 15.2667 15.7552 15.7570 k = 0.1351 0.0242 0.0311 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5899 -15.5898 -14.2249 -14.2249 -12.9616 -12.9608 -12.3232 -12.3222 -12.1617 -12.1612 -12.0759 -12.0750 -11.5305 -11.5294 -3.2059 -3.2056 -2.0862 -2.0860 -0.6371 -0.6339 0.1460 0.1472 0.2940 0.2970 0.7011 0.7053 0.9962 0.9980 1.1998 1.2030 2.0933 2.0974 2.3697 2.3780 2.5926 2.5960 2.7682 2.7721 3.1690 3.1746 3.4093 3.4154 3.8332 3.8373 3.9320 3.9352 4.3444 4.3541 4.9913 4.9970 5.2234 5.2269 5.3375 5.3423 5.4541 5.4596 6.2424 6.2724 6.3829 6.4411 6.5431 6.5821 6.7757 6.8184 7.0008 7.0268 7.1593 7.1691 7.2271 7.2570 7.2788 7.3146 7.4868 7.5073 8.2072 8.2129 10.8262 10.8273 12.9589 12.9636 13.9628 13.9697 15.0394 15.0459 15.2916 15.2928 15.7622 15.7641 k = 0.1486 0.0267 0.0342 ( 9673 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5848 -15.5848 -14.2259 -14.2258 -12.9593 -12.9585 -12.3292 -12.3281 -12.1635 -12.1629 -12.0795 -12.0786 -11.5306 -11.5295 -3.2124 -3.2121 -2.0556 -2.0555 -0.6532 -0.6499 0.1547 0.1561 0.2906 0.2937 0.6998 0.7044 1.0071 1.0090 1.2017 1.2053 2.0770 2.0814 2.3590 2.3673 2.6005 2.6041 2.7718 2.7755 3.1655 3.1710 3.4007 3.4065 3.8250 3.8309 3.9314 3.9332 4.3297 4.3400 4.9882 4.9931 5.2210 5.2246 5.3426 5.3478 5.4456 5.4517 6.2427 6.2749 6.3817 6.4445 6.5398 6.5817 6.7771 6.8226 7.0038 7.0316 7.1620 7.1720 7.2328 7.2556 7.2864 7.3264 7.4931 7.5148 8.2249 8.2309 10.8708 10.8720 12.9556 12.9606 13.9399 13.9472 15.0478 15.0548 15.3193 15.3206 15.7698 15.7719 k = 0.1622 0.0291 0.0373 ( 9673 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5794 -15.5794 -14.2270 -14.2269 -12.9569 -12.9560 -12.3360 -12.3347 -12.1654 -12.1648 -12.0828 -12.0818 -11.5307 -11.5296 -3.2192 -3.2189 -2.0227 -2.0225 -0.6694 -0.6659 0.1591 0.1610 0.2913 0.2942 0.6967 0.7018 1.0188 1.0208 1.2050 1.2089 2.0611 2.0658 2.3486 2.3570 2.6065 2.6102 2.7732 2.7765 3.1658 3.1711 3.3898 3.3954 3.8146 3.8222 3.9313 3.9329 4.3152 4.3259 4.9833 4.9872 5.2183 5.2223 5.3452 5.3508 5.4413 5.4480 6.2432 6.2774 6.3807 6.4477 6.5365 6.5810 6.7787 6.8268 7.0075 7.0370 7.1634 7.1753 7.2363 7.2533 7.2979 7.3401 7.5007 7.5232 8.2443 8.2504 10.9179 10.9193 12.9526 12.9578 13.9163 13.9239 15.0562 15.0634 15.3483 15.3498 15.7780 15.7802 k = 0.1757 0.0315 0.0404 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5737 -15.5736 -14.2281 -14.2280 -12.9542 -12.9533 -12.3435 -12.3422 -12.1676 -12.1669 -12.0858 -12.0848 -11.5309 -11.5297 -3.2264 -3.2261 -1.9874 -1.9872 -0.6855 -0.6819 0.1584 0.1607 0.2969 0.2996 0.6917 0.6970 1.0314 1.0334 1.2096 1.2138 2.0453 2.0504 2.3388 2.3473 2.6103 2.6142 2.7723 2.7752 3.1697 3.1749 3.3769 3.3822 3.8018 3.8107 3.9319 3.9346 4.3011 4.3121 4.9767 4.9796 5.2152 5.2198 5.3437 5.3489 5.4439 5.4504 6.2438 6.2798 6.3798 6.4507 6.5332 6.5801 6.7808 6.8310 7.0116 7.0428 7.1639 7.1789 7.2379 7.2508 7.3126 7.3553 7.5089 7.5321 8.2652 8.2714 10.9673 10.9687 12.9499 12.9554 13.8923 13.9001 15.0643 15.0718 15.3782 15.3799 15.7868 15.7892 k = 0.1892 0.0339 0.0435 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5677 -15.5676 -14.2293 -14.2292 -12.9514 -12.9504 -12.3519 -12.3505 -12.1699 -12.1692 -12.0883 -12.0873 -11.5311 -11.5299 -3.2338 -3.2335 -1.9500 -1.9498 -0.7013 -0.6977 0.1526 0.1555 0.3073 0.3097 0.6843 0.6899 1.0450 1.0470 1.2156 1.2200 2.0299 2.0352 2.3296 2.3381 2.6119 2.6160 2.7692 2.7717 3.1770 3.1820 3.3623 3.3673 3.7863 3.7958 3.9341 3.9380 4.2879 4.2990 4.9684 4.9704 5.2115 5.2168 5.3374 5.3418 5.4537 5.4594 6.2445 6.2821 6.3789 6.4534 6.5300 6.5790 6.7830 6.8351 7.0158 7.0487 7.1636 7.1824 7.2380 7.2478 7.3296 7.3716 7.5174 7.5411 8.2869 8.2932 11.0184 11.0200 12.9477 12.9534 13.8681 13.8761 15.0722 15.0799 15.4083 15.4103 15.7961 15.7988 k = 0.2027 0.0364 0.0466 ( 9670 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5614 -15.5613 -14.2306 -14.2305 -12.9484 -12.9474 -12.3611 -12.3595 -12.1724 -12.1716 -12.0905 -12.0895 -11.5313 -11.5301 -3.2415 -3.2412 -1.9106 -1.9103 -0.7167 -0.7131 0.1430 0.1463 0.3213 0.3234 0.6745 0.6803 1.0598 1.0616 1.2229 1.2273 2.0145 2.0202 2.3211 2.3297 2.6113 2.6155 2.7643 2.7664 3.1871 3.1920 3.3463 3.3511 3.7681 3.7779 3.9378 3.9426 4.2758 4.2869 4.9588 4.9599 5.2071 5.2131 5.3275 5.3309 5.4691 5.4740 6.2452 6.2843 6.3781 6.4556 6.5267 6.5776 6.7856 6.8390 7.0201 7.0545 7.1628 7.1856 7.2372 7.2451 7.3481 7.3889 7.5263 7.5503 8.3097 8.3160 11.0708 11.0726 12.9461 12.9519 13.8439 13.8521 15.0798 15.0876 15.4380 15.4405 15.8061 15.8091 k = 0.2162 0.0388 0.0497 ( 9675 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5549 -15.5548 -14.2319 -14.2318 -12.9453 -12.9442 -12.3710 -12.3694 -12.1749 -12.1741 -12.0922 -12.0912 -11.5316 -11.5304 -3.2494 -3.2491 -1.8694 -1.8691 -0.7316 -0.7281 0.1306 0.1344 0.3377 0.3396 0.6623 0.6682 1.0759 1.0774 1.2312 1.2355 1.9994 2.0054 2.3134 2.3220 2.6085 2.6129 2.7579 2.7597 3.1994 3.2042 3.3293 3.3338 3.7478 3.7572 3.9429 3.9483 4.2650 4.2760 4.9477 4.9484 5.2017 5.2085 5.3155 5.3181 5.4885 5.4925 6.2461 6.2864 6.3773 6.4575 6.5236 6.5761 6.7883 6.8428 7.0243 7.0603 7.1613 7.1883 7.2354 7.2425 7.3677 7.4070 7.5362 7.5602 8.3330 8.3392 11.1243 11.1261 12.9451 12.9510 13.8201 13.8283 15.0871 15.0951 15.4669 15.4699 15.8169 15.8202 k = 0.2297 0.0412 0.0528 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5482 -15.5481 -14.2332 -14.2331 -12.9420 -12.9408 -12.3816 -12.3800 -12.1774 -12.1765 -12.0936 -12.0925 -11.5319 -11.5307 -3.2574 -3.2571 -1.8265 -1.8261 -0.7460 -0.7425 0.1164 0.1206 0.3557 0.3573 0.6478 0.6537 1.0930 1.0943 1.2405 1.2446 1.9843 1.9906 2.3065 2.3152 2.6037 2.6081 2.7506 2.7520 3.2131 3.2177 3.3115 3.3156 3.7258 3.7345 3.9491 3.9548 4.2556 4.2663 4.9351 4.9362 5.1954 5.2030 5.3027 5.3047 5.5103 5.5137 6.2470 6.2883 6.3765 6.4589 6.5207 6.5744 6.7911 6.8463 7.0284 7.0659 7.1594 7.1906 7.2328 7.2410 7.3881 7.4256 7.5466 7.5704 8.3570 8.3632 11.1783 11.1803 12.9448 12.9507 13.7967 13.8050 15.0942 15.1021 15.4943 15.4979 15.8285 15.8323 k = 0.2432 0.0436 0.0559 ( 9686 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5414 -15.5413 -14.2346 -14.2345 -12.9385 -12.9373 -12.3929 -12.3912 -12.1798 -12.1790 -12.0946 -12.0936 -11.5323 -11.5310 -3.2655 -3.2652 -1.7822 -1.7816 -0.7598 -0.7564 0.1010 0.1056 0.3744 0.3759 0.6312 0.6371 1.1110 1.1122 1.2506 1.2544 1.9693 1.9758 2.3004 2.3091 2.5968 2.6013 2.7426 2.7439 3.2269 3.2313 3.2936 3.2971 3.7030 3.7107 3.9560 3.9619 4.2477 4.2580 4.9214 4.9232 5.1880 5.1965 5.2898 5.2918 5.5338 5.5367 6.2479 6.2900 6.3757 6.4598 6.5180 6.5725 6.7940 6.8495 7.0322 7.0711 7.1571 7.1924 7.2301 7.2403 7.4089 7.4446 7.5574 7.5810 8.3816 8.3877 11.2323 11.2345 12.9452 12.9511 13.7740 13.7823 15.1009 15.1089 15.5195 15.5239 15.8410 15.8453 k = 0.2568 0.0461 0.0590 ( 9687 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5345 -15.5345 -14.2361 -14.2360 -12.9349 -12.9336 -12.4047 -12.4030 -12.1822 -12.1813 -12.0953 -12.0943 -11.5326 -11.5314 -3.2736 -3.2732 -1.7365 -1.7359 -0.7728 -0.7696 0.0850 0.0899 0.3932 0.3945 0.6132 0.6189 1.1294 1.1310 1.2615 1.2648 1.9544 1.9612 2.2951 2.3038 2.5881 2.5927 2.7345 2.7358 3.2379 3.2423 3.2781 3.2798 3.6802 3.6868 3.9635 3.9694 4.2412 4.2512 4.9070 4.9094 5.1794 5.1888 5.2772 5.2798 5.5584 5.5609 6.2490 6.2917 6.3750 6.4601 6.5156 6.5705 6.7970 6.8525 7.0359 7.0762 7.1544 7.1932 7.2277 7.2403 7.4299 7.4638 7.5685 7.5916 8.4070 8.4128 11.2861 11.2884 12.9463 12.9522 13.7521 13.7604 15.1074 15.1153 15.5421 15.5476 15.8544 15.8594 k = 0.2703 0.0485 0.0621 ( 9680 PWs) bands (ev): -84.3026 -84.3026 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5276 -15.5275 -14.2375 -14.2374 -12.9311 -12.9298 -12.4170 -12.4152 -12.1844 -12.1836 -12.0957 -12.0947 -11.5330 -11.5318 -3.2816 -3.2813 -1.6898 -1.6890 -0.7852 -0.7822 0.0686 0.0738 0.4112 0.4123 0.5945 0.5997 1.1478 1.1502 1.2732 1.2758 1.9396 1.9466 2.2905 2.2992 2.5778 2.5825 2.7265 2.7279 3.2361 3.2420 3.2713 3.2743 3.6587 3.6641 3.9713 3.9771 4.2360 4.2455 4.8918 4.8948 5.1697 5.1800 5.2657 5.2691 5.5834 5.5857 6.2501 6.2931 6.3744 6.4597 6.5137 6.5684 6.8002 6.8552 7.0396 7.0812 7.1516 7.1932 7.2263 7.2410 7.4511 7.4832 7.5801 7.6025 8.4327 8.4383 11.3392 11.3415 12.9482 12.9541 13.7312 13.7395 15.1135 15.1213 15.5618 15.5685 15.8685 15.8743 k = 0.2838 0.0509 0.0652 ( 9680 PWs) bands (ev): -84.3026 -84.3026 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5207 -15.5206 -14.2390 -14.2389 -12.9273 -12.9259 -12.4296 -12.4278 -12.1865 -12.1857 -12.0958 -12.0949 -11.5334 -11.5323 -3.2896 -3.2892 -1.6422 -1.6414 -0.7968 -0.7941 0.0522 0.0578 0.4269 0.4280 0.5765 0.5811 1.1659 1.1693 1.2857 1.2876 1.9251 1.9323 2.2865 2.2952 2.5660 2.5707 2.7189 2.7206 3.2191 3.2254 3.2776 3.2818 3.6395 3.6437 3.9792 3.9849 4.2320 4.2411 4.8761 4.8796 5.1590 5.1701 5.2555 5.2597 5.6086 5.6107 6.2513 6.2944 6.3739 6.4587 6.5122 6.5661 6.8033 6.8576 7.0425 7.0852 7.1485 7.1920 7.2257 7.2420 7.4720 7.5024 7.5917 7.6135 8.4581 8.4636 11.3911 11.3935 12.9509 12.9567 13.7115 13.7196 15.1193 15.1270 15.5786 15.5866 15.8830 15.8897 k = 0.2973 0.0533 0.0683 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5139 -15.5138 -14.2405 -14.2404 -12.9233 -12.9219 -12.4424 -12.4405 -12.1884 -12.1876 -12.0958 -12.0949 -11.5338 -11.5327 -3.2974 -3.2970 -1.5940 -1.5930 -0.8078 -0.8054 0.0361 0.0419 0.4373 0.4395 0.5621 0.5655 1.1830 1.1876 1.2991 1.3005 1.9111 1.9184 2.2830 2.2916 2.5529 2.5577 2.7121 2.7140 3.1968 3.2031 3.2863 3.2905 3.6238 3.6269 3.9872 3.9928 4.2289 4.2377 4.8599 4.8640 5.1475 5.1592 5.2467 5.2515 5.6337 5.6357 6.2525 6.2955 6.3735 6.4570 6.5111 6.5638 6.8065 6.8596 7.0453 7.0890 7.1455 7.1898 7.2266 7.2436 7.4927 7.5214 7.6039 7.6247 8.4835 8.4887 11.4415 11.4440 12.9543 12.9600 13.6930 13.7010 15.1248 15.1323 15.5926 15.6019 15.8973 15.9050 k = 0.3108 0.0557 0.0714 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5072 -15.5071 -14.2419 -14.2419 -12.9192 -12.9179 -12.4553 -12.4534 -12.1902 -12.1894 -12.0957 -12.0948 -11.5342 -11.5332 -3.3049 -3.3046 -1.5456 -1.5444 -0.8180 -0.8160 0.0205 0.0266 0.4386 0.4425 0.5554 0.5573 1.1985 1.2043 1.3133 1.3148 1.8977 1.9051 2.2798 2.2883 2.5388 2.5437 2.7062 2.7083 3.1720 3.1783 3.2932 3.2972 3.6125 3.6146 3.9951 4.0005 4.2267 4.2351 4.8434 4.8480 5.1355 5.1475 5.2394 5.2444 5.6584 5.6602 6.2539 6.2963 6.3732 6.4546 6.5105 6.5614 6.8096 6.8613 7.0474 7.0920 7.1424 7.1866 7.2282 7.2453 7.5128 7.5399 7.6155 7.6354 8.5084 8.5132 11.4899 11.4925 12.9585 12.9640 13.6758 13.6836 15.1300 15.1372 15.6043 15.6149 15.9107 15.9194 k = 0.3243 0.0582 0.0745 ( 9677 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5007 -15.5006 -14.2434 -14.2433 -12.9151 -12.9137 -12.4681 -12.4663 -12.1918 -12.1911 -12.0954 -12.0946 -11.5347 -11.5337 -3.3123 -3.3120 -1.4971 -1.4957 -0.8276 -0.8261 0.0055 0.0118 0.4283 0.4338 0.5585 0.5598 1.2119 1.2188 1.3284 1.3306 1.8854 1.8927 2.2768 2.2852 2.5238 2.5287 2.7013 2.7038 3.1452 3.1515 3.2974 3.3012 3.6060 3.6075 4.0028 4.0082 4.2251 4.2332 4.8269 4.8319 5.1232 5.1354 5.2332 5.2384 5.6824 5.6842 6.2553 6.2969 6.3731 6.4517 6.5103 6.5589 6.8125 6.8624 7.0489 7.0940 7.1392 7.1826 7.2301 7.2470 7.5323 7.5578 7.6269 7.6458 8.5324 8.5370 11.5361 11.5387 12.9634 12.9687 13.6600 13.6676 15.1347 15.1417 15.6140 15.6259 15.9223 15.9321 k = 0.3378 0.0606 0.0776 ( 9678 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4943 -15.4943 -14.2448 -14.2447 -12.9110 -12.9096 -12.4808 -12.4790 -12.1933 -12.1926 -12.0951 -12.0943 -11.5351 -11.5341 -3.3193 -3.3190 -1.4488 -1.4472 -0.8366 -0.8355 -0.0086 -0.0020 0.4090 0.4154 0.5695 0.5711 1.2229 1.2306 1.3446 1.3474 1.8744 1.8817 2.2740 2.2822 2.5080 2.5130 2.6978 2.7004 3.1169 3.1230 3.2989 3.3024 3.6044 3.6054 4.0104 4.0156 4.2240 4.2319 4.8105 4.8159 5.1110 5.1230 5.2282 5.2333 5.7055 5.7073 6.2568 6.2972 6.3731 6.4484 6.5104 6.5564 6.8155 6.8633 7.0500 7.0951 7.1367 7.1786 7.2328 7.2490 7.5511 7.5751 7.6382 7.6560 8.5560 8.5602 11.5797 11.5823 12.9689 12.9739 13.6456 13.6529 15.1391 15.1457 15.6223 15.6355 15.9313 15.9421 k = 0.3514 0.0630 0.0807 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4883 -15.4883 -14.2462 -14.2461 -12.9068 -12.9055 -12.4931 -12.4914 -12.1946 -12.1939 -12.0947 -12.0939 -11.5355 -11.5346 -3.3259 -3.3256 -1.4012 -1.3994 -0.8450 -0.8445 -0.0216 -0.0148 0.3844 0.3912 0.5852 0.5870 1.2315 1.2395 1.3616 1.3647 1.8652 1.8724 2.2712 2.2793 2.4916 2.4967 2.6956 2.6984 3.0872 3.0932 3.2982 3.3014 3.6070 3.6078 4.0178 4.0228 4.2232 4.2309 4.7945 4.8001 5.0989 5.1106 5.2240 5.2289 5.7275 5.7293 6.2584 6.2973 6.3735 6.4447 6.5109 6.5539 6.8184 6.8638 7.0509 7.0951 7.1350 7.1747 7.2357 7.2510 7.5690 7.5915 7.6490 7.6657 8.5784 8.5823 11.6205 11.6231 12.9750 12.9797 13.6327 13.6397 15.1431 15.1493 15.6298 15.6440 15.9368 15.9487 k = 0.3649 0.0654 0.0839 ( 9676 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4826 -15.4825 -14.2475 -14.2474 -12.9027 -12.9014 -12.5050 -12.5034 -12.1957 -12.1951 -12.0942 -12.0935 -11.5359 -11.5351 -3.3321 -3.3319 -1.3546 -1.3525 -0.8532 -0.8528 -0.0333 -0.0263 0.3570 0.3640 0.6030 0.6050 1.2376 1.2457 1.3788 1.3820 1.8581 1.8651 2.2685 2.2764 2.4747 2.4799 2.6948 2.6977 3.0567 3.0624 3.2960 3.2988 3.6129 3.6137 4.0249 4.0297 4.2226 4.2300 4.7791 4.7849 5.0872 5.0985 5.2207 5.2253 5.7483 5.7501 6.2600 6.2970 6.3741 6.4406 6.5116 6.5513 6.8213 6.8640 7.0514 7.0940 7.1342 7.1709 7.2388 7.2531 7.5860 7.6070 7.6594 7.6750 8.5998 8.6034 11.6581 11.6607 12.9814 12.9859 13.6212 13.6278 15.1466 15.1524 15.6369 15.6522 15.9382 15.9513 k = 0.3784 0.0679 0.0870 ( 9680 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4773 -15.4772 -14.2487 -14.2487 -12.8987 -12.8974 -12.5164 -12.5148 -12.1967 -12.1962 -12.0937 -12.0931 -11.5362 -11.5355 -3.3379 -3.3377 -1.3094 -1.3070 -0.8614 -0.8605 -0.0435 -0.0364 0.3283 0.3353 0.6217 0.6236 1.2415 1.2494 1.3955 1.3986 1.8535 1.8602 2.2659 2.2736 2.4573 2.4626 2.6955 2.6985 3.0259 3.0312 3.2929 3.2954 3.6211 3.6219 4.0317 4.0363 4.2221 4.2292 4.7645 4.7704 5.0761 5.0868 5.2179 5.2222 5.7677 5.7695 6.2618 6.2965 6.3750 6.4364 6.5124 6.5487 6.8242 6.8637 7.0517 7.0919 7.1340 7.1673 7.2419 7.2549 7.6018 7.6213 7.6689 7.6834 8.6194 8.6227 11.6925 11.6949 12.9882 12.9922 13.6111 13.6173 15.1497 15.1551 15.6441 15.6602 15.9354 15.9496 k = 0.3919 0.0703 0.0901 ( 9678 PWs) bands (ev): -84.3025 -84.3025 -50.0024 -50.0024 -48.3955 -48.3955 -48.0609 -48.0609 -15.4724 -15.4723 -14.2499 -14.2498 -12.8948 -12.8936 -12.5270 -12.5255 -12.1976 -12.1971 -12.0933 -12.0927 -11.5366 -11.5359 -3.3432 -3.3430 -1.2659 -1.2632 -0.8694 -0.8680 -0.0521 -0.0450 0.2993 0.3062 0.6404 0.6421 1.2433 1.2509 1.4111 1.4140 1.8516 1.8578 2.2637 2.2712 2.4395 2.4448 2.6977 2.7007 2.9953 3.0001 3.2894 3.2916 3.6306 3.6316 4.0382 4.0425 4.2215 4.2283 4.7509 4.7568 5.0657 5.0756 5.2158 5.2196 5.7856 5.7872 6.2636 6.2956 6.3763 6.4320 6.5135 6.5461 6.8271 6.8633 7.0521 7.0891 7.1346 7.1641 7.2449 7.2567 7.6164 7.6345 7.6778 7.6911 8.6377 8.6406 11.7233 11.7256 12.9950 12.9987 13.6025 13.6082 15.1524 15.1573 15.6516 15.6684 15.9284 15.9437 k = 0.4054 0.0727 0.0932 ( 9675 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4679 -15.4679 -14.2509 -14.2509 -12.8911 -12.8900 -12.5368 -12.5354 -12.1984 -12.1979 -12.0928 -12.0923 -11.5369 -11.5363 -3.3479 -3.3478 -1.2247 -1.2217 -0.8773 -0.8753 -0.0590 -0.0519 0.2707 0.2775 0.6584 0.6601 1.2435 1.2504 1.4251 1.4277 1.8523 1.8580 2.2621 2.2692 2.4214 2.4268 2.7013 2.7043 2.9655 2.9699 3.2860 3.2879 3.6408 3.6417 4.0443 4.0484 4.2208 4.2273 4.7387 4.7444 5.0562 5.0652 5.2140 5.2174 5.8017 5.8033 6.2656 6.2945 6.3778 6.4275 6.5147 6.5435 6.8300 6.8625 7.0523 7.0857 7.1354 7.1611 7.2480 7.2584 7.6299 7.6463 7.6859 7.6980 8.6545 8.6571 11.7507 11.7528 13.0017 13.0051 13.5952 13.6003 15.1547 15.1590 15.6598 15.6772 15.9178 15.9340 k = 0.4189 0.0751 0.0963 ( 9677 PWs) bands (ev): -84.3025 -84.3025 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4640 -15.4639 -14.2518 -14.2518 -12.8877 -12.8867 -12.5456 -12.5444 -12.1990 -12.1986 -12.0924 -12.0919 -11.5371 -11.5366 -3.3521 -3.3520 -1.1863 -1.1830 -0.8852 -0.8827 -0.0640 -0.0571 0.2433 0.2498 0.6754 0.6769 1.2424 1.2485 1.4372 1.4394 1.8553 1.8605 2.2612 2.2681 2.4032 2.4086 2.7062 2.7091 2.9371 2.9411 3.2829 3.2845 3.6508 3.6517 4.0500 4.0537 4.2201 4.2260 4.7279 4.7332 5.0477 5.0557 5.2127 5.2156 5.8160 5.8174 6.2676 6.2931 6.3797 6.4230 6.5161 6.5409 6.8327 6.8612 7.0524 7.0818 7.1366 7.1582 7.2509 7.2599 7.6419 7.6567 7.6932 7.7040 8.6692 8.6713 11.7744 11.7763 13.0082 13.0111 13.5891 13.5937 15.1566 15.1604 15.6688 15.6865 15.9045 15.9212 k = 0.4324 0.0776 0.0994 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4606 -15.4605 -14.2526 -14.2526 -12.8846 -12.8837 -12.5533 -12.5522 -12.1996 -12.1992 -12.0920 -12.0916 -11.5374 -11.5369 -3.3557 -3.3556 -1.1510 -1.1475 -0.8932 -0.8902 -0.0672 -0.0607 0.2178 0.2239 0.6909 0.6922 1.2403 1.2456 1.4472 1.4490 1.8603 1.8648 2.2615 2.2680 2.3851 2.3905 2.7123 2.7152 2.9106 2.9141 3.2801 3.2815 3.6601 3.6610 4.0551 4.0584 4.2193 4.2246 4.7187 4.7235 5.0404 5.0473 5.2117 5.2142 5.8284 5.8296 6.2697 6.2914 6.3819 6.4185 6.5176 6.5384 6.8355 6.8597 7.0528 7.0777 7.1378 7.1556 7.2534 7.2609 7.6526 7.6654 7.6996 7.7091 8.6819 8.6837 11.7944 11.7961 13.0141 13.0166 13.5842 13.5881 15.1582 15.1613 15.6787 15.6962 15.8895 15.9064 k = 0.4459 0.0800 0.1025 ( 9691 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4577 -15.4577 -14.2533 -14.2533 -12.8819 -12.8811 -12.5598 -12.5589 -12.2000 -12.1997 -12.0916 -12.0913 -11.5375 -11.5372 -3.3587 -3.3586 -1.1197 -1.1161 -0.9011 -0.8979 -0.0688 -0.0629 0.1951 0.2005 0.7043 0.7055 1.2377 1.2420 1.4552 1.4566 1.8663 1.8700 2.2631 2.2692 2.3675 2.3728 2.7195 2.7221 2.8865 2.8896 3.2779 3.2790 3.6684 3.6691 4.0596 4.0624 4.2185 4.2230 4.7112 4.7153 5.0343 5.0400 5.2110 5.2130 5.8386 5.8397 6.2718 6.2896 6.3845 6.4140 6.5191 6.5359 6.8382 6.8580 7.0532 7.0735 7.1389 7.1531 7.2554 7.2614 7.6616 7.6724 7.7048 7.7128 8.6924 8.6938 11.8108 11.8122 13.0194 13.0214 13.5804 13.5836 15.1594 15.1620 15.6894 15.7062 15.8740 15.8904 k = 0.4595 0.0824 0.1056 ( 9693 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4555 -15.4555 -14.2539 -14.2538 -12.8797 -12.8791 -12.5649 -12.5642 -12.2003 -12.2001 -12.0914 -12.0911 -11.5377 -11.5374 -3.3610 -3.3609 -1.0929 -1.0895 -0.9088 -0.9055 -0.0689 -0.0640 0.1761 0.1806 0.7155 0.7163 1.2351 1.2385 1.4612 1.4622 1.8725 1.8754 2.2662 2.2719 2.3510 2.3560 2.7272 2.7296 2.8656 2.8682 3.2762 3.2770 3.6751 3.6758 4.0634 4.0656 4.2179 4.2215 4.7055 4.7087 5.0296 5.0340 5.2106 5.2121 5.8468 5.8476 6.2740 6.2876 6.3873 6.4097 6.5209 6.5335 6.8409 6.8559 7.0543 7.0697 7.1405 7.1509 7.2574 7.2619 7.6691 7.6775 7.7093 7.7155 8.7008 8.7018 11.8236 11.8246 13.0237 13.0252 13.5777 13.5801 15.1604 15.1623 15.7004 15.7157 15.8594 15.8743 k = 0.4730 0.0848 0.1087 ( 9688 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4539 -15.4539 -14.2542 -14.2542 -12.8780 -12.8776 -12.5686 -12.5682 -12.2005 -12.2004 -12.0911 -12.0910 -11.5378 -11.5376 -3.3627 -3.3626 -1.0716 -1.0688 -0.9154 -0.9127 -0.0681 -0.0645 0.1618 0.1651 0.7238 0.7244 1.2331 1.2353 1.4654 1.4661 1.8779 1.8799 2.2708 2.2756 2.3368 2.3412 2.7349 2.7367 2.8487 2.8507 3.2750 3.2755 3.6802 3.6806 4.0663 4.0679 4.2175 4.2200 4.7016 4.7038 5.0265 5.0294 5.2104 5.2114 5.8527 5.8532 6.2763 6.2854 6.3904 6.4054 6.5227 6.5311 6.8437 6.8538 7.0559 7.0663 7.1421 7.1490 7.2593 7.2623 7.6751 7.6809 7.7130 7.7173 8.7070 8.7077 11.8327 11.8334 13.0270 13.0280 13.5759 13.5776 15.1611 15.1624 15.7112 15.7234 15.8476 15.8596 k = 0.4865 0.0873 0.1118 ( 9684 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4529 -15.4529 -14.2545 -14.2545 -12.8769 -12.8768 -12.5708 -12.5706 -12.2006 -12.2006 -12.0910 -12.0909 -11.5378 -11.5377 -3.3637 -3.3637 -1.0573 -1.0557 -0.9200 -0.9184 -0.0668 -0.0649 0.1532 0.1549 0.7290 0.7293 1.2319 1.2330 1.4679 1.4682 1.8818 1.8828 2.2759 2.2790 2.3267 2.3296 2.7411 2.7421 2.8374 2.8385 3.2743 3.2746 3.6834 3.6836 4.0683 4.0691 4.2175 4.2188 4.6995 4.7006 5.0249 5.0263 5.2103 5.2108 5.8563 5.8566 6.2786 6.2832 6.3938 6.4014 6.5247 6.5289 6.8464 6.8514 7.0580 7.0632 7.1438 7.1473 7.2608 7.2623 7.6793 7.6822 7.7156 7.7178 8.7108 8.7112 11.8383 11.8386 13.0292 13.0297 13.5751 13.5759 15.1617 15.1624 15.7206 15.7276 15.8408 15.8477 k = 0.5000 0.0897 0.1149 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4526 -15.4526 -14.2545 -14.2545 -12.8765 -12.8765 -12.5715 -12.5715 -12.2007 -12.2007 -12.0909 -12.0909 -11.5378 -11.5378 -3.3640 -3.3640 -1.0517 -1.0517 -0.9211 -0.9211 -0.0657 -0.0657 0.1508 0.1508 0.7309 0.7309 1.2318 1.2318 1.4688 1.4688 1.8835 1.8835 2.2795 2.2795 2.3238 2.3238 2.7439 2.7439 2.8337 2.8337 3.2742 3.2742 3.6845 3.6845 4.0692 4.0692 4.2179 4.2179 4.6992 4.6992 5.0248 5.0248 5.2105 5.2105 5.8576 5.8576 6.2809 6.2809 6.3975 6.3975 6.5267 6.5267 6.8488 6.8488 7.0604 7.0604 7.1454 7.1454 7.2616 7.2616 7.6816 7.6816 7.7172 7.7172 8.7123 8.7123 11.8402 11.8402 13.0301 13.0301 13.5751 13.5751 15.1621 15.1621 15.7266 15.7266 15.8409 15.8409 k = 0.5000-0.3410 0.0030 ( 9712 PWs) bands (ev): -84.3030 -84.3030 -50.0025 -50.0025 -48.3956 -48.3956 -48.0611 -48.0611 -15.3594 -15.3594 -14.4558 -14.4558 -12.7893 -12.7893 -12.4290 -12.4290 -12.2814 -12.2814 -12.1162 -12.1162 -11.5323 -11.5323 -3.3312 -3.3312 -1.8099 -1.8099 -0.7670 -0.7670 -0.1072 -0.1072 0.2875 0.2875 0.8756 0.8756 0.9212 0.9212 1.8922 1.8922 2.1815 2.1815 2.3309 2.3309 2.3719 2.3719 2.6446 2.6446 2.8747 2.8747 3.7682 3.7682 3.9454 3.9454 4.0862 4.0862 4.1552 4.1552 4.6366 4.6366 4.9058 4.9058 5.3385 5.3385 5.6573 5.6573 6.3310 6.3310 6.3908 6.3908 6.5615 6.5615 6.8580 6.8580 6.9952 6.9952 7.1172 7.1172 7.2202 7.2202 7.4424 7.4424 7.6974 7.6974 8.3030 8.3030 12.4216 12.4216 13.1538 13.1538 13.5873 13.5873 14.5279 14.5279 15.1928 15.1928 15.5547 15.5547 k = 0.4884-0.3330 0.0030 ( 9709 PWs) bands (ev): -84.3029 -84.3029 -50.0025 -50.0025 -48.3956 -48.3956 -48.0611 -48.0611 -15.3598 -15.3598 -14.4556 -14.4555 -12.7896 -12.7895 -12.4288 -12.4287 -12.2813 -12.2810 -12.1160 -12.1159 -11.5325 -11.5324 -3.3314 -3.3313 -1.8101 -1.8100 -0.7666 -0.7665 -0.1079 -0.1076 0.2883 0.2885 0.8700 0.8715 0.9247 0.9260 1.8914 1.8917 2.1762 2.1785 2.3337 2.3369 2.3718 2.3735 2.6445 2.6449 2.8753 2.8758 3.7655 3.7664 3.9459 3.9467 4.0865 4.0872 4.1557 4.1558 4.6359 4.6365 4.9057 4.9066 5.3379 5.3388 5.6548 5.6559 6.3292 6.3327 6.3872 6.3948 6.5594 6.5636 6.8529 6.8638 6.9922 6.9994 7.1165 7.1185 7.2188 7.2217 7.4415 7.4430 7.6967 7.6982 8.3026 8.3028 12.4177 12.4184 13.1547 13.1553 13.5862 13.5865 14.5295 14.5300 15.1935 15.1939 15.5544 15.5547 k = 0.4767-0.3251 0.0029 ( 9714 PWs) bands (ev): -84.3030 -84.3030 -50.0025 -50.0025 -48.3956 -48.3956 -48.0611 -48.0611 -15.3609 -15.3609 -14.4549 -14.4548 -12.7903 -12.7901 -12.4282 -12.4279 -12.2806 -12.2801 -12.1156 -12.1154 -11.5330 -11.5328 -3.3319 -3.3318 -1.8103 -1.8101 -0.7654 -0.7653 -0.1097 -0.1091 0.2907 0.2913 0.8581 0.8603 0.9339 0.9358 1.8892 1.8897 2.1650 2.1688 2.3432 2.3487 2.3735 2.3775 2.6446 2.6454 2.8777 2.8786 3.7585 3.7603 3.9483 3.9498 4.0879 4.0895 4.1571 4.1573 4.6342 4.6354 4.9062 4.9079 5.3369 5.3388 5.6483 5.6504 6.3272 6.3340 6.3841 6.3988 6.5574 6.5657 6.8487 6.8701 6.9900 7.0041 7.1164 7.1202 7.2174 7.2232 7.4400 7.4429 7.6957 7.6987 8.3018 8.3022 12.4067 12.4083 13.1579 13.1590 13.5834 13.5841 14.5347 14.5358 15.1958 15.1965 15.5539 15.5545 k = 0.4651-0.3172 0.0028 ( 9712 PWs) bands (ev): -84.3030 -84.3030 -50.0025 -50.0025 -48.3956 -48.3956 -48.0611 -48.0611 -15.3627 -15.3627 -14.4536 -14.4536 -12.7914 -12.7912 -12.4272 -12.4267 -12.2794 -12.2787 -12.1148 -12.1145 -11.5337 -11.5335 -3.3328 -3.3326 -1.8108 -1.8105 -0.7634 -0.7631 -0.1125 -0.1116 0.2948 0.2956 0.8435 0.8461 0.9449 0.9469 1.8846 1.8855 2.1521 2.1567 2.3535 2.3598 2.3797 2.3867 2.6451 2.6462 2.8819 2.8832 3.7477 3.7504 3.9520 3.9540 4.0905 4.0929 4.1595 4.1598 4.6318 4.6335 4.9074 4.9100 5.3357 5.3384 5.6382 5.6412 6.3251 6.3350 6.3815 6.4028 6.5554 6.5678 6.8453 6.8765 6.9893 7.0098 7.1171 7.1226 7.2163 7.2250 7.4380 7.4424 7.6946 7.6992 8.3005 8.3012 12.3892 12.3914 13.1631 13.1646 13.5790 13.5800 14.5435 14.5451 15.1997 15.2009 15.5530 15.5539 k = 0.4535-0.3093 0.0028 ( 9708 PWs) bands (ev): -84.3029 -84.3029 -50.0025 -50.0025 -48.3956 -48.3956 -48.0610 -48.0610 -15.3653 -15.3652 -14.4520 -14.4519 -12.7929 -12.7926 -12.4258 -12.4251 -12.2776 -12.2767 -12.1137 -12.1133 -11.5348 -11.5345 -3.3339 -3.3337 -1.8114 -1.8110 -0.7606 -0.7603 -0.1160 -0.1149 0.3003 0.3013 0.8276 0.8304 0.9562 0.9582 1.8766 1.8780 2.1409 2.1458 2.3600 2.3652 2.3929 2.4017 2.6463 2.6477 2.8878 2.8896 3.7339 3.7372 3.9566 3.9590 4.0942 4.0973 4.1628 4.1631 4.6285 4.6308 4.9093 4.9127 5.3340 5.3376 5.6249 5.6284 6.3229 6.3356 6.3796 6.4066 6.5536 6.5700 6.8427 6.8826 6.9899 7.0161 7.1187 7.1254 7.2155 7.2270 7.4356 7.4414 7.6934 7.6996 8.2989 8.2998 12.3656 12.3684 13.1697 13.1716 13.5731 13.5745 14.5559 14.5580 15.2051 15.2066 15.5518 15.5530 k = 0.4419-0.3013 0.0027 ( 9701 PWs) bands (ev): -84.3029 -84.3029 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3685 -15.3685 -14.4498 -14.4497 -12.7949 -12.7945 -12.4239 -12.4232 -12.2753 -12.2741 -12.1124 -12.1118 -11.5360 -11.5358 -3.3353 -3.3350 -1.8122 -1.8117 -0.7570 -0.7567 -0.1201 -0.1188 0.3070 0.3081 0.8110 0.8141 0.9672 0.9693 1.8641 1.8659 2.1338 2.1387 2.3639 2.3679 2.4092 2.4188 2.6484 2.6502 2.8955 2.8978 3.7177 3.7214 3.9617 3.9643 4.0987 4.1025 4.1668 4.1672 4.6247 4.6274 4.9118 4.9160 5.3320 5.3364 5.6087 5.6127 6.3207 6.3358 6.3785 6.4103 6.5519 6.5722 6.8406 6.8877 6.9920 7.0229 7.1210 7.1286 7.2148 7.2291 7.4327 7.4400 7.6922 7.7000 8.2969 8.2980 12.3364 12.3397 13.1773 13.1795 13.5661 13.5678 14.5717 14.5744 15.2117 15.2136 15.5502 15.5517 k = 0.4302-0.2934 0.0026 ( 9694 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3725 -15.3724 -14.4471 -14.4470 -12.7972 -12.7968 -12.4217 -12.4208 -12.2724 -12.2710 -12.1107 -12.1101 -11.5376 -11.5372 -3.3369 -3.3365 -1.8132 -1.8126 -0.7528 -0.7524 -0.1246 -0.1231 0.3145 0.3159 0.7942 0.7974 0.9779 0.9799 1.8467 1.8490 2.1318 2.1366 2.3668 2.3701 2.4250 2.4350 2.6518 2.6540 2.9052 2.9080 3.6995 3.7037 3.9670 3.9697 4.1038 4.1084 4.1715 4.1720 4.6203 4.6234 4.9149 4.9199 5.3296 5.3348 5.5903 5.5943 6.3183 6.3356 6.3780 6.4136 6.5503 6.5744 6.8388 6.8916 6.9956 7.0300 7.1242 7.1321 7.2144 7.2312 7.4295 7.4380 7.6909 7.7004 8.2945 8.2958 12.3022 12.3060 13.1852 13.1877 13.5583 13.5603 14.5910 14.5942 15.2194 15.2217 15.5481 15.5500 k = 0.4186-0.2855 0.0026 ( 9688 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3770 -15.3769 -14.4440 -14.4438 -12.8000 -12.7995 -12.4192 -12.4182 -12.2689 -12.2674 -12.1089 -12.1081 -11.5393 -11.5389 -3.3386 -3.3383 -1.8145 -1.8138 -0.7481 -0.7475 -0.1292 -0.1275 0.3227 0.3242 0.7774 0.7808 0.9881 0.9901 1.8246 1.8272 2.1346 2.1394 2.3697 2.3725 2.4389 2.4492 2.6566 2.6593 2.9168 2.9202 3.6799 3.6844 3.9722 3.9749 4.1093 4.1145 4.1767 4.1775 4.6155 4.6190 4.9186 4.9243 5.3267 5.3325 5.5702 5.5741 6.3159 6.3351 6.3781 6.4168 6.5490 6.5766 6.8372 6.8942 7.0005 7.0372 7.1280 7.1357 7.2142 7.2335 7.4259 7.4357 7.6892 7.7004 8.2917 8.2932 12.2637 12.2678 13.1930 13.1957 13.5499 13.5522 14.6135 14.6171 15.2279 15.2305 15.5455 15.5477 k = 0.4070-0.2775 0.0025 ( 9690 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3822 -15.3821 -14.4404 -14.4402 -12.8032 -12.8026 -12.4164 -12.4153 -12.2649 -12.2633 -12.1069 -12.1060 -11.5412 -11.5408 -3.3405 -3.3401 -1.8161 -1.8154 -0.7428 -0.7421 -0.1337 -0.1318 0.3312 0.3327 0.7609 0.7644 0.9979 0.9999 1.7986 1.8015 2.1413 2.1461 2.3730 2.3755 2.4504 2.4607 2.6629 2.6661 2.9304 2.9343 3.6591 3.6639 3.9772 3.9798 4.1149 4.1207 4.1824 4.1835 4.6105 4.6144 4.9230 4.9294 5.3231 5.3296 5.5490 5.5525 6.3134 6.3344 6.3786 6.4196 6.5478 6.5788 6.8355 6.8953 7.0063 7.0443 7.1323 7.1393 7.2141 7.2356 7.4218 7.4329 7.6873 7.7003 8.2883 8.2900 12.2213 12.2257 13.2003 13.2031 13.5413 13.5440 14.6390 14.6431 15.2369 15.2399 15.5422 15.5447 k = 0.3953-0.2696 0.0024 ( 9697 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3880 -15.3879 -14.4363 -14.4361 -12.8067 -12.8060 -12.4134 -12.4122 -12.2604 -12.2586 -12.1047 -12.1037 -11.5432 -11.5427 -3.3424 -3.3420 -1.8181 -1.8173 -0.7371 -0.7363 -0.1378 -0.1358 0.3395 0.3412 0.7448 0.7485 1.0073 1.0093 1.7697 1.7727 2.1504 2.1553 2.3768 2.3791 2.4597 2.4698 2.6703 2.6741 2.9460 2.9504 3.6375 3.6426 3.9820 3.9843 4.1202 4.1265 4.1887 4.1901 4.6055 4.6097 4.9278 4.9350 5.3189 5.3258 5.5275 5.5303 6.3107 6.3335 6.3794 6.4222 6.5469 6.5811 6.8337 6.8952 7.0125 7.0510 7.1366 7.1430 7.2144 7.2378 7.4172 7.4294 7.6850 7.6999 8.2844 8.2863 12.1755 12.1801 13.2066 13.2095 13.5330 13.5359 14.6673 14.6719 15.2461 15.2495 15.5382 15.5411 k = 0.3837-0.2617 0.0023 ( 9691 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3944 -15.3943 -14.4318 -14.4316 -12.8105 -12.8099 -12.4102 -12.4089 -12.2553 -12.2534 -12.1024 -12.1013 -11.5453 -11.5448 -3.3443 -3.3438 -1.8205 -1.8196 -0.7311 -0.7301 -0.1413 -0.1391 0.3475 0.3493 0.7295 0.7334 1.0165 1.0185 1.7387 1.7418 2.1605 2.1655 2.3812 2.3835 2.4674 2.4773 2.6787 2.6830 2.9635 2.9683 3.6154 3.6207 3.9864 3.9886 4.1249 4.1315 4.1955 4.1974 4.6007 4.6053 4.9333 4.9412 5.3138 5.3211 5.5062 5.5081 6.3080 6.3325 6.3804 6.4246 6.5461 6.5833 6.8318 6.8943 7.0191 7.0575 7.1406 7.1477 7.2152 7.2403 7.4125 7.4258 7.6829 7.6996 8.2803 8.2824 12.1267 12.1315 13.2118 13.2147 13.5252 13.5283 14.6980 14.7030 15.2555 15.2592 15.5335 15.5368 k = 0.3721-0.2537 0.0023 ( 9685 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4012 -15.4011 -14.4268 -14.4266 -12.8148 -12.8140 -12.4067 -12.4055 -12.2497 -12.2477 -12.1001 -12.0989 -11.5475 -11.5470 -3.3461 -3.3456 -1.8233 -1.8224 -0.7248 -0.7236 -0.1440 -0.1417 0.3546 0.3566 0.7151 0.7193 1.0256 1.0275 1.7064 1.7096 2.1704 2.1754 2.3861 2.3885 2.4745 2.4840 2.6875 2.6922 2.9828 2.9880 3.5929 3.5985 3.9905 3.9924 4.1286 4.1353 4.2030 4.2054 4.5966 4.6014 4.9393 4.9480 5.3077 5.3153 5.4858 5.4868 6.3052 6.3314 6.3815 6.4268 6.5456 6.5855 6.8297 6.8928 7.0254 7.0635 7.1436 7.1532 7.2164 7.2427 7.4074 7.4218 7.6804 7.6990 8.2762 8.2785 12.0753 12.0802 13.2157 13.2185 13.5183 13.5217 14.7307 14.7361 15.2648 15.2688 15.5281 15.5317 k = 0.3605-0.2458 0.0022 ( 9691 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4086 -15.4084 -14.4214 -14.4211 -12.8193 -12.8185 -12.4032 -12.4019 -12.2437 -12.2416 -12.0978 -12.0965 -11.5497 -11.5491 -3.3478 -3.3472 -1.8268 -1.8258 -0.7184 -0.7170 -0.1457 -0.1433 0.3607 0.3629 0.7020 0.7063 1.0344 1.0364 1.6733 1.6764 2.1791 2.1840 2.3912 2.3938 2.4820 2.4911 2.6965 2.7013 3.0035 3.0091 3.5704 3.5762 3.9941 3.9959 4.1308 4.1375 4.2112 4.2142 4.5932 4.5983 4.9457 4.9552 5.3003 5.3081 5.4663 5.4674 6.3024 6.3303 6.3825 6.4288 6.5452 6.5876 6.8272 6.8906 7.0310 7.0687 7.1454 7.1589 7.2178 7.2448 7.4018 7.4172 7.6777 7.6981 8.2712 8.2737 12.0216 12.0266 13.2180 13.2208 13.5128 13.5164 14.7649 14.7707 15.2737 15.2780 15.5220 15.5260 k = 0.3488-0.2379 0.0021 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4163 -15.4162 -14.4155 -14.4152 -12.8241 -12.8233 -12.3995 -12.3982 -12.2372 -12.2350 -12.0955 -12.0941 -11.5518 -11.5512 -3.3492 -3.3486 -1.8308 -1.8298 -0.7119 -0.7103 -0.1462 -0.1437 0.3654 0.3678 0.6902 0.6948 1.0433 1.0452 1.6398 1.6429 2.1857 2.1905 2.3958 2.3987 2.4911 2.4998 2.7053 2.7102 3.0253 3.0312 3.5480 3.5540 3.9974 3.9989 4.1314 4.1379 4.2203 4.2239 4.5911 4.5964 4.9526 4.9628 5.2916 5.2996 5.4482 5.4506 6.2995 6.3291 6.3836 6.4306 6.5450 6.5896 6.8247 6.8883 7.0361 7.0736 7.1467 7.1650 7.2197 7.2470 7.3960 7.4123 7.6750 7.6971 8.2661 8.2687 11.9659 11.9710 13.2188 13.2214 13.5089 13.5128 14.7999 14.8061 15.2822 15.2869 15.5154 15.5199 k = 0.3372-0.2300 0.0021 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4245 -15.4243 -14.4092 -14.4090 -12.8293 -12.8284 -12.3957 -12.3944 -12.2304 -12.2282 -12.0933 -12.0918 -11.5538 -11.5532 -3.3503 -3.3497 -1.8356 -1.8346 -0.7054 -0.7036 -0.1454 -0.1428 0.3684 0.3710 0.6801 0.6848 1.0521 1.0539 1.6063 1.6094 2.1902 2.1948 2.3994 2.4025 2.5024 2.5106 2.7138 2.7186 3.0478 3.0540 3.5259 3.5321 4.0001 4.0015 4.1301 4.1362 4.2301 4.2342 4.5906 4.5960 4.9599 4.9709 5.2816 5.2897 5.4323 5.4362 6.2965 6.3277 6.3845 6.4324 6.5449 6.5915 6.8220 6.8857 7.0406 7.0777 7.1473 7.1709 7.2218 7.2489 7.3896 7.4068 7.6720 7.6958 8.2605 8.2633 11.9085 11.9135 13.2180 13.2204 13.5071 13.5112 14.8352 14.8417 15.2903 15.2952 15.5085 15.5135 k = 0.3256-0.2220 0.0020 ( 9676 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0023 -48.3955 -48.3955 -48.0610 -48.0610 -15.4330 -15.4328 -14.4026 -14.4023 -12.8347 -12.8338 -12.3918 -12.3906 -12.2233 -12.2210 -12.0913 -12.0897 -11.5557 -11.5551 -3.3509 -3.3504 -1.8412 -1.8401 -0.6989 -0.6968 -0.1432 -0.1405 0.3696 0.3725 0.6717 0.6766 1.0609 1.0627 1.5729 1.5760 2.1923 2.1967 2.4018 2.4050 2.5161 2.5239 2.7220 2.7266 3.0704 3.0769 3.5046 3.5109 4.0023 4.0036 4.1269 4.1326 4.2405 4.2452 4.5919 4.5975 4.9676 4.9793 5.2705 5.2786 5.4189 5.4242 6.2935 6.3263 6.3854 6.4340 6.5449 6.5933 6.8192 6.8831 7.0443 7.0814 7.1478 7.1768 7.2240 7.2506 7.3829 7.4008 7.6688 7.6942 8.2553 8.2582 11.8496 11.8546 13.2154 13.2178 13.5077 13.5119 14.8697 14.8765 15.2978 15.3030 15.5017 15.5071 k = 0.3140-0.2141 0.0019 ( 9680 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4417 -15.4416 -14.3956 -14.3953 -12.8403 -12.8394 -12.3878 -12.3866 -12.2159 -12.2136 -12.0895 -12.0877 -11.5574 -11.5568 -3.3511 -3.3506 -1.8476 -1.8466 -0.6925 -0.6902 -0.1395 -0.1368 0.3690 0.3720 0.6650 0.6700 1.0698 1.0715 1.5399 1.5429 2.1924 2.1965 2.4029 2.4062 2.5317 2.5391 2.7300 2.7343 3.0926 3.0993 3.4842 3.4907 4.0038 4.0052 4.1218 4.1269 4.2514 4.2565 4.5956 4.6012 4.9755 4.9880 5.2585 5.2667 5.4080 5.4144 6.2905 6.3247 6.3861 6.4356 6.5450 6.5949 6.8162 6.8804 7.0471 7.0843 7.1477 7.1819 7.2261 7.2517 7.3756 7.3942 7.6650 7.6919 8.2491 8.2522 11.7895 11.7945 13.2112 13.2134 13.5110 13.5153 14.9028 14.9098 15.3046 15.3103 15.4954 15.5014 k = 0.3023-0.2062 0.0018 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4507 -15.4505 -14.3882 -14.3879 -12.8462 -12.8453 -12.3838 -12.3827 -12.2084 -12.2061 -12.0878 -12.0859 -11.5589 -11.5583 -3.3508 -3.3502 -1.8551 -1.8541 -0.6861 -0.6836 -0.1343 -0.1315 0.3664 0.3697 0.6600 0.6651 1.0786 1.0802 1.5074 1.5104 2.1908 2.1945 2.4030 2.4063 2.5483 2.5556 2.7379 2.7419 3.1136 3.1205 3.4653 3.4719 4.0047 4.0062 4.1149 4.1195 4.2625 4.2680 4.6020 4.6076 4.9836 4.9968 5.2464 5.2544 5.3993 5.4066 6.2874 6.3230 6.3868 6.4370 6.5452 6.5964 6.8133 6.8777 7.0494 7.0867 7.1475 7.1868 7.2283 7.2525 7.3680 7.3871 7.6607 7.6889 8.2427 8.2460 11.7285 11.7334 13.2055 13.2075 13.5171 13.5214 14.9336 14.9406 15.3107 15.3169 15.4903 15.4968 k = 0.2907-0.1982 0.0018 ( 9682 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3955 -48.0610 -48.0610 -15.4598 -15.4597 -14.3806 -14.3803 -12.8522 -12.8513 -12.3797 -12.3786 -12.2008 -12.1985 -12.0864 -12.0844 -11.5601 -11.5595 -3.3498 -3.3493 -1.8636 -1.8625 -0.6798 -0.6771 -0.1276 -0.1246 0.3621 0.3655 0.6566 0.6617 1.0873 1.0889 1.4756 1.4786 2.1879 2.1912 2.4024 2.4056 2.5651 2.5723 2.7458 2.7495 3.1328 3.1396 3.4485 3.4550 4.0049 4.0065 4.1064 4.1105 4.2737 4.2795 4.6113 4.6169 4.9919 5.0057 5.2344 5.2423 5.3926 5.4005 6.2843 6.3211 6.3872 6.4383 6.5454 6.5977 6.8103 6.8752 7.0509 7.0885 7.1474 7.1912 7.2304 7.2530 7.3599 7.3796 7.6560 7.6853 8.2361 8.2394 11.6666 11.6715 13.1982 13.2001 13.5261 13.5305 14.9611 14.9682 15.3159 15.3225 15.4870 15.4941 k = 0.2791-0.1903 0.0017 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4691 -15.4690 -14.3726 -14.3723 -12.8584 -12.8575 -12.3756 -12.3746 -12.1932 -12.1909 -12.0853 -12.0831 -11.5610 -11.5604 -3.3482 -3.3476 -1.8732 -1.8722 -0.6736 -0.6706 -0.1194 -0.1163 0.3563 0.3598 0.6546 0.6596 1.0959 1.0974 1.4445 1.4475 2.1840 2.1869 2.4014 2.4044 2.5812 2.5884 2.7540 2.7574 3.1491 3.1558 3.4344 3.4407 4.0042 4.0061 4.0965 4.1002 4.2848 4.2908 4.6238 4.6293 5.0002 5.0147 5.2232 5.2309 5.3874 5.3958 6.2812 6.3191 6.3876 6.4396 6.5457 6.5988 6.8075 6.8727 7.0519 7.0896 7.1476 7.1952 7.2325 7.2531 7.3515 7.3716 7.6506 7.6810 8.2294 8.2329 11.6043 11.6090 13.1895 13.1914 13.5381 13.5425 14.9847 14.9918 15.3196 15.3267 15.4864 15.4941 k = 0.2674-0.1824 0.0016 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4785 -15.4783 -14.3644 -14.3641 -12.8648 -12.8639 -12.3714 -12.3704 -12.1856 -12.1834 -12.0843 -12.0821 -11.5616 -11.5610 -3.3458 -3.3453 -1.8839 -1.8829 -0.6674 -0.6642 -0.1097 -0.1066 0.3492 0.3529 0.6538 0.6586 1.1041 1.1056 1.4143 1.4173 2.1795 2.1820 2.4001 2.4030 2.5961 2.6032 2.7626 2.7658 3.1616 3.1679 3.4238 3.4298 4.0026 4.0049 4.0855 4.0890 4.2956 4.3016 4.6396 4.6449 5.0085 5.0234 5.2132 5.2205 5.3836 5.3922 6.2782 6.3168 6.3878 6.4407 6.5460 6.5997 6.8047 6.8704 7.0520 7.0897 7.1478 7.1984 7.2344 7.2528 7.3425 7.3631 7.6445 7.6758 8.2226 8.2262 11.5417 11.5463 13.1797 13.1817 13.5530 13.5574 15.0041 15.0109 15.3216 15.3290 15.4892 15.4973 k = 0.2558-0.1745 0.0016 ( 9676 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0610 -48.0610 -15.4878 -15.4877 -14.3560 -14.3558 -12.8713 -12.8703 -12.3672 -12.3663 -12.1783 -12.1760 -12.0837 -12.0813 -11.5619 -11.5613 -3.3427 -3.3422 -1.8959 -1.8949 -0.6612 -0.6578 -0.0988 -0.0956 0.3412 0.3449 0.6539 0.6585 1.1119 1.1133 1.3851 1.3881 2.1748 2.1769 2.3985 2.4015 2.6090 2.6160 2.7718 2.7748 3.1696 3.1752 3.4174 3.4230 4.0000 4.0027 4.0737 4.0772 4.3059 4.3121 4.6588 4.6639 5.0167 5.0319 5.2046 5.2115 5.3808 5.3896 6.2752 6.3145 6.3879 6.4417 6.5463 6.6005 6.8022 6.8682 7.0517 7.0892 7.1483 7.2012 7.2364 7.2525 7.3333 7.3544 7.6378 7.6698 8.2158 8.2194 11.4790 11.4835 13.1690 13.1710 13.5707 13.5751 15.0190 15.0256 15.3213 15.3289 15.4958 15.5041 k = 0.2442-0.1665 0.0015 ( 9676 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0610 -48.0610 -15.4972 -15.4970 -14.3475 -14.3472 -12.8778 -12.8769 -12.3630 -12.3621 -12.1712 -12.1690 -12.0832 -12.0807 -11.5618 -11.5612 -3.3387 -3.3382 -1.9090 -1.9081 -0.6548 -0.6513 -0.0866 -0.0834 0.3326 0.3363 0.6547 0.6591 1.1190 1.1204 1.3570 1.3601 2.1701 2.1719 2.3970 2.4000 2.6196 2.6263 2.7815 2.7844 3.1726 3.1774 3.4152 3.4206 3.9963 3.9995 4.0615 4.0654 4.3158 4.3220 4.6812 4.6859 5.0246 5.0400 5.1978 5.2042 5.3791 5.3879 6.2722 6.3119 6.3879 6.4425 6.5466 6.6011 6.7996 6.8660 7.0508 7.0878 7.1490 7.2031 7.2384 7.2519 7.3238 7.3455 7.6302 7.6629 8.2088 8.2125 11.4165 11.4209 13.1575 13.1597 13.5911 13.5954 15.0297 15.0359 15.3187 15.3264 15.5058 15.5143 k = 0.2326-0.1586 0.0014 ( 9670 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5064 -15.5063 -14.3388 -14.3385 -12.8844 -12.8835 -12.3587 -12.3579 -12.1645 -12.1624 -12.0829 -12.0802 -11.5614 -11.5608 -3.3339 -3.3335 -1.9234 -1.9225 -0.6484 -0.6447 -0.0735 -0.0703 0.3235 0.3273 0.6559 0.6601 1.1251 1.1265 1.3302 1.3335 2.1656 2.1672 2.3954 2.3985 2.6278 2.6342 2.7916 2.7945 3.1708 3.1748 3.4170 3.4223 3.9913 3.9951 4.0494 4.0539 4.3252 4.3314 4.7065 4.7109 5.0322 5.0475 5.1928 5.1988 5.3781 5.3870 6.2692 6.3092 6.3879 6.4433 6.5469 6.6015 6.7973 6.8639 7.0494 7.0857 7.1499 7.2043 7.2405 7.2515 7.3142 7.3365 7.6221 7.6553 8.2019 8.2057 11.3545 11.3588 13.1455 13.1479 13.6139 13.6182 15.0365 15.0423 15.3139 15.3215 15.5188 15.5272 k = 0.2209-0.1507 0.0013 ( 9674 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5156 -15.5154 -14.3301 -14.3298 -12.8910 -12.8902 -12.3545 -12.3537 -12.1584 -12.1562 -12.0826 -12.0799 -11.5607 -11.5600 -3.3283 -3.3278 -1.9390 -1.9381 -0.6418 -0.6381 -0.0597 -0.0564 0.3145 0.3182 0.6576 0.6616 1.1297 1.1312 1.3051 1.3086 2.1617 2.1631 2.3939 2.3972 2.6334 2.6394 2.8018 2.8048 3.1652 3.1687 3.4217 3.4273 3.9850 3.9894 4.0377 4.0431 4.3341 4.3403 4.7345 4.7384 5.0394 5.0545 5.1899 5.1956 5.3779 5.3868 6.2664 6.3063 6.3877 6.4438 6.5472 6.6018 6.7950 6.8617 7.0474 7.0826 7.1508 7.2044 7.2424 7.2509 7.3044 7.3276 7.6130 7.6466 8.1948 8.1986 11.2932 11.2973 13.1331 13.1357 13.6390 13.6433 15.0400 15.0454 15.3073 15.3147 15.5337 15.5420 k = 0.2093-0.1427 0.0013 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0609 -48.0609 -15.5245 -15.5244 -14.3213 -14.3210 -12.8976 -12.8968 -12.3503 -12.3494 -12.1528 -12.1508 -12.0823 -12.0795 -11.5596 -11.5589 -3.3218 -3.3214 -1.9557 -1.9548 -0.6351 -0.6312 -0.0453 -0.0420 0.3057 0.3095 0.6595 0.6632 1.1324 1.1341 1.2820 1.2858 2.1585 2.1599 2.3926 2.3961 2.6368 2.6422 2.8114 2.8146 3.1570 3.1603 3.4282 3.4342 3.9773 3.9823 4.0270 4.0331 4.3426 4.3487 4.7645 4.7679 5.0464 5.0609 5.1890 5.1948 5.3784 5.3873 6.2636 6.3032 6.3876 6.4442 6.5475 6.6019 6.7928 6.8594 7.0448 7.0789 7.1517 7.2035 7.2440 7.2504 7.2946 7.3189 7.6031 7.6371 8.1879 8.1917 11.2327 11.2367 13.1207 13.1233 13.6661 13.6703 15.0409 15.0459 15.2992 15.3065 15.5496 15.5580 k = 0.1977-0.1348 0.0012 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3955 -48.0610 -48.0610 -15.5333 -15.5332 -14.3126 -14.3123 -12.9042 -12.9034 -12.3461 -12.3452 -12.1480 -12.1461 -12.0817 -12.0790 -11.5582 -11.5575 -3.3145 -3.3141 -1.9734 -1.9726 -0.6281 -0.6243 -0.0307 -0.0275 0.2975 0.3013 0.6615 0.6650 1.1323 1.1344 1.2617 1.2659 2.1560 2.1575 2.3914 2.3953 2.6379 2.6429 2.8200 2.8234 3.1478 3.1512 3.4356 3.4419 3.9686 3.9739 4.0174 4.0240 4.3506 4.3568 4.7958 4.7986 5.0533 5.0670 5.1901 5.1964 5.3795 5.3884 6.2609 6.3000 6.3874 6.4444 6.5478 6.6018 6.7908 6.8570 7.0419 7.0746 7.1524 7.2018 7.2453 7.2501 7.2852 7.3106 7.5922 7.6265 8.1810 8.1848 11.1735 11.1773 13.1082 13.1109 13.6949 13.6990 15.0396 15.0442 15.2901 15.2972 15.5659 15.5742 k = 0.1860-0.1269 0.0011 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0609 -48.0609 -15.5417 -15.5416 -14.3039 -14.3037 -12.9107 -12.9099 -12.3419 -12.3410 -12.1440 -12.1423 -12.0809 -12.0782 -11.5566 -11.5559 -3.3064 -3.3060 -1.9920 -1.9912 -0.6210 -0.6171 -0.0163 -0.0130 0.2901 0.2940 0.6637 0.6670 1.1286 1.1313 1.2450 1.2495 2.1546 2.1562 2.3905 2.3947 2.6371 2.6416 2.8267 2.8305 3.1390 3.1427 3.4429 3.4496 3.9592 3.9645 4.0088 4.0157 4.3584 4.3645 4.8275 4.8297 5.0605 5.0731 5.1932 5.2003 5.3814 5.3904 6.2584 6.2967 6.3873 6.4443 6.5481 6.6016 6.7890 6.8544 7.0388 7.0702 7.1532 7.1993 7.2460 7.2501 7.2765 7.3034 7.5811 7.6157 8.1746 8.1784 11.1157 11.1194 13.0958 13.0986 13.7251 13.7291 15.0367 15.0410 15.2802 15.2872 15.5821 15.5903 k = 0.1744-0.1189 0.0011 ( 9682 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0609 -48.0609 -15.5499 -15.5498 -14.2954 -14.2951 -12.9170 -12.9162 -12.3378 -12.3369 -12.1411 -12.1396 -12.0797 -12.0771 -11.5548 -11.5540 -3.2975 -3.2972 -2.0115 -2.0107 -0.6137 -0.6099 -0.0023 0.0009 0.2840 0.2879 0.6658 0.6690 1.1208 1.1240 1.2326 1.2373 2.1543 2.1560 2.3899 2.3944 2.6346 2.6385 2.8308 2.8350 3.1319 3.1360 3.4494 3.4564 3.9495 3.9546 4.0011 4.0079 4.3659 4.3718 4.8585 4.8600 5.0687 5.0798 5.1981 5.2062 5.3839 5.3931 6.2560 6.2934 6.3871 6.4440 6.5485 6.6013 6.7873 6.8516 7.0351 7.0651 7.1536 7.1960 7.2449 7.2504 7.2690 7.2972 7.5694 7.6041 8.1684 8.1721 11.0596 11.0631 13.0837 13.0866 13.7563 13.7603 15.0326 15.0366 15.2697 15.2765 15.5977 15.6059 k = 0.1628-0.1110 0.0010 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5578 -15.5577 -14.2871 -14.2868 -12.9232 -12.9225 -12.3337 -12.3328 -12.1391 -12.1380 -12.0779 -12.0756 -11.5527 -11.5520 -3.2880 -3.2877 -2.0316 -2.0309 -0.6062 -0.6025 0.0108 0.0140 0.2795 0.2833 0.6680 0.6710 1.1089 1.1125 1.2243 1.2291 2.1550 2.1570 2.3897 2.3945 2.6306 2.6340 2.8317 2.8362 3.1276 3.1320 3.4547 3.4619 3.9399 3.9446 3.9940 4.0006 4.3731 4.3789 4.8871 4.8885 5.0788 5.0881 5.2048 5.2139 5.3873 5.3967 6.2538 6.2899 6.3871 6.4435 6.5489 6.6007 6.7856 6.8485 7.0313 7.0599 7.1536 7.1918 7.2414 7.2512 7.2633 7.2925 7.5573 7.5920 8.1625 8.1661 11.0055 11.0088 13.0720 13.0749 13.7883 13.7921 15.0277 15.0315 15.2589 15.2655 15.6126 15.6207 k = 0.1512-0.1031 0.0009 ( 9680 PWs) bands (ev): -84.3026 -84.3026 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5652 -15.5651 -14.2790 -14.2787 -12.9292 -12.9285 -12.3297 -12.3288 -12.1382 -12.1373 -12.0757 -12.0736 -11.5505 -11.5498 -3.2779 -3.2776 -2.0522 -2.0515 -0.5987 -0.5951 0.0227 0.0257 0.2768 0.2806 0.6702 0.6730 1.0940 1.0979 1.2193 1.2241 2.1569 2.1592 2.3899 2.3950 2.6251 2.6281 2.8291 2.8339 3.1268 3.1316 3.4585 3.4658 3.9306 3.9349 3.9874 3.9937 4.3800 4.3856 4.9116 4.9140 5.0915 5.0989 5.2129 5.2228 5.3916 5.4013 6.2517 6.2864 6.3870 6.4426 6.5494 6.6000 6.7841 6.8450 7.0272 7.0542 7.1532 7.1871 7.2360 7.2522 7.2591 7.2897 7.5450 7.5797 8.1568 8.1603 10.9536 10.9568 13.0608 13.0637 13.8207 13.8244 15.0224 15.0259 15.2478 15.2543 15.6267 15.6347 k = 0.1395-0.0952 0.0009 ( 9673 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5722 -15.5722 -14.2712 -14.2710 -12.9349 -12.9343 -12.3258 -12.3249 -12.1381 -12.1375 -12.0731 -12.0713 -11.5483 -11.5476 -3.2673 -3.2670 -2.0729 -2.0723 -0.5912 -0.5878 0.0329 0.0358 0.2762 0.2800 0.6724 0.6750 1.0772 1.0812 1.2165 1.2210 2.1600 2.1624 2.3905 2.3960 2.6185 2.6210 2.8230 2.8279 3.1298 3.1349 3.4606 3.4680 3.9218 3.9258 3.9811 3.9870 4.3866 4.3920 4.9313 4.9350 5.1073 5.1127 5.2223 5.2329 5.3970 5.4071 6.2499 6.2829 6.3871 6.4414 6.5501 6.5991 6.7826 6.8411 7.0233 7.0488 7.1524 7.1818 7.2297 7.2522 7.2569 7.2884 7.5328 7.5674 8.1515 8.1549 10.9043 10.9072 13.0502 13.0530 13.8530 13.8566 15.0168 15.0202 15.2366 15.2430 15.6399 15.6477 k = 0.1279-0.0872 0.0008 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5788 -15.5788 -14.2638 -14.2636 -12.9404 -12.9398 -12.3221 -12.3211 -12.1389 -12.1384 -12.0703 -12.0688 -11.5460 -11.5453 -3.2564 -3.2561 -2.0937 -2.0931 -0.5838 -0.5805 0.0412 0.0439 0.2780 0.2816 0.6746 0.6770 1.0594 1.0635 1.2149 1.2192 2.1640 2.1667 2.3918 2.3976 2.6107 2.6129 2.8138 2.8188 3.1364 3.1418 3.4609 3.4683 3.9138 3.9173 3.9751 3.9807 4.3929 4.3980 4.9461 4.9509 5.1259 5.1294 5.2326 5.2437 5.4039 5.4143 6.2483 6.2794 6.3873 6.4398 6.5508 6.5979 6.7812 6.8369 7.0191 7.0429 7.1511 7.1762 7.2235 7.2494 7.2577 7.2882 7.5209 7.5551 8.1466 8.1498 10.8577 10.8604 13.0401 13.0429 13.8850 13.8884 15.0113 15.0144 15.2255 15.2316 15.6522 15.6598 k = 0.1163-0.0793 0.0007 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5850 -15.5849 -14.2568 -14.2566 -12.9456 -12.9450 -12.3185 -12.3175 -12.1402 -12.1398 -12.0674 -12.0661 -11.5437 -11.5431 -3.2453 -3.2451 -2.1142 -2.1136 -0.5765 -0.5734 0.0475 0.0500 0.2820 0.2854 0.6766 0.6789 1.0415 1.0455 1.2139 1.2179 2.1690 2.1718 2.3936 2.3997 2.6019 2.6037 2.8022 2.8071 3.1462 3.1519 3.4593 3.4666 3.9064 3.9096 3.9695 3.9746 4.3989 4.4037 4.9565 4.9621 5.1459 5.1479 5.2436 5.2548 5.4124 5.4232 6.2469 6.2759 6.3876 6.4379 6.5516 6.5966 6.7799 6.8322 7.0149 7.0371 7.1490 7.1702 7.2180 7.2455 7.2595 7.2887 7.5096 7.5430 8.1419 8.1449 10.8141 10.8166 13.0308 13.0334 13.9161 13.9194 15.0060 15.0089 15.2146 15.2205 15.6637 15.6709 k = 0.1047-0.0714 0.0006 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5906 -15.5905 -14.2502 -14.2501 -12.9504 -12.9498 -12.3151 -12.3141 -12.1420 -12.1415 -12.0645 -12.0634 -11.5415 -11.5409 -3.2342 -3.2340 -2.1341 -2.1336 -0.5695 -0.5667 0.0518 0.0541 0.2880 0.2911 0.6787 0.6807 1.0239 1.0279 1.2131 1.2169 2.1747 2.1777 2.3962 2.4025 2.5921 2.5937 2.7890 2.7938 3.1586 3.1645 3.4558 3.4631 3.8998 3.9027 3.9643 3.9689 4.4045 4.4089 4.9635 4.9694 5.1659 5.1669 5.2549 5.2658 5.4228 5.4338 6.2457 6.2725 6.3880 6.4356 6.5526 6.5949 6.7786 6.8271 7.0108 7.0313 7.1463 7.1640 7.2134 7.2416 7.2614 7.2890 7.4990 7.5312 8.1377 8.1405 10.7738 10.7761 13.0222 13.0247 13.9460 13.9491 15.0009 15.0038 15.2039 15.2095 15.6742 15.6810 k = 0.0930-0.0634 0.0006 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5957 -15.5956 -14.2442 -14.2441 -12.9548 -12.9543 -12.3118 -12.3109 -12.1440 -12.1435 -12.0617 -12.0608 -11.5393 -11.5388 -3.2234 -3.2232 -2.1532 -2.1527 -0.5628 -0.5602 0.0545 0.0565 0.2955 0.2984 0.6806 0.6824 1.0070 1.0109 1.2124 1.2159 2.1810 2.1841 2.3995 2.4061 2.5814 2.5828 2.7751 2.7797 3.1731 3.1790 3.4506 3.4578 3.8940 3.8965 3.9595 3.9636 4.4097 4.4137 4.9680 4.9739 5.1844 5.1852 5.2659 5.2762 5.4353 5.4462 6.2448 6.2691 6.3886 6.4329 6.5538 6.5930 6.7775 6.8218 7.0073 7.0260 7.1432 7.1579 7.2100 7.2377 7.2637 7.2896 7.4893 7.5200 8.1339 8.1364 10.7370 10.7391 13.0145 13.0167 13.9743 13.9771 14.9964 14.9991 15.1937 15.1990 15.6838 15.6901 k = 0.0814-0.0555 0.0005 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0608 -15.6002 -15.6002 -14.2388 -14.2387 -12.9588 -12.9583 -12.3089 -12.3080 -12.1461 -12.1455 -12.0591 -12.0583 -11.5373 -11.5368 -3.2130 -3.2128 -2.1711 -2.1707 -0.5566 -0.5543 0.0558 0.0575 0.3042 0.3067 0.6824 0.6840 0.9912 0.9950 1.2118 1.2149 2.1877 2.1907 2.4038 2.4105 2.5697 2.5713 2.7612 2.7655 3.1889 3.1949 3.4437 3.4508 3.8890 3.8912 3.9552 3.9588 4.4144 4.4179 4.9710 4.9765 5.2005 5.2018 5.2761 5.2855 5.4496 5.4600 6.2441 6.2659 6.3895 6.4299 6.5551 6.5909 6.7767 6.8162 7.0035 7.0204 7.1397 7.1520 7.2076 7.2338 7.2660 7.2900 7.4806 7.5093 8.1305 8.1329 10.7040 10.7058 13.0076 13.0096 14.0005 14.0030 14.9924 14.9949 15.1841 15.1890 15.6925 15.6982 k = 0.0698-0.0476 0.0004 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6042 -15.6041 -14.2340 -14.2339 -12.9623 -12.9619 -12.3062 -12.3053 -12.1482 -12.1476 -12.0567 -12.0561 -11.5355 -11.5351 -3.2033 -3.2031 -2.1875 -2.1871 -0.5510 -0.5490 0.0561 0.0575 0.3132 0.3154 0.6840 0.6855 0.9768 0.9803 1.2111 1.2139 2.1944 2.1973 2.4091 2.4158 2.5573 2.5591 2.7481 2.7520 3.2056 3.2116 3.4354 3.4423 3.8848 3.8866 3.9514 3.9545 4.4186 4.4217 4.9729 4.9779 5.2143 5.2161 5.2851 5.2933 5.4651 5.4747 6.2437 6.2628 6.3905 6.4265 6.5567 6.5885 6.7761 6.8106 7.0001 7.0149 7.1364 7.1465 7.2063 7.2303 7.2684 7.2901 7.4734 7.4995 8.1277 8.1298 10.6749 10.6765 13.0015 13.0033 14.0242 14.0265 14.9889 14.9912 15.1753 15.1797 15.7002 15.7052 k = 0.0581-0.0396 0.0004 ( 9660 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6076 -15.6075 -14.2298 -14.2297 -12.9653 -12.9650 -12.3038 -12.3031 -12.1501 -12.1495 -12.0546 -12.0541 -11.5339 -11.5336 -3.1945 -3.1944 -2.2020 -2.2017 -0.5460 -0.5443 0.0557 0.0569 0.3221 0.3239 0.6855 0.6868 0.9641 0.9671 1.2105 1.2129 2.2009 2.2036 2.4154 2.4221 2.5442 2.5464 2.7363 2.7396 3.2226 3.2285 3.4260 3.4326 3.8812 3.8827 3.9482 3.9508 4.4222 4.4249 4.9741 4.9785 5.2259 5.2278 5.2927 5.2996 5.4809 5.4894 6.2437 6.2598 6.3919 6.4229 6.5586 6.5859 6.7759 6.8050 6.9975 7.0100 7.1333 7.1415 7.2058 7.2269 7.2711 7.2900 7.4677 7.4906 8.1255 8.1272 10.6500 10.6513 12.9964 12.9979 14.0451 14.0471 14.9861 14.9882 15.1674 15.1713 15.7069 15.7113 k = 0.0465-0.0317 0.0003 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6104 -15.6103 -14.2264 -14.2263 -12.9678 -12.9676 -12.3017 -12.3011 -12.1518 -12.1513 -12.0529 -12.0525 -11.5326 -11.5323 -3.1869 -3.1868 -2.2144 -2.2142 -0.5417 -0.5403 0.0550 0.0559 0.3303 0.3318 0.6868 0.6878 0.9532 0.9559 1.2100 1.2120 2.2068 2.2092 2.4229 2.4293 2.5308 2.5334 2.7262 2.7290 3.2393 3.2450 3.4159 3.4221 3.8784 3.8796 3.9456 3.9477 4.4253 4.4275 4.9750 4.9785 5.2353 5.2372 5.2988 5.3043 5.4959 5.5030 6.2439 6.2570 6.3936 6.4191 6.5606 6.5831 6.7762 6.7997 6.9954 7.0056 7.1305 7.1370 7.2061 7.2236 7.2735 7.2892 7.4634 7.4825 8.1234 8.1248 10.6293 10.6304 12.9922 12.9934 14.0628 14.0644 14.9840 14.9857 15.1607 15.1639 15.7126 15.7162 k = 0.0349-0.0238 0.0002 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6126 -15.6125 -14.2237 -14.2236 -12.9698 -12.9696 -12.3001 -12.2996 -12.1532 -12.1527 -12.0515 -12.0512 -11.5315 -11.5313 -3.1807 -3.1806 -2.2244 -2.2242 -0.5383 -0.5373 0.0542 0.0549 0.3373 0.3384 0.6879 0.6887 0.9446 0.9466 1.2096 1.2111 2.2119 2.2139 2.4313 2.4373 2.5174 2.5204 2.7181 2.7203 3.2551 3.2602 3.4058 3.4112 3.8762 3.8771 3.9436 3.9451 4.4278 4.4294 4.9756 4.9783 5.2426 5.2443 5.3035 5.3075 5.5090 5.5145 6.2444 6.2544 6.3957 6.4153 6.5629 6.5801 6.7768 6.7946 6.9939 7.0017 7.1284 7.1332 7.2068 7.2203 7.2760 7.2882 7.4608 7.4756 8.1218 8.1229 10.6132 10.6140 12.9890 12.9899 14.0769 14.0781 14.9824 14.9838 15.1553 15.1579 15.7172 15.7199 k = 0.0233-0.0159 0.0001 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6141 -15.6141 -14.2217 -14.2217 -12.9712 -12.9711 -12.2989 -12.2985 -12.1541 -12.1538 -12.0505 -12.0503 -11.5307 -11.5305 -3.1761 -3.1760 -2.2317 -2.2316 -0.5358 -0.5350 0.0536 0.0540 0.3426 0.3433 0.6887 0.6892 0.9383 0.9397 1.2093 1.2104 2.2159 2.2173 2.4404 2.4456 2.5049 2.5080 2.7123 2.7138 3.2688 3.2729 3.3968 3.4011 3.8748 3.8754 3.9422 3.9433 4.4297 4.4308 4.9761 4.9779 5.2480 5.2492 5.3069 5.3096 5.5193 5.5231 6.2453 6.2520 6.3981 6.4114 6.5655 6.5771 6.7781 6.7900 6.9932 6.9985 7.1270 7.1302 7.2082 7.2174 7.2783 7.2866 7.4595 7.4697 8.1207 8.1214 10.6016 10.6021 12.9867 12.9873 14.0873 14.0881 14.9815 14.9824 15.1515 15.1532 15.7206 15.7225 k = 0.0116-0.0079 0.0001 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6151 -15.6151 -14.2205 -14.2205 -12.9720 -12.9720 -12.2981 -12.2979 -12.1547 -12.1546 -12.0498 -12.0497 -11.5302 -11.5301 -3.1733 -3.1732 -2.2362 -2.2361 -0.5341 -0.5338 0.0532 0.0534 0.3460 0.3464 0.6892 0.6895 0.9346 0.9354 1.2093 1.2098 2.2185 2.2192 2.4491 2.4526 2.4950 2.4975 2.7090 2.7097 3.2789 3.2813 3.3907 3.3931 3.8739 3.8742 3.9415 3.9420 4.4309 4.4315 4.9765 4.9774 5.2513 5.2520 5.3091 5.3104 5.5262 5.5281 6.2465 6.2499 6.4010 6.4077 6.5682 6.5741 6.7801 6.7861 6.9931 6.9958 7.1264 7.1280 7.2100 7.2147 7.2808 7.2850 7.4600 7.4651 8.1199 8.1203 10.5947 10.5949 12.9854 12.9857 14.0937 14.0941 14.9810 14.9815 15.1493 15.1502 15.7229 15.7238 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 k =-0.0116-0.0021 0.0076 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6151 -15.6151 -14.2205 -14.2205 -12.9721 -12.9721 -12.2978 -12.2977 -12.1548 -12.1548 -12.0499 -12.0497 -11.5302 -11.5301 -3.1732 -3.1732 -2.2362 -2.2361 -0.5340 -0.5336 0.0530 0.0532 0.3462 0.3467 0.6894 0.6896 0.9342 0.9351 1.2092 1.2097 2.2185 2.2192 2.4494 2.4530 2.4948 2.4973 2.7088 2.7094 3.2797 3.2816 3.3905 3.3924 3.8740 3.8745 3.9415 3.9419 4.4309 4.4317 4.9763 4.9774 5.2510 5.2524 5.3097 5.3104 5.5259 5.5277 6.2471 6.2494 6.4007 6.4080 6.5680 6.5744 6.7803 6.7859 6.9924 6.9965 7.1255 7.1290 7.2102 7.2146 7.2808 7.2853 7.4597 7.4660 8.1199 8.1202 10.5948 10.5950 12.9852 12.9855 14.0939 14.0943 14.9804 14.9810 15.1493 15.1503 15.7237 15.7241 k =-0.0233-0.0042 0.0153 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6141 -15.6141 -14.2216 -14.2216 -12.9715 -12.9714 -12.2979 -12.2977 -12.1547 -12.1547 -12.0505 -12.0503 -11.5306 -11.5305 -3.1760 -3.1760 -2.2318 -2.2316 -0.5351 -0.5345 0.0528 0.0533 0.3436 0.3445 0.6892 0.6897 0.9367 0.9385 1.2089 1.2100 2.2159 2.2172 2.4414 2.4467 2.5044 2.5075 2.7114 2.7126 3.2712 3.2745 3.3956 3.3990 3.8753 3.8763 3.9422 3.9430 4.4297 4.4313 4.9754 4.9775 5.2474 5.2501 5.3087 5.3102 5.5180 5.5216 6.2464 6.2511 6.3976 6.4121 6.5651 6.5777 6.7785 6.7895 6.9914 6.9995 7.1249 7.1318 7.2085 7.2172 7.2783 7.2872 7.4591 7.4713 8.1204 8.1210 10.6020 10.6025 12.9859 12.9864 14.0883 14.0891 14.9793 14.9803 15.1516 15.1536 15.7233 15.7241 k =-0.0349-0.0063 0.0229 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6126 -15.6125 -14.2235 -14.2234 -12.9705 -12.9703 -12.2979 -12.2978 -12.1546 -12.1545 -12.0516 -12.0512 -11.5313 -11.5311 -3.1806 -3.1805 -2.2245 -2.2243 -0.5370 -0.5360 0.0526 0.0533 0.3394 0.3408 0.6890 0.6896 0.9413 0.9438 1.2086 1.2102 2.2119 2.2138 2.4331 2.4393 2.5168 2.5198 2.7158 2.7177 3.2595 3.2637 3.4032 3.4077 3.8776 3.8790 3.9435 3.9447 4.4280 4.4305 4.9741 4.9773 5.2420 5.2457 5.3074 5.3095 5.5059 5.5112 6.2460 6.2531 6.3950 6.4163 6.5626 6.5811 6.7772 6.7937 6.9909 7.0028 7.1249 7.1353 7.2074 7.2199 7.2759 7.2888 7.4605 7.4783 8.1214 8.1224 10.6141 10.6149 12.9872 12.9880 14.0791 14.0804 14.9777 14.9792 15.1557 15.1585 15.7226 15.7239 k =-0.0465-0.0083 0.0306 ( 9662 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6104 -15.6103 -14.2261 -14.2260 -12.9691 -12.9689 -12.2981 -12.2978 -12.1543 -12.1542 -12.0530 -12.0525 -11.5323 -11.5320 -3.1867 -3.1866 -2.2146 -2.2143 -0.5394 -0.5381 0.0522 0.0531 0.3341 0.3358 0.6886 0.6894 0.9478 0.9511 1.2082 1.2104 2.2068 2.2091 2.4254 2.4321 2.5303 2.5330 2.7220 2.7244 3.2460 3.2507 3.4120 3.4170 3.8809 3.8828 3.9453 3.9469 4.4259 4.4291 4.9724 4.9766 5.2345 5.2389 5.3057 5.3086 5.4901 5.4970 6.2460 6.2554 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15.7227 k =-0.0698-0.0125 0.0459 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6042 -15.6041 -14.2333 -14.2332 -12.9651 -12.9647 -12.2988 -12.2984 -12.1534 -12.1533 -12.0570 -12.0563 -11.5349 -11.5345 -3.2028 -3.2026 -2.1878 -2.1874 -0.5461 -0.5442 0.0503 0.0517 0.3209 0.3233 0.6870 0.6882 0.9665 0.9709 1.2073 1.2103 2.1945 2.1972 2.4132 2.4202 2.5576 2.5594 2.7387 2.7420 3.2170 3.2222 3.4292 3.4349 3.8904 3.8929 3.9506 3.9530 4.4203 4.4251 4.9672 4.9733 5.2132 5.2177 5.3010 5.3062 5.4509 5.4610 6.2468 6.2608 6.3897 6.4285 6.5568 6.5905 6.7767 6.8083 6.9930 7.0154 7.1284 7.1497 7.2079 7.2283 7.2687 7.2913 7.4760 7.5063 8.1271 8.1290 10.6785 10.6800 12.9942 12.9957 14.0327 14.0349 14.9718 14.9739 15.1763 15.1811 15.7188 15.7215 k =-0.0814-0.0146 0.0535 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6002 -15.6002 -14.2379 -14.2378 -12.9626 -12.9621 -12.2994 -12.2989 -12.1528 -12.1526 -12.0595 -12.0587 -11.5365 -11.5360 -3.2123 -3.2121 -2.1715 -2.1711 -0.5502 -0.5481 0.0486 0.0502 0.3138 0.3165 0.6857 0.6871 0.9786 0.9833 1.2067 1.2101 2.1878 2.1906 2.4087 2.4156 2.5707 2.5722 2.7485 2.7522 3.2030 3.2082 3.4367 3.4426 3.8965 3.8993 3.9541 3.9569 4.4169 4.4224 4.9632 4.9700 5.1992 5.2033 5.2976 5.3046 5.4296 5.4412 6.2477 6.2639 6.3886 6.4321 6.5554 6.5932 6.7774 6.8134 6.9952 7.0206 7.1306 7.1556 7.2095 7.2310 7.2668 7.2918 7.4844 7.5175 8.1301 8.1323 10.7088 10.7105 12.9977 12.9993 14.0119 14.0143 14.9699 14.9720 15.1852 15.1905 15.7165 15.7197 k =-0.0930-0.0167 0.0612 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5957 -15.5956 -14.2431 -14.2429 -12.9596 -12.9591 -12.3002 -12.2997 -12.1520 -12.1518 -12.0624 -12.0615 -11.5382 -11.5377 -3.2224 -3.2223 -2.1537 -2.1532 -0.5548 -0.5524 0.0459 0.0477 0.3069 0.3099 0.6839 0.6856 0.9922 0.9973 1.2059 1.2096 2.1812 2.1839 2.4051 2.4119 2.5830 2.5845 2.7587 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-2.0728 -0.5769 -0.5736 0.0227 0.0253 0.2893 0.2928 0.6728 0.6754 1.0588 1.0644 1.2024 1.2072 2.1598 2.1617 2.3986 2.4043 2.6235 2.6260 2.7897 2.7938 3.1595 3.1641 3.4540 3.4605 3.9382 3.9413 3.9774 3.9825 4.3955 4.4042 4.9061 4.9134 5.1122 5.1173 5.2615 5.2764 5.3560 5.3704 6.2554 6.2824 6.3862 6.4450 6.5510 6.6013 6.7835 6.8358 7.0089 7.0456 7.1418 7.1850 7.2265 7.2436 7.2659 7.2974 7.5407 7.5789 8.1505 8.1541 10.9165 10.9192 13.0213 13.0234 13.8838 13.8870 14.9629 14.9644 15.2348 15.2415 15.6922 15.6982 k =-0.1512-0.0271 0.0994 ( 9674 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5652 -15.5651 -14.2763 -14.2761 -12.9405 -12.9397 -12.3100 -12.3094 -12.1459 -12.1453 -12.0811 -12.0795 -11.5482 -11.5476 -3.2750 -3.2747 -2.0526 -2.0518 -0.5830 -0.5796 0.0132 0.0159 0.2887 0.2923 0.6690 0.6718 1.0768 1.0824 1.2023 1.2075 2.1564 2.1581 2.3986 2.4040 2.6310 2.6340 2.7920 2.7959 3.1595 3.1640 3.4528 3.4593 3.9483 3.9514 3.9829 3.9885 4.3905 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11.0241 13.0329 13.0350 13.8293 13.8326 14.9605 14.9619 15.2527 15.2599 15.6754 15.6826 k =-0.1744-0.0313 0.1147 ( 9675 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5500 -15.5499 -14.2920 -14.2918 -12.9311 -12.9303 -12.3173 -12.3165 -12.1429 -12.1420 -12.0900 -12.0881 -11.5521 -11.5515 -3.2934 -3.2931 -2.0115 -2.0106 -0.5955 -0.5920 -0.0099 -0.0069 0.2925 0.2960 0.6602 0.6636 1.1098 1.1151 1.2078 1.2130 2.1524 2.1537 2.4001 2.4047 2.6424 2.6465 2.7879 2.7912 3.1696 3.1738 3.4456 3.4521 3.9693 3.9725 3.9940 4.0009 4.3800 4.3899 4.8239 4.8282 5.0776 5.0874 5.2302 5.2422 5.3513 5.3619 6.2624 6.2950 6.3858 6.4489 6.5493 6.6026 6.7877 6.8447 7.0188 7.0600 7.1450 7.1961 7.2324 7.2470 7.2839 7.3115 7.5762 7.6137 8.1674 8.1717 11.0767 11.0799 13.0389 13.0409 13.8030 13.8062 14.9591 14.9606 15.2602 15.2676 15.6657 15.6734 k =-0.1860-0.0334 0.1224 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 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5.3677 6.2708 6.3076 6.3857 6.4505 6.5481 6.6022 6.7921 6.8508 7.0278 7.0729 7.1436 7.2007 7.2326 7.2466 7.3145 7.3356 7.6065 7.6423 8.1874 8.1922 11.2542 11.2578 13.0565 13.0580 13.7321 13.7351 14.9517 14.9541 15.2718 15.2796 15.6348 15.6442 k =-0.2209-0.0396 0.1453 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3955 -48.0609 -48.0609 -15.5157 -15.5156 -14.3252 -14.3249 -12.9102 -12.9093 -12.3377 -12.3368 -12.1387 -12.1368 -12.1082 -12.1054 -11.5577 -11.5571 -3.3209 -3.3204 -1.9370 -1.9359 -0.6209 -0.6174 -0.0657 -0.0624 0.3151 0.3186 0.6386 0.6431 1.1354 1.1378 1.2701 1.2727 2.1541 2.1556 2.4084 2.4116 2.6415 2.6482 2.7586 2.7611 3.2140 3.2183 3.4179 3.4237 4.0038 4.0073 4.0240 4.0317 4.3530 4.3639 4.6938 4.6966 5.0530 5.0689 5.2041 5.2106 5.3642 5.3719 6.2738 6.3117 6.3857 6.4505 6.5478 6.6017 6.7936 6.8525 7.0301 7.0766 7.1419 7.2008 7.2320 7.2464 7.3254 7.3449 7.6149 7.6500 8.1941 8.1990 11.3159 11.3196 13.0620 13.0632 13.7122 13.7151 14.9476 14.9505 15.2707 15.2786 15.6257 15.6355 k =-0.2326-0.0417 0.1530 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0609 -48.0609 -15.5066 -15.5064 -14.3336 -14.3333 -12.9048 -12.9038 -12.3439 -12.3430 -12.1387 -12.1365 -12.1121 -12.1091 -11.5585 -11.5579 -3.3255 -3.3250 -1.9207 -1.9195 -0.6272 -0.6238 -0.0800 -0.0766 0.3224 0.3259 0.6328 0.6375 1.1342 1.1362 1.2949 1.2971 2.1560 2.1578 2.4114 2.4142 2.6337 2.6409 2.7519 2.7545 3.2241 3.2286 3.4116 3.4171 4.0085 4.0116 4.0346 4.0417 4.3437 4.3548 4.6655 4.6687 5.0469 5.0638 5.2026 5.2082 5.3697 5.3769 6.2769 6.3156 6.3856 6.4503 6.5475 6.6011 6.7954 6.8542 7.0323 7.0801 7.1399 7.2004 7.2315 7.2461 7.3365 7.3546 7.6223 7.6567 8.2014 8.2064 11.3783 11.3822 13.0672 13.0681 13.6945 13.6973 14.9422 14.9456 15.2667 15.2744 15.6182 15.6281 k =-0.2442-0.0438 0.1606 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4974 -15.4972 -14.3419 -14.3416 -12.8992 -12.8983 -12.3506 -12.3497 -12.1395 -12.1372 -12.1154 -12.1123 -11.5590 -11.5584 -3.3292 -3.3287 -1.9055 -1.9043 -0.6335 -0.6302 -0.0939 -0.0905 0.3298 0.3332 0.6269 0.6320 1.1317 1.1336 1.3216 1.3234 2.1581 2.1602 2.4144 2.4170 2.6225 2.6299 2.7467 2.7496 3.2304 3.2354 3.4079 3.4132 4.0118 4.0146 4.0453 4.0520 4.3328 4.3440 4.6409 4.6446 5.0401 5.0577 5.2034 5.2086 5.3761 5.3830 6.2800 6.3193 6.3855 6.4499 6.5473 6.6004 6.7972 6.8558 7.0339 7.0832 7.1374 7.1994 7.2307 7.2455 7.3473 7.3644 7.6289 7.6623 8.2086 8.2137 11.4413 11.4453 13.0719 13.0726 13.6792 13.6818 14.9352 14.9392 15.2597 15.2672 15.6127 15.6227 k =-0.2558-0.0459 0.1683 ( 9681 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4880 -15.4879 -14.3501 -14.3497 -12.8936 -12.8926 -12.3576 -12.3567 -12.1412 -12.1389 -12.1178 -12.1148 -11.5592 -11.5586 -3.3320 -3.3314 -1.8914 -1.8901 -0.6398 -0.6367 -0.1072 -0.1038 0.3369 0.3403 0.6214 0.6267 1.1286 1.1304 1.3497 1.3514 2.1603 2.1628 2.4176 2.4199 2.6083 2.6158 2.7432 2.7463 3.2313 3.2369 3.4084 3.4138 4.0140 4.0167 4.0556 4.0621 4.3201 4.3313 4.6207 4.6250 5.0326 5.0505 5.2067 5.2115 5.3834 5.3901 6.2831 6.3229 6.3854 6.4493 6.5471 6.5996 6.7991 6.8575 7.0351 7.0860 7.1344 7.1977 7.2300 7.2449 7.3578 7.3741 7.6346 7.6671 8.2158 8.2210 11.5046 11.5086 13.0762 13.0767 13.6663 13.6688 14.9261 14.9308 15.2501 15.2572 15.6096 15.6194 k =-0.2674-0.0480 0.1759 ( 9683 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4787 -15.4786 -14.3581 -14.3578 -12.8880 -12.8870 -12.3650 -12.3640 -12.1437 -12.1417 -12.1194 -12.1167 -11.5590 -11.5585 -3.3339 -3.3333 -1.8784 -1.8771 -0.6462 -0.6432 -0.1197 -0.1163 0.3432 0.3466 0.6166 0.6219 1.1251 1.1269 1.3790 1.3805 2.1625 2.1653 2.4204 2.4227 2.5921 2.5996 2.7409 2.7444 3.2257 3.2320 3.4141 3.4197 4.0153 4.0178 4.0652 4.0717 4.3056 4.3166 4.6052 4.6099 5.0245 5.0422 5.2121 5.2167 5.3918 5.3983 6.2863 6.3262 6.3853 6.4484 6.5470 6.5986 6.8011 6.8592 7.0359 7.0884 7.1309 7.1956 7.2290 7.2438 7.3679 7.3837 7.6395 7.6710 8.2230 8.2281 11.5678 11.5719 13.0799 13.0804 13.6558 13.6581 14.9146 14.9200 15.2386 15.2451 15.6089 15.6183 k =-0.2791-0.0501 0.1836 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0023 -50.0023 -48.3955 -48.3955 -48.0610 -48.0610 -15.4694 -15.4693 -14.3659 -14.3656 -12.8824 -12.8814 -12.3726 -12.3716 -12.1470 -12.1453 -12.1203 -12.1180 -11.5586 -11.5581 -3.3349 -3.3343 -1.8665 -1.8652 -0.6526 -0.6498 -0.1312 -0.1278 0.3485 0.3518 0.6127 0.6181 1.1214 1.1232 1.4092 1.4106 2.1643 2.1676 2.4226 2.4249 2.5750 2.5825 2.7394 2.7433 3.2139 3.2206 3.4249 3.4307 4.0157 4.0181 4.0739 4.0805 4.2895 4.3003 4.5945 4.5995 5.0157 5.0331 5.2194 5.2239 5.4015 5.4077 6.2895 6.3293 6.3850 6.4473 6.5469 6.5976 6.8033 6.8612 7.0363 7.0906 7.1273 7.1930 7.2280 7.2425 7.3775 7.3928 7.6440 7.6744 8.2303 8.2355 11.6309 11.6350 13.0831 13.0837 13.6477 13.6499 14.9005 14.9065 15.2259 15.2319 15.6103 15.6192 k =-0.2907-0.0521 0.1912 ( 9674 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4602 -15.4600 -14.3735 -14.3731 -12.8768 -12.8758 -12.3804 -12.3794 -12.1507 -12.1493 -12.1209 -12.1190 -11.5579 -11.5573 -3.3352 -3.3346 -1.8558 -1.8544 -0.6591 -0.6566 -0.1416 -0.1382 0.3521 0.3554 0.6101 0.6156 1.1177 1.1195 1.4402 1.4415 2.1657 2.1693 2.4235 2.4258 2.5584 2.5659 2.7383 2.7426 3.1971 3.2040 3.4398 3.4456 4.0153 4.0177 4.0816 4.0882 4.2722 4.2828 4.5882 4.5933 5.0065 5.0234 5.2283 5.2326 5.4125 5.4185 6.2926 6.3321 6.3848 6.4460 6.5468 6.5964 6.8055 6.8633 7.0360 7.0921 7.1234 7.1900 7.2267 7.2408 7.3866 7.4015 7.6480 7.6771 8.2372 8.2423 11.6934 11.6976 13.0858 13.0867 13.6419 13.6439 14.8835 14.8902 15.2129 15.2184 15.6136 15.6218 k =-0.3023-0.0542 0.1989 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4511 -15.4509 -14.3808 -14.3804 -12.8712 -12.8703 -12.3884 -12.3874 -12.1547 -12.1536 -12.1214 -12.1198 -11.5569 -11.5564 -3.3348 -3.3341 -1.8461 -1.8447 -0.6658 -0.6634 -0.1506 -0.1473 0.3539 0.3570 0.6093 0.6148 1.1140 1.1157 1.4717 1.4730 2.1665 2.1703 2.4220 2.4245 2.5436 2.5512 2.7373 2.7419 3.1765 3.1834 3.4576 3.4634 4.0141 4.0164 4.0880 4.0947 4.2542 4.2645 4.5857 4.5909 4.9969 5.0131 5.2381 5.2425 5.4250 5.4308 6.2957 6.3347 6.3844 6.4445 6.5468 6.5951 6.8078 6.8655 7.0349 7.0928 7.1194 7.1863 7.2250 7.2386 7.3950 7.4096 7.6513 7.6789 8.2436 8.2487 11.7551 11.7594 13.0880 13.0892 13.6380 13.6399 14.8638 14.8711 15.2003 15.2055 15.6182 15.6258 k =-0.3140-0.0563 0.2065 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4422 -15.4420 -14.3878 -14.3874 -12.8657 -12.8648 -12.3965 -12.3955 -12.1589 -12.1580 -12.1219 -12.1206 -11.5556 -11.5551 -3.3337 -3.3330 -1.8375 -1.8361 -0.6725 -0.6704 -0.1583 -0.1551 0.3534 0.3564 0.6106 0.6159 1.1103 1.1120 1.5036 1.5050 2.1664 2.1705 2.4173 2.4200 2.5323 2.5401 2.7362 2.7411 3.1532 3.1600 3.4773 3.4831 4.0121 4.0144 4.0930 4.0999 4.2361 4.2460 4.5865 4.5916 4.9872 5.0026 5.2486 5.2530 5.4393 5.4449 6.2988 6.3370 6.3840 6.4428 6.5468 6.5937 6.8102 6.8679 7.0334 7.0927 7.1156 7.1822 7.2229 7.2360 7.4029 7.4172 7.6544 7.6804 8.2500 8.2550 11.8159 11.8202 13.0899 13.0913 13.6359 13.6377 14.8418 14.8494 15.1888 15.1937 15.6238 15.6308 k =-0.3256-0.0584 0.2142 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0609 -15.4335 -15.4333 -14.3944 -14.3941 -12.8604 -12.8594 -12.4047 -12.4036 -12.1631 -12.1624 -12.1225 -12.1214 -11.5542 -11.5537 -3.3320 -3.3313 -1.8298 -1.8284 -0.6795 -0.6776 -0.1646 -0.1614 0.3506 0.3534 0.6141 0.6192 1.1067 1.1084 1.5357 1.5371 2.1654 2.1697 2.4089 2.4117 2.5253 2.5332 2.7347 2.7399 3.1281 3.1347 3.4983 3.5039 4.0094 4.0118 4.0967 4.1037 4.2183 4.2278 4.5901 4.5950 4.9773 4.9919 5.2591 5.2638 5.4556 5.4609 6.3019 6.3391 6.3835 6.4409 6.5469 6.5921 6.8125 6.8703 7.0311 7.0912 7.1125 7.1776 7.2204 7.2329 7.4102 7.4243 7.6572 7.6815 8.2562 8.2611 11.8755 11.8798 13.0913 13.0930 13.6354 13.6371 14.8178 14.8257 15.1785 15.1832 15.6299 15.6363 k =-0.3372-0.0605 0.2218 ( 9682 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4251 -15.4249 -14.4007 -14.4004 -12.8551 -12.8542 -12.4128 -12.4118 -12.1672 -12.1666 -12.1232 -12.1223 -11.5525 -11.5520 -3.3298 -3.3292 -1.8230 -1.8216 -0.6865 -0.6849 -0.1694 -0.1663 0.3454 0.3481 0.6198 0.6246 1.1032 1.1048 1.5678 1.5692 2.1634 2.1679 2.3975 2.4003 2.5226 2.5304 2.7328 2.7382 3.1019 3.1084 3.5199 3.5254 4.0059 4.0085 4.0990 4.1059 4.2012 4.2103 4.5957 4.6005 4.9674 4.9812 5.2694 5.2744 5.4737 5.4788 6.3049 6.3409 6.3830 6.4388 6.5471 6.5905 6.8148 6.8728 7.0279 7.0877 7.1101 7.1724 7.2175 7.2293 7.4168 7.4307 7.6596 7.6821 8.2622 8.2669 11.9337 11.9380 13.0922 13.0941 13.6361 13.6377 14.7928 14.8008 15.1695 15.1740 15.6363 15.6420 k =-0.3488-0.0626 0.2295 ( 9682 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4170 -15.4169 -14.4066 -14.4064 -12.8501 -12.8492 -12.4208 -12.4198 -12.1712 -12.1707 -12.1240 -12.1232 -11.5507 -11.5503 -3.3272 -3.3266 -1.8170 -1.8157 -0.6936 -0.6922 -0.1729 -0.1698 0.3381 0.3408 0.6275 0.6320 1.0997 1.1012 1.5994 1.6008 2.1605 2.1652 2.3842 2.3869 2.5227 2.5306 2.7304 2.7358 3.0754 3.0817 3.5419 3.5472 4.0017 4.0045 4.0999 4.1068 4.1853 4.1939 4.6031 4.6076 4.9577 4.9706 5.2792 5.2844 5.4938 5.4987 6.3079 6.3424 6.3823 6.4366 6.5473 6.5887 6.8170 6.8754 7.0241 7.0828 7.1089 7.1668 7.2146 7.2255 7.4230 7.4367 7.6619 7.6826 8.2679 8.2723 11.9901 11.9944 13.0926 13.0947 13.6378 13.6392 14.7674 14.7754 15.1617 15.1660 15.6425 15.6476 k =-0.3605-0.0647 0.2371 ( 9687 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4093 -15.4092 -14.4122 -14.4119 -12.8452 -12.8443 -12.4286 -12.4276 -12.1751 -12.1747 -12.1248 -12.1242 -11.5488 -11.5484 -3.3244 -3.3238 -1.8119 -1.8105 -0.7008 -0.6995 -0.1749 -0.1719 0.3291 0.3316 0.6369 0.6410 1.0962 1.0977 1.6303 1.6318 2.1569 2.1616 2.3706 2.3731 2.5245 2.5323 2.7275 2.7327 3.0491 3.0552 3.5640 3.5691 3.9969 4.0000 4.0994 4.1062 4.1706 4.1788 4.6116 4.6159 4.9480 4.9601 5.2883 5.2936 5.5157 5.5203 6.3108 6.3437 6.3817 6.4342 6.5477 6.5869 6.8190 6.8778 7.0193 7.0763 7.1080 7.1606 7.2113 7.2213 7.4287 7.4421 7.6643 7.6830 8.2728 8.2771 12.0447 12.0489 13.0924 13.0947 13.6402 13.6416 14.7425 14.7503 15.1549 15.1590 15.6484 15.6530 k =-0.3721-0.0667 0.2448 ( 9691 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4021 -15.4019 -14.4173 -14.4170 -12.8405 -12.8397 -12.4362 -12.4353 -12.1787 -12.1784 -12.1258 -12.1253 -11.5469 -11.5465 -3.3213 -3.3207 -1.8074 -1.8061 -0.7079 -0.7068 -0.1757 -0.1727 0.3186 0.3212 0.6476 0.6515 1.0927 1.0941 1.6599 1.6614 2.1530 2.1578 2.3575 2.3600 2.5265 2.5344 2.7240 2.7289 3.0236 3.0295 3.5859 3.5907 3.9916 3.9948 4.0974 4.1041 4.1576 4.1653 4.6210 4.6250 4.9386 4.9499 5.2965 5.3019 5.5391 5.5433 6.3137 6.3448 6.3810 6.4315 6.5481 6.5850 6.8208 6.8800 7.0136 7.0688 7.1076 7.1542 7.2080 7.2171 7.4340 7.4471 7.6665 7.6833 8.2775 8.2815 12.0971 12.1012 13.0915 13.0939 13.6431 13.6444 14.7187 14.7263 15.1489 15.1528 15.6538 15.6578 k =-0.3837-0.0688 0.2524 ( 9691 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3953 -15.3952 -14.4220 -14.4217 -12.8360 -12.8353 -12.4435 -12.4426 -12.1821 -12.1819 -12.1268 -12.1263 -11.5450 -11.5445 -3.3180 -3.3175 -1.8035 -1.8023 -0.7149 -0.7139 -0.1753 -0.1725 0.3073 0.3098 0.6593 0.6629 1.0891 1.0905 1.6878 1.6893 2.1494 2.1542 2.3457 2.3481 2.5278 2.5357 2.7202 2.7246 2.9996 3.0052 3.6074 3.6120 3.9858 3.9893 4.0942 4.1007 4.1462 4.1534 4.6309 4.6347 4.9294 4.9399 5.3040 5.3092 5.5635 5.5674 6.3166 6.3457 6.3803 6.4287 6.5487 6.5830 6.8225 6.8819 7.0073 7.0605 7.1072 7.1476 7.2050 7.2129 7.4390 7.4517 7.6687 7.6837 8.2821 8.2858 12.1471 12.1511 13.0898 13.0922 13.6463 13.6475 14.6966 14.7038 15.1435 15.1472 15.6583 15.6619 k =-0.3953-0.0709 0.2601 ( 9689 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3890 -15.3889 -14.4263 -14.4260 -12.8319 -12.8311 -12.4503 -12.4495 -12.1853 -12.1851 -12.1278 -12.1274 -11.5430 -11.5427 -3.3148 -3.3143 -1.8002 -1.7991 -0.7216 -0.7208 -0.1739 -0.1712 0.2954 0.2979 0.6716 0.6749 1.0856 1.0868 1.7133 1.7148 2.1471 2.1519 2.3355 2.3379 2.5272 2.5354 2.7163 2.7199 2.9775 2.9827 3.6283 3.6326 3.9798 3.9833 4.0899 4.0960 4.1367 4.1432 4.6411 4.6447 4.9206 4.9303 5.3105 5.3156 5.5885 5.5921 6.3195 6.3464 6.3797 6.4257 6.5494 6.5811 6.8239 6.8831 7.0005 7.0518 7.1068 7.1410 7.2021 7.2088 7.4440 7.4562 7.6707 7.6839 8.2861 8.2896 12.1944 12.1982 13.0872 13.0896 13.6497 13.6508 14.6766 14.6833 15.1387 15.1421 15.6619 15.6651 k =-0.4070-0.0730 0.2677 ( 9691 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3833 -15.3832 -14.4301 -14.4299 -12.8280 -12.8274 -12.4567 -12.4559 -12.1882 -12.1880 -12.1287 -12.1284 -11.5412 -11.5408 -3.3116 -3.3111 -1.7974 -1.7964 -0.7280 -0.7273 -0.1717 -0.1691 0.2835 0.2858 0.6841 0.6871 1.0820 1.0831 1.7358 1.7372 2.1468 2.1516 2.3268 2.3293 2.5241 2.5324 2.7127 2.7155 2.9577 2.9624 3.6484 3.6524 3.9735 3.9771 4.0847 4.0902 4.1288 4.1346 4.6513 4.6547 4.9121 4.9211 5.3163 5.3210 5.6135 5.6167 6.3223 6.3468 6.3792 6.4225 6.5503 6.5790 6.8251 6.8835 6.9933 7.0425 7.1063 7.1347 7.1993 7.2050 7.4485 7.4600 7.6726 7.6840 8.2898 8.2930 12.2387 12.2423 13.0836 13.0860 13.6531 13.6541 14.6589 14.6652 15.1343 15.1375 15.6646 15.6675 k =-0.4186-0.0751 0.2754 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.3782 -15.3780 -14.4335 -14.4333 -12.8245 -12.8239 -12.4625 -12.4618 -12.1908 -12.1906 -12.1297 -12.1294 -11.5395 -11.5391 -3.3086 -3.3081 -1.7950 -1.7941 -0.7340 -0.7333 -0.1689 -0.1665 0.2718 0.2741 0.6964 0.6991 1.0784 1.0794 1.7547 1.7559 2.1496 2.1543 2.3197 2.3222 2.5177 2.5261 2.7098 2.7118 2.9405 2.9447 3.6674 3.6711 3.9673 3.9708 4.0790 4.0838 4.1225 4.1274 4.6611 4.6644 4.9042 4.9124 5.3213 5.3256 5.6377 5.6406 6.3250 6.3470 6.3790 6.4191 6.5514 6.5770 6.8262 6.8826 6.9867 7.0331 7.1059 7.1290 7.1969 7.2017 7.4527 7.4633 7.6745 7.6843 8.2933 8.2961 12.2796 12.2830 13.0793 13.0815 13.6564 13.6573 14.6438 14.6495 15.1304 15.1332 15.6663 15.6689 k =-0.4302-0.0772 0.2830 ( 9696 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3736 -15.3735 -14.4364 -14.4362 -12.8214 -12.8209 -12.4677 -12.4671 -12.1931 -12.1930 -12.1306 -12.1303 -11.5379 -11.5376 -3.3058 -3.3054 -1.7931 -1.7923 -0.7394 -0.7388 -0.1657 -0.1635 0.2608 0.2629 0.7082 0.7105 1.0749 1.0758 1.7697 1.7708 2.1558 2.1604 2.3138 2.3164 2.5079 2.5162 2.7079 2.7091 2.9260 2.9295 3.6850 3.6884 3.9612 3.9645 4.0731 4.0773 4.1173 4.1214 4.6705 4.6735 4.8969 4.9042 5.3256 5.3294 5.6606 5.6632 6.3277 6.3470 6.3790 6.4155 6.5526 6.5750 6.8271 6.8802 6.9807 7.0236 7.1053 7.1236 7.1945 7.1986 7.4565 7.4660 7.6758 7.6840 8.2962 8.2986 12.3168 12.3198 13.0742 13.0763 13.6595 13.6603 14.6312 14.6362 15.1268 15.1292 15.6671 15.6694 k =-0.4419-0.0793 0.2907 ( 9695 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3698 -15.3697 -14.4389 -14.4387 -12.8187 -12.8182 -12.4723 -12.4717 -12.1951 -12.1949 -12.1313 -12.1312 -11.5365 -11.5362 -3.3032 -3.3029 -1.7915 -1.7908 -0.7442 -0.7437 -0.1624 -0.1605 0.2508 0.2526 0.7191 0.7211 1.0716 1.0724 1.7809 1.7818 2.1656 2.1700 2.3090 2.3117 2.4952 2.5032 2.7068 2.7079 2.9141 2.9170 3.7011 3.7040 3.9555 3.9586 4.0675 4.0709 4.1131 4.1165 4.6792 4.6819 4.8904 4.8967 5.3292 5.3324 5.6816 5.6838 6.3303 6.3468 6.3795 6.4117 6.5540 6.5730 6.8282 6.8761 6.9764 7.0146 7.1049 7.1192 7.1928 7.1961 7.4600 7.4683 7.6771 7.6839 8.2989 8.3009 12.3497 12.3524 13.0688 13.0707 13.6624 13.6631 14.6211 14.6254 15.1236 15.1257 15.6673 15.6693 k =-0.4535-0.0813 0.2983 ( 9694 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3666 -15.3665 -14.4409 -14.4408 -12.8164 -12.8160 -12.4760 -12.4756 -12.1967 -12.1966 -12.1320 -12.1319 -11.5353 -11.5351 -3.3011 -3.3008 -1.7902 -1.7896 -0.7482 -0.7478 -0.1592 -0.1576 0.2421 0.2437 0.7287 0.7303 1.0686 1.0693 1.7886 1.7893 2.1782 2.1823 2.3052 2.3079 2.4806 2.4879 2.7066 2.7076 2.9047 2.9070 3.7151 3.7176 3.9504 3.9531 4.0625 4.0652 4.1098 4.1125 4.6868 4.6893 4.8848 4.8901 5.3321 5.3348 5.6998 5.7017 6.3327 6.3462 6.3806 6.4076 6.5556 6.5710 6.8296 6.8705 6.9740 7.0062 7.1047 7.1154 7.1912 7.1939 7.4633 7.4702 7.6784 7.6837 8.3012 8.3029 12.3778 12.3801 13.0633 13.0649 13.6649 13.6655 14.6133 14.6168 15.1210 15.1227 15.6669 15.6686 k =-0.4651-0.0834 0.3060 ( 9701 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3640 -15.3640 -14.4424 -14.4424 -12.8146 -12.8143 -12.4790 -12.4787 -12.1979 -12.1979 -12.1325 -12.1324 -11.5343 -11.5342 -3.2993 -3.2991 -1.7892 -1.7888 -0.7514 -0.7511 -0.1563 -0.1550 0.2351 0.2363 0.7367 0.7379 1.0661 1.0666 1.7935 1.7941 2.1922 2.1960 2.3021 2.3047 2.4657 2.4718 2.7070 2.7079 2.8976 2.8993 3.7268 3.7287 3.9461 3.9483 4.0583 4.0603 4.1073 4.1093 4.6933 4.6953 4.8803 4.8844 5.3345 5.3365 5.7149 5.7163 6.3351 6.3454 6.3823 6.4035 6.5573 6.5690 6.8316 6.8638 6.9733 6.9984 7.1045 7.1121 7.1899 7.1920 7.4660 7.4713 7.6793 7.6833 8.3030 8.3042 12.4006 12.4023 13.0583 13.0596 13.6670 13.6674 14.6076 14.6103 15.1189 15.1201 15.6663 15.6676 k =-0.4767-0.0855 0.3136 ( 9707 PWs) bands (ev): -84.3029 -84.3029 -50.0025 -50.0025 -48.3956 -48.3956 -48.0611 -48.0611 -15.3622 -15.3622 -14.4436 -14.4435 -12.8132 -12.8130 -12.4812 -12.4809 -12.1988 -12.1988 -12.1329 -12.1328 -11.5336 -11.5335 -3.2981 -3.2979 -1.7885 -1.7882 -0.7537 -0.7535 -0.1540 -0.1531 0.2299 0.2308 0.7427 0.7435 1.0642 1.0646 1.7964 1.7967 2.2057 2.2087 2.2997 2.3020 2.4525 2.4571 2.7077 2.7084 2.8928 2.8939 3.7356 3.7370 3.9429 3.9445 4.0552 4.0565 4.1056 4.1069 4.6983 4.6997 4.8771 4.8799 5.3362 5.3376 5.7261 5.7271 6.3373 6.3442 6.3847 6.3993 6.5592 6.5670 6.8345 6.8566 6.9743 6.9914 7.1045 7.1094 7.1892 7.1906 7.4682 7.4718 7.6801 7.6827 8.3041 8.3049 12.4174 12.4186 13.0544 13.0553 13.6685 13.6688 14.6038 14.6056 15.1174 15.1182 15.6657 15.6666 k =-0.4884-0.0876 0.3213 ( 9702 PWs) bands (ev): -84.3029 -84.3029 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3611 -15.3611 -14.4442 -14.4442 -12.8124 -12.8123 -12.4824 -12.4823 -12.1994 -12.1994 -12.1331 -12.1331 -11.5332 -11.5331 -3.2973 -3.2972 -1.7881 -1.7879 -0.7551 -0.7550 -0.1524 -0.1520 0.2268 0.2273 0.7465 0.7469 1.0630 1.0632 1.7979 1.7981 2.2161 2.2178 2.2984 2.2998 2.4437 2.4462 2.7084 2.7088 2.8900 2.8906 3.7413 3.7420 3.9411 3.9419 4.0534 4.0540 4.1047 4.1054 4.7015 4.7022 4.8754 4.8769 5.3374 5.3381 5.7331 5.7336 6.3393 6.3428 6.3877 6.3952 6.5611 6.5650 6.8385 6.8498 6.9768 6.9855 7.1053 7.1077 7.1891 7.1898 7.4700 7.4719 7.6811 7.6824 8.3050 8.3054 12.4279 12.4285 13.0519 13.0524 13.6695 13.6697 14.6018 14.6027 15.1166 15.1170 15.6654 15.6659 k =-0.5000-0.0897 0.3289 ( 9704 PWs) bands (ev): -84.3029 -84.3029 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3608 -15.3608 -14.4444 -14.4444 -12.8121 -12.8121 -12.4828 -12.4828 -12.1995 -12.1995 -12.1332 -12.1332 -11.5330 -11.5330 -3.2970 -3.2970 -1.7879 -1.7879 -0.7555 -0.7555 -0.1518 -0.1518 0.2259 0.2259 0.7479 0.7479 1.0627 1.0627 1.7984 1.7984 2.2206 2.2206 2.2984 2.2984 2.4413 2.4413 2.7087 2.7087 2.8893 2.8893 3.7434 3.7434 3.9407 3.9407 4.0530 4.0530 4.1047 4.1047 4.7029 4.7029 4.8753 4.8753 5.3380 5.3380 5.7357 5.7357 6.3411 6.3411 6.3913 6.3913 6.5630 6.5630 6.8436 6.8436 6.9806 6.9806 7.1063 7.1063 7.1892 7.1892 7.4712 7.4712 7.6817 7.6817 8.3053 8.3053 12.4317 12.4317 13.0512 13.0512 13.6699 13.6699 14.6015 14.6015 15.1164 15.1164 15.6654 15.6654 k =-0.5000-0.5203 0.2171 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3680 -15.3680 -14.3969 -14.3969 -12.9141 -12.9141 -12.4291 -12.4291 -12.1861 -12.1861 -12.1172 -12.1172 -11.5634 -11.5634 -3.3063 -3.3063 -1.4250 -1.4250 -1.3284 -1.3284 -0.2027 -0.2027 0.4284 0.4284 0.5567 0.5567 1.1244 1.1244 1.5839 1.5839 2.0454 2.0454 2.2703 2.2703 2.5805 2.5805 2.6876 2.6876 3.3153 3.3153 3.5634 3.5634 3.9360 3.9360 4.4256 4.4256 4.6476 4.6476 4.9681 4.9681 5.1262 5.1262 5.2330 5.2330 5.2830 5.2830 6.2642 6.2642 6.4078 6.4078 6.5540 6.5540 6.8497 6.8497 7.0352 7.0352 7.1088 7.1088 7.2669 7.2669 7.3441 7.3441 7.6145 7.6145 8.0559 8.0559 12.4145 12.4145 12.8672 12.8672 13.4439 13.4439 14.6599 14.6599 15.1345 15.1345 15.6473 15.6473 k =-0.4906-0.5105 0.2130 ( 9685 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3682 -15.3682 -14.3967 -14.3967 -12.9143 -12.9142 -12.4291 -12.4291 -12.1862 -12.1857 -12.1174 -12.1169 -11.5634 -11.5633 -3.3063 -3.3062 -1.4257 -1.4254 -1.3267 -1.3264 -0.2034 -0.2029 0.4295 0.4299 0.5565 0.5567 1.1237 1.1239 1.5840 1.5842 2.0438 2.0446 2.2707 2.2715 2.5804 2.5807 2.6875 2.6880 3.3141 3.3146 3.5625 3.5632 3.9352 3.9356 4.4242 4.4247 4.6469 4.6475 4.9666 4.9676 5.1256 5.1271 5.2325 5.2339 5.2813 5.2838 6.2636 6.2654 6.4062 6.4092 6.5527 6.5552 6.8495 6.8502 7.0317 7.0387 7.1060 7.1121 7.2646 7.2703 7.3433 7.3463 7.6140 7.6152 8.0558 8.0572 12.4146 12.4150 12.8657 12.8660 13.4453 13.4454 14.6616 14.6625 15.1330 15.1337 15.6475 15.6481 k =-0.4811-0.5007 0.2089 ( 9686 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3687 -15.3686 -14.3963 -14.3963 -12.9150 -12.9148 -12.4291 -12.4290 -12.1860 -12.1850 -12.1173 -12.1164 -11.5636 -11.5634 -3.3063 -3.3062 -1.4273 -1.4268 -1.3217 -1.3211 -0.2050 -0.2039 0.4330 0.4339 0.5561 0.5566 1.1218 1.1222 1.5843 1.5846 2.0401 2.0415 2.2725 2.2740 2.5803 2.5810 2.6876 2.6887 3.3108 3.3117 3.5605 3.5620 3.9335 3.9343 4.4204 4.4214 4.6454 4.6467 4.9631 4.9652 5.1255 5.1284 5.2323 5.2349 5.2790 5.2838 6.2637 6.2673 6.4045 6.4105 6.5513 6.5564 6.8494 6.8508 7.0283 7.0420 7.1038 7.1157 7.2633 7.2747 7.3433 7.3492 7.6138 7.6162 8.0573 8.0600 12.4155 12.4162 12.8613 12.8619 13.4494 13.4497 14.6676 14.6693 15.1293 15.1308 15.6485 15.6498 k =-0.4717-0.4909 0.2048 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.3694 -15.3694 -14.3956 -14.3956 -12.9160 -12.9158 -12.4290 -12.4288 -12.1855 -12.1840 -12.1170 -12.1157 -11.5637 -11.5635 -3.3063 -3.3061 -1.4296 -1.4289 -1.3135 -1.3127 -0.2072 -0.2057 0.4390 0.4403 0.5556 0.5565 1.1187 1.1194 1.5848 1.5853 2.0346 2.0366 2.2754 2.2775 2.5804 2.5813 2.6881 2.6896 3.3055 3.3068 3.5576 3.5598 3.9308 3.9319 4.4143 4.4157 4.6433 4.6452 4.9578 4.9608 5.1260 5.1302 5.2320 5.2358 5.2762 5.2834 6.2645 6.2697 6.4028 6.4117 6.5500 6.5576 6.8496 6.8516 7.0253 7.0452 7.1024 7.1199 7.2631 7.2801 7.3445 7.3533 7.6142 7.6176 8.0602 8.0642 12.4171 12.4180 12.8542 12.8551 13.4562 13.4567 14.6776 14.6802 15.1235 15.1258 15.6508 15.6526 k =-0.4623-0.4811 0.2007 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3705 -15.3705 -14.3947 -14.3947 -12.9174 -12.9172 -12.4288 -12.4286 -12.1847 -12.1828 -12.1166 -12.1148 -11.5640 -11.5636 -3.3062 -3.3059 -1.4321 -1.4313 -1.3026 -1.3016 -0.2102 -0.2082 0.4471 0.4489 0.5552 0.5563 1.1144 1.1153 1.5855 1.5862 2.0277 2.0301 2.2791 2.2816 2.5805 2.5817 2.6891 2.6910 3.2981 3.2998 3.5539 3.5566 3.9271 3.9285 4.4059 4.4077 4.6405 4.6429 4.9505 4.9545 5.1272 5.1327 5.2310 5.2359 5.2736 5.2829 6.2659 6.2726 6.4009 6.4127 6.5487 6.5586 6.8498 6.8526 7.0222 7.0477 7.1015 7.1242 7.2635 7.2861 7.3463 7.3580 7.6151 7.6194 8.0650 8.0701 12.4192 12.4204 12.8446 12.8458 13.4657 13.4663 14.6915 14.6950 15.1159 15.1190 15.6546 15.6568 k =-0.4528-0.4712 0.1966 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3719 -15.3719 -14.3935 -14.3935 -12.9192 -12.9189 -12.4285 -12.4282 -12.1837 -12.1813 -12.1159 -12.1137 -11.5643 -11.5638 -3.3061 -3.3057 -1.4347 -1.4337 -1.2895 -1.2884 -0.2135 -0.2111 0.4570 0.4592 0.5549 0.5564 1.1089 1.1100 1.5862 1.5871 2.0200 2.0227 2.2831 2.2859 2.5807 2.5821 2.6905 2.6929 3.2887 3.2906 3.5496 3.5528 3.9225 3.9242 4.3953 4.3975 4.6371 4.6400 4.9415 4.9463 5.1292 5.1359 5.2288 5.2345 5.2719 5.2828 6.2680 6.2760 6.3989 6.4134 6.5474 6.5595 6.8502 6.8537 7.0193 7.0495 7.1016 7.1289 7.2643 7.2925 7.3492 7.3637 7.6163 7.6215 8.0709 8.0771 12.4218 12.4233 12.8327 12.8341 13.4776 13.4783 14.7087 14.7133 15.1068 15.1108 15.6601 15.6626 k =-0.4434-0.4614 0.1925 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3736 -15.3735 -14.3920 -14.3920 -12.9214 -12.9210 -12.4280 -12.4277 -12.1825 -12.1797 -12.1151 -12.1125 -11.5646 -11.5641 -3.3059 -3.3055 -1.4372 -1.4361 -1.2745 -1.2732 -0.2172 -0.2144 0.4681 0.4707 0.5551 0.5570 1.1021 1.1034 1.5869 1.5880 2.0119 2.0148 2.2868 2.2898 2.5810 2.5826 2.6926 2.6953 3.2773 3.2794 3.5448 3.5484 3.9170 3.9190 4.3828 4.3852 4.6331 4.6363 4.9309 4.9363 5.1320 5.1398 5.2250 5.2314 5.2719 5.2836 6.2705 6.2797 6.3968 6.4139 6.5461 6.5602 6.8506 6.8549 7.0168 7.0507 7.1023 7.1338 7.2653 7.2989 7.3533 7.3703 7.6180 7.6238 8.0784 8.0855 12.4246 12.4264 12.8188 12.8205 13.4918 13.4927 14.7288 14.7344 15.0968 15.1017 15.6677 15.6704 k =-0.4340-0.4516 0.1884 ( 9676 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3756 -15.3755 -14.3902 -14.3902 -12.9238 -12.9234 -12.4273 -12.4270 -12.1812 -12.1780 -12.1140 -12.1111 -11.5650 -11.5644 -3.3056 -3.3052 -1.4395 -1.4383 -1.2577 -1.2563 -0.2209 -0.2177 0.4796 0.4827 0.5566 0.5589 1.0940 1.0955 1.5874 1.5887 2.0041 2.0071 2.2900 2.2930 2.5815 2.5833 2.6953 2.6983 3.2639 3.2660 3.5399 3.5437 3.9106 3.9128 4.3683 4.3709 4.6285 4.6319 4.9189 4.9249 5.1351 5.1440 5.2199 5.2272 5.2734 5.2854 6.2736 6.2836 6.3946 6.4141 6.5449 6.5608 6.8510 6.8562 7.0145 7.0511 7.1040 7.1390 7.2663 7.3050 7.3586 7.3777 7.6202 7.6264 8.0875 8.0954 12.4274 12.4294 12.8035 12.8054 13.5082 13.5092 14.7510 14.7577 15.0866 15.0926 15.6777 15.6805 k =-0.4245-0.4418 0.1843 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3780 -15.3779 -14.3882 -14.3882 -12.9266 -12.9261 -12.4264 -12.4260 -12.1797 -12.1762 -12.1128 -12.1095 -11.5654 -11.5647 -3.3052 -3.3047 -1.4417 -1.4403 -1.2396 -1.2380 -0.2243 -0.2209 0.4902 0.4937 0.5602 0.5630 1.0846 1.0863 1.5876 1.5891 1.9969 1.9998 2.2923 2.2952 2.5824 2.5844 2.6985 2.7019 3.2488 3.2508 3.5349 3.5389 3.9035 3.9058 4.3523 4.3550 4.6232 4.6268 4.9059 4.9124 5.1379 5.1477 5.2143 5.2229 5.2759 5.2879 6.2772 6.2878 6.3923 6.4141 6.5436 6.5612 6.8513 6.8576 7.0124 7.0508 7.1062 7.1443 7.2667 7.3100 7.3653 7.3859 7.6232 7.6296 8.0982 8.1068 12.4298 12.4319 12.7873 12.7894 13.5264 13.5277 14.7741 14.7821 15.0774 15.0846 15.6903 15.6931 k =-0.4151-0.4320 0.1802 ( 9674 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3806 -15.3805 -14.3859 -14.3859 -12.9296 -12.9291 -12.4253 -12.4248 -12.1781 -12.1743 -12.1114 -12.1079 -11.5658 -11.5651 -3.3047 -3.3041 -1.4437 -1.4423 -1.2202 -1.2186 -0.2274 -0.2237 0.4984 0.5021 0.5674 0.5706 1.0738 1.0756 1.5873 1.5890 1.9907 1.9936 2.2934 2.2960 2.5836 2.5859 2.7022 2.7058 3.2321 3.2338 3.5301 3.5341 3.8954 3.8979 4.3348 4.3376 4.6171 4.6209 4.8921 4.8991 5.1392 5.1492 5.2103 5.2198 5.2792 5.2910 6.2810 6.2921 6.3899 6.4137 6.5424 6.5615 6.8516 6.8591 7.0104 7.0499 7.1088 7.1495 7.2665 7.3138 7.3734 7.3947 7.6262 7.6327 8.1100 8.1190 12.4311 12.4333 12.7709 12.7731 13.5464 13.5478 14.7966 14.8059 15.0707 15.0790 15.7055 15.7082 k =-0.4057-0.4222 0.1761 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3836 -15.3835 -14.3834 -14.3834 -12.9329 -12.9323 -12.4239 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2.5876 2.5908 2.7102 2.7142 3.1951 3.1963 3.5214 3.5251 3.8768 3.8793 4.2969 4.2998 4.6023 4.6061 4.8640 4.8720 5.1327 5.1402 5.2142 5.2224 5.2868 5.2982 6.2892 6.3005 6.3852 6.4122 6.5399 6.5615 6.8518 6.8623 7.0069 7.0467 7.1150 7.1601 7.2638 7.3173 7.3932 7.4144 7.6332 7.6397 8.1375 8.1469 12.4273 12.4294 12.7413 12.7434 13.5905 13.5921 14.8318 14.8427 15.0739 15.0835 15.7435 15.7460 k =-0.3868-0.4025 0.1679 ( 9668 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0610 -48.0610 -15.3905 -15.3904 -14.3776 -14.3776 -12.9399 -12.9392 -12.4201 -12.4194 -12.1733 -12.1688 -12.1066 -12.1024 -11.5672 -11.5663 -3.3021 -3.3014 -1.4503 -1.4485 -1.1570 -1.1552 -0.2313 -0.2271 0.5040 0.5076 0.6130 0.6165 1.0335 1.0358 1.5820 1.5844 1.9821 1.9843 2.2892 2.2907 2.5905 2.5941 2.7138 2.7181 3.1757 3.1767 3.5176 3.5211 3.8661 3.8686 4.2769 4.2799 4.5931 4.5970 4.8504 4.8589 5.1243 5.1305 5.2218 5.2287 5.2908 5.3020 6.2932 6.3047 6.3829 6.4111 6.5386 6.5613 6.8516 6.8639 7.0051 7.0445 7.1184 7.1652 7.2612 7.3173 7.4043 7.4250 7.6368 7.6432 8.1526 8.1619 12.4202 12.4220 12.7303 12.7321 13.6141 13.6159 14.8407 14.8513 15.0880 15.0972 15.7657 15.7680 k =-0.3774-0.3927 0.1638 ( 9671 PWs) bands (ev): -84.3025 -84.3025 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3945 -15.3943 -14.3744 -14.3744 -12.9436 -12.9428 -12.4176 -12.4169 -12.1716 -12.1671 -12.1049 -12.1006 -11.5676 -11.5667 -3.3009 -3.3001 -1.4531 -1.4513 -1.1349 -1.1331 -0.2300 -0.2258 0.5016 0.5052 0.6329 0.6365 1.0176 1.0200 1.5782 1.5809 1.9833 1.9851 2.2856 2.2867 2.5939 2.5979 2.7169 2.7213 3.1561 3.1574 3.5144 3.5175 3.8546 3.8569 4.2567 4.2597 4.5827 4.5866 4.8378 4.8467 5.1131 5.1191 5.2316 5.2374 5.2950 5.3058 6.2970 6.3087 6.3808 6.4098 6.5374 6.5610 6.8512 6.8654 7.0034 7.0421 7.1217 7.1700 7.2577 7.3161 7.4156 7.4357 7.6401 7.6464 8.1682 8.1774 12.4082 12.4098 12.7229 12.7245 13.6385 13.6405 14.8432 14.8527 15.1110 15.1190 15.7884 15.7906 k =-0.3679-0.3829 0.1597 ( 9673 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.3987 -15.3986 -14.3709 -14.3709 -12.9474 -12.9465 -12.4149 -12.4141 -12.1700 -12.1653 -12.1032 -12.0988 -11.5681 -11.5671 -3.2994 -3.2986 -1.4566 -1.4547 -1.1127 -1.1108 -0.2272 -0.2230 0.4981 0.5017 0.6537 0.6573 1.0006 1.0031 1.5733 1.5762 1.9868 1.9882 2.2813 2.2821 2.5977 2.6021 2.7189 2.7235 3.1370 3.1391 3.5116 3.5144 3.8420 3.8443 4.2365 4.2394 4.5708 4.5749 4.8264 4.8357 5.1003 5.1069 5.2426 5.2478 5.2993 5.3096 6.3002 6.3127 6.3790 6.4084 6.5361 6.5607 6.8505 6.8669 7.0016 7.0395 7.1250 7.1743 7.2537 7.3141 7.4271 7.4466 7.6432 7.6495 8.1844 8.1932 12.3909 12.3921 12.7199 12.7213 13.6634 13.6655 14.8404 14.8486 15.1411 15.1476 15.8086 15.8111 k =-0.3585-0.3731 0.1556 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4033 -15.4032 -14.3673 -14.3672 -12.9511 -12.9502 -12.4118 -12.4110 -12.1683 -12.1636 -12.1016 -12.0971 -11.5685 -11.5674 -3.2977 -3.2969 -1.4609 -1.4589 -1.0904 -1.0885 -0.2224 -0.2183 0.4938 0.4975 0.6748 0.6784 0.9827 0.9853 1.5671 1.5703 1.9925 1.9936 2.2766 2.2772 2.6017 2.6065 2.7196 2.7244 3.1192 3.1222 3.5093 3.5118 3.8286 3.8308 4.2164 4.2193 4.5574 4.5616 4.8165 4.8261 5.0868 5.0943 5.2540 5.2591 5.3037 5.3135 6.3027 6.3168 6.3774 6.4069 6.5348 6.5603 6.8497 6.8682 6.9997 7.0366 7.1282 7.1781 7.2492 7.3113 7.4384 7.4575 7.6458 7.6521 8.2007 8.2090 12.3679 12.3689 12.7210 12.7224 13.6887 13.6909 14.8341 14.8410 15.1759 15.1809 15.8189 15.8226 k =-0.3491-0.3633 0.1515 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0610 -48.0610 -15.4082 -15.4081 -14.3634 -14.3634 -12.9549 -12.9539 -12.4083 -12.4075 -12.1666 -12.1619 -12.1001 -12.0956 -11.5688 -11.5678 -3.2957 -3.2949 -1.4663 -1.4642 -1.0682 -1.0664 -0.2156 -0.2116 0.4890 0.4927 0.6956 0.6993 0.9641 0.9668 1.5597 1.5631 2.0003 2.0010 2.2719 2.2727 2.6056 2.6108 2.7188 2.7238 3.1033 3.1073 3.5075 3.5098 3.8143 3.8164 4.1966 4.1994 4.5426 4.5469 4.8084 4.8183 5.0731 5.0818 5.2655 5.2708 5.3085 5.3175 6.3044 6.3210 6.3762 6.4055 6.5336 6.5599 6.8487 6.8695 6.9980 7.0339 7.1312 7.1814 7.2445 7.3081 7.4494 7.4682 7.6479 7.6543 8.2169 8.2247 12.3395 12.3407 12.7260 12.7274 13.7140 13.7163 14.8261 14.8318 15.2134 15.2170 15.8124 15.8175 k =-0.3396-0.3534 0.1474 ( 9675 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4135 -15.4133 -14.3593 -14.3593 -12.9585 -12.9576 -12.4046 -12.4036 -12.1649 -12.1602 -12.0988 -12.0942 -11.5691 -11.5680 -3.2935 -3.2927 -1.4729 -1.4707 -1.0463 -1.0446 -0.2068 -0.2029 0.4838 0.4876 0.7158 0.7194 0.9453 0.9479 1.5509 1.5546 2.0099 2.0103 2.2677 2.2687 2.6092 2.6147 2.7162 2.7215 3.0898 3.0948 3.5062 3.5082 3.7993 3.8013 4.1771 4.1799 4.5264 4.5310 4.8023 4.8123 5.0598 5.0696 5.2764 5.2823 5.3137 5.3217 6.3051 6.3251 6.3754 6.4040 6.5324 6.5595 6.8476 6.8707 6.9961 7.0309 7.1342 7.1839 7.2400 7.3046 7.4598 7.4785 7.6495 7.6560 8.2331 8.2403 12.3063 12.3078 12.7340 12.7357 13.7392 13.7416 14.8175 14.8224 15.2517 15.2544 15.7934 15.7991 k =-0.3302-0.3436 0.1433 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4190 -15.4189 -14.3550 -14.3550 -12.9621 -12.9611 -12.4005 -12.3995 -12.1631 -12.1584 -12.0977 -12.0931 -11.5693 -11.5682 -3.2911 -3.2902 -1.4809 -1.4788 -1.0248 -1.0232 -0.1957 -0.1920 0.4784 0.4822 0.7346 0.7381 0.9267 0.9292 1.5409 1.5448 2.0209 2.0211 2.2646 2.2659 2.6121 2.6178 2.7121 2.7176 3.0791 3.0850 3.5052 3.5072 3.7837 3.7857 4.1581 4.1608 4.5091 4.5139 4.7981 4.8082 5.0472 5.0580 5.2862 5.2933 5.3195 5.3263 6.3050 6.3291 6.3750 6.4027 6.5312 6.5592 6.8461 6.8718 6.9940 7.0278 7.1369 7.1855 7.2358 7.3009 7.4693 7.4882 7.6503 7.6570 8.2483 8.2548 12.2691 12.2708 12.7445 12.7464 13.7641 13.7665 14.8095 14.8137 15.2893 15.2916 15.7697 15.7753 k =-0.3208-0.3338 0.1392 ( 9676 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4248 -15.4247 -14.3506 -14.3506 -12.9655 -12.9645 -12.3962 -12.3952 -12.1613 -12.1566 -12.0968 -12.0922 -11.5694 -11.5683 -3.2883 -3.2875 -1.4906 -1.4885 -1.0036 -1.0022 -0.1824 -0.1790 0.4727 0.4765 0.7511 0.7546 0.9094 0.9116 1.5294 1.5335 2.0328 2.0332 2.2633 2.2648 2.6138 2.6197 2.7070 2.7126 3.0712 3.0780 3.5045 3.5065 3.7677 3.7697 4.1396 4.1422 4.4909 4.4959 4.7957 4.8058 5.0356 5.0473 5.2947 5.3033 5.3259 5.3317 6.3043 6.3328 6.3748 6.4016 6.5301 6.5590 6.8445 6.8728 6.9918 7.0248 7.1394 7.1861 7.2323 7.2972 7.4780 7.4972 7.6505 7.6575 8.2628 8.2686 12.2282 12.2301 12.7568 12.7588 13.7883 13.7908 14.8028 14.8065 15.3246 15.3275 15.7454 15.7506 k =-0.3113-0.3240 0.1352 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4309 -15.4308 -14.3460 -14.3460 -12.9687 -12.9677 -12.3917 -12.3905 -12.1593 -12.1547 -12.0961 -12.0915 -11.5695 -11.5684 -3.2854 -3.2846 -1.5022 -1.5001 -0.9829 -0.9816 -0.1671 -0.1640 0.4670 0.4708 0.7640 0.7673 0.8948 0.8965 1.5167 1.5210 2.0450 2.0456 2.2643 2.2661 2.6138 2.6199 2.7014 2.7071 3.0661 3.0736 3.5038 3.5060 3.7517 3.7538 4.1216 4.1241 4.4722 4.4772 4.7952 4.8052 5.0252 5.0377 5.3018 5.3118 5.3329 5.3380 6.3029 6.3362 6.3750 6.4006 6.5290 6.5590 6.8428 6.8736 6.9898 7.0220 7.1416 7.1856 7.2296 7.2935 7.4856 7.5053 7.6498 7.6571 8.2758 8.2808 12.1842 12.1863 12.7701 12.7722 13.8117 13.8142 14.7980 14.8014 15.3563 15.3606 15.7225 15.7275 k =-0.3019-0.3142 0.1311 ( 9679 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4372 -15.4371 -14.3412 -14.3412 -12.9717 -12.9707 -12.3869 -12.3857 -12.1573 -12.1527 -12.0958 -12.0912 -11.5694 -11.5683 -3.2822 -3.2814 -1.5157 -1.5136 -0.9625 -0.9614 -0.1499 -0.1471 0.4612 0.4649 0.7709 0.7743 0.8852 0.8863 1.5026 1.5070 2.0570 2.0576 2.2684 2.2702 2.6117 2.6177 2.6964 2.7021 3.0636 3.0717 3.5031 3.5055 3.7361 3.7383 4.1040 4.1064 4.4530 4.4583 4.7963 4.8061 5.0162 5.0295 5.3076 5.3185 5.3403 5.3452 6.3012 6.3390 6.3756 6.3998 6.5279 6.5592 6.8409 6.8742 6.9876 7.0193 7.1435 7.1840 7.2277 7.2898 7.4920 7.5123 7.6485 7.6562 8.2875 8.2918 12.1374 12.1397 12.7841 12.7863 13.8340 13.8365 14.7957 14.7990 15.3830 15.3890 15.7028 15.7076 k =-0.2925-0.3043 0.1270 ( 9675 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3955 -48.3955 -48.0610 -48.0610 -15.4438 -15.4437 -14.3364 -14.3363 -12.9745 -12.9735 -12.3820 -12.3807 -12.1551 -12.1505 -12.0957 -12.0912 -11.5692 -11.5681 -3.2787 -3.2779 -1.5312 -1.5292 -0.9425 -0.9415 -0.1311 -0.1286 0.4555 0.4591 0.7698 0.7734 0.8824 0.8835 1.4871 1.4917 2.0680 2.0686 2.2761 2.2780 2.6072 2.6130 2.6927 2.6981 3.0632 3.0717 3.5019 3.5047 3.7214 3.7237 4.0869 4.0893 4.4339 4.4394 4.7989 4.8084 5.0088 5.0228 5.3125 5.3237 5.3479 5.3526 6.2991 6.3413 6.3765 6.3993 6.5269 6.5596 6.8388 6.8747 6.9854 7.0167 7.1453 7.1818 7.2268 7.2865 7.4972 7.5181 7.6465 7.6546 8.2980 8.3014 12.0881 12.0905 12.7983 12.8004 13.8551 13.8576 14.7962 14.7995 15.4034 15.4112 15.6875 15.6924 k =-0.2830-0.2945 0.1229 ( 9670 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4507 -15.4505 -14.3314 -14.3314 -12.9770 -12.9760 -12.3769 -12.3756 -12.1528 -12.1483 -12.0960 -12.0914 -11.5688 -11.5677 -3.2751 -3.2743 -1.5489 -1.5469 -0.9228 -0.9218 -0.1109 -0.1088 0.4498 0.4533 0.7610 0.7651 0.8863 0.8881 1.4703 1.4750 2.0774 2.0780 2.2878 2.2895 2.6005 2.6060 2.6905 2.6955 3.0646 3.0733 3.4997 3.5029 3.7084 3.7107 4.0702 4.0725 4.4151 4.4207 4.8027 4.8120 5.0033 5.0179 5.3169 5.3279 5.3552 5.3598 6.2968 6.3429 6.3778 6.3991 6.5258 6.5602 6.8365 6.8749 6.9836 7.0146 7.1466 7.1788 7.2265 7.2835 7.5009 7.5227 7.6439 7.6526 8.3065 8.3092 12.0365 12.0390 12.8124 12.8145 13.8746 13.8771 14.7999 14.8032 15.4161 15.4256 15.6776 15.6829 k =-0.2736-0.2847 0.1188 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4577 -15.4576 -14.3263 -14.3263 -12.9793 -12.9782 -12.3718 -12.3705 -12.1504 -12.1459 -12.0965 -12.0920 -11.5684 -11.5673 -3.2712 -3.2704 -1.5687 -1.5668 -0.9034 -0.9024 -0.0897 -0.0880 0.4443 0.4477 0.7475 0.7517 0.8950 0.8973 1.4521 1.4569 2.0851 2.0855 2.3033 2.3049 2.5923 2.5974 2.6896 2.6943 3.0674 3.0761 3.4959 3.4996 3.6978 3.7002 4.0540 4.0563 4.3968 4.4027 4.8076 4.8165 4.9997 5.0148 5.3208 5.3314 5.3619 5.3663 6.2945 6.3438 6.3793 6.3990 6.5248 6.5610 6.8340 6.8748 6.9819 7.0126 7.1475 7.1756 7.2264 7.2807 7.5032 7.5258 7.6404 7.6498 8.3129 8.3150 11.9828 11.9854 12.8261 12.8281 13.8925 13.8950 14.8068 14.8102 15.4210 15.4319 15.6733 15.6790 k =-0.2642-0.2749 0.1147 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4649 -15.4648 -14.3212 -14.3211 -12.9813 -12.9802 -12.3666 -12.3652 -12.1478 -12.1433 -12.0973 -12.0928 -11.5678 -11.5667 -3.2672 -3.2664 -1.5905 -1.5887 -0.8840 -0.8830 -0.0682 -0.0666 0.4390 0.4421 0.7317 0.7360 0.9062 0.9088 1.4327 1.4376 2.0911 2.0913 2.3220 2.3235 2.5834 2.5881 2.6897 2.6941 3.0713 3.0799 3.4900 3.4941 3.6904 3.6927 4.0382 4.0405 4.3794 4.3855 4.8134 4.8218 4.9983 5.0137 5.3244 5.3345 5.3676 5.3721 6.2921 6.3441 6.3811 6.3993 6.5239 6.5621 6.8315 6.8743 6.9809 7.0113 7.1478 7.1726 7.2267 7.2785 7.5040 7.5274 7.6364 7.6466 8.3175 8.3191 11.9272 11.9298 12.8392 12.8411 13.9087 13.9112 14.8170 14.8206 15.4189 15.4306 15.6737 15.6797 k =-0.2547-0.2651 0.1106 ( 9663 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4722 -15.4721 -14.3159 -14.3159 -12.9830 -12.9819 -12.3614 -12.3600 -12.1451 -12.1407 -12.0984 -12.0939 -11.5670 -11.5659 -3.2630 -3.2622 -1.6143 -1.6126 -0.8648 -0.8636 -0.0467 -0.0453 0.4340 0.4368 0.7153 0.7197 0.9185 0.9212 1.4121 1.4170 2.0957 2.0958 2.3431 2.3444 2.5748 2.5791 2.6904 2.6945 3.0760 3.0845 3.4814 3.4860 3.6868 3.6890 4.0229 4.0251 4.3631 4.3695 4.8198 4.8276 4.9991 5.0147 5.3277 5.3372 5.3724 5.3770 6.2897 6.3438 6.3829 6.3998 6.5230 6.5633 6.8288 6.8734 6.9802 7.0100 7.1474 7.1699 7.2271 7.2766 7.5031 7.5273 7.6318 7.6429 8.3201 8.3215 11.8698 11.8723 12.8516 12.8534 13.9230 13.9257 14.8304 14.8341 15.4114 15.4235 15.6771 15.6833 k =-0.2453-0.2553 0.1065 ( 9669 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4797 -15.4796 -14.3107 -14.3106 -12.9844 -12.9834 -12.3563 -12.3548 -12.1423 -12.1378 -12.0997 -12.0952 -11.5661 -11.5651 -3.2586 -3.2578 -1.6399 -1.6383 -0.8457 -0.8443 -0.0258 -0.0243 0.4292 0.4316 0.6996 0.7038 0.9311 0.9339 1.3903 1.3954 2.0992 2.0993 2.3651 2.3665 2.5672 2.5711 2.6916 2.6955 3.0814 3.0896 3.4702 3.4751 3.6872 3.6892 4.0080 4.0101 4.3481 4.3548 4.8266 4.8339 5.0022 5.0177 5.3306 5.3395 5.3762 5.3812 6.2873 6.3431 6.3846 6.4007 6.5221 6.5646 6.8259 6.8720 6.9799 7.0089 7.1462 7.1678 7.2274 7.2748 7.5006 7.5255 7.6263 7.6385 8.3204 8.3221 11.8107 11.8133 12.8632 12.8649 13.9356 13.9385 14.8467 14.8506 15.4005 15.4126 15.6817 15.6879 k =-0.2358-0.2454 0.1024 ( 9669 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4873 -15.4872 -14.3054 -14.3053 -12.9856 -12.9845 -12.3513 -12.3498 -12.1394 -12.1349 -12.1012 -12.0967 -11.5651 -11.5640 -3.2541 -3.2534 -1.6672 -1.6657 -0.8265 -0.8250 -0.0061 -0.0043 0.4247 0.4268 0.6850 0.6891 0.9437 0.9466 1.3677 1.3729 2.1021 2.1023 2.3868 2.3882 2.5616 2.5652 2.6931 2.6968 3.0875 3.0953 3.4564 3.4618 3.6914 3.6933 3.9935 3.9956 4.3347 4.3418 4.8338 4.8404 5.0074 5.0228 5.3332 5.3414 5.3791 5.3847 6.2851 6.3421 6.3862 6.4020 6.5213 6.5660 6.8230 6.8702 6.9804 7.0083 7.1444 7.1664 7.2278 7.2736 7.4964 7.5220 7.6204 7.6338 8.3189 8.3212 11.7503 11.7528 12.8740 12.8756 13.9465 13.9498 14.8655 14.8695 15.3874 15.3995 15.6862 15.6923 k =-0.2264-0.2356 0.0983 ( 9671 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4949 -15.4948 -14.3001 -14.3000 -12.9864 -12.9854 -12.3464 -12.3448 -12.1365 -12.1320 -12.1028 -12.0983 -11.5639 -11.5629 -3.2495 -3.2488 -1.6959 -1.6945 -0.8074 -0.8056 0.0120 0.0140 0.4207 0.4223 0.6722 0.6760 0.9561 0.9591 1.3443 1.3496 2.1048 2.1051 2.4063 2.4080 2.5586 2.5620 2.6951 2.6985 3.0942 3.1016 3.4408 3.4465 3.6989 3.7007 3.9794 3.9815 4.3232 4.3305 4.8412 4.8470 5.0148 5.0299 5.3351 5.3428 5.3814 5.3878 6.2829 6.3407 6.3876 6.4035 6.5205 6.5675 6.8200 6.8679 6.9815 7.0081 7.1419 7.1654 7.2281 7.2725 7.4905 7.5167 7.6140 7.6287 8.3156 8.3185 11.6886 11.6911 12.8839 12.8854 13.9560 13.9596 14.8861 14.8903 15.3734 15.3853 15.6899 15.6961 k =-0.2170-0.2258 0.0942 ( 9676 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5026 -15.5025 -14.2948 -14.2947 -12.9870 -12.9860 -12.3416 -12.3400 -12.1336 -12.1292 -12.1043 -12.0998 -11.5626 -11.5616 -3.2448 -3.2441 -1.7259 -1.7246 -0.7883 -0.7864 0.0279 0.0303 0.4173 0.4183 0.6613 0.6648 0.9682 0.9713 1.3204 1.3258 2.1075 2.1078 2.4222 2.4242 2.5591 2.5624 2.6978 2.7009 3.1016 3.1086 3.4240 3.4300 3.7091 3.7111 3.9658 3.9679 4.3135 4.3212 4.8487 4.8538 5.0240 5.0388 5.3363 5.3434 5.3835 5.3906 6.2808 6.3390 6.3888 6.4053 6.5199 6.5690 6.8170 6.8651 6.9832 7.0081 7.1391 7.1649 7.2283 7.2717 7.4830 7.5097 7.6072 7.6233 8.3103 8.3138 11.6258 11.6283 12.8930 12.8946 13.9643 13.9683 14.9080 14.9123 15.3589 15.3706 15.6928 15.6990 k =-0.2075-0.2160 0.0901 ( 9671 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5103 -15.5102 -14.2896 -14.2895 -12.9874 -12.9864 -12.3370 -12.3354 -12.1310 -12.1267 -12.1055 -12.1011 -11.5612 -11.5601 -3.2401 -3.2394 -1.7569 -1.7557 -0.7693 -0.7672 0.0412 0.0440 0.4144 0.4150 0.6526 0.6559 0.9800 0.9832 1.2962 1.3017 2.1105 2.1108 2.4334 2.4358 2.5629 2.5663 2.7014 2.7043 3.1098 3.1164 3.4066 3.4129 3.7214 3.7236 3.9526 3.9546 4.3061 4.3140 4.8564 4.8608 5.0349 5.0493 5.3364 5.3431 5.3858 5.3936 6.2787 6.3370 6.3898 6.4073 6.5195 6.5705 6.8139 6.8620 6.9853 7.0085 7.1363 7.1649 7.2289 7.2713 7.4739 7.5011 7.6001 7.6176 8.3040 8.3082 11.5623 11.5647 12.9013 12.9030 13.9716 13.9759 14.9303 14.9348 15.3444 15.3559 15.6951 15.7013 k =-0.1981-0.2062 0.0860 ( 9670 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5179 -15.5178 -14.2844 -14.2843 -12.9875 -12.9865 -12.3327 -12.3311 -12.1288 -12.1249 -12.1059 -12.1019 -11.5596 -11.5586 -3.2353 -3.2347 -1.7886 -1.7875 -0.7505 -0.7482 0.0518 0.0548 0.4121 0.4127 0.6459 0.6491 0.9915 0.9949 1.2720 1.2777 2.1137 2.1141 2.4399 2.4427 2.5691 2.5726 2.7063 2.7090 3.1189 3.1253 3.3893 3.3959 3.7353 3.7379 3.9399 3.9419 4.3008 4.3090 4.8642 4.8679 5.0472 5.0611 5.3354 5.3417 5.3886 5.3969 6.2767 6.3348 6.3907 6.4094 6.5192 6.5720 6.8109 6.8586 6.9878 7.0093 7.1331 7.1649 7.2295 7.2711 7.4633 7.4909 7.5925 7.6114 8.2961 8.3009 11.4982 11.5005 12.9089 12.9107 13.9782 13.9828 14.9523 14.9570 15.3302 15.3414 15.6970 15.7034 k =-0.1887-0.1964 0.0819 ( 9669 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5255 -15.5254 -14.2793 -14.2792 -12.9873 -12.9864 -12.3286 -12.3270 -12.1274 -12.1242 -12.1052 -12.1020 -11.5580 -11.5570 -3.2305 -3.2299 -1.8208 -1.8198 -0.7318 -0.7294 0.0593 0.0627 0.4103 0.4114 0.6412 0.6444 1.0024 1.0061 1.2483 1.2542 2.1173 2.1179 2.4427 2.4459 2.5757 2.5793 2.7127 2.7151 3.1288 3.1351 3.3728 3.3796 3.7504 3.7534 3.9277 3.9296 4.2977 4.3062 4.8720 4.8753 5.0606 5.0739 5.3332 5.3391 5.3924 5.4008 6.2748 6.3322 6.3914 6.4115 6.5192 6.5735 6.8079 6.8549 6.9901 7.0103 7.1303 7.1653 7.2304 7.2711 7.4512 7.4793 7.5846 7.6048 8.2870 8.2924 11.4338 11.4360 12.9159 12.9178 13.9843 13.9892 14.9733 14.9782 15.3162 15.3273 15.6991 15.7056 k =-0.1792-0.1865 0.0778 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5330 -15.5329 -14.2742 -14.2742 -12.9870 -12.9861 -12.3248 -12.3231 -12.1271 -12.1248 -12.1032 -12.1010 -11.5562 -11.5553 -3.2258 -3.2252 -1.8532 -1.8524 -0.7135 -0.7109 0.0640 0.0675 0.4091 0.4108 0.6383 0.6418 1.0127 1.0167 1.2254 1.2315 2.1213 2.1221 2.4432 2.4467 2.5811 2.5848 2.7205 2.7225 3.1397 3.1460 3.3576 3.3647 3.7661 3.7696 3.9161 3.9179 4.2969 4.3057 4.8798 4.8830 5.0747 5.0875 5.3299 5.3354 5.3972 5.4053 6.2728 6.3294 6.3920 6.4136 6.5194 6.5749 6.8049 6.8509 6.9924 7.0119 7.1275 7.1657 7.2313 7.2710 7.4378 7.4664 7.5764 7.5979 8.2770 8.2829 11.3694 11.3715 12.9223 12.9243 13.9900 13.9952 14.9925 14.9975 15.3026 15.3135 15.7015 15.7082 k =-0.1698-0.1767 0.0737 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5403 -15.5402 -14.2693 -14.2693 -12.9865 -12.9856 -12.3212 -12.3196 -12.1277 -12.1263 -12.1003 -12.0989 -11.5544 -11.5535 -3.2211 -3.2206 -1.8856 -1.8849 -0.6955 -0.6929 0.0661 0.0696 0.4086 0.4109 0.6370 0.6408 1.0221 1.0265 1.2038 1.2102 2.1258 2.1267 2.4422 2.4462 2.5843 2.5879 2.7290 2.7307 3.1513 3.1578 3.3443 3.3517 3.7822 3.7862 3.9051 3.9069 4.2983 4.3072 4.8878 4.8910 5.0892 5.1016 5.3258 5.3308 5.4029 5.4106 6.2708 6.3262 6.3924 6.4157 6.5199 6.5763 6.8020 6.8467 6.9940 7.0137 7.1251 7.1665 7.2323 7.2709 7.4233 7.4524 7.5678 7.5904 8.2660 8.2724 11.3053 11.3074 12.9282 12.9304 13.9957 14.0011 15.0093 15.0144 15.2894 15.3001 15.7046 15.7113 k =-0.1604-0.1669 0.0696 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5474 -15.5474 -14.2646 -14.2645 -12.9858 -12.9850 -12.3179 -12.3163 -12.1292 -12.1283 -12.0967 -12.0960 -11.5526 -11.5516 -3.2165 -3.2160 -1.9177 -1.9171 -0.6781 -0.6754 0.0660 0.0695 0.4084 0.4112 0.6369 0.6412 1.0301 1.0348 1.1843 1.1911 2.1307 2.1318 2.4407 2.4451 2.5851 2.5886 2.7374 2.7389 3.1633 3.1698 3.3338 3.3413 3.7983 3.8028 3.8949 3.8966 4.3018 4.3108 4.8957 4.8992 5.1039 5.1159 5.3211 5.3256 5.4095 5.4166 6.2688 6.3228 6.3926 6.4176 6.5208 6.5777 6.7991 6.8425 6.9952 7.0160 7.1231 7.1673 7.2334 7.2707 7.4078 7.4375 7.5590 7.5826 8.2547 8.2615 11.2419 11.2438 12.9337 12.9360 14.0014 14.0070 15.0234 15.0285 15.2765 15.2870 15.7082 15.7151 k =-0.1509-0.1571 0.0655 ( 9673 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5544 -15.5543 -14.2600 -14.2599 -12.9850 -12.9842 -12.3150 -12.3134 -12.1313 -12.1305 -12.0930 -12.0924 -11.5507 -11.5497 -3.2120 -3.2116 -1.9493 -1.9488 -0.6613 -0.6585 0.0641 0.0675 0.4083 0.4116 0.6379 0.6426 1.0358 1.0408 1.1680 1.1750 2.1360 2.1373 2.4390 2.4437 2.5836 2.5870 2.7448 2.7461 3.1752 3.1816 3.3266 3.3341 3.8141 3.8191 3.8855 3.8872 4.3071 4.3162 4.9036 4.9075 5.1186 5.1302 5.3161 5.3201 5.4169 5.4233 6.2667 6.3190 6.3927 6.4193 6.5219 6.5791 6.7962 6.8380 6.9957 7.0181 7.1213 7.1679 7.2342 7.2701 7.3914 7.4219 7.5499 7.5743 8.2423 8.2494 11.1794 11.1813 12.9388 12.9413 14.0072 14.0129 15.0343 15.0393 15.2641 15.2743 15.7122 15.7192 k =-0.1415-0.1473 0.0614 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5611 -15.5610 -14.2555 -14.2555 -12.9841 -12.9833 -12.3123 -12.3107 -12.1337 -12.1329 -12.0891 -12.0885 -11.5487 -11.5479 -3.2076 -3.2072 -1.9802 -1.9797 -0.6453 -0.6425 0.0610 0.0644 0.4080 0.4117 0.6398 0.6448 1.0383 1.0432 1.1562 1.1630 2.1418 2.1432 2.4373 2.4425 2.5804 2.5836 2.7506 2.7518 3.1863 3.1924 3.3234 3.3308 3.8293 3.8347 3.8774 3.8789 4.3142 4.3232 4.9115 4.9158 5.1330 5.1442 5.3112 5.3147 5.4250 5.4307 6.2646 6.3149 6.3926 6.4209 6.5234 6.5804 6.7935 6.8336 6.9961 7.0205 7.1204 7.1688 7.2355 7.2698 7.3746 7.4059 7.5409 7.5657 8.2302 8.2375 11.1183 11.1200 12.9437 12.9462 14.0132 14.0190 15.0420 15.0469 15.2522 15.2620 15.7165 15.7234 k =-0.1321-0.1374 0.0573 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5675 -15.5675 -14.2513 -14.2512 -12.9831 -12.9824 -12.3099 -12.3083 -12.1361 -12.1352 -12.0851 -12.0844 -11.5468 -11.5460 -3.2034 -3.2031 -2.0101 -2.0097 -0.6301 -0.6273 0.0573 0.0605 0.4073 0.4113 0.6423 0.6476 1.0368 1.0411 1.1498 1.1561 2.1478 2.1495 2.4359 2.4415 2.5756 2.5787 2.7543 2.7556 3.1960 3.2014 3.3245 3.3315 3.8432 3.8490 3.8709 3.8721 4.3226 4.3316 4.9192 4.9239 5.1470 5.1577 5.3065 5.3096 5.4336 5.4387 6.2623 6.3106 6.3924 6.4221 6.5253 6.5818 6.7908 6.8292 6.9959 7.0221 7.1201 7.1694 7.2365 7.2691 7.3575 7.3897 7.5318 7.5569 8.2182 8.2256 11.0589 11.0605 12.9482 12.9509 14.0195 14.0253 15.0466 15.0511 15.2407 15.2500 15.7205 15.7273 k =-0.1226-0.1276 0.0532 ( 9659 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5737 -15.5736 -14.2473 -14.2472 -12.9821 -12.9814 -12.3078 -12.3063 -12.1386 -12.1376 -12.0811 -12.0804 -11.5449 -11.5441 -3.1994 -3.1991 -2.0388 -2.0385 -0.6159 -0.6132 0.0534 0.0565 0.4058 0.4100 0.6454 0.6506 1.0312 1.0345 1.1489 1.1542 2.1542 2.1560 2.4349 2.4408 2.5697 2.5727 2.7558 2.7574 3.2041 3.2088 3.3296 3.3362 3.8539 3.8585 3.8683 3.8703 4.3322 4.3410 4.9267 4.9318 5.1605 5.1707 5.3024 5.3050 5.4426 5.4472 6.2601 6.3060 6.3921 6.4231 6.5274 6.5830 6.7884 6.8249 6.9955 7.0232 7.1206 7.1700 7.2371 7.2682 7.3405 7.3738 7.5228 7.5479 8.2065 8.2139 11.0015 11.0030 12.9526 12.9552 14.0260 14.0318 15.0482 15.0523 15.2298 15.2384 15.7240 15.7306 k =-0.1132-0.1178 0.0491 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5795 -15.5794 -14.2435 -14.2434 -12.9810 -12.9803 -12.3059 -12.3045 -12.1409 -12.1399 -12.0771 -12.0764 -11.5431 -11.5423 -3.1956 -3.1953 -2.0662 -2.0659 -0.6027 -0.6001 0.0498 0.0526 0.4035 0.4077 0.6489 0.6540 1.0225 1.0248 1.1521 1.1564 2.1608 2.1628 2.4344 2.4406 2.5630 2.5659 2.7553 2.7573 3.2107 3.2148 3.3376 3.3439 3.8553 3.8577 3.8746 3.8796 4.3426 4.3511 4.9338 4.9393 5.1733 5.1830 5.2989 5.3013 5.4519 5.4561 6.2578 6.3011 6.3917 6.4238 6.5298 6.5842 6.7860 6.8205 6.9947 7.0233 7.1217 7.1702 7.2367 7.2666 7.3241 7.3582 7.5138 7.5385 8.1948 8.2021 10.9465 10.9479 12.9567 12.9594 14.0328 14.0385 15.0471 15.0507 15.2194 15.2273 15.7267 15.7330 k =-0.1038-0.1080 0.0451 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5850 -15.5849 -14.2399 -14.2398 -12.9799 -12.9793 -12.3043 -12.3030 -12.1432 -12.1422 -12.0733 -12.0725 -11.5413 -11.5405 -3.1920 -3.1918 -2.0920 -2.0917 -0.5907 -0.5882 0.0466 0.0493 0.4002 0.4043 0.6527 0.6575 1.0120 1.0134 1.1578 1.1611 2.1675 2.1696 2.4343 2.4408 2.5557 2.5585 2.7531 2.7554 3.2164 3.2204 3.3472 3.3533 3.8532 3.8550 3.8851 3.8909 4.3534 4.3616 4.9405 4.9462 5.1853 5.1945 5.2964 5.2984 5.4613 5.4652 6.2555 6.2961 6.3914 6.4241 6.5325 6.5852 6.7838 6.8163 6.9941 7.0229 7.1235 7.1700 7.2354 7.2645 7.3091 7.3437 7.5051 7.5293 8.1836 8.1907 10.8943 10.8956 12.9606 12.9632 14.0398 14.0454 15.0437 15.0468 15.2096 15.2166 15.7284 15.7343 k =-0.0943-0.0982 0.0410 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5900 -15.5900 -14.2366 -14.2365 -12.9788 -12.9782 -12.3029 -12.3017 -12.1452 -12.1443 -12.0696 -12.0688 -11.5395 -11.5388 -3.1887 -3.1885 -2.1161 -2.1159 -0.5799 -0.5776 0.0443 0.0468 0.3959 0.3999 0.6567 0.6613 1.0007 1.0016 1.1646 1.1673 2.1743 2.1765 2.4347 2.4414 2.5479 2.5507 2.7494 2.7519 3.2219 3.2260 3.3572 3.3632 3.8517 3.8534 3.8953 3.9013 4.3645 4.3722 4.9466 4.9525 5.1965 5.2051 5.2948 5.2967 5.4707 5.4743 6.2532 6.2909 6.3912 6.4239 6.5354 6.5860 6.7820 6.8122 6.9932 7.0216 7.1256 7.1693 7.2326 7.2617 7.2965 7.3307 7.4970 7.5202 8.1731 8.1799 10.8453 10.8465 12.9643 12.9668 14.0469 14.0523 15.0385 15.0410 15.2004 15.2065 15.7293 15.7348 k =-0.0849-0.0884 0.0369 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5947 -15.5946 -14.2335 -14.2335 -12.9777 -12.9772 -12.3018 -12.3006 -12.1471 -12.1462 -12.0661 -12.0654 -11.5379 -11.5373 -3.1857 -3.1855 -2.1383 -2.1382 -0.5704 -0.5682 0.0428 0.0452 0.3908 0.3945 0.6610 0.6651 0.9894 0.9902 1.1719 1.1741 2.1810 2.1833 2.4356 2.4425 2.5400 2.5427 2.7446 2.7474 3.2278 3.2321 3.3665 3.3724 3.8514 3.8531 3.9044 3.9106 4.3753 4.3826 4.9521 4.9581 5.2068 5.2149 5.2941 5.2961 5.4800 5.4833 6.2511 6.2856 6.3912 6.4234 6.5385 6.5865 6.7804 6.8083 6.9923 7.0198 7.1276 7.1677 7.2279 7.2571 7.2874 7.3194 7.4894 7.5114 8.1631 8.1695 10.7997 10.8008 12.9677 12.9702 14.0541 14.0591 15.0319 15.0339 15.1916 15.1968 15.7294 15.7344 k =-0.0755-0.0785 0.0328 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5989 -15.5989 -14.2308 -14.2307 -12.9767 -12.9763 -12.3008 -12.2998 -12.1488 -12.1479 -12.0629 -12.0622 -11.5364 -11.5358 -3.1829 -3.1828 -2.1585 -2.1584 -0.5621 -0.5600 0.0423 0.0445 0.3848 0.3883 0.6654 0.6690 0.9785 0.9794 1.1790 1.1808 2.1876 2.1898 2.4369 2.4439 2.5320 2.5348 2.7391 2.7420 3.2343 3.2387 3.3745 3.3803 3.8525 3.8541 3.9125 3.9186 4.3857 4.3924 4.9570 4.9629 5.2161 5.2237 5.2942 5.2967 5.4888 5.4920 6.2491 6.2804 6.3914 6.4224 6.5418 6.5866 6.7791 6.8046 6.9912 7.0171 7.1293 7.1650 7.2219 7.2510 7.2822 7.3101 7.4825 7.5030 8.1543 8.1603 10.7580 10.7590 12.9710 12.9733 14.0611 14.0658 15.0243 15.0259 15.1835 15.1878 15.7289 15.7333 k =-0.0660-0.0687 0.0287 ( 9678 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6027 -15.6027 -14.2283 -14.2283 -12.9758 -12.9754 -12.3001 -12.2991 -12.1503 -12.1495 -12.0599 -12.0593 -11.5350 -11.5345 -3.1805 -3.1804 -2.1767 -2.1766 -0.5550 -0.5531 0.0427 0.0447 0.3784 0.3815 0.6699 0.6729 0.9685 0.9696 1.1857 1.1872 2.1939 2.1961 2.4387 2.4457 2.5241 2.5270 2.7332 2.7361 3.2414 3.2459 3.3808 3.3864 3.8546 3.8562 3.9195 3.9253 4.3954 4.4014 4.9614 4.9669 5.2243 5.2315 5.2952 5.2983 5.4972 5.5002 6.2473 6.2752 6.3918 6.4211 6.5452 6.5863 6.7781 6.8010 6.9901 7.0139 7.1301 7.1609 7.2155 7.2441 7.2798 7.3028 7.4764 7.4949 8.1463 8.1517 10.7204 10.7212 12.9739 12.9760 14.0679 14.0722 15.0163 15.0176 15.1759 15.1795 15.7280 15.7319 k =-0.0566-0.0589 0.0246 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6060 -15.6060 -14.2262 -14.2261 -12.9749 -12.9746 -12.2994 -12.2986 -12.1516 -12.1509 -12.0573 -12.0568 -11.5337 -11.5333 -3.1783 -3.1782 -2.1926 -2.1925 -0.5490 -0.5474 0.0439 0.0456 0.3717 0.3745 0.6742 0.6767 0.9595 0.9607 1.1917 1.1930 2.1999 2.2019 2.4407 2.4477 2.5165 2.5196 2.7274 2.7302 3.2491 3.2534 3.3853 3.3905 3.8575 3.8591 3.9253 3.9307 4.4042 4.4095 4.9651 4.9702 5.2313 5.2382 5.2970 5.3005 5.5049 5.5076 6.2460 6.2702 6.3926 6.4193 6.5488 6.5856 6.7776 6.7978 6.9898 7.0111 7.1304 7.1562 7.2103 7.2378 7.2793 7.2975 7.4713 7.4877 8.1391 8.1439 10.6872 10.6879 12.9766 12.9785 14.0743 14.0781 15.0083 15.0094 15.1691 15.1720 15.7270 15.7304 k =-0.0472-0.0491 0.0205 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6088 -15.6088 -14.2243 -14.2243 -12.9742 -12.9739 -12.2989 -12.2982 -12.1526 -12.1520 -12.0551 -12.0546 -11.5327 -11.5323 -3.1765 -3.1764 -2.2062 -2.2062 -0.5441 -0.5428 0.0456 0.0471 0.3652 0.3676 0.6783 0.6802 0.9517 0.9529 1.1970 1.1980 2.2053 2.2071 2.4431 2.4498 2.5095 2.5127 2.7219 2.7244 3.2569 3.2610 3.3880 3.3927 3.8610 3.8626 3.9301 3.9350 4.4119 4.4165 4.9683 4.9729 5.2373 5.2437 5.2994 5.3031 5.5117 5.5141 6.2450 6.2655 6.3938 6.4172 6.5524 6.5843 6.7775 6.7948 6.9896 7.0081 7.1297 7.1505 7.2068 7.2322 7.2796 7.2935 7.4672 7.4813 8.1331 8.1372 10.6587 10.6593 12.9790 12.9806 14.0802 14.0835 15.0008 15.0017 15.1631 15.1654 15.7260 15.7288 k =-0.0377-0.0393 0.0164 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6112 -15.6112 -14.2228 -14.2228 -12.9735 -12.9733 -12.2985 -12.2980 -12.1535 -12.1530 -12.0532 -12.0528 -11.5317 -11.5314 -3.1750 -3.1749 -2.2175 -2.2174 -0.5403 -0.5392 0.0476 0.0488 0.3592 0.3611 0.6819 0.6834 0.9452 0.9463 1.2014 1.2022 2.2100 2.2116 2.4456 2.4518 2.5032 2.5065 2.7171 2.7192 3.2646 3.2683 3.3892 3.3934 3.8647 3.8661 3.9339 3.9381 4.4185 4.4222 4.9710 4.9748 5.2423 5.2478 5.3021 5.3056 5.5176 5.5196 6.2445 6.2610 6.3953 6.4149 6.5562 6.5826 6.7779 6.7920 6.9899 7.0051 7.1284 7.1444 7.2053 7.2273 7.2800 7.2903 7.4641 7.4756 8.1283 8.1316 10.6350 10.6355 12.9810 12.9823 14.0853 14.0880 14.9940 14.9948 15.1580 15.1597 15.7251 15.7274 k =-0.0283-0.0295 0.0123 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6130 -15.6130 -14.2216 -14.2216 -12.9730 -12.9728 -12.2982 -12.2978 -12.1541 -12.1538 -12.0516 -12.0513 -11.5310 -11.5308 -3.1738 -3.1738 -2.2263 -2.2262 -0.5373 -0.5365 0.0496 0.0505 0.3541 0.3556 0.6850 0.6861 0.9401 0.9410 1.2048 1.2054 2.2140 2.2152 2.4482 2.4536 2.4980 2.5011 2.7131 2.7148 3.2717 3.2748 3.3893 3.3928 3.8681 3.8693 3.9368 3.9402 4.4238 4.4266 4.9732 4.9762 5.2462 5.2507 5.3049 5.3079 5.5223 5.5240 6.2445 6.2570 6.3971 6.4123 6.5600 6.5803 6.7786 6.7893 6.9902 7.0020 7.1268 7.1385 7.2054 7.2229 7.2806 7.2877 7.4621 7.4709 8.1243 8.1268 10.6165 10.6169 12.9826 12.9836 14.0896 14.0917 14.9885 14.9891 15.1540 15.1552 15.7244 15.7261 k =-0.0189-0.0196 0.0082 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6143 -15.6143 -14.2208 -14.2208 -12.9726 -12.9725 -12.2980 -12.2977 -12.1546 -12.1543 -12.0505 -12.0503 -11.5305 -11.5303 -3.1730 -3.1730 -2.2326 -2.2326 -0.5353 -0.5347 0.0513 0.0520 0.3503 0.3513 0.6873 0.6880 0.9364 0.9371 1.2073 1.2077 2.2169 2.2178 2.4507 2.4548 2.4941 2.4966 2.7102 2.7114 3.2775 3.2798 3.3891 3.3915 3.8710 3.8719 3.9390 3.9413 4.4277 4.4297 4.9749 4.9770 5.2493 5.2523 5.3074 5.3095 5.5259 5.5270 6.2450 6.2535 6.3992 6.4096 6.5637 6.5775 6.7796 6.7869 6.9910 6.9990 7.1257 7.1333 7.2069 7.2190 7.2812 7.2857 7.4609 7.4668 8.1214 8.1231 10.6031 10.6034 12.9838 12.9845 14.0928 14.0942 14.9843 14.9848 15.1510 15.1518 15.7240 15.7251 k =-0.0094-0.0098 0.0041 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6151 -15.6151 -14.2203 -14.2203 -12.9724 -12.9723 -12.2979 -12.2977 -12.1548 -12.1547 -12.0499 -12.0498 -11.5301 -11.5301 -3.1725 -3.1725 -2.2364 -2.2364 -0.5340 -0.5337 0.0525 0.0529 0.3479 0.3484 0.6889 0.6892 0.9343 0.9346 1.2089 1.2091 2.2189 2.2193 2.4529 2.4551 2.4920 2.4935 2.7085 2.7091 3.2816 3.2828 3.3889 3.3902 3.8729 3.8734 3.9405 3.9417 4.4303 4.4313 4.9762 4.9772 5.2514 5.2530 5.3093 5.3104 5.5282 5.5288 6.2463 6.2505 6.4016 6.4069 6.5675 6.5745 6.7810 6.7847 6.9923 6.9964 7.1257 7.1294 7.2093 7.2155 7.2822 7.2843 7.4609 7.4639 8.1200 8.1208 10.5951 10.5952 12.9847 12.9850 14.0950 14.0957 14.9818 14.9820 15.1493 15.1497 15.7238 15.7244 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 k = 0.0000 0.0000 0.0139 ( 9654 PWs) bands (ev): -84.3022 -84.3022 -50.0022 -50.0022 -48.3955 -48.3955 -48.0608 -48.0608 -15.6151 -15.6151 -14.2208 -14.2208 -12.9719 -12.9719 -12.2979 -12.2977 -12.1548 -12.1547 -12.0496 -12.0496 -11.5301 -11.5300 -3.1735 -3.1734 -2.2358 -2.2357 -0.5338 -0.5337 0.0526 0.0528 0.3479 0.3482 0.6893 0.6895 0.9333 0.9343 1.2095 1.2105 2.2194 2.2196 2.4531 2.4549 2.4922 2.4938 2.7083 2.7088 3.2825 3.2831 3.3879 3.3886 3.8715 3.8731 3.9411 3.9427 4.4311 4.4314 4.9766 4.9774 5.2516 5.2521 5.3094 5.3105 5.5271 5.5291 6.2466 6.2500 6.4026 6.4059 6.5682 6.5739 6.7820 6.7846 6.9937 6.9958 7.1248 7.1303 7.2097 7.2150 7.2808 7.2855 7.4599 7.4654 8.1202 8.1209 10.5949 10.5952 12.9848 12.9852 14.0954 14.0961 14.9790 14.9804 15.1487 15.1498 15.7245 15.7250 k = 0.0000 0.0000 0.0277 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6141 -15.6141 -14.2229 -14.2228 -12.9708 -12.9706 -12.2982 -12.2979 -12.1545 -12.1544 -12.0497 -12.0496 -11.5304 -11.5303 -3.1769 -3.1768 -2.2304 -2.2302 -0.5347 -0.5346 0.0514 0.0518 0.3499 0.3505 0.6890 0.6894 0.9332 0.9351 1.2106 1.2126 2.2189 2.2193 2.4512 2.4544 2.4950 2.4979 2.7093 2.7103 3.2801 3.2813 3.3846 3.3860 3.8667 3.8695 3.9414 3.9444 4.4300 4.4307 4.9763 4.9780 5.2489 5.2500 5.3077 5.3100 5.5228 5.5269 6.2456 6.2522 6.4013 6.4077 6.5652 6.5766 6.7821 6.7873 6.9932 6.9973 7.1235 7.1345 7.2069 7.2178 7.2779 7.2873 7.4584 7.4693 8.1211 8.1224 10.6023 10.6029 12.9845 12.9853 14.0945 14.0958 14.9746 14.9772 15.1490 15.1513 15.7265 15.7275 k = 0.0000 0.0000 0.0416 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6126 -15.6126 -14.2264 -14.2262 -12.9688 -12.9686 -12.2987 -12.2982 -12.1541 -12.1538 -12.0497 -12.0495 -11.5309 -11.5306 -3.1826 -3.1824 -2.2214 -2.2211 -0.5363 -0.5361 0.0495 0.0501 0.3533 0.3542 0.6884 0.6890 0.9335 0.9363 1.2127 1.2156 2.2182 2.2187 2.4491 2.4532 2.4998 2.5035 2.7112 2.7127 3.2762 3.2781 3.3795 3.3816 3.8600 3.8635 3.9421 3.9460 4.4283 4.4293 4.9760 4.9785 5.2447 5.2463 5.3052 5.3088 5.5166 5.5227 6.2450 6.2547 6.4003 6.4096 6.5623 6.5791 6.7831 6.7910 6.9929 6.9990 7.1230 7.1400 7.2046 7.2210 7.2750 7.2887 7.4580 7.4739 8.1232 8.1251 10.6147 10.6156 12.9841 12.9854 14.0932 14.0951 14.9680 14.9717 15.1497 15.1528 15.7297 15.7313 k = 0.0000 0.0000 0.0555 ( 9664 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6105 -15.6105 -14.2311 -14.2310 -12.9661 -12.9659 -12.2993 -12.2986 -12.1534 -12.1531 -12.0497 -12.0495 -11.5315 -11.5312 -3.1902 -3.1900 -2.2089 -2.2086 -0.5385 -0.5383 0.0472 0.0480 0.3579 0.3590 0.6877 0.6883 0.9344 0.9380 1.2156 1.2194 2.2172 2.2179 2.4471 2.4519 2.5062 2.5103 2.7138 2.7158 3.2709 3.2733 3.3727 3.3754 3.8519 3.8559 3.9426 3.9472 4.4260 4.4273 4.9757 4.9790 5.2391 5.2411 5.3021 5.3067 5.5086 5.5166 6.2449 6.2576 6.3995 6.4114 6.5595 6.5814 6.7851 6.7957 6.9934 7.0013 7.1232 7.1467 7.2025 7.2246 7.2723 7.2900 7.4589 7.4793 8.1263 8.1288 10.6322 10.6333 12.9836 12.9853 14.0914 14.0939 14.9598 14.9645 15.1504 15.1542 15.7338 15.7360 k = 0.0000 0.0000 0.0693 ( 9660 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6078 -15.6077 -14.2372 -14.2370 -12.9627 -12.9624 -12.3000 -12.2991 -12.1526 -12.1522 -12.0497 -12.0495 -11.5324 -11.5319 -3.1997 -3.1995 -2.1934 -2.1930 -0.5415 -0.5411 0.0447 0.0456 0.3635 0.3648 0.6867 0.6874 0.9362 0.9404 1.2192 1.2237 2.2161 2.2170 2.4456 2.4508 2.5136 2.5180 2.7172 2.7196 3.2640 3.2669 3.3644 3.3677 3.8429 3.8472 3.9424 3.9474 4.4230 4.4247 4.9753 4.9794 5.2321 5.2345 5.2981 5.3040 5.4992 5.5090 6.2453 6.2606 6.3989 6.4131 6.5569 6.5835 6.7879 6.8012 6.9943 7.0037 7.1234 7.1541 7.2009 7.2289 7.2697 7.2909 7.4608 7.4854 8.1305 8.1336 10.6544 10.6558 12.9830 12.9851 14.0890 14.0922 14.9505 14.9559 15.1504 15.1547 15.7384 15.7413 k = 0.0000 0.0000 0.0832 ( 9662 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6045 -15.6044 -14.2444 -14.2442 -12.9587 -12.9583 -12.3009 -12.2998 -12.1516 -12.1511 -12.0498 -12.0495 -11.5333 -11.5328 -3.2108 -3.2105 -2.1748 -2.1744 -0.5451 -0.5447 0.0421 0.0431 0.3697 0.3713 0.6854 0.6862 0.9390 0.9437 1.2233 1.2284 2.2149 2.2159 2.4445 2.4499 2.5219 2.5265 2.7212 2.7240 3.2553 3.2587 3.3550 3.3587 3.8334 3.8377 3.9415 3.9466 4.4194 4.4214 4.9747 4.9796 5.2237 5.2265 5.2936 5.3004 5.4887 5.5001 6.2461 6.2638 6.3985 6.4146 6.5545 6.5852 6.7915 6.8074 6.9951 7.0059 7.1235 7.1619 7.2000 7.2338 7.2673 7.2914 7.4637 7.4918 8.1353 8.1390 10.6813 10.6830 12.9823 12.9848 14.0861 14.0899 14.9405 14.9465 15.1494 15.1540 15.7430 15.7466 k = 0.0000 0.0000 0.0971 ( 9658 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.6006 -15.6006 -14.2528 -14.2526 -12.9540 -12.9536 -12.3018 -12.3007 -12.1504 -12.1499 -12.0498 -12.0494 -11.5344 -11.5339 -3.2232 -3.2229 -2.1536 -2.1531 -0.5496 -0.5491 0.0397 0.0408 0.3765 0.3783 0.6839 0.6847 0.9430 0.9481 1.2277 1.2333 2.2136 2.2148 2.4440 2.4495 2.5308 2.5355 2.7257 2.7288 3.2447 3.2486 3.3447 3.3489 3.8236 3.8277 3.9396 3.9447 4.4150 4.4174 4.9736 4.9792 5.2140 5.2173 5.2886 5.2962 5.4774 5.4903 6.2473 6.2672 6.3982 6.4158 6.5524 6.5867 6.7957 6.8144 6.9968 7.0086 7.1234 7.1694 7.2006 7.2395 7.2655 7.2918 7.4673 7.4984 8.1411 8.1453 10.7128 10.7148 12.9814 12.9843 14.0823 14.0868 14.9302 14.9368 15.1468 15.1516 15.7472 15.7516 k = 0.0000 0.0000 0.1110 ( 9655 PWs) bands (ev): -84.3023 -84.3023 -50.0022 -50.0022 -48.3955 -48.3955 -48.0608 -48.0608 -15.5962 -15.5962 -14.2623 -14.2620 -12.9488 -12.9483 -12.3029 -12.3016 -12.1491 -12.1485 -12.0497 -12.0493 -11.5357 -11.5351 -3.2368 -3.2365 -2.1300 -2.1294 -0.5550 -0.5544 0.0377 0.0388 0.3836 0.3855 0.6822 0.6829 0.9483 0.9537 1.2322 1.2383 2.2122 2.2137 2.4440 2.4496 2.5403 2.5450 2.7305 2.7339 3.2321 3.2364 3.3342 3.3387 3.8135 3.8174 3.9369 3.9420 4.4099 4.4127 4.9718 4.9781 5.2031 5.2070 5.2834 5.2915 5.4658 5.4800 6.2489 6.2706 6.3979 6.4167 6.5505 6.5880 6.8006 6.8219 6.9986 7.0112 7.1227 7.1750 7.2038 7.2455 7.2650 7.2923 7.4720 7.5055 8.1475 8.1523 10.7486 10.7509 12.9803 12.9836 14.0778 14.0828 14.9202 14.9271 15.1422 15.1472 15.7508 15.7560 k = 0.0000 0.0000 0.1248 ( 9656 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5913 -15.5913 -14.2727 -14.2723 -12.9431 -12.9426 -12.3041 -12.3027 -12.1476 -12.1470 -12.0496 -12.0492 -11.5371 -11.5364 -3.2513 -3.2510 -2.1042 -2.1036 -0.5612 -0.5606 0.0362 0.0374 0.3907 0.3928 0.6804 0.6811 0.9550 0.9604 1.2367 1.2431 2.2109 2.2125 2.4446 2.4502 2.5501 2.5548 2.7354 2.7391 3.2174 3.2220 3.3237 3.3285 3.8030 3.8066 3.9338 3.9386 4.4042 4.4073 4.9689 4.9757 5.1910 5.1957 5.2781 5.2865 5.4542 5.4694 6.2507 6.2740 6.3976 6.4173 6.5490 6.5890 6.8060 6.8299 7.0008 7.0139 7.1214 7.1778 7.2102 7.2503 7.2671 7.2929 7.4769 7.5123 8.1545 8.1597 10.7886 10.7910 12.9790 12.9826 14.0722 14.0778 14.9105 14.9179 15.1354 15.1403 15.7536 15.7597 k = 0.0000 0.0000 0.1387 ( 9658 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5859 -15.5859 -14.2839 -14.2836 -12.9370 -12.9364 -12.3053 -12.3038 -12.1461 -12.1455 -12.0495 -12.0490 -11.5386 -11.5379 -3.2665 -3.2661 -2.0766 -2.0759 -0.5684 -0.5677 0.0354 0.0366 0.3977 0.3999 0.6785 0.6793 0.9629 0.9684 1.2411 1.2477 2.2094 2.2113 2.4457 2.4512 2.5603 2.5649 2.7402 2.7441 3.2008 3.2055 3.3138 3.3187 3.7920 3.7954 3.9303 3.9350 4.3978 4.4013 4.9645 4.9718 5.1778 5.1836 5.2733 5.2814 5.4429 5.4589 6.2528 6.2774 6.3972 6.4177 6.5477 6.5897 6.8119 6.8381 7.0034 7.0166 7.1195 7.1781 7.2188 7.2525 7.2733 7.2942 7.4824 7.5194 8.1618 8.1674 10.8324 10.8351 12.9774 12.9814 14.0654 14.0716 14.9017 14.9094 15.1260 15.1308 15.7558 15.7628 k = 0.0000 0.0000 0.1526 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5801 -15.5801 -14.2959 -14.2956 -12.9306 -12.9300 -12.3066 -12.3051 -12.1444 -12.1438 -12.0493 -12.0488 -11.5403 -11.5394 -3.2821 -3.2817 -2.0474 -2.0466 -0.5766 -0.5759 0.0354 0.0366 0.4044 0.4068 0.6769 0.6778 0.9719 0.9774 1.2454 1.2522 2.2078 2.2100 2.4473 2.4527 2.5707 2.5752 2.7446 2.7486 3.1824 3.1873 3.3045 3.3095 3.7804 3.7835 3.9271 3.9313 4.3909 4.3947 4.9581 4.9657 5.1639 5.1710 5.2690 5.2766 5.4322 5.4487 6.2551 6.2809 6.3965 6.4178 6.5467 6.5901 6.8182 6.8465 7.0062 7.0192 7.1170 7.1771 7.2275 7.2535 7.2816 7.2969 7.4884 7.5264 8.1697 8.1757 10.8798 10.8827 12.9755 12.9799 14.0572 14.0641 14.8937 14.9018 15.1141 15.1187 15.7578 15.7655 k = 0.0000 0.0000 0.1664 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5739 -15.5738 -14.3086 -14.3082 -12.9239 -12.9233 -12.3080 -12.3064 -12.1427 -12.1421 -12.0491 -12.0485 -11.5420 -11.5411 -3.2980 -3.2976 -2.0167 -2.0159 -0.5858 -0.5850 0.0362 0.0374 0.4106 0.4132 0.6755 0.6767 0.9817 0.9871 1.2498 1.2567 2.2061 2.2085 2.4493 2.4545 2.5812 2.5857 2.7484 2.7523 3.1629 3.1679 3.2960 3.3010 3.7678 3.7708 3.9243 3.9282 4.3836 4.3877 4.9493 4.9570 5.1495 5.1579 5.2656 5.2724 5.4222 5.4390 6.2575 6.2843 6.3956 6.4178 6.5461 6.5903 6.8249 6.8550 7.0092 7.0217 7.1146 7.1756 7.2342 7.2555 7.2897 7.3031 7.4948 7.5333 8.1780 8.1844 10.9306 10.9337 12.9734 12.9780 14.0476 14.0550 14.8869 14.8953 15.0996 15.1040 15.7600 15.7683 k = 0.0000 0.0000 0.1803 ( 9663 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5673 -15.5673 -14.3218 -14.3214 -12.9171 -12.9164 -12.3095 -12.3078 -12.1410 -12.1404 -12.0487 -12.0481 -11.5438 -11.5429 -3.3140 -3.3136 -1.9850 -1.9842 -0.5960 -0.5951 0.0378 0.0391 0.4163 0.4190 0.6747 0.6762 0.9920 0.9973 1.2544 1.2613 2.2041 2.2068 2.4515 2.4565 2.5920 2.5962 2.7510 2.7549 3.1427 3.1480 3.2884 3.2934 3.7544 3.7572 3.9222 3.9258 4.3759 4.3804 4.9376 4.9452 5.1350 5.1448 5.2633 5.2691 5.4131 5.4299 6.2600 6.2878 6.3944 6.4176 6.5457 6.5904 6.8319 6.8634 7.0124 7.0241 7.1121 7.1737 7.2377 7.2592 7.2971 7.3132 7.5014 7.5403 8.1870 8.1936 10.9845 10.9877 12.9708 12.9758 14.0362 14.0441 14.8811 14.8900 15.0829 15.0871 15.7627 15.7715 k = 0.0000 0.0000 0.1942 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5604 -15.5604 -14.3354 -14.3350 -12.9101 -12.9094 -12.3110 -12.3093 -12.1393 -12.1387 -12.0483 -12.0476 -11.5457 -11.5448 -3.3299 -3.3295 -1.9523 -1.9515 -0.6072 -0.6063 0.0402 0.0415 0.4215 0.4244 0.6746 0.6765 1.0023 1.0074 1.2596 1.2664 2.2018 2.2048 2.4537 2.4585 2.6028 2.6069 2.7522 2.7558 3.1228 3.1283 3.2815 3.2865 3.7401 3.7428 3.9212 3.9246 4.3680 4.3728 4.9229 4.9302 5.1205 5.1317 5.2621 5.2669 5.4049 5.4216 6.2626 6.2912 6.3929 6.4173 6.5455 6.5902 6.8390 6.8717 7.0157 7.0262 7.1096 7.1716 7.2386 7.2628 7.3056 7.3251 7.5084 7.5471 8.1961 8.2029 11.0410 11.0444 12.9678 12.9731 14.0230 14.0314 14.8764 14.8858 15.0644 15.0685 15.7660 15.7752 k = 0.0000 0.0000 0.2080 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5533 -15.5532 -14.3492 -14.3489 -12.9031 -12.9024 -12.3125 -12.3108 -12.1375 -12.1369 -12.0478 -12.0470 -11.5477 -11.5468 -3.3457 -3.3453 -1.9190 -1.9181 -0.6194 -0.6185 0.0434 0.0447 0.4261 0.4292 0.6753 0.6775 1.0120 1.0169 1.2657 1.2723 2.1991 2.2024 2.4557 2.4602 2.6136 2.6175 2.7517 2.7549 3.1039 3.1096 3.2754 3.2803 3.7249 3.7277 3.9213 3.9245 4.3600 4.3651 4.9051 4.9120 5.1064 5.1187 5.2621 5.2659 5.3978 5.4141 6.2652 6.2946 6.3911 6.4169 6.5455 6.5898 6.8463 6.8797 7.0191 7.0282 7.1074 7.1694 7.2384 7.2653 7.3161 7.3378 7.5154 7.5537 8.2053 8.2122 11.0999 11.1035 12.9645 12.9699 14.0078 14.0165 14.8725 14.8825 15.0450 15.0492 15.7701 15.7796 k = 0.0000 0.0000 0.2219 ( 9658 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5460 -15.5459 -14.3633 -14.3629 -12.8961 -12.8954 -12.3140 -12.3123 -12.1358 -12.1353 -12.0472 -12.0464 -11.5497 -11.5487 -3.3611 -3.3607 -1.8851 -1.8842 -0.6325 -0.6315 0.0473 0.0485 0.4303 0.4335 0.6769 0.6795 1.0206 1.0252 1.2732 1.2796 2.1960 2.1995 2.4571 2.4613 2.6241 2.6279 2.7493 2.7520 3.0867 3.0927 3.2700 3.2747 3.7092 3.7120 3.9225 3.9257 4.3521 4.3574 4.8844 4.8908 5.0927 5.1059 5.2631 5.2661 5.3916 5.4075 6.2678 6.2980 6.3891 6.4164 6.5458 6.5893 6.8536 6.8874 7.0224 7.0300 7.1057 7.1673 7.2382 7.2666 7.3279 7.3505 7.5227 7.5602 8.2148 8.2218 11.1608 11.1645 12.9606 12.9663 13.9904 13.9995 14.8690 14.8795 15.0257 15.0304 15.7747 15.7844 k = 0.0000 0.0000 0.2358 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5385 -15.5384 -14.3774 -14.3770 -12.8892 -12.8885 -12.3155 -12.3138 -12.1342 -12.1337 -12.0464 -12.0456 -11.5517 -11.5508 -3.3761 -3.3757 -1.8510 -1.8501 -0.6465 -0.6455 0.0516 0.0529 0.4341 0.4374 0.6795 0.6824 1.0274 1.0317 1.2827 1.2888 2.1922 2.1960 2.4576 2.4616 2.6340 2.6378 2.7453 2.7474 3.0719 3.0783 3.2651 3.2697 3.6933 3.6961 3.9247 3.9281 4.3443 4.3499 4.8610 4.8669 5.0795 5.0931 5.2651 5.2674 5.3865 5.4016 6.2704 6.3014 6.3868 6.4157 6.5461 6.5885 6.8609 6.8946 7.0252 7.0317 7.1041 7.1649 7.2375 7.2668 7.3403 7.3628 7.5302 7.5666 8.2244 8.2313 11.2232 11.2270 12.9563 12.9622 13.9708 13.9802 14.8649 14.8760 15.0080 15.0134 15.7796 15.7893 k = 0.0000 0.0000 0.2497 ( 9659 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5309 -15.5308 -14.3914 -14.3911 -12.8825 -12.8818 -12.3170 -12.3153 -12.1327 -12.1321 -12.0456 -12.0447 -11.5538 -11.5528 -3.3905 -3.3901 -1.8169 -1.8160 -0.6613 -0.6603 0.0564 0.0576 0.4376 0.4410 0.6831 0.6863 1.0318 1.0358 1.2946 1.3004 2.1878 2.1918 2.4567 2.4605 2.6425 2.6464 2.7406 2.7419 3.0599 3.0667 3.2605 3.2651 3.6775 3.6804 3.9279 3.9316 4.3368 4.3427 4.8354 4.8408 5.0667 5.0805 5.2678 5.2696 5.3823 5.3966 6.2731 6.3046 6.3845 6.4149 6.5467 6.5876 6.8681 6.9014 7.0276 7.0336 7.1032 7.1628 7.2369 7.2664 7.3528 7.3746 7.5378 7.5727 8.2340 8.2409 11.2869 11.2907 12.9514 12.9575 13.9491 13.9586 14.8593 14.8708 14.9937 14.9999 15.7843 15.7940 k = 0.0000 0.0000 0.2635 ( 9660 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5233 -15.5233 -14.4052 -14.4049 -12.8760 -12.8753 -12.3184 -12.3168 -12.1312 -12.1307 -12.0447 -12.0438 -11.5558 -11.5548 -3.4043 -3.4039 -1.7829 -1.7820 -0.6768 -0.6757 0.0613 0.0625 0.4410 0.4445 0.6878 0.6912 1.0335 1.0372 1.3092 1.3146 2.1827 2.1868 2.4540 2.4578 2.6483 2.6526 2.7366 2.7378 3.0507 3.0580 3.2560 3.2606 3.6623 3.6653 3.9320 3.9361 4.3298 4.3359 4.8081 4.8130 5.0543 5.0679 5.2710 5.2725 5.3789 5.3924 6.2757 6.3077 6.3821 6.4139 6.5473 6.5866 6.8751 6.9076 7.0293 7.0359 7.1026 7.1605 7.2364 7.2655 7.3649 7.3857 7.5454 7.5787 8.2435 8.2502 11.3513 11.3552 12.9459 12.9522 13.9253 13.9348 14.8513 14.8627 14.9845 14.9913 15.7882 15.7978 k = 0.0000 0.0000 0.2774 ( 9662 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5159 -15.5158 -14.4187 -14.4184 -12.8698 -12.8691 -12.3199 -12.3183 -12.1299 -12.1294 -12.0437 -12.0428 -11.5578 -11.5569 -3.4173 -3.4170 -1.7494 -1.7485 -0.6928 -0.6917 0.0664 0.0675 0.4445 0.4480 0.6934 0.6970 1.0322 1.0356 1.3265 1.3315 2.1767 2.1810 2.4493 2.4529 2.6499 2.6546 2.7355 2.7373 3.0443 3.0520 3.2513 3.2560 3.6481 3.6512 3.9368 3.9414 4.3234 4.3298 4.7795 4.7840 5.0423 5.0555 5.2745 5.2760 5.3764 5.3889 6.2783 6.3107 6.3798 6.4127 6.5481 6.5853 6.8818 6.9131 7.0303 7.0382 7.1026 7.1582 7.2360 7.2643 7.3765 7.3959 7.5531 7.5844 8.2530 8.2595 11.4159 11.4198 12.9399 12.9462 13.8997 13.9091 14.8405 14.8513 14.9814 14.9883 15.7908 15.8001 k = 0.0000 0.0000 0.2913 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5085 -15.5084 -14.4317 -14.4314 -12.8639 -12.8632 -12.3212 -12.3197 -12.1286 -12.1281 -12.0426 -12.0418 -11.5597 -11.5588 -3.4296 -3.4293 -1.7165 -1.7156 -0.7092 -0.7081 0.0713 0.0724 0.4481 0.4516 0.7000 0.7037 1.0280 1.0312 1.3464 1.3510 2.1697 2.1740 2.4422 2.4458 2.6469 2.6516 2.7394 2.7415 3.0402 3.0484 3.2463 3.2512 3.6353 3.6385 3.9421 3.9472 4.3178 4.3243 4.7501 4.7542 5.0308 5.0434 5.2783 5.2798 5.3747 5.3860 6.2809 6.3133 6.3776 6.4113 6.5489 6.5840 6.8883 6.9181 7.0310 7.0406 7.1030 7.1560 7.2357 7.2630 7.3873 7.4052 7.5606 7.5898 8.2621 8.2683 11.4802 11.4841 12.9332 12.9396 13.8725 13.8817 14.8276 14.8373 14.9840 14.9905 15.7915 15.8005 k = 0.0000 0.0000 0.3051 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5014 -15.5014 -14.4441 -14.4438 -12.8583 -12.8577 -12.3225 -12.3211 -12.1275 -12.1271 -12.0415 -12.0407 -11.5615 -11.5607 -3.4410 -3.4407 -1.6845 -1.6836 -0.7258 -0.7248 0.0760 0.0770 0.4519 0.4552 0.7076 0.7113 1.0212 1.0242 1.3686 1.3727 2.1616 2.1659 2.4327 2.4363 2.6405 2.6448 2.7480 2.7498 3.0381 3.0467 3.2407 3.2459 3.6241 3.6275 3.9478 3.9533 4.3131 4.3198 4.7204 4.7241 5.0199 5.0316 5.2820 5.2838 5.3735 5.3837 6.2836 6.3156 6.3757 6.4097 6.5499 6.5825 6.8946 6.9225 7.0316 7.0427 7.1040 7.1540 7.2356 7.2615 7.3974 7.4136 7.5683 7.5951 8.2708 8.2766 11.5437 11.5476 12.9259 12.9324 13.8441 13.8530 14.8136 14.8221 14.9909 14.9971 15.7899 15.7984 k = 0.0000 0.0000 0.3190 ( 9660 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4947 -15.4946 -14.4558 -14.4555 -12.8531 -12.8526 -12.3237 -12.3224 -12.1265 -12.1261 -12.0404 -12.0396 -11.5633 -11.5625 -3.4515 -3.4513 -1.6538 -1.6529 -0.7424 -0.7414 0.0804 0.0813 0.4558 0.4591 0.7160 0.7198 1.0121 1.0148 1.3925 1.3962 2.1521 2.1564 2.4213 2.4247 2.6327 2.6364 2.7595 2.7610 3.0373 3.0464 3.2344 3.2399 3.6150 3.6184 3.9536 3.9596 4.3094 4.3163 4.6907 4.6941 5.0096 5.0204 5.2858 5.2878 5.3729 5.3818 6.2862 6.3175 6.3742 6.4079 6.5510 6.5810 6.9005 6.9262 7.0324 7.0446 7.1055 7.1520 7.2358 7.2600 7.4065 7.4209 7.5756 7.6000 8.2792 8.2846 11.6056 11.6094 12.9181 12.9244 13.8152 13.8236 14.7995 14.8068 15.0011 15.0068 15.7856 15.7936 k = 0.0000 0.0000 0.3329 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4883 -15.4882 -14.4667 -14.4664 -12.8484 -12.8479 -12.3248 -12.3236 -12.1256 -12.1253 -12.0392 -12.0385 -11.5649 -11.5642 -3.4611 -3.4608 -1.6246 -1.6237 -0.7588 -0.7579 0.0844 0.0852 0.4599 0.4630 0.7254 0.7291 1.0010 1.0036 1.4176 1.4210 2.1413 2.1454 2.4083 2.4117 2.6249 2.6281 2.7727 2.7738 3.0375 3.0470 3.2273 3.2331 3.6078 3.6113 3.9595 3.9657 4.3070 4.3139 4.6615 4.6645 5.0000 5.0097 5.2894 5.2916 5.3726 5.3803 6.2889 6.3189 6.3732 6.4059 6.5521 6.5793 6.9059 6.9293 7.0331 7.0459 7.1074 7.1499 7.2358 7.2580 7.4145 7.4272 7.5826 7.6044 8.2866 8.2916 11.6652 11.6689 12.9096 12.9158 13.7863 13.7942 14.7862 14.7923 15.0134 15.0188 15.7787 15.7861 k = 0.0000 0.0000 0.3467 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4824 -15.4824 -14.4766 -14.4764 -12.8442 -12.8437 -12.3258 -12.3247 -12.1249 -12.1245 -12.0381 -12.0375 -11.5664 -11.5657 -3.4696 -3.4693 -1.5972 -1.5964 -0.7746 -0.7738 0.0879 0.0887 0.4641 0.4669 0.7356 0.7393 0.9884 0.9908 1.4433 1.4463 2.1292 2.1330 2.3948 2.3979 2.6178 2.6205 2.7865 2.7873 3.0383 3.0481 3.2196 3.2257 3.6027 3.6061 3.9652 3.9715 4.3059 4.3128 4.6332 4.6360 4.9913 4.9999 5.2928 5.2952 5.3727 5.3792 6.2916 6.3196 6.3728 6.4037 6.5534 6.5776 6.9109 6.9317 7.0340 7.0468 7.1097 7.1479 7.2361 7.2561 7.4217 7.4327 7.5893 7.6085 8.2936 8.2980 11.7218 11.7253 12.9008 12.9067 13.7582 13.7655 14.7740 14.7792 15.0272 15.0321 15.7694 15.7761 k = 0.0000 0.0000 0.3606 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4771 -15.4771 -14.4854 -14.4852 -12.8404 -12.8400 -12.3266 -12.3257 -12.1242 -12.1239 -12.0371 -12.0365 -11.5677 -11.5671 -3.4770 -3.4768 -1.5722 -1.5714 -0.7896 -0.7888 0.0910 0.0916 0.4681 0.4707 0.7466 0.7500 0.9746 0.9770 1.4688 1.4714 2.1159 2.1193 2.3816 2.3844 2.6119 2.6141 2.8002 2.8009 3.0395 3.0493 3.2115 3.2178 3.5994 3.6026 3.9706 3.9768 4.3063 4.3129 4.6064 4.6089 4.9835 4.9910 5.2960 5.2984 5.3729 5.3783 6.2943 6.3197 6.3731 6.4013 6.5547 6.5757 6.9155 6.9336 7.0351 7.0474 7.1125 7.1459 7.2368 7.2543 7.4280 7.4372 7.5957 7.6121 8.3001 8.3040 11.7744 11.7776 12.8918 12.8973 13.7317 13.7382 14.7633 14.7676 15.0417 15.0461 15.7582 15.7642 k = 0.0000 0.0000 0.3745 ( 9661 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4725 -15.4725 -14.4931 -14.4929 -12.8372 -12.8369 -12.3274 -12.3266 -12.1237 -12.1234 -12.0362 -12.0357 -11.5689 -11.5684 -3.4834 -3.4832 -1.5498 -1.5492 -0.8033 -0.8026 0.0935 0.0940 0.4720 0.4742 0.7581 0.7613 0.9603 0.9625 1.4934 1.4956 2.1018 2.1048 2.3696 2.3720 2.6070 2.6088 2.8132 2.8141 3.0408 3.0503 3.2036 3.2098 3.5976 3.6005 3.9755 3.9813 4.3079 4.3141 4.5816 4.5838 4.9769 4.9831 5.2989 5.3012 5.3732 5.3775 6.2970 6.3192 6.3740 6.3988 6.5562 6.5739 6.9196 6.9348 7.0364 7.0476 7.1153 7.1437 7.2374 7.2524 7.4332 7.4409 7.6014 7.6151 8.3057 8.3090 11.8219 11.8248 12.8828 12.8878 13.7077 13.7133 14.7542 14.7577 15.0559 15.0598 15.7462 15.7513 k = 0.0000 0.0000 0.3883 ( 9666 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4686 -15.4686 -14.4995 -14.4994 -12.8346 -12.8343 -12.3280 -12.3273 -12.1233 -12.1231 -12.0354 -12.0349 -11.5698 -11.5694 -3.4886 -3.4885 -1.5307 -1.5301 -0.8153 -0.8147 0.0955 0.0959 0.4755 0.4773 0.7699 0.7728 0.9460 0.9480 1.5160 1.5178 2.0878 2.0903 2.3593 2.3613 2.6032 2.6046 2.8251 2.8260 3.0421 3.0509 3.1962 3.2020 3.5969 3.5994 3.9798 3.9849 4.3107 4.3162 4.5594 4.5614 4.9713 4.9764 5.3015 5.3035 5.3736 5.3769 6.2997 6.3181 6.3754 6.3961 6.5576 6.5720 6.9231 6.9353 7.0376 7.0472 7.1182 7.1412 7.2382 7.2503 7.4376 7.4436 7.6064 7.6173 8.3104 8.3131 11.8632 11.8656 12.8744 12.8786 13.6868 13.6914 14.7469 14.7496 15.0693 15.0726 15.7341 15.7383 k = 0.0000 0.0000 0.4022 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4655 -15.4655 -14.5046 -14.5045 -12.8325 -12.8322 -12.3284 -12.3279 -12.1229 -12.1228 -12.0347 -12.0344 -11.5705 -11.5702 -3.4927 -3.4926 -1.5151 -1.5147 -0.8252 -0.8247 0.0970 0.0974 0.4784 0.4798 0.7813 0.7838 0.9325 0.9342 1.5355 1.5369 2.0749 2.0768 2.3512 2.3527 2.6004 2.6015 2.8352 2.8361 3.0435 3.0510 3.1900 3.1950 3.5970 3.5990 3.9834 3.9875 4.3142 4.3188 4.5406 4.5423 4.9671 4.9709 5.3036 5.3052 5.3740 5.3764 6.3024 6.3166 6.3773 6.3933 6.5592 6.5701 6.9262 6.9355 7.0389 7.0466 7.1213 7.1388 7.2392 7.2484 7.4412 7.4456 7.6107 7.6189 8.3144 8.3164 11.8971 11.8990 12.8671 12.8705 13.6699 13.6734 14.7413 14.7433 15.0810 15.0835 15.7233 15.7265 k = 0.0000 0.0000 0.4161 ( 9663 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4633 -15.4632 -14.5083 -14.5082 -12.8309 -12.8308 -12.3287 -12.3284 -12.1227 -12.1226 -12.0342 -12.0340 -11.5711 -11.5708 -3.4957 -3.4956 -1.5036 -1.5033 -0.8326 -0.8323 0.0981 0.0984 0.4807 0.4816 0.7916 0.7935 0.9208 0.9222 1.5507 1.5517 2.0644 2.0657 2.3454 2.3464 2.5985 2.5992 2.8430 2.8438 3.0449 3.0504 3.1855 3.1891 3.5974 3.5988 3.9863 3.9892 4.3179 4.3212 4.5263 4.5276 4.9642 4.9668 5.3053 5.3064 5.3744 5.3759 6.3050 6.3147 6.3795 6.3905 6.5609 6.5682 6.9290 6.9352 7.0405 7.0458 7.1245 7.1362 7.2403 7.2465 7.4439 7.4468 7.6142 7.6196 8.3172 8.3186 11.9224 11.9238 12.8615 12.8638 13.6575 13.6599 14.7374 14.7388 15.0902 15.0919 15.7147 15.7169 k = 0.0000 0.0000 0.4300 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4619 -15.4619 -14.5105 -14.5104 -12.8300 -12.8299 -12.3289 -12.3287 -12.1225 -12.1225 -12.0338 -12.0337 -11.5713 -11.5712 -3.4974 -3.4974 -1.4965 -1.4964 -0.8372 -0.8370 0.0988 0.0989 0.4822 0.4827 0.7992 0.8003 0.9128 0.9136 1.5605 1.5610 2.0576 2.0583 2.3420 2.3425 2.5974 2.5978 2.8481 2.8485 3.0464 3.0493 3.1830 3.1850 3.5980 3.5987 3.9884 3.9899 4.3209 4.3227 4.5173 4.5180 4.9627 4.9640 5.3064 5.3070 5.3748 5.3755 6.3076 6.3125 6.3821 6.3876 6.5626 6.5663 6.9312 6.9343 7.0419 7.0446 7.1274 7.1333 7.2416 7.2447 7.4458 7.4472 7.6167 7.6195 8.3190 8.3197 11.9382 11.9390 12.8581 12.8593 13.6501 13.6513 14.7352 14.7359 15.0962 15.0971 15.7094 15.7105 k = 0.0000 0.0000 0.4438 ( 9668 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4614 -15.4614 -14.5112 -14.5112 -12.8297 -12.8297 -12.3289 -12.3289 -12.1225 -12.1225 -12.0337 -12.0337 -11.5714 -11.5714 -3.4980 -3.4980 -1.4941 -1.4941 -0.8386 -0.8386 0.0991 0.0991 0.4829 0.4829 0.8024 0.8024 0.9101 0.9101 1.5641 1.5641 2.0554 2.0554 2.3410 2.3410 2.5972 2.5972 2.8500 2.8500 3.0479 3.0479 3.1829 3.1829 3.5984 3.5984 3.9896 3.9896 4.3227 4.3227 4.5145 4.5145 4.9626 4.9626 5.3070 5.3070 5.3751 5.3751 6.3101 6.3101 6.3848 6.3848 6.5644 6.5644 6.9329 6.9329 7.0432 7.0432 7.1304 7.1304 7.2431 7.2431 7.4469 7.4469 7.6186 7.6186 8.3198 8.3198 11.9438 11.9438 12.8573 12.8573 13.6480 13.6480 14.7347 14.7347 15.0985 15.0985 15.7079 15.7079 k = 0.0000-0.4307 0.3320 ( 9658 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4599 -15.4599 -14.3719 -14.3719 -13.0825 -13.0825 -12.3354 -12.3354 -12.0837 -12.0837 -11.9420 -11.9420 -11.6602 -11.6602 -3.2023 -3.2023 -1.5222 -1.5222 -0.4187 -0.4187 0.2198 0.2198 0.3494 0.3494 0.5053 0.5053 1.1333 1.1333 1.1602 1.1602 1.9124 1.9124 2.3163 2.3163 2.3352 2.3352 2.7617 2.7617 3.2245 3.2245 3.3514 3.3514 3.5272 3.5272 3.6796 3.6796 4.1926 4.1926 4.6009 4.6009 4.9927 4.9927 5.3436 5.3436 5.4375 5.4375 6.2442 6.2442 6.3689 6.3689 6.5014 6.5014 6.8303 6.8303 6.9900 6.9900 7.1432 7.1432 7.3303 7.3303 7.6844 7.6844 7.7544 7.7544 8.6892 8.6892 12.1607 12.1607 13.2375 13.2375 13.5144 13.5144 14.8112 14.8112 15.2123 15.2123 15.5252 15.5252 k = 0.0000-0.4196 0.3235 ( 9657 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4602 -15.4602 -14.3716 -14.3716 -13.0823 -13.0823 -12.3353 -12.3352 -12.0837 -12.0837 -11.9424 -11.9423 -11.6600 -11.6600 -3.2023 -3.2023 -1.5237 -1.5237 -0.4188 -0.4187 0.2181 0.2183 0.3488 0.3493 0.5051 0.5055 1.1328 1.1355 1.1601 1.1630 1.9137 1.9139 2.3159 2.3165 2.3351 2.3358 2.7616 2.7617 3.2240 3.2245 3.3516 3.3518 3.5277 3.5282 3.6793 3.6794 4.1929 4.1935 4.6013 4.6015 4.9918 4.9919 5.3430 5.3434 5.4375 5.4377 6.2424 6.2475 6.3666 6.3710 6.5008 6.5023 6.8292 6.8311 6.9893 6.9911 7.1430 7.1433 7.3297 7.3309 7.6832 7.6843 7.7531 7.7545 8.6877 8.6882 12.1574 12.1578 13.2354 13.2364 13.5177 13.5185 14.8104 14.8106 15.2132 15.2139 15.5245 15.5260 k = 0.0000-0.4086 0.3149 ( 9661 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4610 -15.4610 -14.3710 -14.3710 -13.0817 -13.0817 -12.3350 -12.3349 -12.0837 -12.0836 -11.9434 -11.9433 -11.6594 -11.6594 -3.2021 -3.2021 -1.5280 -1.5280 -0.4188 -0.4186 0.2132 0.2137 0.3477 0.3487 0.5050 0.5057 1.1336 1.1384 1.1634 1.1686 1.9179 1.9183 2.3155 2.3165 2.3356 2.3368 2.7613 2.7614 3.2231 3.2242 3.3521 3.3526 3.5298 3.5308 3.6785 3.6789 4.1942 4.1953 4.6028 4.6032 4.9892 4.9894 5.3416 5.3424 5.4378 5.4381 6.2421 6.2522 6.3644 6.3729 6.5005 6.5035 6.8279 6.8317 6.9892 6.9927 7.1424 7.1430 7.3289 7.3312 7.6806 7.6828 7.7506 7.7533 8.6835 8.6845 12.1481 12.1487 13.2304 13.2323 13.5282 13.5298 14.8081 14.8086 15.2166 15.2179 15.5241 15.5269 k = 0.0000-0.3975 0.3064 ( 9667 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.4623 -15.4623 -14.3699 -14.3699 -13.0807 -13.0807 -12.3345 -12.3343 -12.0836 -12.0835 -11.9450 -11.9449 -11.6584 -11.6584 -3.2018 -3.2018 -1.5352 -1.5352 -0.4189 -0.4185 0.2053 0.2060 0.3463 0.3477 0.5050 0.5061 1.1350 1.1408 1.1708 1.1771 1.9251 1.9257 2.3149 2.3164 2.3367 2.3383 2.7608 2.7610 3.2220 3.2235 3.3528 3.3536 3.5336 3.5351 3.6774 3.6779 4.1965 4.1982 4.6053 4.6059 4.9850 4.9854 5.3393 5.3405 5.4382 5.4386 6.2433 6.2580 6.3623 6.3746 6.5006 6.5050 6.8265 6.8321 6.9895 6.9947 7.1417 7.1425 7.3281 7.3315 7.6767 7.6799 7.7470 7.7511 8.6764 8.6779 12.1328 12.1337 13.2231 13.2257 13.5451 13.5473 14.8045 14.8052 15.2223 15.2242 15.5241 15.5281 k = 0.0000-0.3865 0.2979 ( 9672 PWs) bands (ev): -84.3025 -84.3025 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4642 -15.4642 -14.3683 -14.3683 -13.0793 -13.0793 -12.3337 -12.3336 -12.0836 -12.0835 -11.9473 -11.9471 -11.6570 -11.6569 -3.2015 -3.2014 -1.5452 -1.5452 -0.4189 -0.4184 0.1945 0.1954 0.3449 0.3466 0.5053 0.5066 1.1363 1.1421 1.1820 1.1883 1.9356 1.9364 2.3143 2.3160 2.3385 2.3404 2.7599 2.7602 3.2208 3.2227 3.3534 3.3546 3.5390 3.5411 3.6760 3.6767 4.1998 4.2021 4.6089 4.6097 4.9796 4.9802 5.3363 5.3379 5.4388 5.4394 6.2459 6.2648 6.3604 6.3759 6.5010 6.5068 6.8248 6.8322 6.9901 6.9972 7.1407 7.1418 7.3273 7.3319 7.6715 7.6758 7.7423 7.7477 8.6669 8.6688 12.1119 12.1131 13.2143 13.2174 13.5674 13.5700 14.7997 14.8007 15.2304 15.2329 15.5248 15.5300 k = 0.0000-0.3754 0.2894 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4666 -15.4666 -14.3664 -14.3663 -13.0776 -13.0775 -12.3328 -12.3326 -12.0835 -12.0834 -11.9502 -11.9500 -11.6552 -11.6551 -3.2010 -3.2010 -1.5578 -1.5578 -0.4191 -0.4184 0.1812 0.1823 0.3439 0.3457 0.5059 0.5074 1.1375 1.1427 1.1955 1.2014 1.9496 1.9506 2.3137 2.3155 2.3409 2.3430 2.7587 2.7591 3.2198 3.2220 3.3536 3.3551 3.5463 3.5489 3.6744 3.6752 4.2040 4.2068 4.6134 4.6144 4.9731 4.9740 5.3326 5.3345 5.4397 5.4403 6.2497 6.2719 6.3589 6.3770 6.5019 6.5088 6.8231 6.8322 6.9912 7.0001 7.1396 7.1409 7.3262 7.3319 7.6650 7.6703 7.7367 7.7432 8.6552 8.6576 12.0856 12.0871 13.2045 13.2080 13.5939 13.5968 14.7941 14.7952 15.2404 15.2436 15.5265 15.5329 k = 0.0000-0.3644 0.2809 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4694 -15.4694 -14.3640 -14.3640 -13.0755 -13.0754 -12.3317 -12.3314 -12.0835 -12.0832 -11.9537 -11.9534 -11.6530 -11.6529 -3.2004 -3.2004 -1.5730 -1.5729 -0.4193 -0.4185 0.1657 0.1670 0.3435 0.3454 0.5069 0.5085 1.1383 1.1430 1.2098 1.2153 1.9675 1.9686 2.3130 2.3148 2.3440 2.3461 2.7568 2.7573 3.2190 3.2214 3.3529 3.3549 3.5555 3.5585 3.6726 3.6736 4.2090 4.2123 4.6189 4.6200 4.9661 4.9672 5.3282 5.3304 5.4407 5.4415 6.2547 6.2791 6.3581 6.3776 6.5031 6.5111 6.8213 6.8322 6.9929 7.0038 7.1383 7.1398 7.3254 7.3321 7.6574 7.6636 7.7302 7.7378 8.6412 8.6440 12.0545 12.0561 13.1943 13.1979 13.6237 13.6269 14.7878 14.7892 15.2523 15.2561 15.5295 15.5369 k = 0.0000-0.3534 0.2724 ( 9683 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4727 -15.4727 -14.3612 -14.3612 -13.0730 -13.0729 -12.3304 -12.3301 -12.0834 -12.0831 -11.9578 -11.9574 -11.6504 -11.6503 -3.1997 -3.1997 -1.5904 -1.5904 -0.4197 -0.4188 0.1488 0.1502 0.3438 0.3458 0.5081 0.5099 1.1389 1.1430 1.2238 1.2288 1.9894 1.9907 2.3123 2.3141 2.3478 2.3499 2.7542 2.7547 3.2187 3.2213 3.3511 3.3536 3.5664 3.5699 3.6709 3.6721 4.2148 4.2185 4.6253 4.6266 4.9588 4.9602 5.3232 5.3256 5.4420 5.4428 6.2604 6.2857 6.3581 6.3780 6.5048 6.5137 6.8195 6.8321 6.9948 7.0078 7.1369 7.1385 7.3243 7.3320 7.6485 7.6556 7.7226 7.7313 8.6246 8.6279 12.0188 12.0207 13.1838 13.1876 13.6560 13.6593 14.7814 14.7829 15.2657 15.2701 15.5341 15.5423 k = 0.0000-0.3423 0.2639 ( 9684 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4765 -15.4765 -14.3580 -14.3580 -13.0702 -13.0701 -12.3289 -12.3286 -12.0832 -12.0829 -11.9624 -11.9620 -11.6475 -11.6473 -3.1990 -3.1989 -1.6101 -1.6100 -0.4203 -0.4193 0.1307 0.1324 0.3450 0.3470 0.5096 0.5114 1.1393 1.1429 1.2364 1.2409 2.0157 2.0170 2.3116 2.3133 2.3522 2.3542 2.7508 2.7514 3.2188 3.2216 3.3480 3.3510 3.5792 3.5829 3.6695 3.6708 4.2211 4.2252 4.6327 4.6341 4.9517 4.9535 5.3176 5.3203 5.4434 5.4443 6.2668 6.2912 6.3592 6.3780 6.5068 6.5164 6.8177 6.8320 6.9969 7.0121 7.1352 7.1371 7.3233 7.3320 7.6386 7.6464 7.7144 7.7239 8.6064 8.6102 11.9791 11.9812 13.1733 13.1772 13.6899 13.6934 14.7751 14.7767 15.2801 15.2852 15.5403 15.5493 k = 0.0000-0.3313 0.2554 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4807 -15.4807 -14.3544 -14.3544 -13.0672 -13.0670 -12.3273 -12.3270 -12.0831 -12.0827 -11.9675 -11.9671 -11.6442 -11.6440 -3.1981 -3.1981 -1.6317 -1.6316 -0.4212 -0.4201 0.1122 0.1140 0.3472 0.3492 0.5113 0.5132 1.1395 1.1427 1.2467 1.2509 2.0461 2.0475 2.3110 2.3126 2.3572 2.3592 2.7463 2.7470 3.2195 3.2225 3.3436 3.3471 3.5935 3.5974 3.6685 3.6699 4.2278 4.2324 4.6409 4.6424 4.9452 4.9475 5.3116 5.3145 5.4450 5.4460 6.2738 6.2953 6.3614 6.3778 6.5092 6.5195 6.8161 6.8321 6.9994 7.0169 7.1336 7.1355 7.3225 7.3320 7.6276 7.6362 7.7054 7.7158 8.5867 8.5909 11.9358 11.9380 13.1629 13.1667 13.7247 13.7284 14.7694 14.7711 15.2952 15.3009 15.5481 15.5578 k = 0.0000-0.3202 0.2468 ( 9684 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4852 -15.4852 -14.3505 -14.3505 -13.0638 -13.0637 -12.3256 -12.3252 -12.0829 -12.0825 -11.9731 -11.9726 -11.6406 -11.6404 -3.1972 -3.1972 -1.6550 -1.6549 -0.4225 -0.4213 0.0936 0.0955 0.3505 0.3525 0.5132 0.5151 1.1396 1.1424 1.2544 1.2581 2.0807 2.0820 2.3106 2.3121 2.3629 2.3647 2.7407 2.7415 3.2207 3.2238 3.3378 3.3418 3.6091 3.6132 3.6680 3.6696 4.2349 4.2398 4.6498 4.6514 4.9398 4.9425 5.3052 5.3083 5.4467 5.4478 6.2810 6.2979 6.3644 6.3775 6.5117 6.5227 6.8146 6.8324 7.0015 7.0215 7.1316 7.1338 7.3211 7.3314 7.6155 7.6249 7.6957 7.7067 8.5652 8.5698 11.8893 11.8915 13.1526 13.1564 13.7598 13.7638 14.7647 14.7666 15.3104 15.3166 15.5573 15.5677 k = 0.0000-0.3092 0.2383 ( 9685 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4901 -15.4901 -14.3462 -14.3462 -13.0602 -13.0601 -12.3238 -12.3234 -12.0828 -12.0823 -11.9792 -11.9786 -11.6367 -11.6365 -3.1963 -3.1962 -1.6798 -1.6797 -0.4241 -0.4228 0.0753 0.0773 0.3549 0.3569 0.5150 0.5171 1.1395 1.1420 1.2589 1.2624 2.1189 2.1202 2.3105 2.3117 2.3692 2.3709 2.7339 2.7348 3.2220 3.2254 3.3310 3.3354 3.6258 3.6300 3.6683 3.6701 4.2423 4.2474 4.6595 4.6612 4.9358 4.9390 5.2985 5.3018 5.4487 5.4498 6.2884 6.2990 6.3672 6.3778 6.5144 6.5261 6.8132 6.8330 7.0038 7.0264 7.1295 7.1319 7.3195 7.3306 7.6026 7.6126 7.6855 7.6971 8.5426 8.5476 11.8398 11.8422 13.1424 13.1461 13.7947 13.7989 14.7615 14.7635 15.3253 15.3320 15.5677 15.5786 k = 0.0000-0.2981 0.2298 ( 9682 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.4954 -15.4954 -14.3417 -14.3416 -13.0564 -13.0563 -12.3219 -12.3214 -12.0826 -12.0821 -11.9856 -11.9850 -11.6326 -11.6324 -3.1952 -3.1952 -1.7059 -1.7058 -0.4261 -0.4247 0.0577 0.0598 0.3605 0.3626 0.5168 0.5190 1.1393 1.1416 1.2604 1.2635 2.1601 2.1612 2.3106 2.3117 2.3761 2.3778 2.7260 2.7269 3.2233 3.2270 3.3235 3.3283 3.6432 3.6473 3.6696 3.6718 4.2497 4.2551 4.6699 4.6716 4.9335 4.9371 5.2916 5.2951 5.4508 5.4521 6.2957 6.2992 6.3687 6.3796 6.5169 6.5299 6.8120 6.8339 7.0061 7.0313 7.1274 7.1302 7.3181 7.3299 7.5888 7.5995 7.6748 7.6870 8.5187 8.5242 11.7879 11.7904 13.1323 13.1360 13.8287 13.8331 14.7602 14.7622 15.3393 15.3464 15.5787 15.5902 k = 0.0000-0.2871 0.2213 ( 9683 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5008 -15.5008 -14.3368 -14.3367 -13.0524 -13.0523 -12.3200 -12.3194 -12.0824 -12.0818 -11.9923 -11.9917 -11.6282 -11.6280 -3.1941 -3.1941 -1.7330 -1.7330 -0.4286 -0.4272 0.0409 0.0431 0.3673 0.3694 0.5185 0.5208 1.1390 1.1409 1.2588 1.2617 2.2033 2.2041 2.3113 2.3121 2.3840 2.3855 2.7168 2.7179 3.2238 3.2279 3.3159 3.3210 3.6602 3.6641 3.6724 3.6760 4.2572 4.2628 4.6809 4.6828 4.9331 4.9373 5.2847 5.2884 5.4530 5.4544 6.2981 6.3035 6.3684 6.3828 6.5191 6.5339 6.8109 6.8350 7.0085 7.0362 7.1251 7.1286 7.3163 7.3288 7.5742 7.5855 7.6636 7.6762 8.4939 8.4997 11.7338 11.7363 13.1224 13.1260 13.8613 13.8661 14.7610 14.7632 15.3519 15.3593 15.5897 15.6016 k = 0.0000-0.2761 0.2128 ( 9685 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5066 -15.5066 -14.3316 -14.3316 -13.0483 -13.0481 -12.3180 -12.3174 -12.0823 -12.0816 -11.9993 -11.9986 -11.6235 -11.6233 -3.1930 -3.1929 -1.7610 -1.7609 -0.4316 -0.4301 0.0253 0.0276 0.3754 0.3775 0.5200 0.5223 1.1385 1.1402 1.2544 1.2569 2.2467 2.2470 2.3133 2.3138 2.3930 2.3947 2.7066 2.7077 3.2228 3.2274 3.3093 3.3146 3.6717 3.6738 3.6831 3.6876 4.2646 4.2704 4.6926 4.6945 4.9349 4.9395 5.2779 5.2816 5.4554 5.4570 6.2969 6.3109 6.3670 6.3865 6.5210 6.5381 6.8100 6.8365 7.0107 7.0406 7.1227 7.1271 7.3142 7.3271 7.5588 7.5708 7.6522 7.6650 8.4686 8.4748 11.6779 11.6804 13.1127 13.1162 13.8922 13.8972 14.7643 14.7666 15.3628 15.3703 15.6001 15.6124 k = 0.0000-0.2650 0.2043 ( 9690 PWs) bands (ev): -84.3028 -84.3028 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5125 -15.5125 -14.3263 -14.3262 -13.0440 -13.0439 -12.3161 -12.3154 -12.0822 -12.0814 -12.0065 -12.0057 -11.6187 -11.6185 -3.1918 -3.1918 -1.7895 -1.7895 -0.4350 -0.4334 0.0110 0.0133 0.3847 0.3869 0.5212 0.5236 1.1378 1.1393 1.2475 1.2497 2.2839 2.2851 2.3195 2.3208 2.4042 2.4063 2.6954 2.6965 3.2195 3.2243 3.3047 3.3099 3.6775 3.6789 3.7008 3.7049 4.2720 4.2779 4.7048 4.7069 4.9389 4.9440 5.2712 5.2751 5.4580 5.4597 6.2952 6.3182 6.3650 6.3900 6.5225 6.5423 6.8091 6.8382 7.0127 7.0445 7.1202 7.1259 7.3118 7.3253 7.5428 7.5554 7.6404 7.6535 8.4429 8.4494 11.6205 11.6230 13.1032 13.1066 13.9208 13.9261 14.7702 14.7727 15.3712 15.3787 15.6092 15.6219 k = 0.0000-0.2540 0.1958 ( 9684 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5185 -15.5185 -14.3207 -14.3206 -13.0397 -13.0395 -12.3141 -12.3134 -12.0822 -12.0813 -12.0138 -12.0129 -11.6138 -11.6136 -3.1906 -3.1906 -1.8184 -1.8184 -0.4388 -0.4373 -0.0019 0.0005 0.3952 0.3974 0.5220 0.5246 1.1370 1.1382 1.2384 1.2404 2.3009 2.3027 2.3418 2.3443 2.4199 2.4230 2.6834 2.6846 3.2132 3.2181 3.3031 3.3078 3.6831 3.6846 3.7191 3.7229 4.2793 4.2853 4.7176 4.7199 4.9452 4.9508 5.2648 5.2689 5.4608 5.4626 6.2932 6.3254 6.3626 6.3932 6.5236 6.5466 6.8084 6.8400 7.0151 7.0482 7.1178 7.1254 7.3095 7.3233 7.5263 7.5395 7.6286 7.6420 8.4172 8.4240 11.5618 11.5644 13.0939 13.0972 13.9470 13.9526 14.7789 14.7815 15.3768 15.3841 15.6166 15.6297 k = 0.0000-0.2429 0.1873 ( 9684 PWs) bands (ev): -84.3027 -84.3027 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5247 -15.5247 -14.3149 -14.3148 -13.0353 -13.0351 -12.3122 -12.3114 -12.0824 -12.0813 -12.0210 -12.0201 -11.6087 -11.6085 -3.1894 -3.1894 -1.8475 -1.8475 -0.4431 -0.4415 -0.0132 -0.0109 0.4069 0.4091 0.5223 0.5252 1.1357 1.1367 1.2277 1.2293 2.3052 2.3066 2.3683 2.3714 2.4446 2.4485 2.6710 2.6722 3.2044 3.2090 3.3043 3.3084 3.6896 3.6911 3.7373 3.7408 4.2865 4.2926 4.7309 4.7334 4.9538 4.9597 5.2589 5.2631 5.4637 5.4656 6.2911 6.3324 6.3599 6.3958 6.5243 6.5508 6.8075 6.8418 7.0173 7.0506 7.1152 7.1256 7.3068 7.3209 7.5092 7.5230 7.6167 7.6303 8.3915 8.3986 11.5023 11.5048 13.0848 13.0881 13.9706 13.9763 14.7903 14.7930 15.3789 15.3858 15.6224 15.6358 k = 0.0000-0.2319 0.1788 ( 9678 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5309 -15.5309 -14.3090 -14.3089 -13.0308 -13.0306 -12.3103 -12.3095 -12.0829 -12.0816 -12.0281 -12.0271 -11.6035 -11.6033 -3.1882 -3.1881 -1.8765 -1.8765 -0.4478 -0.4462 -0.0230 -0.0206 0.4195 0.4218 0.5222 0.5254 1.1339 1.1347 1.2159 1.2171 2.3070 2.3081 2.3868 2.3898 2.4788 2.4827 2.6588 2.6600 3.1938 3.1982 3.3077 3.3110 3.6969 3.6986 3.7551 3.7582 4.2937 4.2999 4.7446 4.7473 4.9645 4.9708 5.2536 5.2578 5.4668 5.4688 6.2888 6.3392 6.3569 6.3980 6.5247 6.5548 6.8067 6.8435 7.0197 7.0521 7.1128 7.1269 7.3039 7.3183 7.4918 7.5061 7.6049 7.6186 8.3663 8.3737 11.4422 11.4447 13.0760 13.0792 13.9914 13.9972 14.8043 14.8071 15.3770 15.3833 15.6271 15.6405 k = 0.0000-0.2208 0.1702 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5372 -15.5372 -14.3030 -14.3029 -13.0264 -13.0262 -12.3085 -12.3077 -12.0838 -12.0823 -12.0348 -12.0336 -11.5983 -11.5981 -3.1870 -3.1869 -1.9053 -1.9052 -0.4528 -0.4512 -0.0312 -0.0288 0.4328 0.4353 0.5217 0.5252 1.1311 1.1318 1.2037 1.2045 2.3080 2.3089 2.3994 2.4020 2.5162 2.5195 2.6479 2.6490 3.1827 3.1868 3.3123 3.3150 3.7052 3.7070 3.7722 3.7749 4.3009 4.3070 4.7588 4.7618 4.9771 4.9839 5.2489 5.2532 5.4700 5.4722 6.2864 6.3454 6.3540 6.3997 6.5249 6.5586 6.8057 6.8448 7.0221 7.0522 7.1102 7.1289 7.3007 7.3154 7.4741 7.4888 7.5932 7.6071 8.3415 8.3490 11.3817 11.3842 13.0675 13.0707 14.0095 14.0154 14.8205 14.8235 15.3708 15.3764 15.6312 15.6446 k = 0.0000-0.2098 0.1617 ( 9677 PWs) bands (ev): -84.3026 -84.3026 -50.0024 -50.0024 -48.3956 -48.3956 -48.0609 -48.0609 -15.5434 -15.5434 -14.2969 -14.2968 -13.0220 -13.0218 -12.3068 -12.3060 -12.0852 -12.0836 -12.0409 -12.0396 -11.5930 -11.5928 -3.1858 -3.1857 -1.9337 -1.9336 -0.4581 -0.4566 -0.0377 -0.0353 0.4465 0.4494 0.5208 0.5249 1.1264 1.1275 1.1922 1.1926 2.3086 2.3093 2.4089 2.4112 2.5492 2.5518 2.6417 2.6425 3.1722 3.1760 3.3175 3.3198 3.7142 3.7162 3.7886 3.7909 4.3081 4.3143 4.7733 4.7765 4.9916 4.9988 5.2450 5.2494 5.4733 5.4756 6.2839 6.3479 6.3542 6.4009 6.5250 6.5621 6.8046 6.8455 7.0247 7.0512 7.1077 7.1319 7.2970 7.3120 7.4561 7.4712 7.5816 7.5956 8.3175 8.3251 11.3213 11.3237 13.0593 13.0624 14.0251 14.0310 14.8387 14.8417 15.3602 15.3650 15.6355 15.6487 k = 0.0000-0.1988 0.1532 ( 9673 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3956 -48.3956 -48.0609 -48.0609 -15.5496 -15.5496 -14.2908 -14.2907 -13.0176 -13.0174 -12.3052 -12.3044 -12.0875 -12.0857 -12.0461 -12.0447 -11.5878 -11.5876 -3.1846 -3.1845 -1.9614 -1.9614 -0.4636 -0.4621 -0.0425 -0.0401 0.4600 0.4634 0.5199 0.5247 1.1191 1.1208 1.1822 1.1829 2.3088 2.3094 2.4168 2.4188 2.5685 2.5700 2.6468 2.6477 3.1635 3.1670 3.3228 3.3249 3.7239 3.7261 3.8041 3.8061 4.3155 4.3216 4.7881 4.7916 5.0078 5.0153 5.2419 5.2463 5.4768 5.4792 6.2812 6.3447 6.3596 6.4018 6.5250 6.5655 6.8032 6.8456 7.0274 7.0492 7.1054 7.1358 7.2932 7.3083 7.4379 7.4533 7.5704 7.5845 8.2945 8.3023 11.2612 11.2636 13.0515 13.0545 14.0383 14.0441 14.8584 14.8615 15.3456 15.3496 15.6404 15.6532 k = 0.0000-0.1877 0.1447 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5557 -15.5557 -14.2846 -14.2846 -13.0133 -13.0131 -12.3038 -12.3029 -12.0907 -12.0888 -12.0501 -12.0487 -11.5826 -11.5824 -3.1834 -3.1834 -1.9885 -1.9884 -0.4693 -0.4679 -0.0457 -0.0433 0.4719 0.4762 0.5200 0.5257 1.1089 1.1110 1.1749 1.1760 2.3085 2.3089 2.4237 2.4254 2.5697 2.5709 2.6656 2.6671 3.1576 3.1608 3.3278 3.3300 3.7343 3.7366 3.8188 3.8205 4.3230 4.3290 4.8031 4.8068 5.0253 5.0332 5.2396 5.2441 5.4804 5.4829 6.2785 6.3403 6.3655 6.4024 6.5251 6.5686 6.8017 6.8449 7.0301 7.0463 7.1036 7.1403 7.2891 7.3045 7.4198 7.4353 7.5596 7.5737 8.2730 8.2808 11.2017 11.2040 13.0441 13.0470 14.0493 14.0550 14.8791 14.8823 15.3275 15.3308 15.6459 15.6584 k = 0.0000-0.1767 0.1362 ( 9671 PWs) bands (ev): -84.3025 -84.3025 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5617 -15.5617 -14.2786 -14.2785 -13.0091 -13.0090 -12.3025 -12.3016 -12.0948 -12.0929 -12.0528 -12.0515 -11.5775 -11.5772 -3.1823 -3.1822 -2.0146 -2.0146 -0.4751 -0.4737 -0.0472 -0.0448 0.4801 0.4850 0.5235 0.5298 1.0958 1.0983 1.1706 1.1720 2.3075 2.3079 2.4296 2.4311 2.5617 2.5630 2.6889 2.6906 3.1554 3.1584 3.3324 3.3347 3.7451 3.7475 3.8326 3.8339 4.3306 4.3365 4.8182 4.8221 5.0439 5.0522 5.2383 5.2427 5.4841 5.4867 6.2756 6.3355 6.3711 6.4027 6.5252 6.5715 6.7999 6.8434 7.0321 7.0425 7.1022 7.1450 7.2843 7.3000 7.4016 7.4173 7.5488 7.5630 8.2522 8.2600 11.1432 11.1454 13.0370 13.0399 14.0584 14.0639 14.9002 14.9036 15.3067 15.3093 15.6521 15.6641 k = 0.0000-0.1656 0.1277 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5675 -15.5675 -14.2726 -14.2725 -13.0051 -13.0049 -12.3013 -12.3004 -12.0997 -12.0979 -12.0545 -12.0533 -11.5725 -11.5722 -3.1812 -3.1811 -2.0398 -2.0397 -0.4809 -0.4795 -0.0471 -0.0447 0.4829 0.4873 0.5327 0.5385 1.0808 1.0835 1.1688 1.1702 2.3058 2.3062 2.4348 2.4361 2.5509 2.5524 2.7098 2.7115 3.1576 3.1604 3.3362 3.3390 3.7562 3.7588 3.8455 3.8466 4.3385 4.3442 4.8334 4.8374 5.0635 5.0721 5.2380 5.2423 5.4879 5.4905 6.2727 6.3304 6.3765 6.4028 6.5255 6.5743 6.7980 6.8410 7.0336 7.0389 7.1016 7.1498 7.2792 7.2956 7.3838 7.3994 7.5387 7.5529 8.2333 8.2409 11.0859 11.0881 13.0304 13.0331 14.0659 14.0712 14.9214 14.9249 15.2840 15.2860 15.6588 15.6702 k = 0.0000-0.1546 0.1192 ( 9669 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5731 -15.5731 -14.2668 -14.2667 -13.0012 -13.0010 -12.3004 -12.2994 -12.1051 -12.1034 -12.0554 -12.0543 -11.5676 -11.5674 -3.1801 -3.1801 -2.0638 -2.0637 -0.4866 -0.4853 -0.0454 -0.0430 0.4807 0.4844 0.5462 0.5510 1.0649 1.0675 1.1687 1.1701 2.3031 2.3035 2.4394 2.4404 2.5398 2.5413 2.7257 2.7275 3.1642 3.1671 3.3394 3.3427 3.7676 3.7703 3.8575 3.8583 4.3466 4.3521 4.8484 4.8525 5.0837 5.0925 5.2385 5.2428 5.4917 5.4944 6.2696 6.3249 6.3814 6.4029 6.5260 6.5768 6.7959 6.8378 7.0321 7.0367 7.1020 7.1546 7.2735 7.2906 7.3664 7.3820 7.5290 7.5430 8.2157 8.2232 11.0303 11.0323 13.0243 13.0269 14.0720 14.0770 14.9419 14.9456 15.2601 15.2619 15.6657 15.6765 k = 0.0000-0.1436 0.1107 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5785 -15.5785 -14.2611 -14.2611 -12.9975 -12.9973 -12.2995 -12.2986 -12.1109 -12.1092 -12.0556 -12.0547 -11.5629 -11.5627 -3.1791 -3.1790 -2.0865 -2.0865 -0.4922 -0.4911 -0.0421 -0.0398 0.4751 0.4783 0.5616 0.5655 1.0486 1.0512 1.1699 1.1712 2.2994 2.2999 2.4432 2.4441 2.5294 2.5309 2.7361 2.7380 3.1748 3.1781 3.3419 3.3458 3.7790 3.7818 3.8686 3.8694 4.3548 4.3601 4.8632 4.8674 5.1041 5.1131 5.2399 5.2441 5.4956 5.4983 6.2665 6.3191 6.3859 6.4030 6.5268 6.5791 6.7937 6.8340 7.0279 7.0359 7.1036 7.1593 7.2672 7.2854 7.3499 7.3655 7.5198 7.5337 8.1999 8.2072 10.9765 10.9785 13.0185 13.0210 14.0769 14.0817 14.9614 14.9654 15.2358 15.2376 15.6726 15.6828 k = 0.0000-0.1325 0.1021 ( 9657 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.5836 -15.5836 -14.2557 -14.2556 -12.9940 -12.9938 -12.2989 -12.2979 -12.1166 -12.1151 -12.0555 -12.0547 -11.5584 -11.5583 -3.1782 -3.1781 -2.1080 -2.1079 -0.4977 -0.4966 -0.0374 -0.0351 0.4673 0.4702 0.5774 0.5808 1.0326 1.0352 1.1720 1.1732 2.2945 2.2951 2.4463 2.4471 2.5201 2.5217 2.7416 2.7436 3.1886 3.1923 3.3438 3.3484 3.7904 3.7933 3.8789 3.8796 4.3631 4.3681 4.8777 4.8818 5.1246 5.1337 5.2422 5.2464 5.4994 5.5021 6.2633 6.3131 6.3898 6.4032 6.5279 6.5811 6.7915 6.8297 7.0233 7.0346 7.1064 7.1635 7.2602 7.2797 7.3347 7.3503 7.5112 7.5249 8.1862 8.1931 10.9251 10.9269 13.0133 13.0156 14.0809 14.0854 14.9793 14.9835 15.2119 15.2141 15.6793 15.6889 k = 0.0000-0.1215 0.0936 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5884 -15.5884 -14.2505 -14.2504 -12.9907 -12.9906 -12.2983 -12.2974 -12.1222 -12.1208 -12.0550 -12.0544 -11.5542 -11.5540 -3.1773 -3.1772 -2.1280 -2.1280 -0.5029 -0.5019 -0.0314 -0.0292 0.4578 0.4605 0.5931 0.5961 1.0172 1.0197 1.1748 1.1760 2.2884 2.2891 2.4488 2.4494 2.5123 2.5138 2.7431 2.7451 3.2042 3.2085 3.3454 3.3507 3.8016 3.8044 3.8884 3.8891 4.3715 4.3761 4.8916 4.8956 5.1447 5.1538 5.2454 5.2494 5.5032 5.5058 6.2601 6.3069 6.3928 6.4037 6.5294 6.5829 6.7893 6.8249 7.0185 7.0323 7.1099 7.1669 7.2518 7.2726 7.3210 7.3365 7.5030 7.5163 8.1734 8.1799 10.8762 10.8779 13.0085 13.0107 14.0841 14.0883 14.9948 14.9994 15.1895 15.1922 15.6858 15.6947 k = 0.0000-0.1104 0.0851 ( 9663 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5928 -15.5928 -14.2456 -14.2455 -12.9876 -12.9875 -12.2980 -12.2971 -12.1276 -12.1263 -12.0545 -12.0539 -11.5503 -11.5501 -3.1764 -3.1764 -2.1465 -2.1465 -0.5079 -0.5069 -0.0241 -0.0220 0.4469 0.4495 0.6083 0.6109 1.0028 1.0052 1.1782 1.1793 2.2814 2.2821 2.4507 2.4512 2.5061 2.5075 2.7416 2.7436 3.2204 3.2254 3.3468 3.3528 3.8125 3.8152 3.8971 3.8979 4.3798 4.3841 4.9049 4.9087 5.1640 5.1730 5.2493 5.2534 5.5069 5.5095 6.2570 6.3005 6.3951 6.4044 6.5314 6.5844 6.7872 6.8198 7.0138 7.0292 7.1139 7.1693 7.2429 7.2645 7.3098 7.3247 7.4955 7.5084 8.1625 8.1687 10.8302 10.8318 13.0042 13.0062 14.0867 14.0905 15.0072 15.0122 15.1695 15.1728 15.6919 15.7001 k = 0.0000-0.0994 0.0766 ( 9667 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0609 -48.0609 -15.5970 -15.5970 -14.2410 -14.2410 -12.9848 -12.9847 -12.2977 -12.2969 -12.1326 -12.1314 -12.0538 -12.0533 -11.5466 -11.5464 -3.1757 -3.1756 -2.1635 -2.1634 -0.5125 -0.5116 -0.0158 -0.0137 0.4349 0.4375 0.6227 0.6250 0.9895 0.9918 1.1820 1.1830 2.2735 2.2742 2.4520 2.4525 2.5013 2.5026 2.7382 2.7402 3.2358 3.2415 3.3486 3.3553 3.8228 3.8255 3.9051 3.9059 4.3879 4.3918 4.9174 4.9210 5.1821 5.1908 5.2541 5.2584 5.5104 5.5129 6.2540 6.2941 6.3966 6.4054 6.5338 6.5855 6.7852 6.8147 7.0092 7.0254 7.1181 7.1703 7.2336 7.2555 7.3012 7.3150 7.4885 7.5009 8.1531 8.1588 10.7875 10.7890 13.0003 13.0022 14.0887 14.0923 15.0157 15.0209 15.1534 15.1571 15.6975 15.7050 k = 0.0000-0.0883 0.0681 ( 9664 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6007 -15.6007 -14.2368 -14.2368 -12.9823 -12.9822 -12.2976 -12.2968 -12.1372 -12.1362 -12.0531 -12.0527 -11.5432 -11.5431 -3.1750 -3.1749 -2.1788 -2.1787 -0.5167 -0.5160 -0.0066 -0.0046 0.4222 0.4247 0.6360 0.6380 0.9775 0.9796 1.1861 1.1870 2.2650 2.2658 2.4530 2.4534 2.4978 2.4990 2.7337 2.7356 3.2496 3.2557 3.3512 3.3584 3.8325 3.8351 3.9124 3.9132 4.3957 4.3992 4.9290 4.9323 5.1985 5.2067 5.2599 5.2644 5.5138 5.5162 6.2512 6.2877 6.3975 6.4065 6.5368 6.5862 6.7836 6.8096 7.0050 7.0213 7.1219 7.1697 7.2247 7.2463 7.2951 7.3073 7.4824 7.4941 8.1452 8.1503 10.7483 10.7497 12.9969 12.9986 14.0904 14.0936 15.0193 15.0244 15.1423 15.1462 15.7026 15.7094 k = 0.0000-0.0773 0.0596 ( 9665 PWs) bands (ev): -84.3024 -84.3024 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6041 -15.6041 -14.2331 -14.2330 -12.9800 -12.9799 -12.2975 -12.2968 -12.1413 -12.1404 -12.0524 -12.0521 -11.5402 -11.5401 -3.1744 -3.1743 -2.1924 -2.1924 -0.5206 -0.5199 0.0031 0.0050 0.4091 0.4114 0.6480 0.6498 0.9669 0.9689 1.1903 1.1912 2.2564 2.2571 2.4536 2.4539 2.4954 2.4965 2.7287 2.7305 3.2607 3.2670 3.3552 3.3624 3.8415 3.8438 3.9189 3.9197 4.4031 4.4062 4.9396 4.9426 5.2126 5.2201 5.2667 5.2714 5.5169 5.5192 6.2488 6.2814 6.3983 6.4072 6.5402 6.5864 6.7822 6.8047 7.0014 7.0170 7.1249 7.1669 7.2169 7.2380 7.2907 7.3010 7.4770 7.4878 8.1383 8.1429 10.7130 10.7142 12.9939 12.9955 14.0917 14.0945 15.0179 15.0226 15.1368 15.1404 15.7072 15.7132 k = 0.0000-0.0663 0.0511 ( 9662 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6070 -15.6070 -14.2297 -14.2297 -12.9780 -12.9779 -12.2975 -12.2969 -12.1449 -12.1441 -12.0517 -12.0515 -11.5376 -11.5375 -3.1738 -3.1738 -2.2043 -2.2043 -0.5239 -0.5234 0.0132 0.0149 0.3959 0.3980 0.6587 0.6603 0.9578 0.9595 1.1945 1.1953 2.2480 2.2486 2.4540 2.4542 2.4938 2.4947 2.7238 2.7254 3.2691 3.2750 3.3606 3.3673 3.8495 3.8516 3.9247 3.9254 4.4099 4.4126 4.9490 4.9517 5.2243 5.2309 5.2745 5.2794 5.5198 5.5218 6.2467 6.2753 6.3989 6.4077 6.5440 6.5860 6.7812 6.8002 6.9984 7.0130 7.1267 7.1620 7.2110 7.2314 7.2876 7.2961 7.4723 7.4821 8.1328 8.1368 10.6818 10.6828 12.9914 12.9928 14.0928 14.0952 15.0126 15.0165 15.1359 15.1389 15.7113 15.7164 k = 0.0000-0.0552 0.0426 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6095 -15.6095 -14.2268 -14.2268 -12.9763 -12.9762 -12.2976 -12.2970 -12.1480 -12.1473 -12.0511 -12.0509 -11.5353 -11.5352 -3.1734 -3.1733 -2.2144 -2.2144 -0.5268 -0.5264 0.0231 0.0247 0.3831 0.3851 0.6679 0.6692 0.9502 0.9517 1.1985 1.1991 2.2401 2.2407 2.4542 2.4544 2.4928 2.4936 2.7192 2.7206 3.2749 3.2800 3.3669 3.3728 3.8566 3.8584 3.9296 3.9303 4.4160 4.4182 4.9572 4.9594 5.2334 5.2389 5.2829 5.2876 5.5224 5.5241 6.2452 6.2695 6.3996 6.4078 6.5483 6.5851 6.7805 6.7961 6.9959 7.0089 7.1272 7.1554 7.2073 7.2265 7.2853 7.2922 7.4684 7.4770 8.1284 8.1318 10.6549 10.6558 12.9893 12.9905 14.0937 14.0957 15.0052 15.0083 15.1378 15.1401 15.7148 15.7191 k = 0.0000-0.0442 0.0340 ( 9658 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6116 -15.6116 -14.2244 -14.2244 -12.9749 -12.9748 -12.2977 -12.2972 -12.1505 -12.1500 -12.0506 -12.0505 -11.5334 -11.5333 -3.1730 -3.1730 -2.2227 -2.2227 -0.5292 -0.5289 0.0324 0.0338 0.3714 0.3731 0.6755 0.6766 0.9440 0.9453 1.2021 1.2026 2.2331 2.2336 2.4544 2.4545 2.4922 2.4928 2.7152 2.7164 3.2786 3.2827 3.3735 3.3783 3.8625 3.8640 3.9338 3.9343 4.4212 4.4230 4.9640 4.9659 5.2404 5.2447 5.2913 5.2954 5.5246 5.5261 6.2443 6.2640 6.4004 6.4075 6.5528 6.5835 6.7802 6.7925 6.9944 7.0053 7.1266 7.1482 7.2059 7.2229 7.2840 7.2892 7.4654 7.4726 8.1249 8.1277 10.6326 10.6333 12.9877 12.9886 14.0944 14.0960 14.9975 14.9998 15.1408 15.1425 15.7177 15.7212 k = 0.0000-0.0331 0.0255 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6133 -15.6133 -14.2226 -14.2225 -12.9737 -12.9737 -12.2977 -12.2974 -12.1525 -12.1521 -12.0502 -12.0501 -11.5319 -11.5319 -3.1727 -3.1727 -2.2292 -2.2292 -0.5311 -0.5308 0.0407 0.0418 0.3614 0.3627 0.6815 0.6823 0.9393 0.9403 1.2051 1.2055 2.2274 2.2278 2.4544 2.4545 2.4919 2.4924 2.7121 2.7130 3.2808 3.2838 3.3796 3.3831 3.8672 3.8684 3.9370 3.9374 4.4255 4.4268 4.9695 4.9709 5.2455 5.2488 5.2987 5.3021 5.5264 5.5276 6.2440 6.2591 6.4012 6.4069 6.5575 6.5813 6.7802 6.7893 6.9933 7.0018 7.1255 7.1410 7.2061 7.2199 7.2830 7.2868 7.4632 7.4687 8.1223 8.1244 10.6151 10.6156 12.9864 12.9871 14.0949 14.0961 14.9906 14.9922 15.1439 15.1451 15.7201 15.7228 k = 0.0000-0.0221 0.0170 ( 9660 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6144 -15.6144 -14.2212 -14.2212 -12.9729 -12.9729 -12.2978 -12.2975 -12.1538 -12.1536 -12.0499 -12.0498 -11.5309 -11.5308 -3.1725 -3.1725 -2.2339 -2.2339 -0.5324 -0.5323 0.0472 0.0480 0.3536 0.3546 0.6858 0.6864 0.9361 0.9367 1.2074 1.2077 2.2231 2.2234 2.4545 2.4545 2.4918 2.4921 2.7098 2.7104 3.2821 3.2841 3.3844 3.3868 3.8707 3.8715 3.9394 3.9397 4.4287 4.4296 4.9735 4.9744 5.2492 5.2513 5.3046 5.3069 5.5278 5.5286 6.2446 6.2547 6.4021 6.4061 6.5622 6.5784 6.7807 6.7866 6.9929 6.9988 7.1249 7.1350 7.2076 7.2173 7.2826 7.2851 7.4619 7.4657 8.1208 8.1222 10.6025 10.6028 12.9856 12.9861 14.0954 14.0962 14.9852 14.9863 15.1465 15.1472 15.7220 15.7237 k = 0.0000-0.0110 0.0085 ( 9657 PWs) bands (ev): -84.3023 -84.3023 -50.0022 -50.0022 -48.3955 -48.3955 -48.0608 -48.0608 -15.6151 -15.6151 -14.2204 -14.2204 -12.9725 -12.9725 -12.2978 -12.2977 -12.1546 -12.1545 -12.0497 -12.0496 -11.5302 -11.5302 -3.1723 -3.1723 -2.2367 -2.2367 -0.5332 -0.5331 0.0515 0.0519 0.3488 0.3493 0.6885 0.6888 0.9342 0.9345 1.2089 1.2090 2.2205 2.2206 2.4545 2.4545 2.4918 2.4919 2.7085 2.7088 3.2829 3.2839 3.3877 3.3889 3.8729 3.8733 3.9409 3.9410 4.4307 4.4311 4.9760 4.9765 5.2515 5.2526 5.3085 5.3097 5.5287 5.5291 6.2459 6.2510 6.4032 6.4052 6.5668 6.5750 6.7815 6.7845 6.9935 6.9965 7.1252 7.1302 7.2098 7.2148 7.2828 7.2840 7.4615 7.4634 8.1200 8.1207 10.5949 10.5951 12.9851 12.9854 14.0957 14.0961 14.9820 14.9825 15.1482 15.1486 15.7233 15.7241 k = 0.0000 0.0000 0.0000 ( 9663 PWs) bands (ev): -84.3023 -84.3023 -50.0023 -50.0023 -48.3955 -48.3955 -48.0608 -48.0608 -15.6154 -15.6154 -14.2201 -14.2201 -12.9723 -12.9723 -12.2978 -12.2978 -12.1549 -12.1549 -12.0496 -12.0496 -11.5300 -11.5300 -3.1723 -3.1723 -2.2376 -2.2376 -0.5335 -0.5335 0.0531 0.0531 0.3473 0.3473 0.6895 0.6895 0.9337 0.9337 1.2094 1.2094 2.2197 2.2197 2.4545 2.4545 2.4918 2.4918 2.7081 2.7081 3.2835 3.2835 3.3892 3.3892 3.8738 3.8738 3.9414 3.9414 4.4315 4.4315 4.9770 4.9770 5.2527 5.2527 5.3103 5.3103 5.5292 5.5292 6.2481 6.2481 6.4042 6.4042 6.5711 6.5711 6.7827 6.7827 6.9945 6.9945 7.1269 7.1269 7.2122 7.2122 7.2831 7.2831 7.4619 7.4619 8.1197 8.1197 10.5925 10.5925 12.9850 12.9850 14.0960 14.0960 14.9810 14.9810 15.1489 15.1489 15.7240 15.7240 Writing output data file CoCuP2O7.save init_run : 1.28s CPU 0.79s WALL ( 1 calls) electrons : 690.10s CPU 547.35s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 690.08s CPU 547.34s 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 0.00s WALL ( 1 calls) newd : 0.31s CPU 0.17s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.45s CPU 0.54s WALL ( 286 calls) cegterg : 587.05s CPU 488.08s WALL ( 286 calls) Called by sum_band: Called by *egterg: h_psi : 393.96s CPU 262.07s WALL ( 5719 calls) s_psi : 21.92s CPU 18.23s WALL ( 5719 calls) g_psi : 0.77s CPU 0.85s WALL ( 5147 calls) cdiaghg : 173.52s CPU 173.12s WALL ( 5433 calls) cegterg:over : 30.86s CPU 30.69s WALL ( 5147 calls) cegterg:upda : 29.29s CPU 28.73s WALL ( 5147 calls) cegterg:last : 12.69s CPU 12.70s WALL ( 872 calls) cdiaghg:chol : 10.47s CPU 10.64s WALL ( 5433 calls) cdiaghg:inve : 7.60s CPU 7.65s WALL ( 5433 calls) cdiaghg:para : 14.02s CPU 14.29s WALL ( 10866 calls) Called by h_psi: h_psi:vloc : 341.77s CPU 218.26s WALL ( 5719 calls) h_psi:vnl : 51.14s CPU 42.87s WALL ( 5719 calls) add_vuspsi : 26.34s CPU 21.81s WALL ( 5719 calls) General routines calbec : 24.78s CPU 21.04s WALL ( 5719 calls) fft : 0.07s CPU 0.04s WALL ( 19 calls) ffts : 0.01s CPU 0.00s WALL ( 4 calls) fftw : 329.34s CPU 207.64s WALL ( 1209656 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.62s CPU 7.24s WALL ( 572 calls) Parallel routines fft_scatter : 106.21s CPU 84.98s WALL ( 1209679 calls) PWSCF : 12m32.42s CPU 10m40.71s WALL This run was terminated on: 16: 2:42 10Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=