Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:14:16 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Tl2Pt.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 91 38 10 3692 974 150 Max 92 39 11 3696 1004 155 Sum 3295 1369 393 133007 35503 5497 bravais-lattice index = 14 lattice parameter (alat) = 10.5236 a.u. unit-cell volume = 873.8867 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.523610 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.249654 celldm(5)= -0.249654 celldm(6)= -0.500692 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500692 0.865625 0.000000 ) a(3) = ( -0.249654 -0.432813 0.866225 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.578416 0.577217 ) b(2) = ( 0.000000 1.155234 0.577217 ) b(3) = ( 0.000000 0.000000 1.154434 ) PseudoPot. # 1 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 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 Tl 13.00 204.38330 Tl( 1.00) Pt 10.00 195.08400 Pt( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 1 1 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.7503460 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( -0.4328127 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( -1 -1 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) f =( 0.2496540 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.4328127 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 301 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0000000 0.0174914), wk = 0.0033223 k( 3) = ( 0.0000000 0.0000000 0.0349829), wk = 0.0033223 k( 4) = ( 0.0000000 0.0000000 0.0524743), wk = 0.0033223 k( 5) = ( 0.0000000 0.0000000 0.0699657), wk = 0.0033223 k( 6) = ( 0.0000000 0.0000000 0.0874571), wk = 0.0033223 k( 7) = ( 0.0000000 0.0000000 0.1049486), wk = 0.0033223 k( 8) = ( 0.0000000 0.0000000 0.1224400), wk = 0.0033223 k( 9) = ( 0.0000000 0.0000000 0.1399314), wk = 0.0033223 k( 10) = ( 0.0000000 0.0000000 0.1574229), wk = 0.0033223 k( 11) = ( 0.0000000 0.0000000 0.1749143), wk = 0.0033223 k( 12) = ( 0.0000000 0.0000000 0.1924057), wk = 0.0033223 k( 13) = ( 0.0000000 0.0000000 0.2098971), wk = 0.0033223 k( 14) = ( 0.0000000 0.0000000 0.2273886), wk = 0.0033223 k( 15) = ( 0.0000000 0.0000000 0.2448800), wk = 0.0033223 k( 16) = ( 0.0000000 0.0000000 0.2623714), wk = 0.0033223 k( 17) = ( 0.0000000 0.0000000 0.2798628), wk = 0.0033223 k( 18) = ( 0.0000000 0.0000000 0.2973543), wk = 0.0033223 k( 19) = ( 0.0000000 0.0000000 0.3148457), wk = 0.0033223 k( 20) = ( 0.0000000 0.0000000 0.3323371), wk = 0.0033223 k( 21) = ( 0.0000000 0.0000000 0.3498286), wk = 0.0033223 k( 22) = ( 0.0000000 0.0000000 0.3673200), wk = 0.0033223 k( 23) = ( 0.0000000 0.0000000 0.3848114), wk = 0.0033223 k( 24) = ( 0.0000000 0.0000000 0.4023029), wk = 0.0033223 k( 25) = ( 0.0000000 0.0000000 0.4197943), wk = 0.0033223 k( 26) = ( 0.0000000 0.0000000 0.4372857), wk = 0.0033223 k( 27) = ( 0.0000000 0.0000000 0.4547771), wk = 0.0033223 k( 28) = ( 0.0000000 0.0000000 0.4722686), wk = 0.0033223 k( 29) = ( 0.0000000 0.0000000 0.4897600), wk = 0.0033223 k( 30) = ( 0.0000000 0.0000000 0.5072514), wk = 0.0033223 k( 31) = ( 0.0000000 0.0000000 0.5247428), wk = 0.0033223 k( 32) = ( 0.0000000 0.0000000 0.5422343), wk = 0.0033223 k( 33) = ( 0.0000000 0.0000000 0.5597257), wk = 0.0033223 k( 34) = ( 0.0000000 0.0000000 0.5772171), wk = 0.0033223 k( 35) = ( 0.0000000 0.0000000 0.5772171), wk = 0.0033223 k( 36) = ( -0.0151515 0.0087397 0.5772171), wk = 0.0033223 k( 37) = ( -0.0303030 0.0174793 0.5772171), wk = 0.0033223 k( 38) = ( -0.0454546 0.0262190 0.5772171), wk = 0.0033223 k( 39) = ( -0.0606061 0.0349586 0.5772171), wk = 0.0033223 k( 40) = ( -0.0757576 0.0436983 0.5772171), wk = 0.0033223 k( 41) = ( -0.0909091 0.0524380 0.5772171), wk = 0.0033223 k( 42) = ( -0.1060606 0.0611776 0.5772171), wk = 0.0033223 k( 43) = ( -0.1212121 0.0699173 0.5772171), wk = 0.0033223 k( 44) = ( -0.1363636 0.0786569 0.5772171), wk = 0.0033223 k( 45) = ( -0.1515151 0.0873966 0.5772171), wk = 0.0033223 k( 46) = ( -0.1666667 0.0961363 0.5772171), wk = 0.0033223 k( 47) = ( -0.1818182 0.1048759 0.5772171), wk = 0.0033223 k( 48) = ( -0.1969697 0.1136156 0.5772171), wk = 0.0033223 k( 49) = ( -0.2121212 0.1223552 0.5772171), wk = 0.0033223 k( 50) = ( -0.2272727 0.1310949 0.5772171), wk = 0.0033223 k( 51) = ( -0.2424242 0.1398346 0.5772171), wk = 0.0033223 k( 52) = ( -0.2575758 0.1485742 0.5772171), wk = 0.0033223 k( 53) = ( -0.2727273 0.1573139 0.5772171), wk = 0.0033223 k( 54) = ( -0.2878788 0.1660535 0.5772171), wk = 0.0033223 k( 55) = ( -0.3030303 0.1747932 0.5772171), wk = 0.0033223 k( 56) = ( -0.3181818 0.1835329 0.5772171), wk = 0.0033223 k( 57) = ( -0.3333333 0.1922725 0.5772171), wk = 0.0033223 k( 58) = ( -0.3484849 0.2010122 0.5772171), wk = 0.0033223 k( 59) = ( -0.3636364 0.2097518 0.5772171), wk = 0.0033223 k( 60) = ( -0.3787879 0.2184915 0.5772171), wk = 0.0033223 k( 61) = ( -0.3939394 0.2272311 0.5772171), wk = 0.0033223 k( 62) = ( -0.4090909 0.2359708 0.5772171), wk = 0.0033223 k( 63) = ( -0.4242424 0.2447105 0.5772171), wk = 0.0033223 k( 64) = ( -0.4393939 0.2534501 0.5772171), wk = 0.0033223 k( 65) = ( -0.4545455 0.2621898 0.5772171), wk = 0.0033223 k( 66) = ( -0.4696970 0.2709294 0.5772171), wk = 0.0033223 k( 67) = ( -0.4848485 0.2796691 0.5772171), wk = 0.0033223 k( 68) = ( -0.5000000 0.2884088 0.5772171), wk = 0.0033223 k( 69) = ( -0.5000000 0.2884088 0.5772171), wk = 0.0033223 k( 70) = ( -0.4893617 0.2822724 0.5649359), wk = 0.0033223 k( 71) = ( -0.4787234 0.2761361 0.5526547), wk = 0.0033223 k( 72) = ( -0.4680851 0.2699997 0.5403735), wk = 0.0033223 k( 73) = ( -0.4574468 0.2638633 0.5280923), wk = 0.0033223 k( 74) = ( -0.4468085 0.2577270 0.5158111), wk = 0.0033223 k( 75) = ( -0.4361702 0.2515906 0.5035298), wk = 0.0033223 k( 76) = ( -0.4255319 0.2454543 0.4912486), wk = 0.0033223 k( 77) = ( -0.4148936 0.2393179 0.4789674), wk = 0.0033223 k( 78) = ( -0.4042553 0.2331816 0.4666862), wk = 0.0033223 k( 79) = ( -0.3936170 0.2270452 0.4544050), wk = 0.0033223 k( 80) = ( -0.3829787 0.2209088 0.4421238), wk = 0.0033223 k( 81) = ( -0.3723404 0.2147725 0.4298426), wk = 0.0033223 k( 82) = ( -0.3617021 0.2086361 0.4175613), wk = 0.0033223 k( 83) = ( -0.3510638 0.2024998 0.4052801), wk = 0.0033223 k( 84) = ( -0.3404255 0.1963634 0.3929989), wk = 0.0033223 k( 85) = ( -0.3297872 0.1902271 0.3807177), wk = 0.0033223 k( 86) = ( -0.3191489 0.1840907 0.3684365), wk = 0.0033223 k( 87) = ( -0.3085106 0.1779543 0.3561553), wk = 0.0033223 k( 88) = ( -0.2978723 0.1718180 0.3438740), wk = 0.0033223 k( 89) = ( -0.2872340 0.1656816 0.3315928), wk = 0.0033223 k( 90) = ( -0.2765957 0.1595453 0.3193116), wk = 0.0033223 k( 91) = ( -0.2659574 0.1534089 0.3070304), wk = 0.0033223 k( 92) = ( -0.2553191 0.1472726 0.2947492), wk = 0.0033223 k( 93) = ( -0.2446809 0.1411362 0.2824680), wk = 0.0033223 k( 94) = ( -0.2340425 0.1349998 0.2701867), wk = 0.0033223 k( 95) = ( -0.2234043 0.1288635 0.2579055), wk = 0.0033223 k( 96) = ( -0.2127660 0.1227271 0.2456243), wk = 0.0033223 k( 97) = ( -0.2021277 0.1165908 0.2333431), wk = 0.0033223 k( 98) = ( -0.1914894 0.1104544 0.2210619), wk = 0.0033223 k( 99) = ( -0.1808511 0.1043181 0.2087807), wk = 0.0033223 k( 100) = ( -0.1702128 0.0981817 0.1964995), wk = 0.0033223 k( 101) = ( -0.1595745 0.0920454 0.1842182), wk = 0.0033223 k( 102) = ( -0.1489362 0.0859090 0.1719370), wk = 0.0033223 k( 103) = ( -0.1382979 0.0797726 0.1596558), wk = 0.0033223 k( 104) = ( -0.1276596 0.0736363 0.1473746), wk = 0.0033223 k( 105) = ( -0.1170213 0.0674999 0.1350934), wk = 0.0033223 k( 106) = ( -0.1063830 0.0613636 0.1228122), wk = 0.0033223 k( 107) = ( -0.0957447 0.0552272 0.1105309), wk = 0.0033223 k( 108) = ( -0.0851064 0.0490909 0.0982497), wk = 0.0033223 k( 109) = ( -0.0744681 0.0429545 0.0859685), wk = 0.0033223 k( 110) = ( -0.0638298 0.0368181 0.0736873), wk = 0.0033223 k( 111) = ( -0.0531915 0.0306818 0.0614061), wk = 0.0033223 k( 112) = ( -0.0425532 0.0245454 0.0491249), wk = 0.0033223 k( 113) = ( -0.0319149 0.0184091 0.0368436), wk = 0.0033223 k( 114) = ( -0.0212766 0.0122727 0.0245624), wk = 0.0033223 k( 115) = ( -0.0106383 0.0061364 0.0122812), wk = 0.0033223 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 118) = ( 0.0086742 0.0150379 0.0000000), wk = 0.0033223 k( 119) = ( 0.0173483 0.0300759 0.0000000), wk = 0.0033223 k( 120) = ( 0.0260224 0.0451138 0.0000000), wk = 0.0033223 k( 121) = ( 0.0346966 0.0601518 0.0000000), wk = 0.0033223 k( 122) = ( 0.0433707 0.0751897 0.0000000), wk = 0.0033223 k( 123) = ( 0.0520449 0.0902277 0.0000000), wk = 0.0033223 k( 124) = ( 0.0607191 0.1052656 0.0000000), wk = 0.0033223 k( 125) = ( 0.0693932 0.1203036 0.0000000), wk = 0.0033223 k( 126) = ( 0.0780674 0.1353415 0.0000000), wk = 0.0033223 k( 127) = ( 0.0867415 0.1503795 0.0000000), wk = 0.0033223 k( 128) = ( 0.0954157 0.1654174 0.0000000), wk = 0.0033223 k( 129) = ( 0.1040898 0.1804553 0.0000000), wk = 0.0033223 k( 130) = ( 0.1127640 0.1954933 0.0000000), wk = 0.0033223 k( 131) = ( 0.1214381 0.2105312 0.0000000), wk = 0.0033223 k( 132) = ( 0.1301123 0.2255692 0.0000000), wk = 0.0033223 k( 133) = ( 0.1387864 0.2406071 0.0000000), wk = 0.0033223 k( 134) = ( 0.1474606 0.2556451 0.0000000), wk = 0.0033223 k( 135) = ( 0.1561347 0.2706830 0.0000000), wk = 0.0033223 k( 136) = ( 0.1648089 0.2857210 0.0000000), wk = 0.0033223 k( 137) = ( 0.1734830 0.3007589 0.0000000), wk = 0.0033223 k( 138) = ( 0.1821572 0.3157969 0.0000000), wk = 0.0033223 k( 139) = ( 0.1908313 0.3308348 0.0000000), wk = 0.0033223 k( 140) = ( 0.1995055 0.3458728 0.0000000), wk = 0.0033223 k( 141) = ( 0.2081796 0.3609107 0.0000000), wk = 0.0033223 k( 142) = ( 0.2168538 0.3759486 0.0000000), wk = 0.0033223 k( 143) = ( 0.2255279 0.3909866 0.0000000), wk = 0.0033223 k( 144) = ( 0.2342021 0.4060245 0.0000000), wk = 0.0033223 k( 145) = ( 0.2428762 0.4210625 0.0000000), wk = 0.0033223 k( 146) = ( 0.2515504 0.4361004 0.0000000), wk = 0.0033223 k( 147) = ( 0.2602245 0.4511384 0.0000000), wk = 0.0033223 k( 148) = ( 0.2688987 0.4661763 0.0000000), wk = 0.0033223 k( 149) = ( 0.2775728 0.4812143 0.0000000), wk = 0.0033223 k( 150) = ( 0.2862470 0.4962522 0.0000000), wk = 0.0033223 k( 151) = ( 0.2949211 0.5112902 0.0000000), wk = 0.0033223 k( 152) = ( 0.3035953 0.5263281 0.0000000), wk = 0.0033223 k( 153) = ( 0.3122694 0.5413660 0.0000000), wk = 0.0033223 k( 154) = ( 0.3209436 0.5564040 0.0000000), wk = 0.0033223 k( 155) = ( 0.3296177 0.5714419 0.0000000), wk = 0.0033223 k( 156) = ( 0.3382919 0.5864799 0.0000000), wk = 0.0033223 k( 157) = ( 0.3469660 0.6015178 0.0000000), wk = 0.0033223 k( 158) = ( 0.3556402 0.6165558 0.0000000), wk = 0.0033223 k( 159) = ( 0.3643143 0.6315937 0.0000000), wk = 0.0033223 k( 160) = ( 0.3729885 0.6466317 0.0000000), wk = 0.0033223 k( 161) = ( 0.3816626 0.6616696 0.0000000), wk = 0.0033223 k( 162) = ( 0.3903368 0.6767075 0.0000000), wk = 0.0033223 k( 163) = ( 0.3990109 0.6917455 0.0000000), wk = 0.0033223 k( 164) = ( 0.4076851 0.7067834 0.0000000), wk = 0.0033223 k( 165) = ( 0.4163592 0.7218214 0.0000000), wk = 0.0033223 k( 166) = ( 0.4163592 0.7218214 0.0000000), wk = 0.0033223 k( 167) = ( 0.4119814 0.7142317 0.0151899), wk = 0.0033223 k( 168) = ( 0.4076035 0.7066420 0.0303798), wk = 0.0033223 k( 169) = ( 0.4032256 0.6990523 0.0455698), wk = 0.0033223 k( 170) = ( 0.3988477 0.6914626 0.0607597), wk = 0.0033223 k( 171) = ( 0.3944699 0.6838729 0.0759496), wk = 0.0033223 k( 172) = ( 0.3900920 0.6762832 0.0911395), wk = 0.0033223 k( 173) = ( 0.3857141 0.6686935 0.1063295), wk = 0.0033223 k( 174) = ( 0.3813362 0.6611038 0.1215194), wk = 0.0033223 k( 175) = ( 0.3769584 0.6535140 0.1367093), wk = 0.0033223 k( 176) = ( 0.3725805 0.6459243 0.1518992), wk = 0.0033223 k( 177) = ( 0.3682026 0.6383346 0.1670892), wk = 0.0033223 k( 178) = ( 0.3638247 0.6307449 0.1822791), wk = 0.0033223 k( 179) = ( 0.3594469 0.6231552 0.1974690), wk = 0.0033223 k( 180) = ( 0.3550690 0.6155655 0.2126589), wk = 0.0033223 k( 181) = ( 0.3506911 0.6079758 0.2278489), wk = 0.0033223 k( 182) = ( 0.3463132 0.6003861 0.2430388), wk = 0.0033223 k( 183) = ( 0.3419354 0.5927964 0.2582287), wk = 0.0033223 k( 184) = ( 0.3375575 0.5852067 0.2734186), wk = 0.0033223 k( 185) = ( 0.3331796 0.5776170 0.2886086), wk = 0.0033223 k( 186) = ( 0.3288017 0.5700273 0.3037985), wk = 0.0033223 k( 187) = ( 0.3244239 0.5624376 0.3189884), wk = 0.0033223 k( 188) = ( 0.3200460 0.5548479 0.3341783), wk = 0.0033223 k( 189) = ( 0.3156681 0.5472582 0.3493683), wk = 0.0033223 k( 190) = ( 0.3112902 0.5396685 0.3645582), wk = 0.0033223 k( 191) = ( 0.3069124 0.5320788 0.3797481), wk = 0.0033223 k( 192) = ( 0.3025345 0.5244891 0.3949380), wk = 0.0033223 k( 193) = ( 0.2981566 0.5168994 0.4101280), wk = 0.0033223 k( 194) = ( 0.2937787 0.5093097 0.4253179), wk = 0.0033223 k( 195) = ( 0.2894009 0.5017200 0.4405078), wk = 0.0033223 k( 196) = ( 0.2850230 0.4941303 0.4556977), wk = 0.0033223 k( 197) = ( 0.2806451 0.4865405 0.4708877), wk = 0.0033223 k( 198) = ( 0.2762673 0.4789509 0.4860776), wk = 0.0033223 k( 199) = ( 0.2718894 0.4713611 0.5012675), wk = 0.0033223 k( 200) = ( 0.2675115 0.4637714 0.5164574), wk = 0.0033223 k( 201) = ( 0.2631336 0.4561817 0.5316474), wk = 0.0033223 k( 202) = ( 0.2587558 0.4485920 0.5468373), wk = 0.0033223 k( 203) = ( 0.2543779 0.4410023 0.5620272), wk = 0.0033223 k( 204) = ( 0.2500000 0.4334126 0.5772171), wk = 0.0033223 k( 205) = ( 0.2500000 0.4334126 0.5772171), wk = 0.0033223 k( 206) = ( 0.2395833 0.4394211 0.5651918), wk = 0.0033223 k( 207) = ( 0.2291667 0.4454297 0.5531664), wk = 0.0033223 k( 208) = ( 0.2187500 0.4514382 0.5411411), wk = 0.0033223 k( 209) = ( 0.2083333 0.4574467 0.5291157), wk = 0.0033223 k( 210) = ( 0.1979167 0.4634552 0.5170904), wk = 0.0033223 k( 211) = ( 0.1875000 0.4694637 0.5050650), wk = 0.0033223 k( 212) = ( 0.1770833 0.4754722 0.4930396), wk = 0.0033223 k( 213) = ( 0.1666667 0.4814807 0.4810143), wk = 0.0033223 k( 214) = ( 0.1562500 0.4874893 0.4689889), wk = 0.0033223 k( 215) = ( 0.1458333 0.4934978 0.4569636), wk = 0.0033223 k( 216) = ( 0.1354167 0.4995063 0.4449382), wk = 0.0033223 k( 217) = ( 0.1250000 0.5055148 0.4329128), wk = 0.0033223 k( 218) = ( 0.1145833 0.5115233 0.4208875), wk = 0.0033223 k( 219) = ( 0.1041667 0.5175318 0.4088621), wk = 0.0033223 k( 220) = ( 0.0937500 0.5235404 0.3968368), wk = 0.0033223 k( 221) = ( 0.0833333 0.5295489 0.3848114), wk = 0.0033223 k( 222) = ( 0.0729167 0.5355574 0.3727861), wk = 0.0033223 k( 223) = ( 0.0625000 0.5415659 0.3607607), wk = 0.0033223 k( 224) = ( 0.0520833 0.5475744 0.3487353), wk = 0.0033223 k( 225) = ( 0.0416667 0.5535829 0.3367100), wk = 0.0033223 k( 226) = ( 0.0312500 0.5595915 0.3246846), wk = 0.0033223 k( 227) = ( 0.0208333 0.5656000 0.3126593), wk = 0.0033223 k( 228) = ( 0.0104167 0.5716085 0.3006339), wk = 0.0033223 k( 229) = ( 0.0000000 0.5776170 0.2886086), wk = 0.0033223 k( 230) = ( 0.0000000 0.5776170 0.2886086), wk = 0.0033223 k( 231) = ( -0.0138786 0.5728102 0.2982289), wk = 0.0033223 k( 232) = ( -0.0277573 0.5680034 0.3078491), wk = 0.0033223 k( 233) = ( -0.0416359 0.5631966 0.3174694), wk = 0.0033223 k( 234) = ( -0.0555146 0.5583898 0.3270897), wk = 0.0033223 k( 235) = ( -0.0693932 0.5535829 0.3367100), wk = 0.0033223 k( 236) = ( -0.0832718 0.5487761 0.3463303), wk = 0.0033223 k( 237) = ( -0.0971505 0.5439693 0.3559506), wk = 0.0033223 k( 238) = ( -0.1110291 0.5391625 0.3655708), wk = 0.0033223 k( 239) = ( -0.1249078 0.5343557 0.3751911), wk = 0.0033223 k( 240) = ( -0.1387864 0.5295489 0.3848114), wk = 0.0033223 k( 241) = ( -0.1526650 0.5247421 0.3944317), wk = 0.0033223 k( 242) = ( -0.1665437 0.5199353 0.4040520), wk = 0.0033223 k( 243) = ( -0.1804223 0.5151284 0.4136723), wk = 0.0033223 k( 244) = ( -0.1943010 0.5103216 0.4232926), wk = 0.0033223 k( 245) = ( -0.2081796 0.5055148 0.4329128), wk = 0.0033223 k( 246) = ( -0.2220583 0.5007080 0.4425331), wk = 0.0033223 k( 247) = ( -0.2359369 0.4959012 0.4521534), wk = 0.0033223 k( 248) = ( -0.2498155 0.4910944 0.4617737), wk = 0.0033223 k( 249) = ( -0.2636942 0.4862876 0.4713940), wk = 0.0033223 k( 250) = ( -0.2775728 0.4814808 0.4810143), wk = 0.0033223 k( 251) = ( -0.2914515 0.4766739 0.4906346), wk = 0.0033223 k( 252) = ( -0.3053301 0.4718671 0.5002548), wk = 0.0033223 k( 253) = ( -0.3192087 0.4670603 0.5098751), wk = 0.0033223 k( 254) = ( -0.3330874 0.4622535 0.5194954), wk = 0.0033223 k( 255) = ( -0.3469660 0.4574467 0.5291157), wk = 0.0033223 k( 256) = ( -0.3608447 0.4526399 0.5387360), wk = 0.0033223 k( 257) = ( -0.3747233 0.4478331 0.5483563), wk = 0.0033223 k( 258) = ( -0.3886019 0.4430262 0.5579766), wk = 0.0033223 k( 259) = ( -0.4024806 0.4382194 0.5675968), wk = 0.0033223 k( 260) = ( -0.4163592 0.4334126 0.5772171), wk = 0.0033223 k( 261) = ( -0.4163592 0.4334126 0.5772171), wk = 0.0033223 k( 262) = ( -0.4247233 0.4189122 0.5772171), wk = 0.0033223 k( 263) = ( -0.4330874 0.4044118 0.5772171), wk = 0.0033223 k( 264) = ( -0.4414515 0.3899115 0.5772171), wk = 0.0033223 k( 265) = ( -0.4498155 0.3754111 0.5772171), wk = 0.0033223 k( 266) = ( -0.4581796 0.3609107 0.5772171), wk = 0.0033223 k( 267) = ( -0.4665437 0.3464103 0.5772171), wk = 0.0033223 k( 268) = ( -0.4749078 0.3319099 0.5772171), wk = 0.0033223 k( 269) = ( -0.4832719 0.3174095 0.5772171), wk = 0.0033223 k( 270) = ( -0.4916359 0.3029092 0.5772171), wk = 0.0033223 k( 271) = ( -0.5000000 0.2884088 0.5772171), wk = 0.0033223 k( 272) = ( 0.0000000 0.0000000 0.5772171), wk = 0.0033223 k( 273) = ( 0.0086207 0.0149453 0.5772171), wk = 0.0033223 k( 274) = ( 0.0172414 0.0298905 0.5772171), wk = 0.0033223 k( 275) = ( 0.0258621 0.0448358 0.5772171), wk = 0.0033223 k( 276) = ( 0.0344828 0.0597811 0.5772171), wk = 0.0033223 k( 277) = ( 0.0431035 0.0747263 0.5772171), wk = 0.0033223 k( 278) = ( 0.0517241 0.0896716 0.5772171), wk = 0.0033223 k( 279) = ( 0.0603448 0.1046168 0.5772171), wk = 0.0033223 k( 280) = ( 0.0689655 0.1195621 0.5772171), wk = 0.0033223 k( 281) = ( 0.0775862 0.1345074 0.5772171), wk = 0.0033223 k( 282) = ( 0.0862069 0.1494526 0.5772171), wk = 0.0033223 k( 283) = ( 0.0948276 0.1643979 0.5772171), wk = 0.0033223 k( 284) = ( 0.1034483 0.1793432 0.5772171), wk = 0.0033223 k( 285) = ( 0.1120690 0.1942884 0.5772171), wk = 0.0033223 k( 286) = ( 0.1206897 0.2092337 0.5772171), wk = 0.0033223 k( 287) = ( 0.1293103 0.2241789 0.5772171), wk = 0.0033223 k( 288) = ( 0.1379310 0.2391242 0.5772171), wk = 0.0033223 k( 289) = ( 0.1465517 0.2540695 0.5772171), wk = 0.0033223 k( 290) = ( 0.1551724 0.2690147 0.5772171), wk = 0.0033223 k( 291) = ( 0.1637931 0.2839600 0.5772171), wk = 0.0033223 k( 292) = ( 0.1724138 0.2989052 0.5772171), wk = 0.0033223 k( 293) = ( 0.1810345 0.3138505 0.5772171), wk = 0.0033223 k( 294) = ( 0.1896552 0.3287958 0.5772171), wk = 0.0033223 k( 295) = ( 0.1982759 0.3437410 0.5772171), wk = 0.0033223 k( 296) = ( 0.2068966 0.3586863 0.5772171), wk = 0.0033223 k( 297) = ( 0.2155172 0.3736316 0.5772171), wk = 0.0033223 k( 298) = ( 0.2241379 0.3885768 0.5772171), wk = 0.0033223 k( 299) = ( 0.2327586 0.4035221 0.5772171), wk = 0.0033223 k( 300) = ( 0.2413793 0.4184674 0.5772171), wk = 0.0033223 k( 301) = ( 0.2500000 0.4334126 0.5772171), wk = 0.0033223 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 2) = ( 0.0000000 0.0000000 0.0151515), wk = 0.0033223 k( 3) = ( 0.0000000 0.0000000 0.0303030), wk = 0.0033223 k( 4) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0033223 k( 5) = ( 0.0000000 0.0000000 0.0606061), wk = 0.0033223 k( 6) = ( 0.0000000 0.0000000 0.0757576), wk = 0.0033223 k( 7) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0033223 k( 8) = ( 0.0000000 0.0000000 0.1060606), wk = 0.0033223 k( 9) = ( 0.0000000 0.0000000 0.1212121), wk = 0.0033223 k( 10) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0033223 k( 11) = ( 0.0000000 0.0000000 0.1515151), wk = 0.0033223 k( 12) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0033223 k( 13) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0033223 k( 14) = ( 0.0000000 0.0000000 0.1969697), wk = 0.0033223 k( 15) = ( 0.0000000 0.0000000 0.2121212), wk = 0.0033223 k( 16) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0033223 k( 17) = ( 0.0000000 0.0000000 0.2424242), wk = 0.0033223 k( 18) = ( 0.0000000 0.0000000 0.2575758), wk = 0.0033223 k( 19) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0033223 k( 20) = ( 0.0000000 0.0000000 0.2878788), wk = 0.0033223 k( 21) = ( 0.0000000 0.0000000 0.3030303), wk = 0.0033223 k( 22) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0033223 k( 23) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0033223 k( 24) = ( 0.0000000 0.0000000 0.3484849), wk = 0.0033223 k( 25) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0033223 k( 26) = ( 0.0000000 0.0000000 0.3787879), wk = 0.0033223 k( 27) = ( 0.0000000 0.0000000 0.3939394), wk = 0.0033223 k( 28) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0033223 k( 29) = ( 0.0000000 0.0000000 0.4242424), wk = 0.0033223 k( 30) = ( 0.0000000 0.0000000 0.4393939), wk = 0.0033223 k( 31) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0033223 k( 32) = ( 0.0000000 0.0000000 0.4696970), wk = 0.0033223 k( 33) = ( 0.0000000 0.0000000 0.4848485), wk = 0.0033223 k( 34) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 35) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 36) = ( -0.0151515 0.0151515 0.5000000), wk = 0.0033223 k( 37) = ( -0.0303030 0.0303030 0.5000000), wk = 0.0033223 k( 38) = ( -0.0454546 0.0454546 0.5000000), wk = 0.0033223 k( 39) = ( -0.0606061 0.0606061 0.5000000), wk = 0.0033223 k( 40) = ( -0.0757576 0.0757576 0.5000000), wk = 0.0033223 k( 41) = ( -0.0909091 0.0909091 0.5000000), wk = 0.0033223 k( 42) = ( -0.1060606 0.1060606 0.5000000), wk = 0.0033223 k( 43) = ( -0.1212121 0.1212121 0.5000000), wk = 0.0033223 k( 44) = ( -0.1363636 0.1363636 0.5000000), wk = 0.0033223 k( 45) = ( -0.1515151 0.1515151 0.5000000), wk = 0.0033223 k( 46) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0033223 k( 47) = ( -0.1818182 0.1818182 0.5000000), wk = 0.0033223 k( 48) = ( -0.1969697 0.1969697 0.5000000), wk = 0.0033223 k( 49) = ( -0.2121212 0.2121212 0.5000000), wk = 0.0033223 k( 50) = ( -0.2272727 0.2272727 0.5000000), wk = 0.0033223 k( 51) = ( -0.2424242 0.2424242 0.5000000), wk = 0.0033223 k( 52) = ( -0.2575758 0.2575758 0.5000000), wk = 0.0033223 k( 53) = ( -0.2727273 0.2727273 0.5000000), wk = 0.0033223 k( 54) = ( -0.2878788 0.2878788 0.5000000), wk = 0.0033223 k( 55) = ( -0.3030303 0.3030303 0.5000000), wk = 0.0033223 k( 56) = ( -0.3181818 0.3181818 0.5000000), wk = 0.0033223 k( 57) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0033223 k( 58) = ( -0.3484849 0.3484849 0.5000000), wk = 0.0033223 k( 59) = ( -0.3636364 0.3636364 0.5000000), wk = 0.0033223 k( 60) = ( -0.3787879 0.3787879 0.5000000), wk = 0.0033223 k( 61) = ( -0.3939394 0.3939394 0.5000000), wk = 0.0033223 k( 62) = ( -0.4090909 0.4090909 0.5000000), wk = 0.0033223 k( 63) = ( -0.4242424 0.4242424 0.5000000), wk = 0.0033223 k( 64) = ( -0.4393939 0.4393939 0.5000000), wk = 0.0033223 k( 65) = ( -0.4545455 0.4545455 0.5000000), wk = 0.0033223 k( 66) = ( -0.4696970 0.4696970 0.5000000), wk = 0.0033223 k( 67) = ( -0.4848485 0.4848485 0.5000000), wk = 0.0033223 k( 68) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 69) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 70) = ( -0.4893617 0.4893617 0.4893617), wk = 0.0033223 k( 71) = ( -0.4787234 0.4787234 0.4787234), wk = 0.0033223 k( 72) = ( -0.4680851 0.4680851 0.4680851), wk = 0.0033223 k( 73) = ( -0.4574468 0.4574468 0.4574468), wk = 0.0033223 k( 74) = ( -0.4468085 0.4468085 0.4468085), wk = 0.0033223 k( 75) = ( -0.4361702 0.4361702 0.4361702), wk = 0.0033223 k( 76) = ( -0.4255319 0.4255319 0.4255319), wk = 0.0033223 k( 77) = ( -0.4148936 0.4148936 0.4148936), wk = 0.0033223 k( 78) = ( -0.4042553 0.4042553 0.4042553), wk = 0.0033223 k( 79) = ( -0.3936170 0.3936170 0.3936170), wk = 0.0033223 k( 80) = ( -0.3829787 0.3829787 0.3829787), wk = 0.0033223 k( 81) = ( -0.3723404 0.3723404 0.3723404), wk = 0.0033223 k( 82) = ( -0.3617021 0.3617021 0.3617021), wk = 0.0033223 k( 83) = ( -0.3510638 0.3510638 0.3510638), wk = 0.0033223 k( 84) = ( -0.3404255 0.3404255 0.3404255), wk = 0.0033223 k( 85) = ( -0.3297872 0.3297872 0.3297872), wk = 0.0033223 k( 86) = ( -0.3191489 0.3191489 0.3191489), wk = 0.0033223 k( 87) = ( -0.3085106 0.3085106 0.3085106), wk = 0.0033223 k( 88) = ( -0.2978723 0.2978723 0.2978723), wk = 0.0033223 k( 89) = ( -0.2872340 0.2872340 0.2872340), wk = 0.0033223 k( 90) = ( -0.2765957 0.2765957 0.2765957), wk = 0.0033223 k( 91) = ( -0.2659574 0.2659574 0.2659574), wk = 0.0033223 k( 92) = ( -0.2553191 0.2553191 0.2553191), wk = 0.0033223 k( 93) = ( -0.2446809 0.2446809 0.2446809), wk = 0.0033223 k( 94) = ( -0.2340425 0.2340425 0.2340425), wk = 0.0033223 k( 95) = ( -0.2234043 0.2234043 0.2234043), wk = 0.0033223 k( 96) = ( -0.2127660 0.2127660 0.2127660), wk = 0.0033223 k( 97) = ( -0.2021277 0.2021277 0.2021277), wk = 0.0033223 k( 98) = ( -0.1914894 0.1914894 0.1914894), wk = 0.0033223 k( 99) = ( -0.1808511 0.1808511 0.1808511), wk = 0.0033223 k( 100) = ( -0.1702128 0.1702128 0.1702128), wk = 0.0033223 k( 101) = ( -0.1595745 0.1595745 0.1595745), wk = 0.0033223 k( 102) = ( -0.1489362 0.1489362 0.1489362), wk = 0.0033223 k( 103) = ( -0.1382979 0.1382979 0.1382979), wk = 0.0033223 k( 104) = ( -0.1276596 0.1276596 0.1276596), wk = 0.0033223 k( 105) = ( -0.1170213 0.1170213 0.1170213), wk = 0.0033223 k( 106) = ( -0.1063830 0.1063830 0.1063830), wk = 0.0033223 k( 107) = ( -0.0957447 0.0957447 0.0957447), wk = 0.0033223 k( 108) = ( -0.0851064 0.0851064 0.0851064), wk = 0.0033223 k( 109) = ( -0.0744681 0.0744681 0.0744681), wk = 0.0033223 k( 110) = ( -0.0638298 0.0638298 0.0638298), wk = 0.0033223 k( 111) = ( -0.0531915 0.0531915 0.0531915), wk = 0.0033223 k( 112) = ( -0.0425532 0.0425532 0.0425532), wk = 0.0033223 k( 113) = ( -0.0319149 0.0319149 0.0319149), wk = 0.0033223 k( 114) = ( -0.0212766 0.0212766 0.0212766), wk = 0.0033223 k( 115) = ( -0.0106383 0.0106383 0.0106383), wk = 0.0033223 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0033223 k( 118) = ( 0.0086742 0.0086742 -0.0086742), wk = 0.0033223 k( 119) = ( 0.0173483 0.0173483 -0.0173483), wk = 0.0033223 k( 120) = ( 0.0260224 0.0260225 -0.0260225), wk = 0.0033223 k( 121) = ( 0.0346966 0.0346966 -0.0346966), wk = 0.0033223 k( 122) = ( 0.0433707 0.0433707 -0.0433708), wk = 0.0033223 k( 123) = ( 0.0520449 0.0520449 -0.0520449), wk = 0.0033223 k( 124) = ( 0.0607191 0.0607191 -0.0607191), wk = 0.0033223 k( 125) = ( 0.0693932 0.0693932 -0.0693932), wk = 0.0033223 k( 126) = ( 0.0780674 0.0780674 -0.0780674), wk = 0.0033223 k( 127) = ( 0.0867415 0.0867415 -0.0867415), wk = 0.0033223 k( 128) = ( 0.0954157 0.0954157 -0.0954157), wk = 0.0033223 k( 129) = ( 0.1040898 0.1040898 -0.1040898), wk = 0.0033223 k( 130) = ( 0.1127640 0.1127640 -0.1127640), wk = 0.0033223 k( 131) = ( 0.1214381 0.1214381 -0.1214381), wk = 0.0033223 k( 132) = ( 0.1301123 0.1301123 -0.1301123), wk = 0.0033223 k( 133) = ( 0.1387864 0.1387864 -0.1387864), wk = 0.0033223 k( 134) = ( 0.1474606 0.1474606 -0.1474606), wk = 0.0033223 k( 135) = ( 0.1561347 0.1561347 -0.1561347), wk = 0.0033223 k( 136) = ( 0.1648089 0.1648089 -0.1648089), wk = 0.0033223 k( 137) = ( 0.1734830 0.1734830 -0.1734830), wk = 0.0033223 k( 138) = ( 0.1821572 0.1821572 -0.1821572), wk = 0.0033223 k( 139) = ( 0.1908313 0.1908313 -0.1908313), wk = 0.0033223 k( 140) = ( 0.1995055 0.1995055 -0.1995055), wk = 0.0033223 k( 141) = ( 0.2081796 0.2081796 -0.2081796), wk = 0.0033223 k( 142) = ( 0.2168538 0.2168538 -0.2168538), wk = 0.0033223 k( 143) = ( 0.2255279 0.2255279 -0.2255279), wk = 0.0033223 k( 144) = ( 0.2342021 0.2342021 -0.2342021), wk = 0.0033223 k( 145) = ( 0.2428762 0.2428762 -0.2428762), wk = 0.0033223 k( 146) = ( 0.2515504 0.2515504 -0.2515504), wk = 0.0033223 k( 147) = ( 0.2602245 0.2602245 -0.2602245), wk = 0.0033223 k( 148) = ( 0.2688987 0.2688987 -0.2688987), wk = 0.0033223 k( 149) = ( 0.2775728 0.2775728 -0.2775728), wk = 0.0033223 k( 150) = ( 0.2862470 0.2862470 -0.2862470), wk = 0.0033223 k( 151) = ( 0.2949211 0.2949211 -0.2949211), wk = 0.0033223 k( 152) = ( 0.3035953 0.3035953 -0.3035953), wk = 0.0033223 k( 153) = ( 0.3122694 0.3122694 -0.3122694), wk = 0.0033223 k( 154) = ( 0.3209436 0.3209436 -0.3209436), wk = 0.0033223 k( 155) = ( 0.3296177 0.3296177 -0.3296177), wk = 0.0033223 k( 156) = ( 0.3382919 0.3382919 -0.3382919), wk = 0.0033223 k( 157) = ( 0.3469660 0.3469660 -0.3469660), wk = 0.0033223 k( 158) = ( 0.3556402 0.3556402 -0.3556402), wk = 0.0033223 k( 159) = ( 0.3643143 0.3643143 -0.3643143), wk = 0.0033223 k( 160) = ( 0.3729885 0.3729885 -0.3729885), wk = 0.0033223 k( 161) = ( 0.3816626 0.3816626 -0.3816626), wk = 0.0033223 k( 162) = ( 0.3903368 0.3903368 -0.3903368), wk = 0.0033223 k( 163) = ( 0.3990109 0.3990109 -0.3990109), wk = 0.0033223 k( 164) = ( 0.4076851 0.4076851 -0.4076851), wk = 0.0033223 k( 165) = ( 0.4163592 0.4163592 -0.4163592), wk = 0.0033223 k( 166) = ( 0.4163592 0.4163592 -0.4163592), wk = 0.0033223 k( 167) = ( 0.4119814 0.4119814 -0.3988235), wk = 0.0033223 k( 168) = ( 0.4076035 0.4076035 -0.3812877), wk = 0.0033223 k( 169) = ( 0.4032256 0.4032256 -0.3637519), wk = 0.0033223 k( 170) = ( 0.3988477 0.3988477 -0.3462162), wk = 0.0033223 k( 171) = ( 0.3944699 0.3944699 -0.3286804), wk = 0.0033223 k( 172) = ( 0.3900920 0.3900920 -0.3111446), wk = 0.0033223 k( 173) = ( 0.3857141 0.3857141 -0.2936089), wk = 0.0033223 k( 174) = ( 0.3813362 0.3813362 -0.2760731), wk = 0.0033223 k( 175) = ( 0.3769584 0.3769584 -0.2585373), wk = 0.0033223 k( 176) = ( 0.3725805 0.3725805 -0.2410015), wk = 0.0033223 k( 177) = ( 0.3682026 0.3682026 -0.2234658), wk = 0.0033223 k( 178) = ( 0.3638247 0.3638247 -0.2059300), wk = 0.0033223 k( 179) = ( 0.3594469 0.3594469 -0.1883942), wk = 0.0033223 k( 180) = ( 0.3550690 0.3550690 -0.1708585), wk = 0.0033223 k( 181) = ( 0.3506911 0.3506911 -0.1533227), wk = 0.0033223 k( 182) = ( 0.3463132 0.3463132 -0.1357869), wk = 0.0033223 k( 183) = ( 0.3419354 0.3419354 -0.1182512), wk = 0.0033223 k( 184) = ( 0.3375575 0.3375575 -0.1007154), wk = 0.0033223 k( 185) = ( 0.3331796 0.3331796 -0.0831796), wk = 0.0033223 k( 186) = ( 0.3288017 0.3288017 -0.0656439), wk = 0.0033223 k( 187) = ( 0.3244239 0.3244239 -0.0481081), wk = 0.0033223 k( 188) = ( 0.3200460 0.3200460 -0.0305723), wk = 0.0033223 k( 189) = ( 0.3156681 0.3156681 -0.0130365), wk = 0.0033223 k( 190) = ( 0.3112902 0.3112902 0.0044992), wk = 0.0033223 k( 191) = ( 0.3069124 0.3069124 0.0220350), wk = 0.0033223 k( 192) = ( 0.3025345 0.3025345 0.0395708), wk = 0.0033223 k( 193) = ( 0.2981566 0.2981566 0.0571065), wk = 0.0033223 k( 194) = ( 0.2937787 0.2937787 0.0746423), wk = 0.0033223 k( 195) = ( 0.2894009 0.2894009 0.0921781), wk = 0.0033223 k( 196) = ( 0.2850230 0.2850230 0.1097138), wk = 0.0033223 k( 197) = ( 0.2806451 0.2806451 0.1272496), wk = 0.0033223 k( 198) = ( 0.2762673 0.2762673 0.1447854), wk = 0.0033223 k( 199) = ( 0.2718894 0.2718894 0.1623211), wk = 0.0033223 k( 200) = ( 0.2675115 0.2675115 0.1798569), wk = 0.0033223 k( 201) = ( 0.2631336 0.2631336 0.1973927), wk = 0.0033223 k( 202) = ( 0.2587558 0.2587558 0.2149285), wk = 0.0033223 k( 203) = ( 0.2543779 0.2543779 0.2324642), wk = 0.0033223 k( 204) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 205) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 k( 206) = ( 0.2395833 0.2604167 0.2395833), wk = 0.0033223 k( 207) = ( 0.2291667 0.2708333 0.2291667), wk = 0.0033223 k( 208) = ( 0.2187500 0.2812500 0.2187500), wk = 0.0033223 k( 209) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0033223 k( 210) = ( 0.1979167 0.3020833 0.1979167), wk = 0.0033223 k( 211) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0033223 k( 212) = ( 0.1770833 0.3229167 0.1770833), wk = 0.0033223 k( 213) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0033223 k( 214) = ( 0.1562500 0.3437500 0.1562500), wk = 0.0033223 k( 215) = ( 0.1458333 0.3541667 0.1458333), wk = 0.0033223 k( 216) = ( 0.1354167 0.3645833 0.1354167), wk = 0.0033223 k( 217) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0033223 k( 218) = ( 0.1145833 0.3854167 0.1145833), wk = 0.0033223 k( 219) = ( 0.1041667 0.3958333 0.1041667), wk = 0.0033223 k( 220) = ( 0.0937500 0.4062500 0.0937500), wk = 0.0033223 k( 221) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0033223 k( 222) = ( 0.0729167 0.4270833 0.0729167), wk = 0.0033223 k( 223) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0033223 k( 224) = ( 0.0520833 0.4479167 0.0520833), wk = 0.0033223 k( 225) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0033223 k( 226) = ( 0.0312500 0.4687500 0.0312500), wk = 0.0033223 k( 227) = ( 0.0208333 0.4791667 0.0208333), wk = 0.0033223 k( 228) = ( 0.0104167 0.4895833 0.0104167), wk = 0.0033223 k( 229) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 230) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0033223 k( 231) = ( -0.0138786 0.5027880 0.0138786), wk = 0.0033223 k( 232) = ( -0.0277573 0.5055761 0.0277573), wk = 0.0033223 k( 233) = ( -0.0416359 0.5083641 0.0416359), wk = 0.0033223 k( 234) = ( -0.0555146 0.5111521 0.0555146), wk = 0.0033223 k( 235) = ( -0.0693932 0.5139401 0.0693932), wk = 0.0033223 k( 236) = ( -0.0832718 0.5167282 0.0832718), wk = 0.0033223 k( 237) = ( -0.0971505 0.5195162 0.0971505), wk = 0.0033223 k( 238) = ( -0.1110291 0.5223042 0.1110291), wk = 0.0033223 k( 239) = ( -0.1249078 0.5250922 0.1249078), wk = 0.0033223 k( 240) = ( -0.1387864 0.5278803 0.1387864), wk = 0.0033223 k( 241) = ( -0.1526650 0.5306683 0.1526650), wk = 0.0033223 k( 242) = ( -0.1665437 0.5334563 0.1665437), wk = 0.0033223 k( 243) = ( -0.1804223 0.5362443 0.1804223), wk = 0.0033223 k( 244) = ( -0.1943010 0.5390324 0.1943010), wk = 0.0033223 k( 245) = ( -0.2081796 0.5418204 0.2081796), wk = 0.0033223 k( 246) = ( -0.2220583 0.5446084 0.2220583), wk = 0.0033223 k( 247) = ( -0.2359369 0.5473964 0.2359369), wk = 0.0033223 k( 248) = ( -0.2498155 0.5501845 0.2498155), wk = 0.0033223 k( 249) = ( -0.2636942 0.5529725 0.2636942), wk = 0.0033223 k( 250) = ( -0.2775728 0.5557605 0.2775728), wk = 0.0033223 k( 251) = ( -0.2914515 0.5585485 0.2914515), wk = 0.0033223 k( 252) = ( -0.3053301 0.5613366 0.3053301), wk = 0.0033223 k( 253) = ( -0.3192087 0.5641246 0.3192087), wk = 0.0033223 k( 254) = ( -0.3330874 0.5669126 0.3330874), wk = 0.0033223 k( 255) = ( -0.3469660 0.5697006 0.3469660), wk = 0.0033223 k( 256) = ( -0.3608447 0.5724887 0.3608447), wk = 0.0033223 k( 257) = ( -0.3747233 0.5752767 0.3747233), wk = 0.0033223 k( 258) = ( -0.3886019 0.5780647 0.3886019), wk = 0.0033223 k( 259) = ( -0.4024806 0.5808527 0.4024806), wk = 0.0033223 k( 260) = ( -0.4163592 0.5836408 0.4163592), wk = 0.0033223 k( 261) = ( -0.4163592 0.5836408 0.4163592), wk = 0.0033223 k( 262) = ( -0.4247233 0.5752767 0.4247233), wk = 0.0033223 k( 263) = ( -0.4330874 0.5669126 0.4330874), wk = 0.0033223 k( 264) = ( -0.4414515 0.5585485 0.4414515), wk = 0.0033223 k( 265) = ( -0.4498155 0.5501845 0.4498155), wk = 0.0033223 k( 266) = ( -0.4581796 0.5418204 0.4581796), wk = 0.0033223 k( 267) = ( -0.4665437 0.5334563 0.4665437), wk = 0.0033223 k( 268) = ( -0.4749078 0.5250922 0.4749078), wk = 0.0033223 k( 269) = ( -0.4832719 0.5167282 0.4832718), wk = 0.0033223 k( 270) = ( -0.4916359 0.5083641 0.4916359), wk = 0.0033223 k( 271) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0033223 k( 272) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0033223 k( 273) = ( 0.0086207 0.0086207 0.4913793), wk = 0.0033223 k( 274) = ( 0.0172414 0.0172414 0.4827586), wk = 0.0033223 k( 275) = ( 0.0258621 0.0258621 0.4741379), wk = 0.0033223 k( 276) = ( 0.0344828 0.0344828 0.4655172), wk = 0.0033223 k( 277) = ( 0.0431035 0.0431034 0.4568966), wk = 0.0033223 k( 278) = ( 0.0517241 0.0517241 0.4482759), wk = 0.0033223 k( 279) = ( 0.0603448 0.0603448 0.4396552), wk = 0.0033223 k( 280) = ( 0.0689655 0.0689655 0.4310345), wk = 0.0033223 k( 281) = ( 0.0775862 0.0775862 0.4224138), wk = 0.0033223 k( 282) = ( 0.0862069 0.0862069 0.4137931), wk = 0.0033223 k( 283) = ( 0.0948276 0.0948276 0.4051724), wk = 0.0033223 k( 284) = ( 0.1034483 0.1034483 0.3965517), wk = 0.0033223 k( 285) = ( 0.1120690 0.1120690 0.3879310), wk = 0.0033223 k( 286) = ( 0.1206897 0.1206897 0.3793103), wk = 0.0033223 k( 287) = ( 0.1293103 0.1293103 0.3706897), wk = 0.0033223 k( 288) = ( 0.1379310 0.1379310 0.3620690), wk = 0.0033223 k( 289) = ( 0.1465517 0.1465517 0.3534483), wk = 0.0033223 k( 290) = ( 0.1551724 0.1551724 0.3448276), wk = 0.0033223 k( 291) = ( 0.1637931 0.1637931 0.3362069), wk = 0.0033223 k( 292) = ( 0.1724138 0.1724138 0.3275862), wk = 0.0033223 k( 293) = ( 0.1810345 0.1810345 0.3189655), wk = 0.0033223 k( 294) = ( 0.1896552 0.1896552 0.3103448), wk = 0.0033223 k( 295) = ( 0.1982759 0.1982759 0.3017241), wk = 0.0033223 k( 296) = ( 0.2068966 0.2068966 0.2931035), wk = 0.0033223 k( 297) = ( 0.2155172 0.2155172 0.2844828), wk = 0.0033223 k( 298) = ( 0.2241379 0.2241379 0.2758621), wk = 0.0033223 k( 299) = ( 0.2327586 0.2327586 0.2672414), wk = 0.0033223 k( 300) = ( 0.2413793 0.2413793 0.2586207), wk = 0.0033223 k( 301) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0033223 Dense grid: 133007 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 35503 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 252, 86) NL pseudopotentials 0.39 Mb ( 126, 204) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.03 Mb ( 3696) G-vector shells 0.01 Mb ( 1692) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.32 Mb ( 252, 344) Each subspace H/S matrix 0.11 Mb ( 86, 86) Each matrix 0.54 Mb ( 204, 2, 86) The potential is recalculated from file : ./Tl2Pt.save/charge-density.dat Starting wfc are 108 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.3 secs Computing kpt #: 2 total cpu time spent up to now is 7.3 secs Computing kpt #: 3 total cpu time spent up to now is 8.3 secs Computing kpt #: 4 total cpu time spent up to now is 9.3 secs Computing kpt #: 5 total cpu time spent up to now is 10.3 secs Computing kpt #: 6 total cpu time spent up to now is 11.3 secs Computing kpt #: 7 total cpu time spent up to now is 12.2 secs Computing kpt #: 8 total cpu time spent up to now is 13.4 secs Computing kpt #: 9 total cpu time spent up to now is 14.5 secs Computing kpt #: 10 total cpu time spent up to now is 15.6 secs Computing kpt #: 11 total cpu time spent up to now is 16.8 secs Computing kpt #: 12 total cpu time spent up to now is 18.1 secs Computing kpt #: 13 total cpu time spent up to now is 19.6 secs Computing kpt #: 14 total cpu time spent up to now is 21.4 secs Computing kpt #: 15 total cpu time spent up to now is 22.6 secs Computing kpt #: 16 total cpu time spent up to now is 23.8 secs Computing kpt #: 17 total cpu time spent up to now is 25.1 secs Computing kpt #: 18 total cpu time spent up to now is 26.3 secs Computing kpt #: 19 total cpu time spent up to now is 27.5 secs Computing kpt #: 20 total cpu time spent up to now is 28.8 secs Computing kpt #: 21 total cpu time spent up to now is 30.0 secs Computing kpt #: 22 total cpu time spent up to now is 31.3 secs Computing kpt #: 23 total cpu time spent up to now is 32.9 secs Computing kpt #: 24 total cpu time spent up to now is 34.2 secs Computing kpt #: 25 total cpu time spent up to now is 35.5 secs Computing kpt #: 26 total cpu time spent up to now is 37.1 secs Computing kpt #: 27 total cpu time spent up to now is 38.7 secs Computing kpt #: 28 total cpu time spent up to now is 40.1 secs Computing kpt #: 29 total cpu time spent up to now is 41.5 secs Computing kpt #: 30 total cpu time spent up to now is 43.3 secs Computing kpt #: 31 total cpu time spent up to now is 45.1 secs Computing kpt #: 32 total cpu time spent up to now is 46.7 secs Computing kpt #: 33 total cpu time spent up to now is 48.4 secs Computing kpt #: 34 total cpu time spent up to now is 50.0 secs Computing kpt #: 35 total cpu time spent up to now is 51.6 secs Computing kpt #: 36 total cpu time spent up to now is 53.2 secs Computing kpt #: 37 total cpu time spent up to now is 54.9 secs Computing kpt #: 38 total cpu time spent up to now is 56.5 secs Computing kpt #: 39 total cpu time spent up to now is 58.0 secs Computing kpt #: 40 total cpu time spent up to now is 59.4 secs Computing kpt #: 41 total cpu time spent up to now is 60.7 secs Computing kpt #: 42 total cpu time spent up to now is 62.0 secs Computing kpt #: 43 total cpu time spent up to now is 63.3 secs Computing kpt #: 44 total cpu time spent up to now is 64.6 secs Computing kpt #: 45 total cpu time spent up to now is 65.8 secs Computing kpt #: 46 total cpu time spent up to now is 67.1 secs Computing kpt #: 47 total cpu time spent up to now is 68.3 secs Computing kpt #: 48 total cpu time spent up to now is 69.6 secs Computing kpt #: 49 total cpu time spent up to now is 70.8 secs Computing kpt #: 50 total cpu time spent up to now is 72.1 secs Computing kpt #: 51 total cpu time spent up to now is 73.3 secs Computing kpt #: 52 total cpu time spent up to now is 74.5 secs Computing kpt #: 53 total cpu time spent up to now is 75.7 secs Computing kpt #: 54 total cpu time spent up to now is 76.9 secs Computing kpt #: 55 total cpu time spent up to now is 78.2 secs Computing kpt #: 56 total cpu time spent up to now is 79.5 secs Computing kpt #: 57 total cpu time spent up to now is 80.8 secs Computing kpt #: 58 total cpu time spent up to now is 82.1 secs Computing kpt #: 59 total cpu time spent up to now is 83.3 secs Computing kpt #: 60 total cpu time spent up to now is 84.6 secs Computing kpt #: 61 total cpu time spent up to now is 85.8 secs Computing kpt #: 62 total cpu time spent up to now is 87.1 secs Computing kpt #: 63 total cpu time spent up to now is 88.4 secs Computing kpt #: 64 total cpu time spent up to now is 89.7 secs Computing kpt #: 65 total cpu time spent up to now is 91.0 secs Computing kpt #: 66 total cpu time spent up to now is 92.2 secs Computing kpt #: 67 total cpu time spent up to now is 93.5 secs Computing kpt #: 68 total cpu time spent up to now is 94.7 secs Computing kpt #: 69 total cpu time spent up to now is 95.9 secs Computing kpt #: 70 total cpu time spent up to now is 97.1 secs Computing kpt #: 71 total cpu time spent up to now is 98.4 secs Computing kpt #: 72 total cpu time spent up to now is 100.1 secs Computing kpt #: 73 total cpu time spent up to now is 101.7 secs Computing kpt #: 74 total cpu time spent up to now is 103.4 secs Computing kpt #: 75 total cpu time spent up to now is 104.7 secs Computing kpt #: 76 total cpu time spent up to now is 105.9 secs Computing kpt #: 77 total cpu time spent up to now is 107.1 secs Computing kpt #: 78 total cpu time spent up to now is 108.1 secs Computing kpt #: 79 total cpu time spent up to now is 109.2 secs Computing kpt #: 80 total cpu time spent up to now is 110.4 secs Computing kpt #: 81 total cpu time spent up to now is 111.6 secs Computing kpt #: 82 total cpu time spent up to now is 112.8 secs Computing kpt #: 83 total cpu time spent up to now is 114.1 secs Computing kpt #: 84 total cpu time spent up to now is 115.3 secs Computing kpt #: 85 total cpu time spent up to now is 116.5 secs Computing kpt #: 86 total cpu time spent up to now is 117.8 secs Computing kpt #: 87 total cpu time spent up to now is 119.0 secs Computing kpt #: 88 total cpu time spent up to now is 120.2 secs Computing kpt #: 89 total cpu time spent up to now is 121.4 secs Computing kpt #: 90 total cpu time spent up to now is 122.4 secs Computing kpt #: 91 total cpu time spent up to now is 123.4 secs Computing kpt #: 92 total cpu time spent up to now is 124.4 secs Computing kpt #: 93 total cpu time spent up to now is 125.4 secs Computing kpt #: 94 total cpu time spent up to now is 126.5 secs Computing kpt #: 95 total cpu time spent up to now is 127.4 secs Computing kpt #: 96 total cpu time spent up to now is 128.5 secs Computing kpt #: 97 total cpu time spent up to now is 129.4 secs Computing kpt #: 98 total cpu time spent up to now is 130.4 secs Computing kpt #: 99 total cpu time spent up to now is 131.4 secs Computing kpt #: 100 total cpu time spent up to now is 132.5 secs Computing kpt #: 101 total cpu time spent up to now is 133.5 secs Computing kpt #: 102 total cpu time spent up to now is 134.6 secs Computing kpt #: 103 total cpu time spent up to now is 135.8 secs Computing kpt #: 104 total cpu time spent up to now is 137.0 secs Computing kpt #: 105 total cpu time spent up to now is 138.3 secs Computing kpt #: 106 total cpu time spent up to now is 139.7 secs Computing kpt #: 107 total cpu time spent up to now is 140.9 secs Computing kpt #: 108 total cpu time spent up to now is 142.1 secs Computing kpt #: 109 total cpu time spent up to now is 143.2 secs Computing kpt #: 110 total cpu time spent up to now is 144.2 secs Computing kpt #: 111 total cpu time spent up to now is 145.2 secs Computing kpt #: 112 total cpu time spent up to now is 146.2 secs Computing kpt #: 113 total cpu time spent up to now is 147.1 secs Computing kpt #: 114 total cpu time spent up to now is 148.0 secs Computing kpt #: 115 total cpu time spent up to now is 149.1 secs Computing kpt #: 116 total cpu time spent up to now is 150.0 secs Computing kpt #: 117 total cpu time spent up to now is 151.0 secs Computing kpt #: 118 total cpu time spent up to now is 152.0 secs Computing kpt #: 119 total cpu time spent up to now is 153.0 secs Computing kpt #: 120 total cpu time spent up to now is 154.0 secs Computing kpt #: 121 total cpu time spent up to now is 155.0 secs Computing kpt #: 122 total cpu time spent up to now is 156.0 secs Computing kpt #: 123 total cpu time spent up to now is 157.0 secs Computing kpt #: 124 total cpu time spent up to now is 158.2 secs Computing kpt #: 125 total cpu time spent up to now is 159.4 secs Computing kpt #: 126 total cpu time spent up to now is 160.5 secs Computing kpt #: 127 total cpu time spent up to now is 161.7 secs Computing kpt #: 128 total cpu time spent up to now is 162.9 secs Computing kpt #: 129 total cpu time spent up to now is 164.2 secs Computing kpt #: 130 total cpu time spent up to now is 165.7 secs Computing kpt #: 131 total cpu time spent up to now is 167.2 secs Computing kpt #: 132 total cpu time spent up to now is 168.6 secs Computing kpt #: 133 total cpu time spent up to now is 169.9 secs Computing kpt #: 134 total cpu time spent up to now is 171.2 secs Computing kpt #: 135 total cpu time spent up to now is 172.3 secs Computing kpt #: 136 total cpu time spent up to now is 173.5 secs Computing kpt #: 137 total cpu time spent up to now is 174.5 secs Computing kpt #: 138 total cpu time spent up to now is 175.7 secs Computing kpt #: 139 total cpu time spent up to now is 176.8 secs Computing kpt #: 140 total cpu time spent up to now is 178.0 secs Computing kpt #: 141 total cpu time spent up to now is 179.2 secs Computing kpt #: 142 total cpu time spent up to now is 180.4 secs Computing kpt #: 143 total cpu time spent up to now is 181.7 secs Computing kpt #: 144 total cpu time spent up to now is 183.0 secs Computing kpt #: 145 total cpu time spent up to now is 184.4 secs Computing kpt #: 146 total cpu time spent up to now is 185.7 secs Computing kpt #: 147 total cpu time spent up to now is 187.0 secs Computing kpt #: 148 total cpu time spent up to now is 188.2 secs Computing kpt #: 149 total cpu time spent up to now is 189.7 secs Computing kpt #: 150 total cpu time spent up to now is 191.1 secs Computing kpt #: 151 total cpu time spent up to now is 192.5 secs Computing kpt #: 152 total cpu time spent up to now is 193.7 secs Computing kpt #: 153 total cpu time spent up to now is 195.0 secs Computing kpt #: 154 total cpu time spent up to now is 196.2 secs Computing kpt #: 155 total cpu time spent up to now is 197.4 secs Computing kpt #: 156 total cpu time spent up to now is 198.5 secs Computing kpt #: 157 total cpu time spent up to now is 199.8 secs Computing kpt #: 158 total cpu time spent up to now is 201.0 secs Computing kpt #: 159 total cpu time spent up to now is 202.2 secs Computing kpt #: 160 total cpu time spent up to now is 203.6 secs Computing kpt #: 161 total cpu time spent up to now is 205.2 secs Computing kpt #: 162 total cpu time spent up to now is 206.8 secs Computing kpt #: 163 total cpu time spent up to now is 209.4 secs Computing kpt #: 164 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 212.4 secs Computing kpt #: 165 total cpu time spent up to now is 215.0 secs Computing kpt #: 166 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 218.0 secs Computing kpt #: 167 total cpu time spent up to now is 220.8 secs Computing kpt #: 168 total cpu time spent up to now is 223.4 secs Computing kpt #: 169 total cpu time spent up to now is 225.9 secs Computing kpt #: 170 total cpu time spent up to now is 228.0 secs Computing kpt #: 171 total cpu time spent up to now is 229.8 secs Computing kpt #: 172 total cpu time spent up to now is 231.1 secs Computing kpt #: 173 total cpu time spent up to now is 232.5 secs Computing kpt #: 174 total cpu time spent up to now is 233.8 secs Computing kpt #: 175 total cpu time spent up to now is 235.1 secs Computing kpt #: 176 total cpu time spent up to now is 236.4 secs Computing kpt #: 177 total cpu time spent up to now is 237.7 secs Computing kpt #: 178 total cpu time spent up to now is 238.9 secs Computing kpt #: 179 total cpu time spent up to now is 240.4 secs Computing kpt #: 180 total cpu time spent up to now is 241.6 secs Computing kpt #: 181 total cpu time spent up to now is 242.9 secs Computing kpt #: 182 total cpu time spent up to now is 244.1 secs Computing kpt #: 183 total cpu time spent up to now is 245.4 secs Computing kpt #: 184 total cpu time spent up to now is 246.6 secs Computing kpt #: 185 total cpu time spent up to now is 247.9 secs Computing kpt #: 186 total cpu time spent up to now is 249.2 secs Computing kpt #: 187 total cpu time spent up to now is 250.5 secs Computing kpt #: 188 total cpu time spent up to now is 251.8 secs Computing kpt #: 189 total cpu time spent up to now is 253.1 secs Computing kpt #: 190 total cpu time spent up to now is 254.3 secs Computing kpt #: 191 total cpu time spent up to now is 255.6 secs Computing kpt #: 192 total cpu time spent up to now is 256.9 secs Computing kpt #: 193 total cpu time spent up to now is 258.1 secs Computing kpt #: 194 total cpu time spent up to now is 259.3 secs Computing kpt #: 195 total cpu time spent up to now is 260.5 secs Computing kpt #: 196 total cpu time spent up to now is 261.8 secs Computing kpt #: 197 total cpu time spent up to now is 263.0 secs Computing kpt #: 198 total cpu time spent up to now is 264.2 secs Computing kpt #: 199 total cpu time spent up to now is 265.4 secs Computing kpt #: 200 total cpu time spent up to now is 266.6 secs Computing kpt #: 201 total cpu time spent up to now is 267.8 secs Computing kpt #: 202 total cpu time spent up to now is 269.0 secs Computing kpt #: 203 total cpu time spent up to now is 270.3 secs Computing kpt #: 204 total cpu time spent up to now is 272.5 secs Computing kpt #: 205 total cpu time spent up to now is 275.4 secs Computing kpt #: 206 total cpu time spent up to now is 276.7 secs Computing kpt #: 207 total cpu time spent up to now is 278.1 secs Computing kpt #: 208 total cpu time spent up to now is 279.6 secs Computing kpt #: 209 total cpu time spent up to now is 281.0 secs Computing kpt #: 210 total cpu time spent up to now is 282.4 secs Computing kpt #: 211 total cpu time spent up to now is 283.6 secs Computing kpt #: 212 total cpu time spent up to now is 284.8 secs Computing kpt #: 213 total cpu time spent up to now is 286.1 secs Computing kpt #: 214 total cpu time spent up to now is 287.3 secs Computing kpt #: 215 total cpu time spent up to now is 288.5 secs Computing kpt #: 216 total cpu time spent up to now is 289.8 secs Computing kpt #: 217 total cpu time spent up to now is 291.0 secs Computing kpt #: 218 total cpu time spent up to now is 292.2 secs Computing kpt #: 219 total cpu time spent up to now is 293.5 secs Computing kpt #: 220 total cpu time spent up to now is 294.8 secs Computing kpt #: 221 total cpu time spent up to now is 296.1 secs Computing kpt #: 222 total cpu time spent up to now is 297.4 secs Computing kpt #: 223 total cpu time spent up to now is 298.7 secs Computing kpt #: 224 total cpu time spent up to now is 300.0 secs Computing kpt #: 225 total cpu time spent up to now is 301.4 secs Computing kpt #: 226 total cpu time spent up to now is 302.7 secs Computing kpt #: 227 total cpu time spent up to now is 304.4 secs Computing kpt #: 228 total cpu time spent up to now is 306.4 secs Computing kpt #: 229 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 309.3 secs Computing kpt #: 230 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 312.2 secs Computing kpt #: 231 total cpu time spent up to now is 313.5 secs Computing kpt #: 232 total cpu time spent up to now is 314.7 secs Computing kpt #: 233 total cpu time spent up to now is 315.9 secs Computing kpt #: 234 total cpu time spent up to now is 317.1 secs Computing kpt #: 235 total cpu time spent up to now is 318.3 secs Computing kpt #: 236 total cpu time spent up to now is 319.5 secs Computing kpt #: 237 total cpu time spent up to now is 320.7 secs Computing kpt #: 238 total cpu time spent up to now is 321.9 secs Computing kpt #: 239 total cpu time spent up to now is 323.1 secs Computing kpt #: 240 total cpu time spent up to now is 324.3 secs Computing kpt #: 241 total cpu time spent up to now is 325.5 secs Computing kpt #: 242 total cpu time spent up to now is 326.7 secs Computing kpt #: 243 total cpu time spent up to now is 327.9 secs Computing kpt #: 244 total cpu time spent up to now is 329.0 secs Computing kpt #: 245 total cpu time spent up to now is 330.3 secs Computing kpt #: 246 total cpu time spent up to now is 331.5 secs Computing kpt #: 247 total cpu time spent up to now is 332.7 secs Computing kpt #: 248 total cpu time spent up to now is 333.9 secs Computing kpt #: 249 total cpu time spent up to now is 335.1 secs Computing kpt #: 250 total cpu time spent up to now is 336.3 secs Computing kpt #: 251 total cpu time spent up to now is 337.5 secs Computing kpt #: 252 total cpu time spent up to now is 338.7 secs Computing kpt #: 253 total cpu time spent up to now is 339.9 secs Computing kpt #: 254 total cpu time spent up to now is 341.2 secs Computing kpt #: 255 total cpu time spent up to now is 342.5 secs Computing kpt #: 256 total cpu time spent up to now is 343.8 secs Computing kpt #: 257 total cpu time spent up to now is 345.1 secs Computing kpt #: 258 total cpu time spent up to now is 347.0 secs Computing kpt #: 259 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 350.0 secs Computing kpt #: 260 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 353.1 secs Computing kpt #: 261 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 356.1 secs Computing kpt #: 262 total cpu time spent up to now is 359.0 secs Computing kpt #: 263 total cpu time spent up to now is 361.1 secs Computing kpt #: 264 total cpu time spent up to now is 362.9 secs Computing kpt #: 265 total cpu time spent up to now is 364.7 secs Computing kpt #: 266 total cpu time spent up to now is 366.4 secs Computing kpt #: 267 total cpu time spent up to now is 367.8 secs Computing kpt #: 268 total cpu time spent up to now is 369.1 secs Computing kpt #: 269 total cpu time spent up to now is 370.3 secs Computing kpt #: 270 total cpu time spent up to now is 371.6 secs Computing kpt #: 271 total cpu time spent up to now is 372.8 secs Computing kpt #: 272 total cpu time spent up to now is 374.5 secs Computing kpt #: 273 total cpu time spent up to now is 375.9 secs Computing kpt #: 274 total cpu time spent up to now is 377.2 secs Computing kpt #: 275 total cpu time spent up to now is 378.4 secs Computing kpt #: 276 total cpu time spent up to now is 379.6 secs Computing kpt #: 277 total cpu time spent up to now is 380.9 secs Computing kpt #: 278 total cpu time spent up to now is 382.1 secs Computing kpt #: 279 total cpu time spent up to now is 383.3 secs Computing kpt #: 280 total cpu time spent up to now is 384.5 secs Computing kpt #: 281 total cpu time spent up to now is 385.8 secs Computing kpt #: 282 total cpu time spent up to now is 387.0 secs Computing kpt #: 283 total cpu time spent up to now is 388.2 secs Computing kpt #: 284 total cpu time spent up to now is 389.4 secs Computing kpt #: 285 total cpu time spent up to now is 390.6 secs Computing kpt #: 286 total cpu time spent up to now is 391.8 secs Computing kpt #: 287 total cpu time spent up to now is 393.1 secs Computing kpt #: 288 total cpu time spent up to now is 394.3 secs Computing kpt #: 289 total cpu time spent up to now is 395.5 secs Computing kpt #: 290 total cpu time spent up to now is 396.8 secs Computing kpt #: 291 total cpu time spent up to now is 398.0 secs Computing kpt #: 292 total cpu time spent up to now is 399.3 secs Computing kpt #: 293 total cpu time spent up to now is 400.5 secs Computing kpt #: 294 total cpu time spent up to now is 401.7 secs Computing kpt #: 295 total cpu time spent up to now is 402.9 secs Computing kpt #: 296 total cpu time spent up to now is 404.1 secs Computing kpt #: 297 total cpu time spent up to now is 405.3 secs Computing kpt #: 298 total cpu time spent up to now is 406.5 secs Computing kpt #: 299 total cpu time spent up to now is 407.7 secs Computing kpt #: 300 total cpu time spent up to now is 408.9 secs Computing kpt #: 301 total cpu time spent up to now is 410.3 secs ethr = 1.39E-08, avg # of iterations = 31.7 total cpu time spent up to now is 410.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4479 PWs) bands (ev): 1.0925 1.0925 1.1035 1.1035 1.1083 1.1083 1.1386 1.1386 1.1570 1.1570 1.1902 1.1902 1.1961 1.1961 1.2069 1.2069 3.0921 3.0921 3.1002 3.1002 3.1615 3.1615 3.2079 3.2079 3.2089 3.2089 3.2236 3.2236 3.2622 3.2622 3.2711 3.2711 3.2796 3.2796 3.3753 3.3753 3.4906 3.4906 3.5314 3.5314 3.6015 3.6015 7.5644 7.5644 8.2263 8.2263 8.3863 8.3863 8.7654 8.7654 10.2260 10.2260 10.4696 10.4696 11.1389 11.1389 11.1898 11.1898 11.7148 11.7148 11.8468 11.8468 11.9715 11.9715 12.2239 12.2239 12.6483 12.6483 12.8620 12.8620 13.4638 13.4638 13.6791 13.6791 13.7966 13.7966 14.8266 14.8266 14.9530 14.9530 15.1571 15.1571 16.3124 16.3124 17.6096 17.6096 k = 0.0000 0.0000 0.0175 ( 4479 PWs) bands (ev): 1.0925 1.0925 1.1037 1.1037 1.1082 1.1082 1.1385 1.1385 1.1570 1.1570 1.1903 1.1903 1.1959 1.1959 1.2070 1.2070 3.0932 3.0932 3.1003 3.1003 3.1616 3.1616 3.2059 3.2059 3.2111 3.2111 3.2237 3.2237 3.2616 3.2616 3.2712 3.2712 3.2808 3.2808 3.3751 3.3751 3.4897 3.4897 3.5319 3.5319 3.6018 3.6018 7.5635 7.5635 8.2264 8.2264 8.3863 8.3863 8.7646 8.7646 10.2235 10.2235 10.4698 10.4698 11.1342 11.1342 11.1845 11.1845 11.7103 11.7103 11.8489 11.8489 11.9764 11.9764 12.2172 12.2172 12.6496 12.6496 12.8662 12.8662 13.4587 13.4587 13.6831 13.6831 13.7981 13.7981 14.8289 14.8289 14.9582 14.9582 15.1679 15.1679 16.3196 16.3196 17.6112 17.6112 k = 0.0000 0.0000 0.0350 ( 4483 PWs) bands (ev): 1.0925 1.0925 1.1040 1.1040 1.1080 1.1080 1.1384 1.1384 1.1569 1.1569 1.1904 1.1904 1.1955 1.1955 1.2073 1.2073 3.0964 3.0964 3.1007 3.1007 3.1620 3.1620 3.2036 3.2036 3.2139 3.2139 3.2239 3.2239 3.2601 3.2601 3.2715 3.2715 3.2838 3.2838 3.3744 3.3744 3.4871 3.4871 3.5332 3.5332 3.6026 3.6026 7.5607 7.5607 8.2264 8.2264 8.3861 8.3861 8.7623 8.7623 10.2161 10.2161 10.4706 10.4706 11.1104 11.1104 11.1797 11.1797 11.6987 11.6987 11.8547 11.8547 11.9889 11.9889 12.1983 12.1983 12.6530 12.6530 12.8770 12.8770 13.4443 13.4443 13.6909 13.6909 13.8071 13.8071 14.8321 14.8321 14.9782 14.9782 15.1988 15.1988 16.3408 16.3408 17.6159 17.6159 k = 0.0000 0.0000 0.0525 ( 4487 PWs) bands (ev): 1.0924 1.0924 1.1045 1.1045 1.1076 1.1076 1.1381 1.1381 1.1569 1.1569 1.1906 1.1906 1.1949 1.1949 1.2076 1.2076 3.0992 3.0992 3.1035 3.1035 3.1628 3.1628 3.2013 3.2013 3.2167 3.2167 3.2247 3.2247 3.2587 3.2587 3.2720 3.2720 3.2879 3.2879 3.3733 3.3733 3.4832 3.4832 3.5351 3.5351 3.6039 3.6039 7.5559 7.5559 8.2262 8.2262 8.3862 8.3862 8.7585 8.7585 10.2042 10.2042 10.4718 10.4718 11.0612 11.0612 11.1851 11.1851 11.6828 11.6828 11.8631 11.8631 12.0051 12.0051 12.1704 12.1704 12.6575 12.6575 12.8900 12.8900 13.4239 13.4239 13.6922 13.6922 13.8341 13.8341 14.8308 14.8308 15.0188 15.0188 15.2472 15.2472 16.3757 16.3757 17.6238 17.6238 k = 0.0000 0.0000 0.0700 ( 4491 PWs) bands (ev): 1.0924 1.0924 1.1053 1.1053 1.1070 1.1070 1.1377 1.1377 1.1570 1.1570 1.1906 1.1906 1.1944 1.1944 1.2079 1.2079 3.0998 3.0998 3.1098 3.1098 3.1643 3.1643 3.1990 3.1990 3.2188 3.2188 3.2272 3.2272 3.2577 3.2577 3.2726 3.2726 3.2925 3.2925 3.3718 3.3718 3.4785 3.4785 3.5371 3.5371 3.6056 3.6056 7.5488 7.5488 8.2251 8.2251 8.3869 8.3869 8.7533 8.7533 10.1878 10.1878 10.4733 10.4733 10.9948 10.9948 11.1971 11.1971 11.6646 11.6646 11.8730 11.8730 12.0208 12.0208 12.1378 12.1378 12.6622 12.6622 12.8983 12.8983 13.4023 13.4023 13.6828 13.6828 13.8835 13.8835 14.8252 14.8252 15.0791 15.0791 15.3111 15.3111 16.4233 16.4233 17.6350 17.6350 k = 0.0000 0.0000 0.0875 ( 4495 PWs) bands (ev): 1.0923 1.0923 1.1060 1.1060 1.1065 1.1065 1.1371 1.1371 1.1573 1.1573 1.1901 1.1901 1.1943 1.1943 1.2082 1.2082 3.1001 3.1001 3.1167 3.1167 3.1666 3.1666 3.1971 3.1971 3.2198 3.2198 3.2324 3.2324 3.2573 3.2573 3.2735 3.2735 3.2973 3.2973 3.3700 3.3700 3.4731 3.4731 3.5390 3.5390 3.6078 3.6078 7.5390 7.5390 8.2224 8.2224 8.3888 8.3888 8.7469 8.7469 10.1675 10.1675 10.4749 10.4749 10.9190 10.9190 11.2121 11.2121 11.6446 11.6446 11.8835 11.8835 12.0325 12.0325 12.1065 12.1065 12.6666 12.6666 12.8949 12.8949 13.3835 13.3835 13.6681 13.6681 13.9509 13.9509 14.8180 14.8180 15.1542 15.1542 15.3896 15.3896 16.4826 16.4826 17.6496 17.6496 k = 0.0000 0.0000 0.1049 ( 4487 PWs) bands (ev): 1.0923 1.0923 1.1056 1.1056 1.1074 1.1074 1.1362 1.1362 1.1578 1.1578 1.1893 1.1893 1.1945 1.1945 1.2084 1.2084 3.1004 3.1004 3.1228 3.1228 3.1697 3.1697 3.1958 3.1958 3.2206 3.2206 3.2399 3.2399 3.2582 3.2582 3.2745 3.2745 3.3020 3.3020 3.3681 3.3681 3.4676 3.4676 3.5407 3.5407 3.6103 3.6103 7.5261 7.5261 8.2174 8.2174 8.3928 8.3928 8.7395 8.7395 10.1434 10.1434 10.4764 10.4764 10.8391 10.8391 11.2280 11.2280 11.6231 11.6231 11.8926 11.8926 12.0350 12.0350 12.0854 12.0854 12.6703 12.6703 12.8758 12.8758 13.3673 13.3673 13.6555 13.6555 14.0306 14.0306 14.8113 14.8113 15.2395 15.2395 15.4827 15.4827 16.5525 16.5525 17.6677 17.6677 k = 0.0000 0.0000 0.1224 ( 4473 PWs) bands (ev): 1.0922 1.0922 1.1048 1.1048 1.1087 1.1087 1.1352 1.1352 1.1586 1.1586 1.1881 1.1881 1.1949 1.1949 1.2086 1.2086 3.1007 3.1007 3.1271 3.1271 3.1724 3.1724 3.1958 3.1958 3.2216 3.2216 3.2483 3.2483 3.2625 3.2625 3.2759 3.2759 3.3065 3.3065 3.3660 3.3660 3.4620 3.4620 3.5422 3.5422 3.6131 3.6131 7.5094 7.5094 8.2094 8.2094 8.3992 8.3992 8.7315 8.7315 10.1160 10.1160 10.4773 10.4773 10.7596 10.7596 11.2423 11.2423 11.6004 11.6004 11.8977 11.8977 12.0262 12.0262 12.0813 12.0813 12.6732 12.6732 12.8419 12.8419 13.3483 13.3483 13.6517 13.6517 14.1188 14.1188 14.8064 14.8064 15.3311 15.3311 15.5903 15.5903 16.6319 16.6319 17.6897 17.6897 k = 0.0000 0.0000 0.1399 ( 4477 PWs) bands (ev): 1.0921 1.0921 1.1040 1.1040 1.1101 1.1101 1.1339 1.1339 1.1595 1.1595 1.1868 1.1868 1.1954 1.1954 1.2086 1.2086 3.1010 3.1010 3.1297 3.1297 3.1732 3.1732 3.1972 3.1972 3.2233 3.2233 3.2529 3.2529 3.2732 3.2732 3.2801 3.2801 3.3104 3.3104 3.3642 3.3642 3.4566 3.4566 3.5433 3.5433 3.6160 3.6160 7.4883 7.4883 8.1978 8.1978 8.4087 8.4087 8.7232 8.7232 10.0856 10.0856 10.4769 10.4769 10.6845 10.6845 11.2525 11.2525 11.5778 11.5778 11.8961 11.8961 12.0197 12.0197 12.0851 12.0851 12.6747 12.6747 12.7979 12.7979 13.3205 13.3205 13.6597 13.6597 14.2126 14.2126 14.8040 14.8040 15.4260 15.4260 15.7123 15.7123 16.7193 16.7193 17.7156 17.7156 k = 0.0000 0.0000 0.1574 ( 4479 PWs) bands (ev): 1.0919 1.0919 1.1032 1.1032 1.1117 1.1117 1.1326 1.1326 1.1605 1.1605 1.1854 1.1854 1.1958 1.1958 1.2085 1.2085 3.1012 3.1012 3.1311 3.1311 3.1722 3.1722 3.1991 3.1991 3.2256 3.2256 3.2548 3.2548 3.2771 3.2771 3.2990 3.2990 3.3138 3.3138 3.3630 3.3630 3.4516 3.4516 3.5442 3.5442 3.6192 3.6192 7.4618 7.4618 8.1826 8.1826 8.4213 8.4213 8.7151 8.7151 10.0525 10.0525 10.4735 10.4735 10.6174 10.6174 11.2555 11.2555 11.5571 11.5571 11.8880 11.8880 12.0224 12.0224 12.0902 12.0902 12.6731 12.6731 12.7509 12.7509 13.2823 13.2823 13.6778 13.6778 14.3097 14.3097 14.8045 14.8045 15.5219 15.5219 15.8481 15.8481 16.8136 16.8136 17.7458 17.7458 k = 0.0000 0.0000 0.1749 ( 4475 PWs) bands (ev): 1.0916 1.0916 1.1025 1.1025 1.1133 1.1133 1.1314 1.1314 1.1615 1.1615 1.1841 1.1841 1.1961 1.1961 1.2083 1.2083 3.1013 3.1013 3.1318 3.1318 3.1701 3.1701 3.2006 3.2006 3.2284 3.2284 3.2561 3.2561 3.2787 3.2787 3.3128 3.3128 3.3289 3.3289 3.3630 3.3630 3.4472 3.4472 3.5448 3.5448 3.6224 3.6224 7.4290 7.4290 8.1641 8.1641 8.4370 8.4370 8.7077 8.7077 10.0175 10.0175 10.4626 10.4626 10.5642 10.5642 11.2489 11.2489 11.5400 11.5400 11.8770 11.8770 12.0325 12.0325 12.0950 12.0950 12.6606 12.6606 12.7138 12.7138 13.2352 13.2352 13.7013 13.7013 14.4082 14.4082 14.8082 14.8082 15.6166 15.6166 15.9967 15.9967 16.9134 16.9134 17.7803 17.7803 k = 0.0000 0.0000 0.1924 ( 4475 PWs) bands (ev): 1.0913 1.0913 1.1018 1.1018 1.1149 1.1149 1.1302 1.1302 1.1626 1.1626 1.1829 1.1829 1.1963 1.1963 1.2080 1.2080 3.1012 3.1012 3.1325 3.1325 3.1675 3.1675 3.2015 3.2015 3.2312 3.2312 3.2573 3.2573 3.2801 3.2801 3.3132 3.3132 3.3548 3.3548 3.3698 3.3698 3.4437 3.4437 3.5452 3.5452 3.6258 3.6258 7.3891 7.3891 8.1428 8.1428 8.4557 8.4557 8.7015 8.7015 9.9811 9.9811 10.4375 10.4375 10.5319 10.5319 11.2320 11.2320 11.5269 11.5269 11.8661 11.8661 12.0464 12.0464 12.0993 12.0993 12.6274 12.6274 12.7004 12.7004 13.1819 13.1819 13.7257 13.7257 14.5066 14.5066 14.8154 14.8154 15.7080 15.7080 16.1563 16.1563 17.0171 17.0171 17.8191 17.8191 k = 0.0000 0.0000 0.2099 ( 4465 PWs) bands (ev): 1.0909 1.0909 1.1011 1.1011 1.1164 1.1164 1.1293 1.1293 1.1635 1.1635 1.1818 1.1818 1.1964 1.1964 1.2076 1.2076 3.1007 3.1007 3.1333 3.1333 3.1649 3.1649 3.2019 3.2019 3.2339 3.2339 3.2586 3.2586 3.2813 3.2813 3.3116 3.3116 3.3607 3.3607 3.4019 3.4019 3.4416 3.4416 3.5456 3.5456 3.6295 3.6295 7.3411 7.3411 8.1196 8.1196 8.4771 8.4771 8.6967 8.6967 9.9444 9.9444 10.4014 10.4014 10.5175 10.5175 11.2065 11.2065 11.5159 11.5159 11.8565 11.8565 12.0615 12.0615 12.1034 12.1034 12.5893 12.5893 12.6982 12.6982 13.1248 13.1248 13.7480 13.7480 14.6032 14.6032 14.8267 14.8267 15.7940 15.7940 16.3248 16.3248 17.1229 17.1229 17.8607 17.8607 k = 0.0000 0.0000 0.2274 ( 4461 PWs) bands (ev): 1.0905 1.0905 1.1006 1.1006 1.1177 1.1177 1.1288 1.1288 1.1641 1.1641 1.1810 1.1810 1.1963 1.1963 1.2071 1.2071 3.0999 3.0999 3.1346 3.1346 3.1623 3.1623 3.2020 3.2020 3.2362 3.2362 3.2599 3.2599 3.2823 3.2823 3.3088 3.3088 3.3625 3.3625 3.4357 3.4357 3.4467 3.4467 3.5462 3.5462 3.6337 3.6337 7.2845 7.2845 8.0954 8.0954 8.5010 8.5010 8.6937 8.6937 9.9081 9.9081 10.3642 10.3642 10.5102 10.5102 11.1755 11.1755 11.5038 11.5038 11.8483 11.8483 12.0755 12.0755 12.1080 12.1080 12.5578 12.5578 12.6987 12.6987 13.0657 13.0657 13.7663 13.7663 14.6949 14.6949 14.8440 14.8440 15.8726 15.8726 16.4988 16.4988 17.2284 17.2284 17.8974 17.8974 k = 0.0000 0.0000 0.2449 ( 4453 PWs) bands (ev): 1.0900 1.0900 1.1001 1.1001 1.1186 1.1186 1.1289 1.1289 1.1645 1.1645 1.1804 1.1804 1.1960 1.1960 1.2066 1.2066 3.0988 3.0988 3.1363 3.1363 3.1599 3.1599 3.2017 3.2017 3.2380 3.2380 3.2613 3.2613 3.2828 3.2828 3.3054 3.3054 3.3638 3.3638 3.4394 3.4394 3.4848 3.4848 3.5483 3.5483 3.6392 3.6392 7.2187 7.2187 8.0712 8.0712 8.5272 8.5272 8.6925 8.6925 9.8731 9.8731 10.3304 10.3304 10.5045 10.5045 11.1421 11.1421 11.4878 11.4878 11.8411 11.8411 12.0865 12.0865 12.1144 12.1144 12.5369 12.5369 12.6999 12.6999 13.0059 13.0059 13.7797 13.7797 14.7736 14.7736 14.8744 14.8744 15.9415 15.9415 16.6736 16.6736 17.3311 17.3311 17.9123 17.9123 k = 0.0000 0.0000 0.2624 ( 4455 PWs) bands (ev): 1.0895 1.0895 1.0996 1.0996 1.1189 1.1189 1.1297 1.1297 1.1644 1.1644 1.1800 1.1800 1.1957 1.1957 1.2060 1.2060 3.0974 3.0974 3.1384 3.1384 3.1579 3.1579 3.2012 3.2012 3.2389 3.2389 3.2628 3.2628 3.2824 3.2824 3.3022 3.3022 3.3646 3.3646 3.4415 3.4415 3.5185 3.5185 3.5579 3.5579 3.6483 3.6483 7.1439 7.1439 8.0476 8.0476 8.5555 8.5555 8.6931 8.6931 9.8399 9.8399 10.3012 10.3012 10.4982 10.4982 11.1089 11.1089 11.4657 11.4657 11.8344 11.8344 12.0933 12.0933 12.1227 12.1227 12.5281 12.5281 12.7009 12.7009 12.9472 12.9472 13.7879 13.7879 14.8242 14.8242 14.9317 14.9317 15.9987 15.9987 16.8409 16.8409 17.4305 17.4305 17.9300 17.9300 k = 0.0000 0.0000 0.2799 ( 4465 PWs) bands (ev): 1.0890 1.0890 1.0993 1.0993 1.1187 1.1187 1.1311 1.1311 1.1641 1.1641 1.1798 1.1798 1.1952 1.1952 1.2055 1.2055 3.0958 3.0958 3.1407 3.1407 3.1565 3.1565 3.2005 3.2005 3.2390 3.2390 3.2643 3.2643 3.2809 3.2809 3.3000 3.3000 3.3648 3.3648 3.4450 3.4450 3.5309 3.5309 3.5828 3.5828 3.6670 3.6670 7.0604 7.0604 8.0252 8.0252 8.5858 8.5858 8.6954 8.6954 9.8087 9.8087 10.2767 10.2767 10.4902 10.4902 11.0781 11.0781 11.4370 11.4370 11.8280 11.8280 12.0969 12.0969 12.1315 12.1315 12.5313 12.5313 12.7006 12.7006 12.8917 12.8917 13.7910 13.7910 14.8529 14.8529 15.0085 15.0085 16.0424 16.0424 16.9883 16.9883 17.5330 17.5330 17.9784 17.9784 k = 0.0000 0.0000 0.2974 ( 4469 PWs) bands (ev): 1.0886 1.0886 1.0990 1.0990 1.1183 1.1183 1.1329 1.1329 1.1634 1.1634 1.1796 1.1796 1.1946 1.1946 1.2050 1.2050 3.0941 3.0941 3.1427 3.1427 3.1560 3.1560 3.1997 3.1997 3.2379 3.2379 3.2657 3.2657 3.2786 3.2786 3.2989 3.2989 3.3646 3.3646 3.4497 3.4497 3.5329 3.5329 3.6033 3.6033 3.7038 3.7038 6.9688 6.9688 8.0045 8.0045 8.6179 8.6179 8.6993 8.6993 9.7796 9.7796 10.2566 10.2566 10.4800 10.4800 11.0510 11.0510 11.4019 11.4019 11.8220 11.8220 12.0987 12.0987 12.1388 12.1388 12.5445 12.5445 12.6960 12.6960 12.8438 12.8438 13.7896 13.7896 14.8743 14.8743 15.0890 15.0890 16.0715 16.0715 17.1014 17.1014 17.6531 17.6531 18.0607 18.0607 k = 0.0000 0.0000 0.3148 ( 4456 PWs) bands (ev): 1.0881 1.0881 1.0989 1.0989 1.1177 1.1177 1.1350 1.1350 1.1626 1.1626 1.1793 1.1793 1.1940 1.1940 1.2047 1.2047 3.0925 3.0925 3.1439 3.1439 3.1571 3.1571 3.1986 3.1986 3.2356 3.2356 3.2666 3.2666 3.2764 3.2764 3.2987 3.2987 3.3639 3.3639 3.4556 3.4556 3.5325 3.5325 3.6132 3.6132 3.7568 3.7568 6.8700 6.8700 7.9855 7.9855 8.6514 8.6514 8.7045 8.7045 9.7523 9.7523 10.2406 10.2406 10.4675 10.4675 11.0283 11.0283 11.3614 11.3614 11.8165 11.8165 12.0996 12.0996 12.1438 12.1438 12.5646 12.5646 12.6802 12.6802 12.8125 12.8125 13.7841 13.7841 14.8929 14.8929 15.1674 15.1674 16.0853 16.0853 17.1768 17.1768 17.7994 17.7994 18.1713 18.1713 k = 0.0000 0.0000 0.3323 ( 4452 PWs) bands (ev): 1.0878 1.0878 1.0988 1.0988 1.1171 1.1171 1.1372 1.1372 1.1615 1.1615 1.1788 1.1788 1.1934 1.1934 1.2046 1.2046 3.0910 3.0910 3.1441 3.1441 3.1597 3.1597 3.1973 3.1973 3.2320 3.2320 3.2665 3.2665 3.2753 3.2753 3.2989 3.2989 3.3630 3.3630 3.4623 3.4623 3.5313 3.5313 3.6176 3.6176 3.8191 3.8191 6.7651 6.7651 7.9683 7.9683 8.6855 8.6855 8.7117 8.7117 9.7264 9.7264 10.2284 10.2284 10.4527 10.4527 11.0106 11.0106 11.3170 11.3170 11.8115 11.8115 12.0998 12.0998 12.1462 12.1462 12.5867 12.5867 12.6486 12.6486 12.8056 12.8056 13.7753 13.7753 14.9098 14.9098 15.2418 15.2418 16.0839 16.0839 17.2261 17.2261 17.9648 17.9648 18.3041 18.3041 k = 0.0000 0.0000 0.3498 ( 4454 PWs) bands (ev): 1.0874 1.0874 1.0988 1.0988 1.1165 1.1165 1.1395 1.1395 1.1604 1.1604 1.1780 1.1780 1.1926 1.1926 1.2047 1.2047 3.0897 3.0897 3.1438 3.1438 3.1635 3.1635 3.1958 3.1958 3.2272 3.2272 3.2656 3.2656 3.2755 3.2755 3.2993 3.2993 3.3620 3.3620 3.4696 3.4696 3.5297 3.5297 3.6196 3.6196 3.8874 3.8874 6.6551 6.6551 7.9528 7.9528 8.7112 8.7112 8.7294 8.7294 9.7014 9.7014 10.2197 10.2197 10.4360 10.4360 10.9976 10.9976 11.2704 11.2704 11.8069 11.8069 12.0995 12.0995 12.1459 12.1459 12.5934 12.5934 12.6192 12.6192 12.8206 12.8206 13.7640 13.7640 14.9249 14.9249 15.3112 15.3112 16.0683 16.0683 17.2643 17.2643 18.1355 18.1355 18.4544 18.4544 k = 0.0000 0.0000 0.3673 ( 4450 PWs) bands (ev): 1.0872 1.0872 1.0989 1.0989 1.1159 1.1159 1.1419 1.1419 1.1591 1.1591 1.1771 1.1771 1.1918 1.1918 1.2051 1.2051 3.0887 3.0887 3.1433 3.1433 3.1678 3.1678 3.1942 3.1942 3.2215 3.2215 3.2644 3.2644 3.2763 3.2763 3.2998 3.2998 3.3610 3.3610 3.4774 3.4774 3.5278 3.5278 3.6201 3.6201 3.9605 3.9605 6.5410 6.5410 7.9388 7.9388 8.7208 8.7208 8.7648 8.7648 9.6769 9.6769 10.2141 10.2141 10.4181 10.4181 10.9890 10.9890 11.2230 11.2230 11.8028 11.8028 12.0986 12.0986 12.1432 12.1432 12.5517 12.5517 12.6296 12.6296 12.8517 12.8517 13.7509 13.7509 14.9381 14.9381 15.3751 15.3751 16.0399 16.0399 17.3019 17.3019 18.3016 18.3016 18.6132 18.6132 k = 0.0000 0.0000 0.3848 ( 4444 PWs) bands (ev): 1.0870 1.0870 1.0992 1.0992 1.1153 1.1153 1.1442 1.1442 1.1578 1.1578 1.1759 1.1759 1.1908 1.1908 1.2056 1.2056 3.0880 3.0880 3.1428 3.1428 3.1723 3.1723 3.1925 3.1925 3.2155 3.2155 3.2633 3.2633 3.2773 3.2773 3.3003 3.3003 3.3601 3.3601 3.4855 3.4855 3.5258 3.5258 3.6196 3.6196 4.0376 4.0376 6.4238 6.4238 7.9264 7.9264 8.7283 8.7283 8.8036 8.8036 9.6523 9.6523 10.2114 10.2114 10.3995 10.3995 10.9843 10.9843 11.1764 11.1764 11.7991 11.7991 12.0970 12.0970 12.1385 12.1385 12.5040 12.5040 12.6401 12.6401 12.8945 12.8945 13.7368 13.7368 14.9493 14.9493 15.4330 15.4330 16.0009 16.0009 17.3449 17.3449 18.4598 18.4598 18.7632 18.7632 k = 0.0000 0.0000 0.4023 ( 4450 PWs) bands (ev): 1.0868 1.0868 1.0997 1.0997 1.1147 1.1147 1.1465 1.1465 1.1564 1.1564 1.1747 1.1747 1.1897 1.1897 1.2063 1.2063 3.0875 3.0875 3.1424 3.1424 3.1765 3.1765 3.1907 3.1907 3.2095 3.2095 3.2622 3.2622 3.2782 3.2782 3.3007 3.3007 3.3593 3.3593 3.4938 3.4938 3.5238 3.5238 3.6183 3.6183 4.1186 4.1186 6.3042 6.3042 7.9154 7.9154 8.7353 8.7353 8.8438 8.8438 9.6270 9.6270 10.2110 10.2110 10.3810 10.3810 10.9826 10.9826 11.1317 11.1317 11.7955 11.7955 12.0944 12.0944 12.1327 12.1327 12.4571 12.4571 12.6468 12.6468 12.9451 12.9451 13.7224 13.7224 14.9584 14.9584 15.4845 15.4845 15.9541 15.9541 17.3964 17.3964 18.6107 18.6107 18.8874 18.8874 k = 0.0000 0.0000 0.4198 ( 4456 PWs) bands (ev): 1.0867 1.0867 1.1003 1.1003 1.1142 1.1142 1.1487 1.1487 1.1549 1.1549 1.1735 1.1735 1.1885 1.1885 1.2071 1.2071 3.0874 3.0874 3.1422 3.1422 3.1793 3.1793 3.1893 3.1893 3.2044 3.2044 3.2610 3.2610 3.2790 3.2790 3.3010 3.3010 3.3586 3.3586 3.5020 3.5020 3.5219 3.5219 3.6163 3.6163 4.2032 4.2032 6.1830 6.1830 7.9056 7.9056 8.7419 8.7419 8.8849 8.8849 9.6009 9.6009 10.2126 10.2126 10.3631 10.3631 10.9833 10.9833 11.0901 11.0901 11.7919 11.7919 12.0903 12.0903 12.1268 12.1268 12.4121 12.4121 12.6505 12.6505 13.0002 13.0002 13.7081 13.7081 14.9655 14.9655 15.5291 15.5291 15.9026 15.9026 17.4575 17.4575 18.7547 18.7547 18.9948 18.9948 k = 0.0000 0.0000 0.4373 ( 4460 PWs) bands (ev): 1.0865 1.0865 1.1010 1.1010 1.1137 1.1137 1.1505 1.1505 1.1535 1.1535 1.1723 1.1723 1.1872 1.1872 1.2079 1.2079 3.0876 3.0876 3.1422 3.1422 3.1792 3.1792 3.1886 3.1886 3.2017 3.2017 3.2597 3.2597 3.2797 3.2797 3.3013 3.3013 3.3581 3.3581 3.5098 3.5098 3.5205 3.5205 3.6138 3.6138 4.2912 4.2912 6.0609 6.0609 7.8971 7.8971 8.7481 8.7481 8.9268 8.9268 9.5735 9.5735 10.2156 10.2156 10.3462 10.3462 10.9854 10.9854 11.0526 11.0526 11.7883 11.7883 12.0842 12.0842 12.1220 12.1220 12.3697 12.3697 12.6523 12.6523 13.0571 13.0571 13.6945 13.6945 14.9707 14.9707 15.5656 15.5656 15.8502 15.8502 17.5282 17.5282 18.8887 18.8887 19.1025 19.1025 k = 0.0000 0.0000 0.4548 ( 4456 PWs) bands (ev): 1.0865 1.0865 1.1019 1.1019 1.1132 1.1132 1.1506 1.1506 1.1538 1.1538 1.1714 1.1714 1.1858 1.1858 1.2087 1.2087 3.0882 3.0882 3.1424 3.1424 3.1762 3.1762 3.1872 3.1872 3.2029 3.2029 3.2582 3.2582 3.2802 3.2802 3.3015 3.3015 3.3578 3.3578 3.5145 3.5145 3.5223 3.5223 3.6106 3.6106 4.3826 4.3826 5.9385 5.9385 7.8897 7.8897 8.7536 8.7536 8.9691 8.9691 9.5448 9.5448 10.2196 10.2196 10.3308 10.3308 10.9875 10.9875 11.0208 11.0208 11.7844 11.7844 12.0764 12.0764 12.1190 12.1190 12.3301 12.3301 12.6528 12.6528 13.1137 13.1137 13.6819 13.6819 14.9741 14.9741 15.5916 15.5916 15.8021 15.8021 17.6077 17.6077 19.0056 19.0056 19.2191 19.2191 k = 0.0000 0.0000 0.4723 ( 4456 PWs) bands (ev): 1.0864 1.0864 1.1030 1.1030 1.1127 1.1127 1.1492 1.1492 1.1554 1.1554 1.1706 1.1706 1.1843 1.1843 1.2095 1.2095 3.0890 3.0890 3.1427 3.1427 3.1718 3.1718 3.1851 3.1851 3.2066 3.2066 3.2565 3.2565 3.2806 3.2806 3.3016 3.3016 3.3576 3.3576 3.5143 3.5143 3.5290 3.5290 3.6069 3.6069 4.4773 4.4773 5.8162 5.8162 7.8834 7.8834 8.7585 8.7585 9.0116 9.0116 9.5146 9.5146 10.2241 10.2241 10.3168 10.3168 10.9817 10.9817 11.0022 11.0022 11.7804 11.7804 12.0678 12.0678 12.1177 12.1177 12.2935 12.2935 12.6525 12.6525 13.1681 13.1681 13.6707 13.6707 14.9760 14.9760 15.6020 15.6020 15.7659 15.7659 17.6945 17.6945 19.0956 19.0956 19.3477 19.3477 k = 0.0000 0.0000 0.4898 ( 4458 PWs) bands (ev): 1.0864 1.0864 1.1041 1.1041 1.1122 1.1122 1.1475 1.1475 1.1571 1.1571 1.1701 1.1701 1.1828 1.1828 1.2102 1.2102 3.0900 3.0900 3.1431 3.1431 3.1670 3.1670 3.1830 3.1830 3.2112 3.2112 3.2544 3.2544 3.2810 3.2810 3.3017 3.3017 3.3574 3.3574 3.5130 3.5130 3.5369 3.5369 3.6028 3.6028 4.5750 4.5750 5.6946 5.6946 7.8781 7.8781 8.7627 8.7627 9.0538 9.0538 9.4830 9.4830 10.2289 10.2289 10.3043 10.3043 10.9628 10.9628 11.0020 11.0020 11.7762 11.7762 12.0595 12.0595 12.1180 12.1180 12.2603 12.2603 12.6518 12.6518 13.2184 13.2184 13.6611 13.6611 14.9766 14.9766 15.5917 15.5917 15.7493 15.7493 17.7863 17.7863 19.1493 19.1493 19.4827 19.4827 k = 0.0000 0.0000 0.5073 ( 4452 PWs) bands (ev): 1.0863 1.0863 1.1053 1.1053 1.1117 1.1117 1.1459 1.1459 1.1586 1.1586 1.1699 1.1699 1.1814 1.1814 1.2108 1.2108 3.0911 3.0911 3.1436 3.1436 3.1624 3.1624 3.1811 3.1811 3.2160 3.2160 3.2521 3.2521 3.2812 3.2812 3.3018 3.3018 3.3574 3.3574 3.5117 3.5117 3.5447 3.5447 3.5981 3.5981 4.6758 4.6758 5.5740 5.5740 7.8738 7.8738 8.7662 8.7662 9.0954 9.0954 9.4505 9.4505 10.2338 10.2338 10.2932 10.2932 10.9453 10.9453 11.0051 11.0051 11.7720 11.7720 12.0525 12.0525 12.1197 12.1197 12.2306 12.2306 12.6510 12.6510 13.2628 13.2628 13.6531 13.6531 14.9763 14.9763 15.5665 15.5665 15.7489 15.7489 17.8799 17.8799 19.1579 19.1579 19.6010 19.6010 k = 0.0000 0.0000 0.5247 ( 4452 PWs) bands (ev): 1.0863 1.0863 1.1064 1.1064 1.1113 1.1113 1.1444 1.1444 1.1598 1.1598 1.1701 1.1701 1.1799 1.1799 1.2113 1.2113 3.0922 3.0922 3.1442 3.1442 3.1582 3.1582 3.1796 3.1796 3.2207 3.2207 3.2495 3.2495 3.2814 3.2814 3.3019 3.3019 3.3574 3.3574 3.5106 3.5106 3.5523 3.5523 3.5931 3.5931 4.7794 4.7794 5.4547 5.4547 7.8705 7.8705 8.7690 8.7690 9.1354 9.1354 9.4176 9.4176 10.2388 10.2388 10.2835 10.2835 10.9320 10.9320 11.0082 11.0082 11.7682 11.7682 12.0471 12.0471 12.1230 12.1230 12.2046 12.2046 12.6502 12.6502 13.2995 13.2995 13.6468 13.6468 14.9754 14.9754 15.5381 15.5381 15.7549 15.7549 17.9702 17.9702 19.1237 19.1237 19.6575 19.6575 k = 0.0000 0.0000 0.5422 ( 4462 PWs) bands (ev): 1.0863 1.0863 1.1075 1.1075 1.1107 1.1107 1.1433 1.1433 1.1606 1.1606 1.1705 1.1705 1.1786 1.1786 1.2117 1.2117 3.0932 3.0932 3.1448 3.1448 3.1549 3.1549 3.1785 3.1785 3.2249 3.2249 3.2468 3.2468 3.2816 3.2816 3.3019 3.3019 3.3574 3.3574 3.5098 3.5098 3.5595 3.5595 3.5876 3.5876 4.8857 4.8857 5.3371 5.3371 7.8681 7.8681 8.7709 8.7709 9.1721 9.1721 9.3861 9.3861 10.2438 10.2438 10.2750 10.2750 10.9229 10.9229 11.0106 11.0106 11.7651 11.7651 12.0435 12.0435 12.1281 12.1281 12.1826 12.1826 12.6496 12.6496 13.3271 13.3271 13.6423 13.6423 14.9743 14.9743 15.5144 15.5144 15.7614 15.7614 18.0494 18.0494 19.0684 19.0684 19.6806 19.6806 k = 0.0000 0.0000 0.5597 ( 4464 PWs) bands (ev): 1.0863 1.0863 1.1085 1.1085 1.1101 1.1101 1.1426 1.1426 1.1611 1.1611 1.1709 1.1709 1.1777 1.1777 1.2119 1.2119 3.0938 3.0938 3.1454 3.1454 3.1527 3.1527 3.1778 3.1778 3.2282 3.2282 3.2444 3.2444 3.2816 3.2816 3.3019 3.3019 3.3574 3.3574 3.5093 3.5093 3.5661 3.5661 3.5822 3.5822 4.9943 4.9943 5.2216 5.2216 7.8667 7.8667 8.7721 8.7721 9.2012 9.2012 9.3601 9.3601 10.2486 10.2486 10.2681 10.2681 10.9176 10.9176 11.0121 11.0121 11.7631 11.7631 12.0414 12.0414 12.1351 12.1351 12.1651 12.1651 12.6492 12.6492 13.3442 13.3442 13.6397 13.6397 14.9735 14.9735 15.4990 15.4990 15.7659 15.7659 18.1059 18.1059 19.0200 19.0200 19.6962 19.6962 k = 0.0000 0.0000 0.5772 ( 4464 PWs) bands (ev): 1.0863 1.0863 1.1093 1.1093 1.1094 1.1094 1.1423 1.1423 1.1612 1.1612 1.1711 1.1711 1.1773 1.1773 1.2120 1.2120 3.0940 3.0940 3.1456 3.1456 3.1519 3.1519 3.1775 3.1775 3.2296 3.2296 3.2433 3.2433 3.2817 3.2817 3.3019 3.3019 3.3574 3.3574 3.5091 3.5091 3.5698 3.5698 3.5789 3.5789 5.0919 5.0919 5.1217 5.1217 7.8662 7.8662 8.7725 8.7725 9.2135 9.2135 9.3488 9.3488 10.2511 10.2511 10.2649 10.2649 10.9158 10.9158 11.0126 11.0126 11.7624 11.7624 12.0408 12.0408 12.1407 12.1407 12.1560 12.1560 12.6490 12.6490 13.3500 13.3500 13.6388 13.6388 14.9731 14.9731 15.4938 15.4938 15.7674 15.7674 18.1268 18.1268 19.0008 19.0008 19.7020 19.7020 k = 0.0000 0.0000 0.5772 ( 4464 PWs) bands (ev): 1.0863 1.0863 1.1093 1.1093 1.1094 1.1094 1.1423 1.1423 1.1612 1.1612 1.1711 1.1711 1.1773 1.1773 1.2120 1.2120 3.0940 3.0940 3.1456 3.1456 3.1519 3.1519 3.1775 3.1775 3.2296 3.2296 3.2433 3.2433 3.2817 3.2817 3.3019 3.3019 3.3574 3.3574 3.5091 3.5091 3.5698 3.5698 3.5789 3.5789 5.0919 5.0919 5.1217 5.1217 7.8662 7.8662 8.7725 8.7725 9.2135 9.2135 9.3488 9.3488 10.2511 10.2511 10.2649 10.2649 10.9158 10.9158 11.0126 11.0126 11.7624 11.7624 12.0408 12.0408 12.1407 12.1407 12.1560 12.1560 12.6490 12.6490 13.3500 13.3500 13.6388 13.6388 14.9731 14.9731 15.4938 15.4938 15.7674 15.7674 18.1268 18.1268 19.0008 19.0008 19.7020 19.7020 k =-0.0152 0.0087 0.5772 ( 4468 PWs) bands (ev): 1.0863 1.0863 1.1091 1.1091 1.1095 1.1095 1.1423 1.1423 1.1607 1.1607 1.1717 1.1717 1.1773 1.1773 1.2119 1.2119 3.0941 3.0941 3.1451 3.1451 3.1520 3.1520 3.1774 3.1774 3.2298 3.2298 3.2434 3.2434 3.2815 3.2815 3.3021 3.3021 3.3570 3.3570 3.5096 3.5096 3.5692 3.5692 3.5795 3.5795 5.0939 5.0939 5.1232 5.1232 7.8671 7.8671 8.7716 8.7716 9.2105 9.2105 9.3489 9.3489 10.2505 10.2505 10.2631 10.2631 10.9051 10.9051 11.0123 11.0123 11.7573 11.7573 12.0338 12.0338 12.0939 12.0939 12.2256 12.2256 12.6495 12.6495 13.3287 13.3287 13.6380 13.6380 14.9970 14.9970 15.5034 15.5034 15.7695 15.7695 18.1190 18.1190 19.0043 19.0043 19.7062 19.7062 k =-0.0303 0.0175 0.5772 ( 4482 PWs) bands (ev): 1.0864 1.0864 1.1087 1.1087 1.1095 1.1095 1.1423 1.1423 1.1595 1.1595 1.1731 1.1731 1.1775 1.1775 1.2117 1.2117 3.0943 3.0943 3.1437 3.1437 3.1521 3.1521 3.1772 3.1772 3.2302 3.2302 3.2439 3.2439 3.2810 3.2810 3.3028 3.3028 3.3559 3.3559 3.5111 3.5111 3.5678 3.5678 3.5809 3.5809 5.0997 5.0997 5.1275 5.1275 7.8696 7.8696 8.7691 8.7691 9.2013 9.2013 9.3492 9.3492 10.2486 10.2486 10.2579 10.2579 10.8760 10.8760 11.0087 11.0087 11.7421 11.7421 12.0126 12.0126 12.0710 12.0710 12.3162 12.3162 12.6510 12.6510 13.2687 13.2687 13.6363 13.6363 15.0645 15.0645 15.5318 15.5318 15.7760 15.7760 18.0968 18.0968 19.0139 19.0139 19.7177 19.7177 k =-0.0455 0.0262 0.5772 ( 4486 PWs) bands (ev): 1.0866 1.0866 1.1083 1.1083 1.1093 1.1093 1.1423 1.1423 1.1579 1.1579 1.1750 1.1750 1.1778 1.1778 1.2113 1.2113 3.0947 3.0947 3.1419 3.1419 3.1520 3.1520 3.1768 3.1768 3.2309 3.2309 3.2446 3.2446 3.2801 3.2801 3.3040 3.3040 3.3543 3.3543 3.5135 3.5135 3.5660 3.5660 3.5829 3.5829 5.1093 5.1093 5.1347 5.1347 7.8738 7.8738 8.7648 8.7648 9.1862 9.1862 9.3495 9.3495 10.2454 10.2454 10.2488 10.2488 10.8338 10.8338 10.9983 10.9983 11.7180 11.7180 11.9927 11.9927 12.0645 12.0645 12.4160 12.4160 12.6539 12.6539 13.1795 13.1795 13.6350 13.6350 15.1657 15.1657 15.5768 15.5768 15.7883 15.7883 18.0628 18.0628 19.0284 19.0284 19.7325 19.7325 k =-0.0606 0.0350 0.5772 ( 4482 PWs) bands (ev): 1.0869 1.0869 1.1077 1.1077 1.1091 1.1091 1.1423 1.1423 1.1564 1.1564 1.1771 1.1771 1.1783 1.1783 1.2108 1.2108 3.0951 3.0951 3.1398 3.1398 3.1515 3.1515 3.1763 3.1763 3.2316 3.2316 3.2458 3.2458 3.2787 3.2787 3.3057 3.3057 3.3526 3.3526 3.5163 3.5163 3.5639 3.5639 3.5853 3.5853 5.1227 5.1227 5.1450 5.1450 7.8796 7.8796 8.7589 8.7589 9.1650 9.1650 9.3499 9.3499 10.2353 10.2353 10.2413 10.2413 10.7823 10.7823 10.9800 10.9800 11.6896 11.6896 11.9799 11.9799 12.0632 12.0632 12.5200 12.5200 12.6593 12.6593 13.0728 13.0728 13.6361 13.6361 15.2893 15.2893 15.6342 15.6342 15.8100 15.8100 18.0204 18.0204 19.0461 19.0461 19.7440 19.7440 k =-0.0758 0.0437 0.5772 ( 4482 PWs) bands (ev): 1.0871 1.0871 1.1071 1.1071 1.1088 1.1088 1.1420 1.1420 1.1551 1.1551 1.1788 1.1788 1.1793 1.1793 1.2103 1.2103 3.0956 3.0956 3.1376 3.1376 3.1505 3.1505 3.1757 3.1757 3.2321 3.2321 3.2475 3.2475 3.2767 3.2767 3.3079 3.3079 3.3511 3.3511 3.5195 3.5195 3.5616 3.5616 3.5880 3.5880 5.1397 5.1397 5.1584 5.1584 7.8869 7.8869 8.7511 8.7511 9.1378 9.1378 9.3503 9.3503 10.2171 10.2171 10.2357 10.2357 10.7245 10.7245 10.9544 10.9544 11.6618 11.6618 11.9682 11.9682 12.0653 12.0653 12.6124 12.6124 12.6786 12.6786 12.9610 12.9610 13.6414 13.6414 15.4243 15.4243 15.6954 15.6954 15.8497 15.8497 17.9737 17.9737 19.0655 19.0655 19.7437 19.7437 k =-0.0909 0.0524 0.5772 ( 4476 PWs) bands (ev): 1.0874 1.0874 1.1064 1.1064 1.1084 1.1084 1.1416 1.1416 1.1540 1.1540 1.1795 1.1795 1.1814 1.1814 1.2096 1.2096 3.0960 3.0960 3.1354 3.1354 3.1492 3.1492 3.1751 3.1751 3.2323 3.2323 3.2496 3.2496 3.2739 3.2739 3.3108 3.3108 3.3501 3.3501 3.5226 3.5226 3.5592 3.5592 3.5910 3.5910 5.1598 5.1598 5.1755 5.1755 7.8957 7.8957 8.7415 8.7415 9.1048 9.1048 9.3506 9.3506 10.1935 10.1935 10.2289 10.2289 10.6625 10.6625 10.9236 10.9236 11.6375 11.6375 11.9503 11.9503 12.0704 12.0704 12.6379 12.6379 12.7496 12.7496 12.8682 12.8682 13.6530 13.6530 15.5594 15.5594 15.7493 15.7493 15.9202 15.9202 17.9267 17.9267 19.0855 19.0855 19.7254 19.7254 k =-0.1061 0.0612 0.5772 ( 4472 PWs) bands (ev): 1.0876 1.0876 1.1056 1.1056 1.1080 1.1080 1.1410 1.1410 1.1532 1.1532 1.1804 1.1804 1.1835 1.1835 1.2090 1.2090 3.0963 3.0963 3.1331 3.1331 3.1474 3.1474 3.1746 3.1746 3.2321 3.2321 3.2519 3.2519 3.2704 3.2704 3.3145 3.3145 3.3499 3.3499 3.5255 3.5255 3.5567 3.5567 3.5943 3.5943 5.1820 5.1820 5.1972 5.1972 7.9058 7.9058 8.7300 8.7300 9.0660 9.0660 9.3509 9.3509 10.1637 10.1637 10.2205 10.2205 10.5985 10.5985 10.8899 10.8899 11.6172 11.6172 11.9213 11.9213 12.0774 12.0774 12.6155 12.6155 12.7484 12.7484 12.9047 12.9047 13.6728 13.6728 15.6794 15.6794 15.8001 15.8001 16.0248 16.0248 17.8833 17.8833 19.1053 19.1053 19.6892 19.6892 k =-0.1212 0.0699 0.5772 ( 4464 PWs) bands (ev): 1.0877 1.0877 1.1049 1.1049 1.1076 1.1076 1.1400 1.1400 1.1527 1.1527 1.1813 1.1813 1.1855 1.1855 1.2083 1.2083 3.0963 3.0963 3.1309 3.1309 3.1453 3.1453 3.1744 3.1744 3.2316 3.2316 3.2539 3.2539 3.2668 3.2668 3.3189 3.3189 3.3506 3.3506 3.5280 3.5280 3.5542 3.5542 3.5978 3.5978 5.2056 5.2056 5.2243 5.2243 7.9171 7.9171 8.7164 8.7164 9.0216 9.0216 9.3509 9.3509 10.1273 10.1273 10.2102 10.2102 10.5344 10.5344 10.8558 10.8558 11.6002 11.6002 11.8783 11.8783 12.0845 12.0845 12.5520 12.5520 12.7277 12.7277 13.0157 13.0157 13.7022 13.7022 15.7609 15.7609 15.8720 15.8720 16.1558 16.1558 17.8475 17.8475 19.1239 19.1239 19.6406 19.6406 k =-0.1364 0.0787 0.5772 ( 4462 PWs) bands (ev): 1.0877 1.0877 1.1040 1.1040 1.1074 1.1074 1.1390 1.1390 1.1524 1.1524 1.1825 1.1825 1.1872 1.1872 1.2077 1.2077 3.0962 3.0962 3.1286 3.1286 3.1428 3.1428 3.1746 3.1746 3.2307 3.2307 3.2540 3.2540 3.2647 3.2647 3.3239 3.3239 3.3520 3.3520 3.5299 3.5299 3.5516 3.5516 3.6014 3.6014 5.2307 5.2307 5.2566 5.2566 7.9294 7.9294 8.7007 8.7007 8.9719 8.9719 9.3507 9.3507 10.0843 10.0843 10.1973 10.1973 10.4722 10.4722 10.8230 10.8230 11.5837 11.5837 11.8208 11.8208 12.0906 12.0906 12.4777 12.4777 12.7278 12.7278 13.1336 13.1336 13.7425 13.7425 15.8082 15.8082 15.9627 15.9627 16.3045 16.3045 17.8237 17.8237 19.1394 19.1394 19.5867 19.5867 k =-0.1515 0.0874 0.5772 ( 4454 PWs) bands (ev): 1.0875 1.0875 1.1032 1.1032 1.1073 1.1073 1.1377 1.1377 1.1523 1.1523 1.1838 1.1838 1.1887 1.1887 1.2073 1.2073 3.0958 3.0958 3.1262 3.1262 3.1401 3.1401 3.1754 3.1754 3.2293 3.2293 3.2509 3.2509 3.2657 3.2657 3.3295 3.3295 3.3543 3.3543 3.5313 3.5313 3.5490 3.5490 3.6050 3.6050 5.2581 5.2581 5.2935 5.2935 7.9425 7.9425 8.6827 8.6827 8.9172 8.9172 9.3502 9.3502 10.0349 10.0349 10.1805 10.1805 10.4137 10.4137 10.7931 10.7931 11.5617 11.5617 11.7542 11.7542 12.0953 12.0953 12.4134 12.4134 12.7342 12.7342 13.2520 13.2520 13.7941 13.7941 15.8464 15.8464 16.0483 16.0483 16.4631 16.4631 17.8159 17.8159 19.1489 19.1489 19.5347 19.5347 k =-0.1667 0.0961 0.5772 ( 4458 PWs) bands (ev): 1.0870 1.0870 1.1023 1.1023 1.1074 1.1074 1.1365 1.1365 1.1521 1.1521 1.1852 1.1852 1.1900 1.1900 1.2070 1.2070 3.0952 3.0952 3.1236 3.1236 3.1371 3.1371 3.1768 3.1768 3.2271 3.2271 3.2465 3.2465 3.2684 3.2684 3.3355 3.3355 3.3575 3.3575 3.5321 3.5321 3.5464 3.5464 3.6086 3.6086 5.2880 5.2880 5.3345 5.3345 7.9559 7.9559 8.6620 8.6620 8.8579 8.8579 9.3491 9.3491 9.9801 9.9801 10.1582 10.1582 10.3610 10.3610 10.7668 10.7668 11.5206 11.5206 11.6948 11.6948 12.0987 12.0987 12.3628 12.3628 12.7420 12.7420 13.3690 13.3690 13.8571 13.8571 15.8852 15.8852 16.1197 16.1197 16.6258 16.6258 17.8282 17.8282 19.1475 19.1475 19.4919 19.4919 k =-0.1818 0.1049 0.5772 ( 4458 PWs) bands (ev): 1.0864 1.0864 1.1014 1.1014 1.1077 1.1077 1.1353 1.1353 1.1519 1.1519 1.1867 1.1867 1.1908 1.1908 1.2070 1.2070 3.0944 3.0944 3.1208 3.1208 3.1339 3.1339 3.1788 3.1788 3.2237 3.2237 3.2425 3.2425 3.2715 3.2715 3.3415 3.3415 3.3615 3.3615 3.5323 3.5323 3.5439 3.5439 3.6120 3.6120 5.3205 5.3205 5.3795 5.3795 7.9691 7.9691 8.6385 8.6385 8.7950 8.7950 9.3475 9.3475 9.9210 9.9210 10.1287 10.1287 10.3160 10.3160 10.7442 10.7442 11.4469 11.4469 11.6604 11.6604 12.1009 12.1009 12.3239 12.3239 12.7496 12.7496 13.4832 13.4832 13.9311 13.9311 15.9275 15.9275 16.1736 16.1736 16.7883 16.7883 17.8631 17.8631 19.1298 19.1298 19.4645 19.4645 k =-0.1970 0.1136 0.5772 ( 4464 PWs) bands (ev): 1.0855 1.0855 1.1005 1.1005 1.1082 1.1082 1.1341 1.1341 1.1516 1.1516 1.1884 1.1884 1.1913 1.1913 1.2074 1.2074 3.0934 3.0934 3.1178 3.1178 3.1305 3.1305 3.1813 3.1813 3.2188 3.2188 3.2396 3.2396 3.2748 3.2748 3.3474 3.3474 3.3665 3.3665 3.5320 3.5320 3.5414 3.5414 3.6153 3.6153 5.3558 5.3558 5.4284 5.4284 7.9815 7.9815 8.6118 8.6118 8.7294 8.7294 9.3450 9.3450 9.8593 9.8593 10.0914 10.0914 10.2789 10.2789 10.7253 10.7253 11.3495 11.3495 11.6470 11.6470 12.1022 12.1022 12.2937 12.2937 12.7561 12.7561 13.5937 13.5937 14.0149 14.0149 15.9749 15.9749 16.2094 16.2094 16.9474 16.9474 17.9216 17.9216 19.0944 19.0944 19.4541 19.4541 k =-0.2121 0.1224 0.5772 ( 4450 PWs) bands (ev): 1.0846 1.0846 1.0996 1.0996 1.1089 1.1089 1.1329 1.1329 1.1511 1.1511 1.1902 1.1902 1.1915 1.1915 1.2080 1.2080 3.0923 3.0923 3.1148 3.1148 3.1271 3.1271 3.1844 3.1844 3.2130 3.2130 3.2379 3.2379 3.2782 3.2782 3.3528 3.3528 3.3724 3.3724 3.5312 3.5312 3.5391 3.5391 3.6182 3.6182 5.3938 5.3938 5.4811 5.4811 7.9918 7.9918 8.5812 8.5812 8.6629 8.6629 9.3414 9.3414 9.7964 9.7964 10.0478 10.0478 10.2479 10.2479 10.7096 10.7096 11.2433 11.2433 11.6438 11.6438 12.1030 12.1030 12.2697 12.2697 12.7614 12.7614 13.6998 13.6998 14.1072 14.1072 16.0281 16.0281 16.2285 16.2285 17.1004 17.1004 18.0027 18.0027 19.0452 19.0452 19.4558 19.4558 k =-0.2273 0.1311 0.5772 ( 4448 PWs) bands (ev): 1.0835 1.0835 1.0986 1.0986 1.1096 1.1096 1.1319 1.1319 1.1505 1.1505 1.1912 1.1912 1.1923 1.1923 1.2089 1.2089 3.0911 3.0911 3.1119 3.1119 3.1235 3.1235 3.1876 3.1876 3.2066 3.2066 3.2368 3.2368 3.2817 3.2817 3.3579 3.3579 3.3791 3.3791 3.5302 3.5302 3.5367 3.5367 3.6208 3.6208 5.4347 5.4347 5.5375 5.5375 7.9985 7.9985 8.5456 8.5456 8.5982 8.5982 9.3363 9.3363 9.7339 9.7339 10.0003 10.0003 10.2201 10.2201 10.6968 10.6968 11.1367 11.1367 11.6458 11.6458 12.1033 12.1033 12.2501 12.2501 12.7653 12.7653 13.8006 13.8006 14.2063 14.2063 16.0867 16.0867 16.2348 16.2348 17.2453 17.2453 18.1035 18.1035 18.9879 18.9879 19.4629 19.4629 k =-0.2424 0.1398 0.5772 ( 4428 PWs) bands (ev): 1.0824 1.0824 1.0977 1.0977 1.1104 1.1104 1.1310 1.1310 1.1497 1.1497 1.1910 1.1910 1.1942 1.1942 1.2099 1.2099 3.0897 3.0897 3.1090 3.1090 3.1199 3.1199 3.1901 3.1901 3.2010 3.2010 3.2363 3.2363 3.2852 3.2852 3.3627 3.3627 3.3864 3.3864 3.5290 3.5290 3.5343 3.5343 3.6230 3.6230 5.4783 5.4783 5.5975 5.5975 7.9990 7.9990 8.5035 8.5035 8.5392 8.5392 9.3292 9.3292 9.6733 9.6733 9.9513 9.9513 10.1924 10.1924 10.6864 10.6864 11.0347 11.0347 11.6508 11.6508 12.1032 12.1032 12.2336 12.2336 12.7681 12.7681 13.8958 13.8958 14.3104 14.3104 16.1461 16.1461 16.2376 16.2376 17.3804 17.3804 18.2201 18.2201 18.9270 18.9270 19.4705 19.4705 k =-0.2576 0.1486 0.5772 ( 4426 PWs) bands (ev): 1.0812 1.0812 1.0969 1.0969 1.1112 1.1112 1.1302 1.1302 1.1488 1.1488 1.1906 1.1906 1.1962 1.1962 1.2111 1.2111 3.0882 3.0882 3.1064 3.1064 3.1162 3.1162 3.1883 3.1883 3.1997 3.1997 3.2361 3.2361 3.2887 3.2887 3.3672 3.3672 3.3939 3.3939 3.5277 3.5277 3.5318 3.5318 3.6248 3.6248 5.5248 5.5248 5.6609 5.6609 7.9896 7.9896 8.4572 8.4572 8.4875 8.4875 9.3190 9.3190 9.6163 9.6163 9.9023 9.9023 10.1627 10.1627 10.6779 10.6779 10.9407 10.9407 11.6577 11.6577 12.1029 12.1029 12.2194 12.2194 12.7698 12.7698 13.9849 13.9849 14.4175 14.4175 16.1789 16.1789 16.2688 16.2688 17.5042 17.5042 18.3481 18.3481 18.8654 18.8654 19.4766 19.4766 k =-0.2727 0.1573 0.5772 ( 4432 PWs) bands (ev): 1.0800 1.0800 1.0961 1.0961 1.1120 1.1120 1.1295 1.1295 1.1478 1.1478 1.1901 1.1901 1.1982 1.1982 1.2122 1.2122 3.0865 3.0865 3.1040 3.1040 3.1126 3.1126 3.1825 3.1825 3.2026 3.2026 3.2360 3.2360 3.2922 3.2922 3.3716 3.3716 3.4014 3.4014 3.5266 3.5266 3.5291 3.5291 3.6262 3.6262 5.5740 5.5740 5.7277 5.7277 7.9662 7.9662 8.4160 8.4160 8.4378 8.4378 9.3049 9.3049 9.5646 9.5646 9.8544 9.8544 10.1295 10.1295 10.6711 10.6711 10.8570 10.8570 11.6659 11.6659 12.1024 12.1024 12.2072 12.2072 12.7707 12.7707 14.0675 14.0675 14.5259 14.5259 16.1745 16.1745 16.3434 16.3434 17.6158 17.6158 18.4825 18.4825 18.8058 18.8058 19.4814 19.4814 k =-0.2879 0.1661 0.5772 ( 4442 PWs) bands (ev): 1.0789 1.0789 1.0953 1.0953 1.1126 1.1126 1.1289 1.1289 1.1467 1.1467 1.1895 1.1895 1.2002 1.2002 1.2134 1.2134 3.0847 3.0847 3.1020 3.1020 3.1090 3.1090 3.1758 3.1758 3.2064 3.2064 3.2362 3.2362 3.2958 3.2958 3.3759 3.3759 3.4087 3.4087 3.5254 3.5254 3.5266 3.5266 3.6273 3.6273 5.6261 5.6261 5.7978 5.7978 7.9258 7.9258 8.3820 8.3820 8.3909 8.3909 9.2854 9.2854 9.5199 9.5199 9.8083 9.8083 10.0918 10.0918 10.6655 10.6655 10.7851 10.7851 11.6751 11.6751 12.1017 12.1017 12.1965 12.1965 12.7709 12.7709 14.1431 14.1431 14.6332 14.6332 16.1621 16.1621 16.4360 16.4360 17.7147 17.7147 18.6128 18.6128 18.7552 18.7552 19.4860 19.4860 k =-0.3030 0.1748 0.5772 ( 4450 PWs) bands (ev): 1.0777 1.0777 1.0947 1.0947 1.1132 1.1132 1.1284 1.1284 1.1456 1.1456 1.1889 1.1889 1.2021 1.2021 1.2146 1.2146 3.0828 3.0828 3.1003 3.1003 3.1055 3.1055 3.1691 3.1691 3.2105 3.2105 3.2365 3.2365 3.2995 3.2995 3.3802 3.3802 3.4155 3.4155 3.5228 3.5228 3.5258 3.5258 3.6279 3.6279 5.6810 5.6810 5.8709 5.8709 7.8686 7.8686 8.3271 8.3271 8.3748 8.3748 9.2599 9.2599 9.4833 9.4833 9.7646 9.7646 10.0500 10.0500 10.6608 10.6608 10.7257 10.7257 11.6850 11.6850 12.1008 12.1008 12.1871 12.1871 12.7705 12.7705 14.2117 14.2117 14.7372 14.7372 16.1525 16.1525 16.5396 16.5396 17.8011 17.8011 18.6610 18.6610 18.7877 18.7877 19.4928 19.4928 k =-0.3182 0.1835 0.5772 ( 4454 PWs) bands (ev): 1.0767 1.0767 1.0941 1.0941 1.1136 1.1136 1.1279 1.1279 1.1445 1.1445 1.1884 1.1884 1.2040 1.2040 1.2158 1.2158 3.0809 3.0809 3.0988 3.0988 3.1021 3.1021 3.1626 3.1626 3.2144 3.2144 3.2369 3.2369 3.3032 3.3032 3.3844 3.3844 3.4216 3.4216 3.5196 3.5196 3.5258 3.5258 3.6282 3.6282 5.7385 5.7385 5.9470 5.9470 7.7977 7.7977 8.2654 8.2654 8.3725 8.3725 9.2288 9.2288 9.4547 9.4547 9.7236 9.7236 10.0050 10.0050 10.6555 10.6555 10.6793 10.6793 11.6952 11.6952 12.0996 12.0996 12.1788 12.1788 12.7696 12.7696 14.2731 14.2731 14.8350 14.8350 16.1510 16.1510 16.6521 16.6521 17.8755 17.8755 18.6176 18.6176 18.9075 18.9075 19.5045 19.5045 k =-0.3333 0.1923 0.5772 ( 4452 PWs) bands (ev): 1.0757 1.0757 1.0936 1.0936 1.1138 1.1138 1.1275 1.1275 1.1435 1.1435 1.1879 1.1879 1.2059 1.2059 1.2169 1.2169 3.0790 3.0790 3.0973 3.0973 3.0992 3.0992 3.1564 3.1564 3.2181 3.2181 3.2375 3.2375 3.3070 3.3070 3.3885 3.3885 3.4270 3.4270 3.5162 3.5162 3.5264 3.5264 3.6283 3.6283 5.7988 5.7988 6.0257 6.0257 7.7172 7.7172 8.1984 8.1984 8.3787 8.3787 9.1938 9.1938 9.4325 9.4325 9.6858 9.6858 9.9583 9.9583 10.6359 10.6359 10.6583 10.6583 11.7057 11.7057 12.0982 12.0982 12.1717 12.1717 12.7685 12.7685 14.3276 14.3276 14.9237 14.9237 16.1616 16.1616 16.7725 16.7725 17.9387 17.9387 18.5680 18.5680 19.0214 19.0214 19.5251 19.5251 k =-0.3485 0.2010 0.5772 ( 4460 PWs) bands (ev): 1.0748 1.0748 1.0932 1.0932 1.1140 1.1140 1.1271 1.1271 1.1426 1.1426 1.1874 1.1874 1.2076 1.2076 1.2180 1.2180 3.0774 3.0774 3.0948 3.0948 3.0975 3.0975 3.1505 3.1505 3.2216 3.2216 3.2381 3.2381 3.3108 3.3108 3.3925 3.3925 3.4316 3.4316 3.5127 3.5127 3.5277 3.5277 3.6280 3.6280 5.8617 5.8617 6.1068 6.1068 7.6303 7.6303 8.1265 8.1265 8.3904 8.3904 9.1571 9.1571 9.4146 9.4146 9.6514 9.6514 9.9119 9.9119 10.6083 10.6083 10.6545 10.6545 11.7162 11.7162 12.0966 12.0966 12.1655 12.1655 12.7672 12.7672 14.3754 14.3754 15.0002 15.0002 16.1879 16.1879 16.8994 16.8994 17.9917 17.9917 18.5204 18.5204 19.1125 19.1125 19.5565 19.5565 k =-0.3636 0.2098 0.5772 ( 4460 PWs) bands (ev): 1.0740 1.0740 1.0928 1.0928 1.1141 1.1141 1.1266 1.1266 1.1418 1.1418 1.1869 1.1869 1.2092 1.2092 1.2190 1.2190 3.0759 3.0759 3.0920 3.0920 3.0964 3.0964 3.1451 3.1451 3.2247 3.2247 3.2389 3.2389 3.3147 3.3147 3.3963 3.3963 3.4352 3.4352 3.5092 3.5092 3.5294 3.5294 3.6274 3.6274 5.9272 5.9272 6.1901 6.1901 7.5395 7.5395 8.0499 8.0499 8.4052 8.4052 9.1206 9.1206 9.3992 9.3992 9.6209 9.6209 9.8673 9.8673 10.5864 10.5864 10.6524 10.6524 11.7265 11.7265 12.0947 12.0947 12.1603 12.1603 12.7657 12.7657 14.4170 14.4170 15.0624 15.0624 16.2322 16.2322 17.0316 17.0316 18.0352 18.0352 18.4762 18.4762 19.1715 19.1715 19.5609 19.5609 k =-0.3788 0.2185 0.5772 ( 4462 PWs) bands (ev): 1.0732 1.0732 1.0926 1.0926 1.1141 1.1141 1.1260 1.1260 1.1412 1.1412 1.1865 1.1865 1.2107 1.2107 1.2199 1.2199 3.0747 3.0747 3.0893 3.0893 3.0955 3.0955 3.1401 3.1401 3.2273 3.2273 3.2397 3.2397 3.3185 3.3185 3.3999 3.3999 3.4379 3.4379 3.5058 3.5058 3.5317 3.5317 3.6267 3.6267 5.9950 5.9950 6.2750 6.2750 7.4464 7.4464 7.9693 7.9693 8.4218 8.4218 9.0858 9.0858 9.3851 9.3851 9.5945 9.5945 9.8259 9.8259 10.5697 10.5697 10.6509 10.6509 11.7365 11.7365 12.0926 12.0926 12.1559 12.1559 12.7642 12.7642 14.4528 14.4528 15.1096 15.1096 16.2951 16.2951 17.1670 17.1670 18.0698 18.0698 18.4362 18.4362 19.1927 19.1927 19.4552 19.4552 k =-0.3939 0.2272 0.5772 ( 4452 PWs) bands (ev): 1.0726 1.0726 1.0924 1.0924 1.1141 1.1141 1.1254 1.1254 1.1408 1.1408 1.1861 1.1861 1.2120 1.2120 1.2207 1.2207 3.0737 3.0737 3.0867 3.0867 3.0946 3.0946 3.1357 3.1357 3.2296 3.2296 3.2406 3.2406 3.3223 3.3223 3.4033 3.4033 3.4397 3.4397 3.5025 3.5025 3.5344 3.5344 3.6259 3.6259 6.0651 6.0651 6.3611 6.3611 7.3524 7.3524 7.8856 7.8856 8.4388 8.4388 9.0536 9.0536 9.3716 9.3716 9.5722 9.5722 9.7887 9.7887 10.5570 10.5570 10.6498 10.6498 11.7459 11.7459 12.0903 12.0903 12.1523 12.1523 12.7628 12.7628 14.4832 14.4832 15.1427 15.1427 16.3749 16.3749 17.3033 17.3033 18.0956 18.0956 18.4016 18.4016 19.1614 19.1614 19.3649 19.3649 k =-0.4091 0.2360 0.5772 ( 4442 PWs) bands (ev): 1.0721 1.0721 1.0923 1.0923 1.1140 1.1140 1.1246 1.1246 1.1405 1.1405 1.1858 1.1858 1.2132 1.2132 1.2215 1.2215 3.0731 3.0731 3.0844 3.0844 3.0937 3.0937 3.1319 3.1319 3.2315 3.2315 3.2415 3.2415 3.3259 3.3259 3.4063 3.4063 3.4409 3.4409 3.4995 3.4995 3.5372 3.5372 3.6249 3.6249 6.1370 6.1370 6.4476 6.4476 7.2586 7.2586 7.8001 7.8001 8.4555 8.4555 9.0247 9.0247 9.3586 9.3586 9.5540 9.5540 9.7561 9.7561 10.5474 10.5474 10.6490 10.6490 11.7545 11.7545 12.0880 12.0880 12.1495 12.1495 12.7614 12.7614 14.5087 14.5087 15.1641 15.1641 16.4680 16.4680 17.4369 17.4369 18.1118 18.1118 18.3747 18.3747 19.0719 19.0719 19.3245 19.3245 k =-0.4242 0.2447 0.5772 ( 4438 PWs) bands (ev): 1.0716 1.0716 1.0923 1.0923 1.1140 1.1140 1.1239 1.1239 1.1404 1.1404 1.1855 1.1855 1.2142 1.2142 1.2221 1.2221 3.0727 3.0727 3.0823 3.0823 3.0928 3.0928 3.1287 3.1287 3.2329 3.2329 3.2424 3.2424 3.3292 3.3292 3.4090 3.4090 3.4415 3.4415 3.4967 3.4967 3.5400 3.5400 3.6239 3.6239 6.2103 6.2103 6.5332 6.5332 7.1661 7.1661 7.7142 7.7142 8.4710 8.4710 8.9995 8.9995 9.3461 9.3461 9.5397 9.5397 9.7284 9.7284 10.5403 10.5403 10.6484 10.6484 11.7622 11.7622 12.0857 12.0857 12.1472 12.1472 12.7601 12.7601 14.5296 14.5296 15.1766 15.1766 16.5698 16.5698 17.5625 17.5625 18.1170 18.1170 18.3595 18.3595 18.9625 18.9625 19.3054 19.3054 k =-0.4394 0.2535 0.5772 ( 4438 PWs) bands (ev): 1.0712 1.0712 1.0922 1.0922 1.1139 1.1139 1.1232 1.1232 1.1403 1.1403 1.1852 1.1852 1.2150 1.2150 1.2227 1.2227 3.0726 3.0726 3.0805 3.0805 3.0919 3.0919 3.1262 3.1262 3.2340 3.2340 3.2433 3.2433 3.3322 3.3322 3.4112 3.4112 3.4417 3.4417 3.4944 3.4944 3.5426 3.5426 3.6230 3.6230 6.2842 6.2842 6.6161 6.6161 7.0762 7.0762 7.6302 7.6302 8.4848 8.4848 8.9785 8.9785 9.3347 9.3347 9.5288 9.5288 9.7059 9.7059 10.5351 10.5351 10.6479 10.6479 11.7688 11.7688 12.0836 12.0836 12.1455 12.1455 12.7590 12.7590 14.5463 14.5463 15.1831 15.1831 16.6741 16.6741 17.6716 17.6716 18.1111 18.1111 18.3611 18.3611 18.8602 18.8602 19.2847 19.2847 k =-0.4545 0.2622 0.5772 ( 4428 PWs) bands (ev): 1.0709 1.0709 1.0923 1.0923 1.1139 1.1139 1.1225 1.1225 1.1403 1.1403 1.1850 1.1850 1.2156 1.2156 1.2231 1.2231 3.0728 3.0728 3.0789 3.0789 3.0910 3.0910 3.1242 3.1242 3.2348 3.2348 3.2440 3.2440 3.3347 3.3347 3.4130 3.4130 3.4417 3.4417 3.4924 3.4924 3.5449 3.5449 3.6221 3.6221 6.3568 6.3568 6.6931 6.6931 6.9912 6.9912 7.5516 7.5516 8.4962 8.4962 8.9619 8.9619 9.3251 9.3251 9.5208 9.5208 9.6884 9.6884 10.5314 10.5314 10.6476 10.6476 11.7742 11.7742 12.0818 12.0818 12.1443 12.1443 12.7582 12.7582 14.5591 14.5591 15.1859 15.1859 16.7737 16.7737 17.7522 17.7522 18.0996 18.0996 18.3829 18.3829 18.7759 18.7759 19.2495 19.2495 k =-0.4697 0.2709 0.5772 ( 4424 PWs) bands (ev): 1.0707 1.0707 1.0923 1.0923 1.1139 1.1139 1.1220 1.1220 1.1403 1.1403 1.1849 1.1849 1.2161 1.2161 1.2234 1.2234 3.0731 3.0731 3.0776 3.0776 3.0903 3.0903 3.1229 3.1229 3.2353 3.2353 3.2446 3.2446 3.3365 3.3365 3.4142 3.4142 3.4416 3.4416 3.4910 3.4910 3.5466 3.5466 3.6214 3.6214 6.4246 6.4246 6.7581 6.7581 6.9157 6.9157 7.4839 7.4839 8.5047 8.5047 8.9499 8.9499 9.3177 9.3177 9.5155 9.5155 9.6759 9.6759 10.5290 10.5290 10.6474 10.6474 11.7781 11.7781 12.0804 12.0804 12.1434 12.1434 12.7575 12.7575 14.5680 14.5680 15.1867 15.1867 16.8591 16.8591 17.7947 17.7947 18.0920 18.0920 18.4222 18.4222 18.7146 18.7146 19.1944 19.1944 k =-0.4848 0.2797 0.5772 ( 4416 PWs) bands (ev): 1.0706 1.0706 1.0923 1.0923 1.1139 1.1139 1.1217 1.1217 1.1403 1.1403 1.1848 1.1848 1.2164 1.2164 1.2236 1.2236 3.0736 3.0736 3.0766 3.0766 3.0899 3.0899 3.1221 3.1221 3.2356 3.2356 3.2449 3.2449 3.3377 3.3377 3.4149 3.4149 3.4415 3.4415 3.4901 3.4901 3.5477 3.5477 3.6210 3.6210 6.4786 6.4786 6.7987 6.7987 6.8628 6.8628 7.4358 7.4358 8.5100 8.5100 8.9426 8.9426 9.3130 9.3130 9.5124 9.5124 9.6685 9.6685 10.5276 10.5276 10.6472 10.6472 11.7805 11.7805 12.0795 12.0795 12.1430 12.1430 12.7571 12.7571 14.5734 14.5734 15.1868 15.1868 16.9185 16.9185 17.8057 17.8057 18.0915 18.0915 18.4645 18.4645 18.6774 18.6774 19.1371 19.1371 k =-0.5000 0.2884 0.5772 ( 4408 PWs) bands (ev): 1.0706 1.0706 1.0923 1.0923 1.1139 1.1139 1.1216 1.1216 1.1403 1.1403 1.1848 1.1848 1.2165 1.2165 1.2237 1.2237 3.0738 3.0738 3.0761 3.0761 3.0897 3.0897 3.1218 3.1218 3.2357 3.2357 3.2450 3.2450 3.3381 3.3381 3.4152 3.4152 3.4415 3.4415 3.4898 3.4898 3.5481 3.5481 3.6209 3.6209 6.5011 6.5011 6.8035 6.8035 6.8512 6.8512 7.4179 7.4179 8.5118 8.5118 8.9402 8.9402 9.3115 9.3115 9.5114 9.5114 9.6660 9.6660 10.5271 10.5271 10.6472 10.6472 11.7813 11.7813 12.0792 12.0792 12.1428 12.1428 12.7570 12.7570 14.5751 14.5751 15.1867 15.1867 16.9401 16.9401 17.8057 17.8057 18.0925 18.0925 18.4840 18.4840 18.6647 18.6647 19.1119 19.1119 k =-0.5000 0.2884 0.5772 ( 4408 PWs) bands (ev): 1.0706 1.0706 1.0923 1.0923 1.1139 1.1139 1.1216 1.1216 1.1403 1.1403 1.1848 1.1848 1.2165 1.2165 1.2237 1.2237 3.0738 3.0738 3.0761 3.0761 3.0897 3.0897 3.1218 3.1218 3.2357 3.2357 3.2450 3.2450 3.3381 3.3381 3.4152 3.4152 3.4415 3.4415 3.4898 3.4898 3.5481 3.5481 3.6209 3.6209 6.5011 6.5011 6.8035 6.8035 6.8512 6.8512 7.4179 7.4179 8.5118 8.5118 8.9402 8.9402 9.3115 9.3115 9.5114 9.5114 9.6660 9.6660 10.5271 10.5271 10.6472 10.6472 11.7813 11.7813 12.0792 12.0792 12.1428 12.1428 12.7570 12.7570 14.5751 14.5751 15.1867 15.1867 16.9401 16.9401 17.8057 17.8057 18.0925 18.0925 18.4840 18.4840 18.6647 18.6647 19.1119 19.1119 k =-0.4894 0.2823 0.5649 ( 4416 PWs) bands (ev): 1.0706 1.0706 1.0923 1.0923 1.1139 1.1139 1.1217 1.1217 1.1403 1.1403 1.1848 1.1848 1.2164 1.2164 1.2236 1.2236 3.0732 3.0732 3.0770 3.0770 3.0899 3.0899 3.1221 3.1221 3.2356 3.2356 3.2449 3.2449 3.3377 3.3377 3.4149 3.4149 3.4415 3.4415 3.4901 3.4901 3.5478 3.5478 3.6210 3.6210 6.4780 6.4780 6.8086 6.8086 6.8535 6.8535 7.4358 7.4358 8.5100 8.5100 8.9426 8.9426 9.3130 9.3130 9.5124 9.5124 9.6685 9.6685 10.5276 10.5276 10.6472 10.6472 11.7805 11.7805 12.0795 12.0795 12.1430 12.1430 12.7571 12.7571 14.5734 14.5734 15.1868 15.1868 16.9187 16.9187 17.8059 17.8059 18.0916 18.0916 18.4645 18.4645 18.6768 18.6768 19.1376 19.1376 k =-0.4787 0.2761 0.5527 ( 4420 PWs) bands (ev): 1.0707 1.0707 1.0923 1.0923 1.1140 1.1140 1.1220 1.1220 1.1403 1.1403 1.1849 1.1849 1.2161 1.2161 1.2234 1.2234 3.0722 3.0722 3.0786 3.0786 3.0905 3.0905 3.1227 3.1227 3.2353 3.2353 3.2446 3.2446 3.3366 3.3366 3.4142 3.4142 3.4415 3.4415 3.4910 3.4910 3.5468 3.5468 3.6214 3.6214 6.4163 6.4163 6.8192 6.8192 6.8610 6.8610 7.4856 7.4856 8.5048 8.5048 8.9498 8.9498 9.3175 9.3175 9.5155 9.5155 9.6759 9.6759 10.5289 10.5289 10.6474 10.6474 11.7782 11.7782 12.0804 12.0804 12.1434 12.1434 12.7575 12.7575 14.5682 14.5682 15.1870 15.1870 16.8584 16.8584 17.7983 17.7983 18.0939 18.0939 18.4180 18.4180 18.7093 18.7093 19.2063 19.2063 k =-0.4681 0.2700 0.5404 ( 4424 PWs) bands (ev): 1.0709 1.0709 1.0924 1.0924 1.1141 1.1141 1.1224 1.1224 1.1403 1.1403 1.1850 1.1850 1.2156 1.2156 1.2232 1.2232 3.0714 3.0714 3.0801 3.0801 3.0917 3.0917 3.1238 3.1238 3.2347 3.2347 3.2441 3.2441 3.3348 3.3348 3.4129 3.4129 3.4415 3.4415 3.4924 3.4924 3.5452 3.5452 3.6221 3.6221 6.3296 6.3296 6.8293 6.8293 6.8745 6.8745 7.5589 7.5589 8.4964 8.4964 8.9616 8.9616 9.3241 9.3241 9.5214 9.5214 9.6883 9.6883 10.5312 10.5312 10.6476 10.6476 11.7742 11.7742 12.0818 12.0818 12.1443 12.1443 12.7582 12.7582 14.5596 14.5596 15.1872 15.1872 16.7682 16.7682 17.7666 17.7666 18.1072 18.1072 18.3638 18.3638 18.7586 18.7586 19.3014 19.3014 k =-0.4574 0.2639 0.5281 ( 4440 PWs) bands (ev): 1.0710 1.0710 1.0925 1.0925 1.1142 1.1142 1.1229 1.1229 1.1403 1.1403 1.1851 1.1851 1.2149 1.2149 1.2228 1.2228 3.0709 3.0709 3.0813 3.0813 3.0936 3.0936 3.1253 3.1253 3.2337 3.2337 3.2435 3.2435 3.3324 3.3324 3.4111 3.4111 3.4415 3.4415 3.4942 3.4942 3.5430 3.5430 3.6229 3.6229 6.2280 6.2280 6.8380 6.8380 6.8931 6.8931 7.6468 7.6468 8.4852 8.4852 8.9780 8.9780 9.3318 9.3318 9.5309 9.5309 9.7060 9.7060 10.5345 10.5345 10.6479 10.6479 11.7688 11.7688 12.0837 12.0837 12.1458 12.1458 12.7592 12.7592 14.5478 14.5478 15.1875 15.1875 16.6571 16.6571 17.7049 17.7049 18.1265 18.1265 18.3186 18.3186 18.8231 18.8231 19.4050 19.4050 k =-0.4468 0.2577 0.5158 ( 4448 PWs) bands (ev): 1.0713 1.0713 1.0926 1.0926 1.1144 1.1144 1.1236 1.1236 1.1404 1.1404 1.1853 1.1853 1.2140 1.2140 1.2223 1.2223 3.0707 3.0707 3.0821 3.0821 3.0965 3.0965 3.1272 3.1272 3.2322 3.2322 3.2431 3.2431 3.3295 3.3295 3.4088 3.4088 3.4415 3.4415 3.4963 3.4963 3.5403 3.5403 3.6241 3.6241 6.1175 6.1175 6.8465 6.8465 6.9158 6.9158 7.7425 7.7425 8.4717 8.4717 8.9987 8.9987 9.3394 9.3394 9.5451 9.5451 9.7292 9.7292 10.5390 10.5390 10.6484 10.6484 11.7620 11.7620 12.0858 12.0858 12.1481 12.1481 12.7605 12.7605 14.5329 14.5329 15.1876 15.1876 16.5317 16.5317 17.6188 17.6188 18.1288 18.1288 18.3034 18.3034 18.9006 18.9006 19.4870 19.4870 k =-0.4362 0.2516 0.5035 ( 4444 PWs) bands (ev): 1.0717 1.0717 1.0927 1.0927 1.1146 1.1146 1.1243 1.1243 1.1405 1.1405 1.1854 1.1854 1.2130 1.2130 1.2218 1.2218 3.0707 3.0707 3.0826 3.0826 3.1001 3.1001 3.1296 3.1296 3.2300 3.2300 3.2429 3.2429 3.3264 3.3264 3.4061 3.4061 3.4414 3.4414 3.4984 3.4984 3.5372 3.5372 3.6253 3.6253 6.0021 6.0021 6.8557 6.8557 6.9420 6.9420 7.8410 7.8410 8.4565 8.4565 9.0234 9.0234 9.3460 9.3460 9.5647 9.5647 9.7581 9.7581 10.5447 10.5447 10.6491 10.6491 11.7539 11.7539 12.0881 12.0881 12.1515 12.1515 12.7621 12.7621 14.5150 14.5150 15.1876 15.1876 16.3968 16.3968 17.5162 17.5162 18.1001 18.1001 18.3277 18.3277 18.9878 18.9878 19.5227 19.5227 k =-0.4255 0.2455 0.4912 ( 4442 PWs) bands (ev): 1.0721 1.0721 1.0929 1.0929 1.1149 1.1149 1.1250 1.1250 1.1408 1.1408 1.1855 1.1855 1.2117 1.2117 1.2213 1.2213 3.0711 3.0711 3.0829 3.0829 3.1043 3.1043 3.1323 3.1323 3.2273 3.2273 3.2429 3.2429 3.3230 3.3230 3.4031 3.4031 3.4413 3.4413 3.5004 3.5004 3.5340 3.5340 3.6268 3.6268 5.8838 5.8838 6.8661 6.8661 6.9718 6.9718 7.9386 7.9386 8.4399 8.4399 9.0518 9.0518 9.3512 9.3512 9.5902 9.5902 9.7929 9.7929 10.5519 10.5519 10.6500 10.6500 11.7446 11.7446 12.0903 12.0903 12.1563 12.1563 12.7643 12.7643 14.4945 14.4945 15.1871 15.1871 16.2554 16.2554 17.4030 17.4030 18.0548 18.0548 18.3740 18.3740 19.0808 19.0808 19.5225 19.5225 k =-0.4149 0.2393 0.4790 ( 4442 PWs) bands (ev): 1.0725 1.0725 1.0932 1.0932 1.1152 1.1152 1.1256 1.1256 1.1413 1.1413 1.1856 1.1856 1.2103 1.2103 1.2208 1.2208 3.0716 3.0716 3.0832 3.0832 3.1091 3.1091 3.1354 3.1354 3.2240 3.2240 3.2431 3.2431 3.3195 3.3195 3.3997 3.3997 3.4410 3.4410 3.5017 3.5017 3.5311 3.5311 3.6283 3.6283 5.7644 5.7644 6.8777 6.8777 7.0051 7.0051 8.0329 8.0329 8.4225 8.4225 9.0832 9.0832 9.3554 9.3554 9.6213 9.6213 9.8337 9.8337 10.5608 10.5608 10.6513 10.6513 11.7343 11.7343 12.0924 12.0924 12.1630 12.1630 12.7668 12.7668 14.4716 14.4716 15.1862 15.1862 16.1098 16.1098 17.2830 17.2830 18.0049 18.0049 18.4287 18.4287 19.1751 19.1751 19.4923 19.4923 k =-0.4043 0.2332 0.4667 ( 4446 PWs) bands (ev): 1.0730 1.0730 1.0935 1.0935 1.1155 1.1155 1.1262 1.1262 1.1420 1.1420 1.1855 1.1855 1.2087 1.2087 1.2202 1.2202 3.0723 3.0723 3.0836 3.0836 3.1143 3.1143 3.1390 3.1390 3.2202 3.2202 3.2433 3.2433 3.3160 3.3160 3.3959 3.3959 3.4405 3.4405 3.5018 3.5018 3.5288 3.5288 3.6299 3.6299 5.6447 5.6447 6.8908 6.8908 7.0420 7.0420 8.1216 8.1216 8.4048 8.4048 9.1166 9.1166 9.3599 9.3599 9.6577 9.6577 9.8802 9.8802 10.5719 10.5719 10.6529 10.6529 11.7230 11.7230 12.0942 12.0942 12.1718 12.1718 12.7700 12.7700 14.4464 14.4464 15.1846 15.1846 15.9615 15.9615 17.1589 17.1589 17.9544 17.9544 18.4864 18.4864 19.2632 19.2632 19.4394 19.4394 k =-0.3936 0.2270 0.4544 ( 4452 PWs) bands (ev): 1.0736 1.0736 1.0938 1.0938 1.1159 1.1159 1.1268 1.1268 1.1429 1.1429 1.1854 1.1854 1.2069 1.2069 1.2198 1.2198 3.0732 3.0732 3.0841 3.0841 3.1198 3.1198 3.1428 3.1428 3.2161 3.2161 3.2437 3.2437 3.3127 3.3127 3.3919 3.3919 3.4398 3.4398 3.5002 3.5002 3.5279 3.5279 3.6315 3.6315 5.5256 5.5256 6.9052 6.9052 7.0823 7.0823 8.2030 8.2030 8.3875 8.3875 9.1505 9.1505 9.3668 9.3668 9.6985 9.6985 9.9321 9.9321 10.5857 10.5857 10.6551 10.6551 11.7109 11.7109 12.0959 12.0959 12.1832 12.1832 12.7738 12.7738 14.4193 14.4193 15.1823 15.1823 15.8117 15.8117 17.0322 17.0322 17.9049 17.9049 18.5436 18.5436 19.3085 19.3085 19.4030 19.4030 k =-0.3830 0.2209 0.4421 ( 4450 PWs) bands (ev): 1.0742 1.0742 1.0942 1.0942 1.1163 1.1163 1.1273 1.1273 1.1439 1.1439 1.1851 1.1851 1.2050 1.2050 1.2193 1.2193 3.0740 3.0740 3.0850 3.0850 3.1256 3.1256 3.1471 3.1471 3.2117 3.2117 3.2440 3.2440 3.3095 3.3095 3.3877 3.3877 3.4389 3.4389 3.4968 3.4968 3.5282 3.5282 3.6332 3.6332 5.4077 5.4077 6.9209 6.9209 7.1261 7.1261 8.2748 8.2748 8.3720 8.3720 9.1823 9.1823 9.3790 9.3790 9.7432 9.7432 9.9882 9.9882 10.6027 10.6027 10.6578 10.6578 11.6981 11.6981 12.0974 12.0974 12.1975 12.1975 12.7785 12.7785 14.3905 14.3905 15.1791 15.1791 15.6611 15.6611 16.9042 16.9042 17.8569 17.8569 18.5958 18.5958 19.2444 19.2444 19.4519 19.4519 k =-0.3723 0.2148 0.4298 ( 4458 PWs) bands (ev): 1.0748 1.0748 1.0946 1.0946 1.1166 1.1166 1.1278 1.1278 1.1452 1.1452 1.1847 1.1847 1.2031 1.2031 1.2189 1.2189 3.0747 3.0747 3.0862 3.0862 3.1315 3.1315 3.1517 3.1517 3.2071 3.2071 3.2444 3.2444 3.3066 3.3066 3.3832 3.3832 3.4378 3.4378 3.4919 3.4919 3.5296 3.5296 3.6349 3.6349 5.2912 5.2912 6.9378 6.9378 7.1733 7.1733 8.3246 8.3246 8.3703 8.3703 9.2087 9.2087 9.4004 9.4004 9.7909 9.7909 10.0470 10.0470 10.6237 10.6237 10.6615 10.6615 11.6848 11.6848 12.0989 12.0989 12.2153 12.2153 12.7842 12.7842 14.3602 14.3602 15.1748 15.1748 15.5105 15.5105 16.7758 16.7758 17.8106 17.8106 18.6350 18.6350 19.1560 19.1560 19.5042 19.5042 k =-0.3617 0.2086 0.4176 ( 4448 PWs) bands (ev): 1.0755 1.0755 1.0950 1.0950 1.1170 1.1170 1.1283 1.1283 1.1466 1.1466 1.1841 1.1841 1.2010 1.2010 1.2186 1.2186 3.0754 3.0754 3.0877 3.0877 3.1374 3.1374 3.1566 3.1566 3.2024 3.2024 3.2449 3.2449 3.3039 3.3039 3.3786 3.3786 3.4365 3.4365 3.4860 3.4860 3.5315 3.5315 3.6365 3.6365 5.1766 5.1766 6.9560 6.9560 7.2236 7.2236 8.3246 8.3246 8.4104 8.4104 9.2277 9.2277 9.4335 9.4335 9.8413 9.8413 10.1066 10.1066 10.6488 10.6488 10.6671 10.6671 11.6710 11.6710 12.1004 12.1004 12.2368 12.2368 12.7911 12.7911 14.3287 14.3287 15.1693 15.1693 15.3605 15.3605 16.6475 16.6475 17.7663 17.7663 18.6459 18.6459 19.0788 19.0788 19.5300 19.5300 k =-0.3511 0.2025 0.4053 ( 4458 PWs) bands (ev): 1.0762 1.0762 1.0953 1.0953 1.1174 1.1174 1.1289 1.1289 1.1481 1.1481 1.1833 1.1833 1.1990 1.1990 1.2184 1.2184 3.0761 3.0761 3.0897 3.0897 3.1432 3.1432 3.1620 3.1620 3.1978 3.1978 3.2454 3.2454 3.3016 3.3016 3.3739 3.3739 3.4350 3.4350 3.4795 3.4795 3.5336 3.5336 3.6380 3.6380 5.0642 5.0642 6.9752 6.9752 7.2770 7.2770 8.3109 8.3109 8.4561 8.4561 9.2397 9.2397 9.4782 9.4782 9.8935 9.8935 10.1645 10.1645 10.6676 10.6676 10.6860 10.6860 11.6570 11.6570 12.1020 12.1020 12.2628 12.2628 12.7996 12.7996 14.2962 14.2962 15.1624 15.1624 15.2116 15.2116 16.5199 16.5199 17.7238 17.7238 18.6090 18.6090 19.0327 19.0327 19.5152 19.5152 k =-0.3404 0.1964 0.3930 ( 4458 PWs) bands (ev): 1.0769 1.0769 1.0957 1.0957 1.1178 1.1178 1.1296 1.1296 1.1496 1.1496 1.1824 1.1824 1.1970 1.1970 1.2182 1.2182 3.0767 3.0767 3.0920 3.0920 3.1484 3.1484 3.1677 3.1677 3.1935 3.1935 3.2459 3.2459 3.2995 3.2995 3.3690 3.3690 3.4333 3.4333 3.4725 3.4725 3.5357 3.5357 3.6395 3.6395 4.9541 4.9541 6.9955 6.9955 7.3333 7.3333 8.2963 8.2963 8.4953 8.4953 9.2472 9.2472 9.5322 9.5322 9.9472 9.9472 10.2186 10.2186 10.6758 10.6758 10.7235 10.7235 11.6428 11.6428 12.1038 12.1038 12.2935 12.2935 12.8102 12.8102 14.2629 14.2629 15.0642 15.0642 15.1540 15.1540 16.3935 16.3935 17.6830 17.6830 18.5216 18.5216 19.0163 19.0163 19.4535 19.4535 k =-0.3298 0.1902 0.3807 ( 4452 PWs) bands (ev): 1.0777 1.0777 1.0960 1.0960 1.1182 1.1182 1.1304 1.1304 1.1511 1.1511 1.1814 1.1814 1.1951 1.1951 1.2180 1.2180 3.0773 3.0773 3.0946 3.0946 3.1528 3.1528 3.1738 3.1738 3.1899 3.1899 3.2466 3.2466 3.2978 3.2978 3.3640 3.3640 3.4313 3.4313 3.4652 3.4652 3.5377 3.5377 3.6408 3.6408 4.8465 4.8465 7.0167 7.0167 7.3921 7.3921 8.2823 8.2823 8.5273 8.5273 9.2526 9.2526 9.5935 9.5935 10.0015 10.0015 10.2670 10.2670 10.6844 10.6844 10.7687 10.7687 11.6287 11.6287 12.1058 12.1058 12.3292 12.3292 12.8236 12.8236 14.2290 14.2290 14.9189 14.9189 15.1436 15.1436 16.2686 16.2686 17.6438 17.6438 18.4015 18.4015 19.0043 19.0043 19.3533 19.3533 k =-0.3191 0.1841 0.3684 ( 4460 PWs) bands (ev): 1.0784 1.0784 1.0963 1.0963 1.1187 1.1187 1.1313 1.1313 1.1525 1.1525 1.1802 1.1802 1.1933 1.1933 1.2179 1.2179 3.0781 3.0781 3.0975 3.0975 3.1557 3.1557 3.1799 3.1799 3.1877 3.1877 3.2474 3.2474 3.2963 3.2963 3.3590 3.3590 3.4290 3.4290 3.4576 3.4576 3.5397 3.5397 3.6420 3.6420 4.7415 4.7415 7.0388 7.0388 7.4533 7.4533 8.2693 8.2693 8.5523 8.5523 9.2577 9.2577 9.6604 9.6604 10.0558 10.0558 10.3092 10.3092 10.6949 10.6949 10.8193 10.8193 11.6147 11.6147 12.1080 12.1080 12.3698 12.3698 12.8410 12.8410 14.1947 14.1947 14.7760 14.7760 15.1311 15.1311 16.1457 16.1457 17.6060 17.6060 18.2639 18.2639 18.9704 18.9704 19.2324 19.2324 k =-0.3085 0.1780 0.3562 ( 4464 PWs) bands (ev): 1.0792 1.0792 1.0964 1.0964 1.1193 1.1193 1.1323 1.1323 1.1537 1.1537 1.1788 1.1788 1.1918 1.1918 1.2177 1.2177 3.0789 3.0789 3.1005 3.1005 3.1566 3.1566 3.1851 3.1851 3.1885 3.1885 3.2484 3.2484 3.2951 3.2951 3.3541 3.3541 3.4265 3.4265 3.4500 3.4500 3.5415 3.5415 3.6431 3.6431 4.6394 4.6394 7.0616 7.0616 7.5166 7.5166 8.2574 8.2574 8.5711 8.5711 9.2637 9.2637 9.7320 9.7320 10.1092 10.1092 10.3454 10.3454 10.7080 10.7080 10.8733 10.8733 11.6011 11.6011 12.1104 12.1104 12.4143 12.4143 12.8639 12.8639 14.1601 14.1601 14.6362 14.6362 15.1159 15.1159 16.0253 16.0253 17.5691 17.5691 18.1170 18.1170 18.8976 18.8976 19.1071 19.1071 k =-0.2979 0.1718 0.3439 ( 4464 PWs) bands (ev): 1.0799 1.0799 1.0966 1.0966 1.1200 1.1200 1.1334 1.1334 1.1546 1.1546 1.1774 1.1774 1.1906 1.1906 1.2176 1.2176 3.0798 3.0798 3.1038 3.1038 3.1555 3.1555 3.1875 3.1875 3.1939 3.1939 3.2497 3.2497 3.2941 3.2941 3.3493 3.3493 3.4237 3.4237 3.4423 3.4423 3.5430 3.5430 3.6440 3.6440 4.5402 4.5402 7.0849 7.0849 7.5815 7.5815 8.2469 8.2469 8.5843 8.5843 9.2711 9.2711 9.8073 9.8073 10.1608 10.1608 10.3765 10.3765 10.7245 10.7245 10.9285 10.9285 11.5880 11.5880 12.1129 12.1129 12.4609 12.4609 12.8945 12.8945 14.1251 14.1251 14.5000 14.5000 15.0975 15.0975 15.9079 15.9079 17.5329 17.5329 17.9650 17.9650 18.7850 18.7850 18.9830 18.9830 k =-0.2872 0.1657 0.3316 ( 4462 PWs) bands (ev): 1.0807 1.0807 1.0966 1.0966 1.1208 1.1208 1.1345 1.1345 1.1552 1.1552 1.1759 1.1759 1.1898 1.1898 1.2175 1.2175 3.0809 3.0809 3.1072 3.1072 3.1528 3.1528 3.1902 3.1902 3.2002 3.2002 3.2514 3.2514 3.2933 3.2933 3.3447 3.3447 3.4205 3.4205 3.4349 3.4349 3.5445 3.5445 3.6446 3.6446 4.4441 4.4441 7.1088 7.1088 7.6478 7.6478 8.2377 8.2377 8.5927 8.5927 9.2807 9.2807 9.8860 9.8860 10.2095 10.2095 10.4034 10.4034 10.7451 10.7451 10.9828 10.9828 11.5756 11.5756 12.1155 12.1155 12.5070 12.5070 12.9353 12.9353 14.0896 14.0896 14.3685 14.3685 15.0751 15.0751 15.7942 15.7942 17.4966 17.4966 17.8107 17.8107 18.6480 18.6480 18.8541 18.8541 k =-0.2766 0.1595 0.3193 ( 4470 PWs) bands (ev): 1.0814 1.0814 1.0966 1.0966 1.1217 1.1217 1.1357 1.1357 1.1555 1.1555 1.1744 1.1744 1.1894 1.1894 1.2173 1.2173 3.0822 3.0822 3.1107 3.1107 3.1494 3.1494 3.1934 3.1934 3.2062 3.2062 3.2536 3.2536 3.2926 3.2926 3.3405 3.3405 3.4167 3.4167 3.4278 3.4278 3.5457 3.5457 3.6451 3.6451 4.3510 4.3510 7.1330 7.1330 7.7149 7.7149 8.2300 8.2300 8.5972 8.5972 9.2928 9.2928 9.9674 9.9674 10.2544 10.2544 10.4272 10.4272 10.7706 10.7706 11.0348 11.0348 11.5641 11.5641 12.1181 12.1181 12.5493 12.5493 12.9885 12.9885 14.0526 14.0526 14.2434 14.2434 15.0479 15.0479 15.6848 15.6848 17.4589 17.4589 17.6562 17.6562 18.5019 18.5019 18.7159 18.7159 k =-0.2660 0.1534 0.3070 ( 4464 PWs) bands (ev): 1.0821 1.0821 1.0966 1.0966 1.1227 1.1227 1.1368 1.1368 1.1554 1.1554 1.1729 1.1729 1.1894 1.1894 1.2170 1.2170 3.0836 3.0836 3.1143 3.1143 3.1458 3.1458 3.1966 3.1966 3.2119 3.2119 3.2562 3.2562 3.2919 3.2919 3.3369 3.3369 3.4119 3.4119 3.4216 3.4216 3.5467 3.5467 3.6453 3.6453 4.2612 4.2612 7.1575 7.1575 7.7824 7.7824 8.2239 8.2239 8.5984 8.5984 9.3075 9.3075 10.0511 10.0511 10.2948 10.2948 10.4484 10.4484 10.8016 10.8016 11.0839 11.0839 11.5537 11.5537 12.1208 12.1208 12.5855 12.5855 13.0547 13.0547 14.0103 14.0103 14.1300 14.1300 15.0147 15.0147 15.5808 15.5808 17.4144 17.4144 17.5077 17.5077 18.3559 18.3559 18.5684 18.5684 k =-0.2553 0.1473 0.2947 ( 4464 PWs) bands (ev): 1.0828 1.0828 1.0965 1.0965 1.1238 1.1238 1.1377 1.1377 1.1549 1.1549 1.1716 1.1716 1.1898 1.1898 1.2167 1.2167 3.0852 3.0852 3.1180 3.1180 3.1421 3.1421 3.1995 3.1995 3.2171 3.2171 3.2593 3.2593 3.2911 3.2911 3.3341 3.3341 3.4061 3.4061 3.4165 3.4165 3.5476 3.5476 3.6452 3.6452 4.1747 4.1747 7.1821 7.1821 7.8494 7.8494 8.2194 8.2194 8.5972 8.5972 9.3253 9.3253 10.1364 10.1364 10.3305 10.3305 10.4675 10.4675 10.8381 10.8381 11.1303 11.1303 11.5446 11.5446 12.1234 12.1234 12.6149 12.6149 13.1316 13.1316 13.9499 13.9499 14.0431 14.0431 14.9743 14.9743 15.4830 15.4830 17.3209 17.3209 17.4072 17.4072 18.2153 18.2153 18.4138 18.4138 k =-0.2447 0.1411 0.2825 ( 4468 PWs) bands (ev): 1.0835 1.0835 1.0965 1.0965 1.1249 1.1249 1.1383 1.1383 1.1543 1.1543 1.1704 1.1704 1.1906 1.1906 1.2164 1.2164 3.0870 3.0870 3.1216 3.1216 3.1387 3.1387 3.2021 3.2021 3.2217 3.2217 3.2626 3.2626 3.2898 3.2898 3.3324 3.3324 3.3996 3.3996 3.4121 3.4121 3.5482 3.5482 3.6449 3.6449 4.0915 4.0915 7.2067 7.2067 7.9154 7.9154 8.2167 8.2167 8.5941 8.5941 9.3464 9.3464 10.2224 10.2224 10.3619 10.3619 10.4849 10.4849 10.8797 10.8797 11.1747 11.1747 11.5370 11.5370 12.1259 12.1259 12.6378 12.6378 13.2134 13.2134 13.8667 13.8667 13.9914 13.9914 14.9255 14.9255 15.3922 15.3922 17.1754 17.1754 17.3577 17.3577 18.0840 18.0840 18.2545 18.2545 k =-0.2340 0.1350 0.2702 ( 4462 PWs) bands (ev): 1.0841 1.0841 1.0966 1.0966 1.1261 1.1261 1.1385 1.1385 1.1537 1.1537 1.1695 1.1695 1.1916 1.1916 1.2159 1.2159 3.0888 3.0888 3.1247 3.1247 3.1360 3.1360 3.2042 3.2042 3.2258 3.2258 3.2661 3.2661 3.2881 3.2881 3.3319 3.3319 3.3931 3.3931 3.4081 3.4081 3.5487 3.5487 3.6442 3.6442 4.0119 4.0119 7.2312 7.2312 7.9791 7.9791 8.2159 8.2159 8.5901 8.5901 9.3710 9.3710 10.3068 10.3068 10.3906 10.3906 10.5014 10.5014 10.9249 10.9249 11.2184 11.2184 11.5312 11.5312 12.1283 12.1283 12.6555 12.6555 13.2885 13.2885 13.7882 13.7882 13.9561 13.9561 14.8676 14.8676 15.3086 15.3086 17.0245 17.0245 17.3126 17.3126 17.9646 17.9646 18.0929 18.0929 k =-0.2234 0.1289 0.2579 ( 4460 PWs) bands (ev): 1.0847 1.0847 1.0967 1.0967 1.1274 1.1274 1.1382 1.1382 1.1531 1.1531 1.1690 1.1690 1.1927 1.1927 1.2154 1.2154 3.0908 3.0908 3.1264 3.1264 3.1352 3.1352 3.2058 3.2058 3.2294 3.2294 3.2695 3.2695 3.2858 3.2858 3.3325 3.3325 3.3869 3.3869 3.4042 3.4042 3.5490 3.5490 3.6432 3.6432 3.9358 3.9358 7.2555 7.2555 8.0394 8.0394 8.2175 8.2175 8.5857 8.5857 9.3994 9.3994 10.3802 10.3802 10.4239 10.4239 10.5194 10.5194 10.9722 10.9722 11.2630 11.2630 11.5272 11.5272 12.1305 12.1305 12.6692 12.6692 13.3353 13.3353 13.7418 13.7418 13.9284 13.9284 14.8011 14.8011 15.2314 15.2314 16.8744 16.8744 17.2655 17.2655 17.8567 17.8567 17.9335 17.9335 k =-0.2128 0.1227 0.2456 ( 4454 PWs) bands (ev): 1.0852 1.0852 1.0969 1.0969 1.1287 1.1287 1.1373 1.1373 1.1527 1.1527 1.1689 1.1689 1.1939 1.1939 1.2148 1.2148 3.0928 3.0928 3.1257 3.1257 3.1372 3.1372 3.2069 3.2069 3.2323 3.2323 3.2727 3.2727 3.2832 3.2832 3.3338 3.3338 3.3817 3.3817 3.4005 3.4005 3.5490 3.5490 3.6418 3.6418 3.8635 3.8635 7.2794 7.2794 8.0939 8.0939 8.2226 8.2226 8.5817 8.5817 9.4318 9.4318 10.4189 10.4189 10.4763 10.4763 10.5485 10.5485 11.0199 11.0199 11.3101 11.3101 11.5254 11.5254 12.1326 12.1326 12.6798 12.6798 13.3306 13.3306 13.7453 13.7453 13.9106 13.9106 14.7274 14.7274 15.1588 15.1588 16.7265 16.7265 17.2157 17.2157 17.7395 17.7395 17.8005 17.8005 k =-0.2021 0.1166 0.2333 ( 4450 PWs) bands (ev): 1.0858 1.0858 1.0972 1.0972 1.1299 1.1299 1.1359 1.1359 1.1523 1.1523 1.1692 1.1692 1.1952 1.1952 1.2141 1.2141 3.0948 3.0948 3.1239 3.1239 3.1406 3.1406 3.2077 3.2077 3.2347 3.2347 3.2747 3.2747 3.2812 3.2812 3.3348 3.3348 3.3780 3.3780 3.3969 3.3969 3.5486 3.5486 3.6397 3.6397 3.7953 3.7953 7.3030 7.3030 8.1387 8.1387 8.2340 8.2340 8.5790 8.5790 9.4686 9.4686 10.4396 10.4396 10.5119 10.5119 10.6078 10.6078 11.0667 11.0667 11.3610 11.3610 11.5261 11.5261 12.1344 12.1344 12.6880 12.6880 13.2817 13.2817 13.7738 13.7738 13.9175 13.9175 14.6484 14.6484 15.0887 15.0887 16.5815 16.5815 17.1630 17.1630 17.5889 17.5889 17.7206 17.7206 k =-0.1915 0.1105 0.2211 ( 4452 PWs) bands (ev): 1.0862 1.0862 1.0976 1.0976 1.1310 1.1310 1.1342 1.1342 1.1521 1.1521 1.1699 1.1699 1.1964 1.1964 1.2134 1.2134 3.0967 3.0967 3.1222 3.1222 3.1445 3.1445 3.2081 3.2081 3.2364 3.2364 3.2735 3.2735 3.2821 3.2821 3.3346 3.3346 3.3763 3.3763 3.3938 3.3938 3.5478 3.5478 3.6364 3.6364 3.7321 3.7321 7.3259 7.3259 8.1692 8.1692 8.2550 8.2550 8.5784 8.5784 9.5097 9.5097 10.4550 10.4550 10.5309 10.5309 10.6835 10.6835 11.1127 11.1127 11.4158 11.4158 11.5296 11.5296 12.1359 12.1359 12.6943 12.6943 13.2132 13.2132 13.7805 13.7805 13.9684 13.9684 14.5663 14.5663 15.0192 15.0192 16.4397 16.4397 17.1059 17.1059 17.4363 17.4363 17.6663 17.6663 k =-0.1809 0.1043 0.2088 ( 4456 PWs) bands (ev): 1.0867 1.0867 1.0981 1.0981 1.1313 1.1313 1.1329 1.1329 1.1519 1.1519 1.1710 1.1710 1.1975 1.1975 1.2126 1.2126 3.0984 3.0984 3.1209 3.1209 3.1486 3.1486 3.2082 3.2082 3.2375 3.2375 3.2704 3.2704 3.2848 3.2848 3.3325 3.3325 3.3763 3.3763 3.3919 3.3919 3.5458 3.5458 3.6287 3.6287 3.6777 3.6777 7.3483 7.3483 8.1862 8.1862 8.2835 8.2835 8.5809 8.5809 9.5552 9.5552 10.4670 10.4670 10.5471 10.5471 10.7593 10.7593 11.1589 11.1589 11.4729 11.4729 11.5374 11.5374 12.1371 12.1371 12.6990 12.6990 13.1401 13.1401 13.7662 13.7662 14.0442 14.0442 14.4832 14.4832 14.9498 14.9498 16.3017 16.3017 17.0373 17.0373 17.2985 17.2985 17.6300 17.6300 k =-0.1702 0.0982 0.1965 ( 4454 PWs) bands (ev): 1.0871 1.0871 1.0986 1.0986 1.1293 1.1293 1.1335 1.1335 1.1518 1.1518 1.1724 1.1724 1.1984 1.1984 1.2118 1.2118 3.0998 3.0998 3.1202 3.1202 3.1529 3.1529 3.2080 3.2080 3.2381 3.2381 3.2669 3.2669 3.2877 3.2877 3.3288 3.3288 3.3764 3.3764 3.3924 3.3924 3.5405 3.5405 3.6028 3.6028 3.6482 3.6482 7.3699 7.3699 8.1960 8.1960 8.3118 8.3118 8.5872 8.5872 9.6050 9.6050 10.4758 10.4758 10.5642 10.5642 10.8295 10.8295 11.2074 11.2074 11.5229 11.5229 11.5578 11.5578 12.1379 12.1379 12.7024 12.7024 13.0693 13.0693 13.7444 13.7444 14.1206 14.1206 14.4012 14.4012 14.8812 14.8812 16.1679 16.1679 16.9420 16.9420 17.1920 17.1920 17.6112 17.6112 k =-0.1596 0.0920 0.1842 ( 4450 PWs) bands (ev): 1.0876 1.0876 1.0993 1.0993 1.1270 1.1270 1.1344 1.1344 1.1517 1.1517 1.1740 1.1740 1.1991 1.1991 1.2111 1.2111 3.1007 3.1007 3.1202 3.1202 3.1571 3.1571 3.2075 3.2075 3.2382 3.2382 3.2633 3.2633 3.2903 3.2903 3.3240 3.3240 3.3751 3.3751 3.3963 3.3963 3.5226 3.5226 3.5719 3.5719 3.6399 3.6399 7.3908 7.3908 8.2029 8.2029 8.3354 8.3354 8.5977 8.5977 9.6586 9.6586 10.4818 10.4818 10.5837 10.5837 10.8909 10.8909 11.2602 11.2602 11.5470 11.5470 11.6083 11.6083 12.1382 12.1382 12.7047 12.7047 13.0043 13.0043 13.7197 13.7197 14.1827 14.1827 14.3239 14.3239 14.8167 14.8167 16.0386 16.0386 16.8147 16.8147 17.1211 17.1211 17.6113 17.6113 k =-0.1489 0.0859 0.1719 ( 4450 PWs) bands (ev): 1.0880 1.0880 1.0999 1.0999 1.1246 1.1246 1.1351 1.1351 1.1518 1.1518 1.1758 1.1758 1.1996 1.1996 1.2104 1.2104 3.1012 3.1012 3.1208 3.1208 3.1614 3.1614 3.2067 3.2067 3.2380 3.2380 3.2599 3.2599 3.2924 3.2924 3.3187 3.3187 3.3728 3.3728 3.4024 3.4024 3.4855 3.4855 3.5598 3.5598 3.6356 3.6356 7.4109 7.4109 8.2084 8.2084 8.3527 8.3527 8.6121 8.6121 9.7153 9.7153 10.4854 10.4854 10.6061 10.6061 10.9420 10.9420 11.3177 11.3177 11.5656 11.5656 11.6670 11.6670 12.1380 12.1380 12.7063 12.7063 12.9475 12.9475 13.6931 13.6931 14.2027 14.2027 14.2705 14.2705 14.7627 14.7627 15.9143 15.9143 16.6688 16.6688 17.0688 17.0688 17.6330 17.6330 k =-0.1383 0.0798 0.1597 ( 4462 PWs) bands (ev): 1.0885 1.0885 1.1006 1.1006 1.1222 1.1222 1.1357 1.1357 1.1520 1.1520 1.1776 1.1776 1.1997 1.1997 1.2098 1.2098 3.1013 3.1013 3.1220 3.1220 3.1656 3.1656 3.2055 3.2055 3.2374 3.2374 3.2567 3.2567 3.2935 3.2935 3.3133 3.3133 3.3702 3.3702 3.4096 3.4096 3.4440 3.4440 3.5556 3.5556 3.6321 3.6321 7.4301 7.4301 8.2130 8.2130 8.3645 8.3645 8.6291 8.6291 9.7741 9.7741 10.4872 10.4872 10.6320 10.6320 10.9831 10.9831 11.3779 11.3779 11.5889 11.5889 11.7231 11.7231 12.1370 12.1370 12.7072 12.7072 12.9009 12.9009 13.6647 13.6647 14.1503 14.1503 14.2630 14.2630 14.7279 14.7279 15.7954 15.7954 16.5162 16.5162 17.0197 17.0197 17.6783 17.6783 k =-0.1277 0.0736 0.1474 ( 4462 PWs) bands (ev): 1.0890 1.0890 1.1014 1.1014 1.1198 1.1198 1.1361 1.1361 1.1524 1.1524 1.1795 1.1795 1.1994 1.1994 1.2094 1.2094 3.1012 3.1012 3.1234 3.1234 3.1698 3.1698 3.2040 3.2040 3.2366 3.2366 3.2539 3.2539 3.2930 3.2930 3.3079 3.3079 3.3675 3.3675 3.4052 3.4052 3.4176 3.4176 3.5533 3.5533 3.6289 3.6289 7.4482 7.4482 8.2169 8.2169 8.3720 8.3720 8.6473 8.6473 9.8338 9.8338 10.4877 10.4877 10.6616 10.6616 11.0158 11.0158 11.4360 11.4360 11.6209 11.6209 11.7731 11.7731 12.1350 12.1350 12.7079 12.7079 12.8660 12.8660 13.6339 13.6339 14.0847 14.0847 14.2395 14.2395 14.7172 14.7172 15.6825 15.6825 16.3623 16.3623 16.9662 16.9662 17.7475 17.7475 k =-0.1170 0.0675 0.1351 ( 4457 PWs) bands (ev): 1.0894 1.0894 1.1022 1.1022 1.1176 1.1176 1.1365 1.1365 1.1530 1.1530 1.1815 1.1815 1.1989 1.1989 1.2092 1.2092 3.1009 3.1009 3.1249 3.1249 3.1739 3.1739 3.2018 3.2018 3.2354 3.2354 3.2515 3.2515 3.2900 3.2900 3.3027 3.3027 3.3619 3.3619 3.3754 3.3754 3.4256 3.4256 3.5514 3.5514 3.6256 3.6256 7.4654 7.4654 8.2202 8.2202 8.3766 8.3766 8.6656 8.6656 9.8930 9.8930 10.4872 10.4872 10.6956 10.6956 11.0420 11.0420 11.4861 11.4861 11.6653 11.6653 11.8146 11.8146 12.1317 12.1317 12.7080 12.7080 12.8446 12.8446 13.6002 13.6002 14.0230 14.0230 14.1905 14.1905 14.7259 14.7259 15.5758 15.5758 16.2101 16.2101 16.9052 16.9052 17.8337 17.8337 k =-0.1064 0.0614 0.1228 ( 4453 PWs) bands (ev): 1.0899 1.0899 1.1030 1.1030 1.1154 1.1154 1.1367 1.1367 1.1535 1.1535 1.1834 1.1834 1.1981 1.1981 1.2091 1.2091 3.1007 3.1007 3.1262 3.1262 3.1778 3.1778 3.1990 3.1990 3.2339 3.2339 3.2497 3.2497 3.2831 3.2831 3.2975 3.2975 3.3419 3.3419 3.3681 3.3681 3.4338 3.4338 3.5497 3.5497 3.6224 3.6224 7.4815 7.4815 8.2228 8.2228 8.3793 8.3793 8.6831 8.6831 9.9500 9.9500 10.4859 10.4859 10.7344 10.7344 11.0636 11.0636 11.5255 11.5255 11.7224 11.7224 11.8465 11.8465 12.1266 12.1266 12.7067 12.7067 12.8375 12.8375 13.5632 13.5632 13.9684 13.9684 14.1260 14.1260 14.7447 14.7447 15.4760 15.4760 16.0611 16.0611 16.8371 16.8371 17.8275 17.8275 k =-0.0957 0.0552 0.1105 ( 4457 PWs) bands (ev): 1.0903 1.0903 1.1038 1.1038 1.1134 1.1134 1.1369 1.1369 1.1542 1.1542 1.1852 1.1852 1.1971 1.1971 1.2090 1.2090 3.1004 3.1004 3.1270 3.1270 3.1815 3.1815 3.1951 3.1951 3.2320 3.2320 3.2484 3.2484 3.2716 3.2716 3.2924 3.2924 3.3253 3.3253 3.3673 3.3673 3.4419 3.4419 3.5480 3.5480 3.6193 3.6193 7.4963 7.4963 8.2248 8.2248 8.3810 8.3810 8.6991 8.6991 10.0035 10.0035 10.4842 10.4842 10.7782 10.7782 11.0818 11.0818 11.5564 11.5564 11.7874 11.7874 11.8686 11.8686 12.1195 12.1195 12.7030 12.7030 12.8444 12.8444 13.5237 13.5237 13.9220 13.9220 14.0556 14.0556 14.7664 14.7664 15.3833 15.3833 15.9169 15.9169 16.7638 16.7638 17.7765 17.7765 k =-0.0851 0.0491 0.0982 ( 4471 PWs) bands (ev): 1.0907 1.0907 1.1045 1.1045 1.1115 1.1115 1.1371 1.1371 1.1548 1.1548 1.1870 1.1870 1.1960 1.1960 1.2088 1.2088 3.1001 3.1001 3.1269 3.1269 3.1840 3.1840 3.1906 3.1906 3.2298 3.2298 3.2466 3.2466 3.2590 3.2590 3.2877 3.2877 3.3153 3.3153 3.3676 3.3676 3.4498 3.4498 3.5461 3.5461 3.6162 3.6162 7.5100 7.5100 8.2261 8.2261 8.3821 8.3821 8.7135 8.7135 10.0522 10.0522 10.4821 10.4821 10.8270 10.8270 11.0975 11.0975 11.5820 11.5820 11.8518 11.8518 11.8848 11.8848 12.1104 12.1104 12.6972 12.6972 12.8616 12.8616 13.4838 13.4838 13.8838 13.8838 13.9858 13.9858 14.7872 14.7872 15.2981 15.2981 15.7789 15.7789 16.6882 16.6882 17.7338 17.7338 k =-0.0745 0.0430 0.0860 ( 4475 PWs) bands (ev): 1.0911 1.0911 1.1052 1.1052 1.1099 1.1099 1.1373 1.1373 1.1553 1.1553 1.1887 1.1887 1.1950 1.1950 1.2087 1.2087 3.0999 3.0999 3.1255 3.1255 3.1808 3.1808 3.1901 3.1901 3.2276 3.2276 3.2409 3.2409 3.2528 3.2528 3.2834 3.2834 3.3085 3.3085 3.3685 3.3685 3.4574 3.4574 3.5441 3.5441 3.6132 3.6132 7.5222 7.5222 8.2269 8.2269 8.3830 8.3830 8.7260 8.7260 10.0950 10.0950 10.4799 10.4799 10.8801 10.8801 11.1113 11.1113 11.6049 11.6049 11.8790 11.8790 11.9287 11.9287 12.0998 12.0998 12.6899 12.6899 12.8826 12.8826 13.4479 13.4479 13.8524 13.8524 13.9213 13.9213 14.8053 14.8053 15.2209 15.2209 15.6488 15.6488 16.6133 16.6133 17.6996 17.6996 k =-0.0638 0.0368 0.0737 ( 4487 PWs) bands (ev): 1.0914 1.0914 1.1057 1.1057 1.1085 1.1085 1.1375 1.1375 1.1558 1.1558 1.1901 1.1901 1.1941 1.1941 1.2084 1.2084 3.0997 3.0997 3.1220 3.1220 3.1742 3.1742 3.1927 3.1927 3.2256 3.2256 3.2335 3.2335 3.2524 3.2524 3.2798 3.2798 3.3030 3.3030 3.3697 3.3697 3.4647 3.4647 3.5420 3.5420 3.6104 3.6104 7.5331 7.5331 8.2272 8.2272 8.3837 8.3837 8.7367 8.7367 10.1315 10.1315 10.4777 10.4777 10.9360 10.9360 11.1236 11.1236 11.6260 11.6260 11.8798 11.8798 11.9857 11.9857 12.0908 12.0908 12.6819 12.6819 12.9001 12.9001 13.4216 13.4216 13.8236 13.8236 13.8679 13.8679 14.8199 14.8199 15.1519 15.1519 15.5287 15.5287 16.5420 16.5420 17.6726 17.6726 k =-0.0532 0.0307 0.0614 ( 4495 PWs) bands (ev): 1.0917 1.0917 1.1059 1.1059 1.1076 1.1076 1.1377 1.1377 1.1562 1.1562 1.1912 1.1912 1.1935 1.1935 1.2081 1.2081 3.0996 3.0996 3.1165 3.1165 3.1687 3.1687 3.1954 3.1954 3.2236 3.2236 3.2281 3.2281 3.2535 3.2535 3.2766 3.2766 3.2979 3.2979 3.3711 3.3711 3.4714 3.4714 3.5398 3.5398 3.6079 3.6079 7.5425 7.5425 8.2273 8.2273 8.3844 8.3844 8.7457 8.7457 10.1616 10.1616 10.4755 10.4755 10.9922 10.9922 11.1346 11.1346 11.6461 11.6461 11.8754 11.8754 12.0214 12.0214 12.0965 12.0965 12.6737 12.6737 12.9079 12.9079 13.4099 13.4099 13.7890 13.7890 13.8340 13.8340 14.8304 14.8304 15.0916 15.0916 15.4210 15.4210 16.4770 16.4770 17.6517 17.6517 k =-0.0426 0.0245 0.0491 ( 4495 PWs) bands (ev): 1.0920 1.0920 1.1053 1.1053 1.1075 1.1075 1.1379 1.1379 1.1566 1.1566 1.1914 1.1914 1.1938 1.1938 1.2078 1.2078 3.0994 3.0994 3.1099 3.1099 3.1651 3.1651 3.1980 3.1980 3.2208 3.2208 3.2253 3.2253 3.2553 3.2553 3.2741 3.2741 3.2931 3.2931 3.3724 3.3724 3.4775 3.4775 3.5375 3.5375 3.6057 3.6057 7.5503 7.5503 8.2271 8.2271 8.3850 8.3850 8.7529 8.7529 10.1855 10.1855 10.4735 10.4735 11.0453 11.0453 11.1450 11.1450 11.6652 11.6652 11.8687 11.8687 12.0211 12.0211 12.1293 12.1293 12.6659 12.6659 12.9040 12.9040 13.4135 13.4135 13.7515 13.7515 13.8166 13.8166 14.8365 14.8365 15.0408 15.0408 15.3286 15.3286 16.4205 16.4205 17.6357 17.6357 k =-0.0319 0.0184 0.0368 ( 4491 PWs) bands (ev): 1.0922 1.0922 1.1046 1.1046 1.1078 1.1078 1.1382 1.1382 1.1568 1.1568 1.1910 1.1910 1.1946 1.1946 1.2075 1.2075 3.0988 3.0988 3.1037 3.1037 3.1631 3.1631 3.2006 3.2006 3.2175 3.2175 3.2243 3.2243 3.2576 3.2576 3.2722 3.2722 3.2885 3.2885 3.3736 3.3736 3.4828 3.4828 3.5352 3.5352 3.6039 3.6039 7.5564 7.5564 8.2268 8.2268 8.3856 8.3856 8.7584 8.7584 10.2035 10.2035 10.4719 10.4719 11.0904 11.0904 11.1557 11.1557 11.6831 11.6831 11.8613 11.8613 12.0059 12.0059 12.1672 12.1672 12.6589 12.6589 12.8917 12.8917 13.4278 13.4278 13.7199 13.7199 13.8067 13.8067 14.8376 14.8376 15.0008 15.0008 15.2544 15.2544 16.3744 16.3744 17.6239 17.6239 k =-0.0213 0.0123 0.0246 ( 4483 PWs) bands (ev): 1.0923 1.0923 1.1040 1.1040 1.1081 1.1081 1.1384 1.1384 1.1569 1.1569 1.1906 1.1906 1.1954 1.1954 1.2072 1.2072 3.0962 3.0962 3.1007 3.1007 3.1621 3.1621 3.2031 3.2031 3.2143 3.2143 3.2239 3.2239 3.2598 3.2598 3.2712 3.2712 3.2844 3.2844 3.3745 3.3745 3.4870 3.4870 3.5333 3.5333 3.6026 3.6026 7.5608 7.5608 8.2266 8.2266 8.3860 8.3860 8.7623 8.7623 10.2161 10.2161 10.4706 10.4706 11.1210 11.1210 11.1693 11.1693 11.6988 11.6988 11.8542 11.8542 11.9891 11.9891 12.1978 12.1978 12.6533 12.6533 12.8772 12.8772 13.4453 13.4453 13.6971 13.6971 13.8007 13.8007 14.8342 14.8342 14.9731 14.9731 15.2004 15.2004 16.3404 16.3404 17.6159 17.6159 k =-0.0106 0.0061 0.0123 ( 4479 PWs) bands (ev): 1.0924 1.0924 1.1037 1.1037 1.1083 1.1083 1.1385 1.1385 1.1570 1.1570 1.1903 1.1903 1.1959 1.1959 1.2070 1.2070 3.0932 3.0932 3.1003 3.1003 3.1616 3.1616 3.2057 3.2057 3.2113 3.2113 3.2237 3.2237 3.2616 3.2616 3.2710 3.2710 3.2810 3.2810 3.3751 3.3751 3.4897 3.4897 3.5319 3.5319 3.6018 3.6018 7.5635 7.5635 8.2264 8.2264 8.3862 8.3862 8.7646 8.7646 10.2235 10.2235 10.4698 10.4698 11.1352 11.1352 11.1836 11.1836 11.7104 11.7104 11.8489 11.8489 11.9763 11.9763 12.2173 12.2173 12.6496 12.6496 12.8661 12.8661 13.4588 13.4588 13.6835 13.6835 13.7976 13.7976 14.8290 14.8290 14.9577 14.9577 15.1679 15.1679 16.3195 16.3195 17.6112 17.6112 k = 0.0000 0.0000 0.0000 ( 4479 PWs) bands (ev): 1.0925 1.0925 1.1035 1.1035 1.1083 1.1083 1.1386 1.1386 1.1570 1.1570 1.1902 1.1902 1.1961 1.1961 1.2069 1.2069 3.0921 3.0921 3.1002 3.1002 3.1615 3.1615 3.2079 3.2079 3.2089 3.2089 3.2236 3.2236 3.2622 3.2622 3.2711 3.2711 3.2796 3.2796 3.3753 3.3753 3.4906 3.4906 3.5314 3.5314 3.6015 3.6015 7.5644 7.5644 8.2263 8.2263 8.3863 8.3863 8.7654 8.7654 10.2260 10.2260 10.4696 10.4696 11.1389 11.1389 11.1898 11.1898 11.7148 11.7148 11.8468 11.8468 11.9715 11.9715 12.2239 12.2239 12.6483 12.6483 12.8620 12.8620 13.4638 13.4638 13.6791 13.6791 13.7966 13.7966 14.8266 14.8266 14.9530 14.9530 15.1571 15.1571 16.3124 16.3124 17.6096 17.6096 k = 0.0000 0.0000 0.0000 ( 4479 PWs) bands (ev): 1.0925 1.0925 1.1035 1.1035 1.1083 1.1083 1.1386 1.1386 1.1570 1.1570 1.1902 1.1902 1.1961 1.1961 1.2069 1.2069 3.0921 3.0921 3.1002 3.1002 3.1615 3.1615 3.2079 3.2079 3.2089 3.2089 3.2236 3.2236 3.2622 3.2622 3.2711 3.2711 3.2796 3.2796 3.3753 3.3753 3.4906 3.4906 3.5314 3.5314 3.6015 3.6015 7.5644 7.5644 8.2263 8.2263 8.3863 8.3863 8.7654 8.7654 10.2260 10.2260 10.4696 10.4696 11.1389 11.1389 11.1898 11.1898 11.7148 11.7148 11.8468 11.8468 11.9715 11.9715 12.2239 12.2239 12.6483 12.6483 12.8620 12.8620 13.4638 13.4638 13.6791 13.6791 13.7966 13.7966 14.8266 14.8266 14.9530 14.9530 15.1571 15.1571 16.3124 16.3124 17.6096 17.6096 k = 0.0087 0.0150 0.0000 ( 4479 PWs) bands (ev): 1.0925 1.0925 1.1037 1.1037 1.1083 1.1083 1.1385 1.1385 1.1571 1.1571 1.1901 1.1901 1.1956 1.1956 1.2074 1.2074 3.0922 3.0922 3.1008 3.1008 3.1620 3.1620 3.2044 3.2044 3.2123 3.2123 3.2239 3.2239 3.2623 3.2623 3.2699 3.2699 3.2812 3.2812 3.3756 3.3756 3.4899 3.4899 3.5314 3.5314 3.6019 3.6019 7.5655 7.5655 8.2256 8.2256 8.3853 8.3853 8.7676 8.7676 10.2254 10.2254 10.4675 10.4675 11.1358 11.1358 11.1883 11.1883 11.6984 11.6984 11.8624 11.8624 11.9748 11.9748 12.2206 12.2206 12.6500 12.6500 12.8613 12.8613 13.4513 13.4513 13.6676 13.6676 13.7804 13.7804 14.8483 14.8483 14.9661 14.9661 15.1612 15.1612 16.3225 16.3225 17.6207 17.6207 k = 0.0173 0.0301 0.0000 ( 4487 PWs) bands (ev): 1.0926 1.0926 1.1041 1.1041 1.1082 1.1082 1.1383 1.1383 1.1572 1.1572 1.1898 1.1898 1.1943 1.1943 1.2084 1.2084 3.0920 3.0920 3.1033 3.1033 3.1637 3.1637 3.2003 3.2003 3.2159 3.2159 3.2248 3.2248 3.2623 3.2623 3.2679 3.2679 3.2847 3.2847 3.3764 3.3764 3.4879 3.4879 3.5314 3.5314 3.6029 3.6029 7.5689 7.5689 8.2233 8.2233 8.3822 8.3822 8.7741 8.7741 10.2235 10.2235 10.4615 10.4615 11.1267 11.1267 11.1838 11.1838 11.6623 11.6623 11.8964 11.8964 11.9843 11.9843 12.2107 12.2107 12.6552 12.6552 12.8590 12.8590 13.4136 13.4136 13.6373 13.6373 13.7352 13.7352 14.9099 14.9099 14.9945 14.9945 15.1817 15.1817 16.3520 16.3520 17.6535 17.6535 k = 0.0260 0.0451 0.0000 ( 4499 PWs) bands (ev): 1.0928 1.0928 1.1048 1.1048 1.1079 1.1079 1.1380 1.1380 1.1574 1.1574 1.1890 1.1890 1.1930 1.1930 1.2096 1.2096 3.0906 3.0906 3.1083 3.1083 3.1663 3.1663 3.1960 3.1960 3.2194 3.2194 3.2265 3.2265 3.2615 3.2615 3.2671 3.2671 3.2888 3.2888 3.3777 3.3777 3.4847 3.4847 3.5313 3.5313 3.6045 3.6045 7.5744 7.5744 8.2194 8.2194 8.3771 8.3771 8.7850 8.7850 10.2200 10.2200 10.4519 10.4519 11.1120 11.1120 11.1764 11.1764 11.6195 11.6195 11.9356 11.9356 11.9990 11.9990 12.1949 12.1949 12.6637 12.6637 12.8544 12.8544 13.3511 13.3511 13.5975 13.5975 13.6683 13.6683 15.0035 15.0035 15.0124 15.0124 15.2381 15.2381 16.3998 16.3998 17.7071 17.7071 k = 0.0347 0.0602 0.0000 ( 4507 PWs) bands (ev): 1.0930 1.0930 1.1058 1.1058 1.1077 1.1077 1.1376 1.1376 1.1577 1.1577 1.1872 1.1872 1.1923 1.1923 1.2109 1.2109 3.0882 3.0882 3.1152 3.1152 3.1698 3.1698 3.1915 3.1915 3.2227 3.2227 3.2296 3.2296 3.2597 3.2597 3.2678 3.2678 3.2934 3.2934 3.3795 3.3795 3.4804 3.4804 3.5313 3.5313 3.6067 3.6067 7.5821 7.5821 8.2140 8.2140 8.3698 8.3698 8.8002 8.8002 10.2142 10.2142 10.4392 10.4392 11.0923 11.0923 11.1663 11.1663 11.5749 11.5749 11.9754 11.9754 12.0162 12.0162 12.1751 12.1751 12.6755 12.6755 12.8464 12.8464 13.2677 13.2677 13.5552 13.5552 13.5877 13.5877 15.0090 15.0090 15.1207 15.1207 15.3351 15.3351 16.4641 16.4641 17.7800 17.7800 k = 0.0434 0.0752 0.0000 ( 4507 PWs) bands (ev): 1.0933 1.0933 1.1068 1.1068 1.1076 1.1076 1.1370 1.1370 1.1581 1.1581 1.1847 1.1847 1.1921 1.1921 1.2122 1.2122 3.0853 3.0853 3.1230 3.1230 3.1740 3.1740 3.1869 3.1869 3.2258 3.2258 3.2348 3.2348 3.2581 3.2581 3.2693 3.2693 3.2982 3.2982 3.3817 3.3817 3.4752 3.4752 3.5312 3.5312 3.6092 3.6092 7.5920 7.5920 8.2070 8.2070 8.3605 8.3605 8.8197 8.8197 10.2050 10.2050 10.4244 10.4244 11.0685 11.0685 11.1538 11.1538 11.5303 11.5303 12.0139 12.0139 12.0304 12.0304 12.1560 12.1560 12.6906 12.6906 12.8329 12.8329 13.1700 13.1700 13.4998 13.4998 13.5145 13.5145 14.9921 14.9921 15.2551 15.2551 15.4601 15.4601 16.5429 16.5429 17.8705 17.8705 k = 0.0520 0.0902 0.0000 ( 4491 PWs) bands (ev): 1.0937 1.0937 1.1067 1.1067 1.1087 1.1087 1.1364 1.1364 1.1586 1.1586 1.1818 1.1818 1.1922 1.1922 1.2133 1.2133 3.0819 3.0819 3.1306 3.1306 3.1773 3.1773 3.1838 3.1838 3.2284 3.2284 3.2431 3.2431 3.2573 3.2573 3.2710 3.2710 3.3032 3.3032 3.3843 3.3843 3.4694 3.4694 3.5311 3.5311 3.6120 3.6120 7.6038 7.6038 8.1984 8.1984 8.3491 8.3491 8.8435 8.8435 10.1909 10.1909 10.4089 10.4089 11.0412 11.0412 11.1393 11.1393 11.4867 11.4867 12.0292 12.0292 12.0503 12.0503 12.1486 12.1486 12.7086 12.7086 12.8106 12.8106 13.0659 13.0659 13.4094 13.4094 13.4775 13.4775 14.9690 14.9690 15.4019 15.4019 15.6031 15.6031 16.6344 16.6344 17.9763 17.9763 k = 0.0607 0.1053 0.0000 ( 4479 PWs) bands (ev): 1.0941 1.0941 1.1062 1.1062 1.1104 1.1104 1.1356 1.1356 1.1592 1.1592 1.1787 1.1787 1.1924 1.1924 1.2142 1.2142 3.0784 3.0784 3.1370 3.1370 3.1744 3.1744 3.1872 3.1872 3.2302 3.2302 3.2557 3.2557 3.2576 3.2576 3.2729 3.2729 3.3085 3.3085 3.3871 3.3871 3.4630 3.4630 3.5309 3.5309 3.6149 3.6149 7.6175 7.6175 8.1880 8.1880 8.3355 8.3355 8.8714 8.8714 10.1704 10.1704 10.3945 10.3945 11.0112 11.0112 11.1232 11.1232 11.4445 11.4445 12.0040 12.0040 12.0840 12.0840 12.1598 12.1598 12.7293 12.7293 12.7736 12.7736 12.9656 12.9656 13.3198 13.3198 13.4465 13.4465 14.9431 14.9431 15.5582 15.5582 15.7586 15.7586 16.7371 16.7371 18.0955 18.0955 k = 0.0694 0.1203 0.0000 ( 4463 PWs) bands (ev): 1.0945 1.0945 1.1058 1.1058 1.1124 1.1124 1.1348 1.1348 1.1599 1.1599 1.1755 1.1755 1.1926 1.1926 1.2150 1.2150 3.0747 3.0747 3.1417 3.1417 3.1690 3.1690 3.1929 3.1929 3.2311 3.2311 3.2592 3.2592 3.2735 3.2735 3.2747 3.2747 3.3141 3.3141 3.3902 3.3902 3.4564 3.4564 3.5307 3.5307 3.6178 3.6178 7.6330 7.6330 8.1760 8.1760 8.3198 8.3198 8.9034 8.9034 10.1421 10.1421 10.3825 10.3825 10.9790 10.9790 11.1061 11.1061 11.4038 11.4038 11.9612 11.9612 12.1146 12.1146 12.1795 12.1795 12.7135 12.7135 12.7520 12.7520 12.8827 12.8827 13.2337 13.2337 13.4232 13.4232 14.9166 14.9166 15.7217 15.7217 15.9236 15.9236 16.8495 16.8495 18.2257 18.2257 k = 0.0781 0.1353 0.0000 ( 4463 PWs) bands (ev): 1.0949 1.0949 1.1053 1.1053 1.1145 1.1145 1.1338 1.1338 1.1606 1.1606 1.1722 1.1722 1.1928 1.1928 1.2155 1.2155 3.0710 3.0710 3.1446 3.1446 3.1630 3.1630 3.1988 3.1988 3.2311 3.2311 3.2622 3.2622 3.2763 3.2763 3.2964 3.2964 3.3198 3.3198 3.3934 3.3934 3.4499 3.4499 3.5303 3.5303 3.6208 3.6208 7.6501 7.6501 8.1621 8.1621 8.3019 8.3019 8.9395 8.9395 10.1057 10.1057 10.3738 10.3738 10.9452 10.9452 11.0885 11.0885 11.3645 11.3645 11.9081 11.9081 12.1419 12.1419 12.1932 12.1932 12.6346 12.6346 12.7751 12.7751 12.8218 12.8218 13.1543 13.1543 13.4086 13.4086 14.8906 14.8906 15.8909 15.8909 16.0961 16.0961 16.9705 16.9705 18.3647 18.3647 k = 0.0867 0.1504 0.0000 ( 4463 PWs) bands (ev): 1.0951 1.0951 1.1048 1.1048 1.1167 1.1167 1.1328 1.1328 1.1613 1.1613 1.1691 1.1691 1.1931 1.1931 1.2159 1.2159 3.0673 3.0673 3.1460 3.1460 3.1567 3.1567 3.2046 3.2046 3.2305 3.2305 3.2661 3.2661 3.2777 3.2777 3.3236 3.3236 3.3260 3.3260 3.3968 3.3968 3.4439 3.4439 3.5299 3.5299 3.6239 3.6239 7.6685 7.6685 8.1464 8.1464 8.2819 8.2819 8.9795 8.9795 10.0615 10.0615 10.3681 10.3681 10.9102 10.9102 11.0709 11.0709 11.3264 11.3264 11.8478 11.8478 12.1657 12.1657 12.1828 12.1828 12.5636 12.5636 12.7737 12.7737 12.7956 12.7956 13.0858 13.0858 13.4029 13.4029 14.8658 14.8658 16.0647 16.0647 16.2749 16.2749 17.0991 17.0991 18.5098 18.5098 k = 0.0954 0.1654 0.0000 ( 4455 PWs) bands (ev): 1.0953 1.0953 1.1045 1.1045 1.1191 1.1191 1.1317 1.1317 1.1616 1.1616 1.1664 1.1664 1.1933 1.1933 1.2161 1.2161 3.0638 3.0638 3.1464 3.1464 3.1502 3.1502 3.2103 3.2103 3.2296 3.2296 3.2707 3.2707 3.2790 3.2790 3.3317 3.3317 3.3542 3.3542 3.4003 3.4003 3.4398 3.4398 3.5294 3.5294 3.6269 3.6269 7.6881 7.6881 8.1289 8.1289 8.2597 8.2597 9.0232 9.0232 10.0106 10.0106 10.3651 10.3651 10.8744 10.8744 11.0538 11.0538 11.2893 11.2893 11.7814 11.7814 12.1290 12.1290 12.1858 12.1858 12.5266 12.5266 12.7325 12.7325 12.8062 12.8062 13.0362 13.0362 13.4054 13.4054 14.8427 14.8427 16.2419 16.2419 16.4588 16.4588 17.2344 17.2344 18.6576 18.6576 k = 0.1041 0.1805 0.0000 ( 4463 PWs) bands (ev): 1.0952 1.0952 1.1043 1.1043 1.1214 1.1214 1.1306 1.1306 1.1604 1.1604 1.1654 1.1654 1.1936 1.1936 1.2161 1.2161 3.0603 3.0603 3.1431 3.1431 3.1463 3.1463 3.2159 3.2159 3.2284 3.2284 3.2751 3.2751 3.2805 3.2805 3.3380 3.3380 3.3828 3.3828 3.4039 3.4039 3.4417 3.4417 3.5288 3.5288 3.6302 3.6302 7.7085 7.7085 8.1094 8.1094 8.2354 8.2354 9.0706 9.0706 9.9546 9.9546 10.3640 10.3640 10.8381 10.8381 11.0376 11.0376 11.2528 11.2528 11.7095 11.7095 12.0342 12.0342 12.2020 12.2020 12.5208 12.5208 12.7010 12.7010 12.7965 12.7965 13.0166 13.0166 13.4152 13.4152 14.8215 14.8215 16.4218 16.4218 16.6473 16.6473 17.3758 17.3758 18.8031 18.8031 k = 0.1128 0.1955 0.0000 ( 4463 PWs) bands (ev): 1.0949 1.0949 1.1044 1.1044 1.1237 1.1237 1.1296 1.1296 1.1577 1.1577 1.1661 1.1661 1.1939 1.1939 1.2160 1.2160 3.0572 3.0572 3.1363 3.1363 3.1453 3.1453 3.2214 3.2214 3.2272 3.2272 3.2771 3.2771 3.2844 3.2844 3.3443 3.3443 3.3984 3.3984 3.4075 3.4075 3.4604 3.4604 3.5280 3.5280 3.6339 3.6339 7.7294 7.7294 8.0880 8.0880 8.2090 8.2090 9.1214 9.1214 9.8947 9.8947 10.3641 10.3641 10.8016 10.8016 11.0224 11.0224 11.2170 11.2170 11.6312 11.6312 11.9176 11.9176 12.2142 12.2142 12.5183 12.5183 12.6910 12.6910 12.7658 12.7658 13.0284 13.0284 13.4315 13.4315 14.8025 14.8025 16.6034 16.6034 16.8396 16.8396 17.5225 17.5225 18.9378 18.9378 k = 0.1214 0.2105 0.0000 ( 4459 PWs) bands (ev): 1.0943 1.0943 1.1046 1.1046 1.1253 1.1253 1.1293 1.1293 1.1547 1.1547 1.1673 1.1673 1.1941 1.1941 1.2156 1.2156 3.0542 3.0542 3.1293 3.1293 3.1440 3.1440 3.2258 3.2258 3.2269 3.2269 3.2770 3.2770 3.2902 3.2902 3.3507 3.3507 3.4004 3.4004 3.4111 3.4111 3.4962 3.4962 3.5271 3.5271 3.6388 3.6388 7.7503 7.7503 8.0647 8.0647 8.1806 8.1806 9.1753 9.1753 9.8324 9.8324 10.3649 10.3649 10.7653 10.7653 11.0085 11.0085 11.1817 11.1817 11.5445 11.5445 11.7946 11.7946 12.2221 12.2221 12.4977 12.4977 12.7125 12.7125 12.7257 12.7257 13.0603 13.0603 13.4531 13.4531 14.7857 14.7857 16.7857 16.7857 17.0353 17.0353 17.6738 17.6738 19.0485 19.0485 k = 0.1301 0.2256 0.0000 ( 4455 PWs) bands (ev): 1.0935 1.0935 1.1051 1.1051 1.1252 1.1252 1.1306 1.1306 1.1517 1.1517 1.1687 1.1687 1.1944 1.1944 1.2152 1.2152 3.0516 3.0516 3.1222 3.1222 3.1424 3.1424 3.2244 3.2244 3.2319 3.2319 3.2760 3.2760 3.2967 3.2967 3.3572 3.3572 3.3980 3.3980 3.4146 3.4146 3.5260 3.5260 3.5376 3.5376 3.6467 3.6467 7.7707 7.7707 8.0394 8.0394 8.1502 8.1502 9.2321 9.2321 9.7689 9.7689 10.3659 10.3659 10.7294 10.7294 10.9956 10.9956 11.1472 11.1472 11.4458 11.4458 11.6761 11.6761 12.2258 12.2258 12.4618 12.4618 12.6854 12.6854 12.7577 12.7577 13.1035 13.1035 13.4795 13.4795 14.7712 14.7712 16.9675 16.9675 17.2338 17.2338 17.8292 17.8292 19.1216 19.1216 k = 0.1388 0.2406 0.0000 ( 4451 PWs) bands (ev): 1.0926 1.0926 1.1056 1.1056 1.1242 1.1242 1.1326 1.1326 1.1488 1.1488 1.1703 1.1703 1.1947 1.1947 1.2146 1.2146 3.0493 3.0493 3.1152 3.1152 3.1406 3.1406 3.2229 3.2229 3.2363 3.2363 3.2746 3.2746 3.3036 3.3036 3.3638 3.3638 3.3947 3.3947 3.4182 3.4182 3.5248 3.5248 3.5757 3.5757 3.6631 3.6631 7.7900 7.7900 8.0121 8.0121 8.1181 8.1181 9.2914 9.2914 9.7055 9.7055 10.3667 10.3667 10.6942 10.6942 10.9834 10.9834 11.1139 11.1139 11.3316 11.3316 11.5690 11.5690 12.2253 12.2253 12.4190 12.4190 12.6490 12.6490 12.8158 12.8158 13.1540 13.1540 13.5099 13.5099 14.7588 14.7588 17.1473 17.1473 17.4348 17.4348 17.9881 17.9881 19.1545 19.1545 k = 0.1475 0.2556 0.0000 ( 4455 PWs) bands (ev): 1.0915 1.0915 1.1062 1.1062 1.1229 1.1229 1.1347 1.1347 1.1461 1.1461 1.1720 1.1720 1.1949 1.1949 1.2139 1.2139 3.0473 3.0473 3.1082 3.1082 3.1388 3.1388 3.2213 3.2213 3.2395 3.2395 3.2733 3.2733 3.3108 3.3108 3.3703 3.3703 3.3917 3.3917 3.4218 3.4218 3.5233 3.5233 3.6004 3.6004 3.6969 3.6969 7.8074 7.8074 7.9830 7.9830 8.0843 8.0843 9.3527 9.3527 9.6436 9.6436 10.3669 10.3669 10.6601 10.6601 10.9708 10.9708 11.0832 11.0832 11.2027 11.2027 11.4750 11.4750 12.2209 12.2209 12.3738 12.3738 12.6181 12.6181 12.8814 12.8814 13.2097 13.2097 13.5441 13.5441 14.7486 14.7486 17.3229 17.3229 17.6376 17.6376 18.1498 18.1498 19.1543 19.1543 k = 0.1561 0.2707 0.0000 ( 4447 PWs) bands (ev): 1.0904 1.0904 1.1069 1.1069 1.1215 1.1215 1.1362 1.1362 1.1440 1.1440 1.1739 1.1739 1.1952 1.1952 1.2131 1.2131 3.0457 3.0457 3.1013 3.1013 3.1368 3.1368 3.2196 3.2196 3.2407 3.2407 3.2731 3.2731 3.3181 3.3181 3.3768 3.3768 3.3895 3.3895 3.4254 3.4254 3.5217 3.5217 3.6117 3.6117 3.7477 3.7477 7.8220 7.8220 7.9520 7.9520 8.0491 8.0491 9.4154 9.4154 9.5845 9.5845 10.3662 10.3662 10.6274 10.6274 10.9562 10.9562 11.0568 11.0568 11.0637 11.0637 11.3912 11.3912 12.2133 12.2133 12.3282 12.3282 12.5930 12.5930 12.9519 12.9519 13.2700 13.2700 13.5816 13.5816 14.7406 14.7406 17.4912 17.4912 17.8419 17.8419 18.3139 18.3139 19.1286 19.1286 k = 0.1648 0.2857 0.0000 ( 4439 PWs) bands (ev): 1.0892 1.0892 1.1077 1.1077 1.1202 1.1202 1.1366 1.1366 1.1431 1.1431 1.1760 1.1760 1.1955 1.1955 1.2122 1.2122 3.0446 3.0446 3.0945 3.0945 3.1348 3.1348 3.2177 3.2177 3.2394 3.2394 3.2746 3.2746 3.3256 3.3256 3.3825 3.3825 3.3887 3.3887 3.4289 3.4289 3.5198 3.5198 3.6167 3.6167 3.8083 3.8083 7.8327 7.8327 7.9193 7.9193 8.0129 8.0129 9.4787 9.4787 9.5294 9.5294 10.3643 10.3643 10.5967 10.5967 10.9189 10.9189 10.9372 10.9372 11.0375 11.0375 11.3142 11.3142 12.2032 12.2032 12.2832 12.2832 12.5732 12.5732 13.0260 13.0260 13.3343 13.3343 13.6224 13.6224 14.7346 14.7346 17.6467 17.6467 18.0470 18.0470 18.4797 18.4797 19.0845 19.0845 k = 0.1735 0.3008 0.0000 ( 4439 PWs) bands (ev): 1.0880 1.0880 1.1084 1.1084 1.1188 1.1188 1.1354 1.1354 1.1436 1.1436 1.1781 1.1781 1.1958 1.1958 1.2112 1.2112 3.0439 3.0439 3.0878 3.0878 3.1328 3.1328 3.2157 3.2157 3.2355 3.2355 3.2779 3.2779 3.3330 3.3330 3.3848 3.3848 3.3921 3.3921 3.4323 3.4323 3.5179 3.5179 3.6190 3.6190 3.8751 3.8751 7.8382 7.8382 7.8849 7.8849 7.9763 7.9763 9.4796 9.4796 9.5415 9.5415 10.3609 10.3609 10.5682 10.5682 10.7721 10.7721 10.9129 10.9129 11.0264 11.0264 11.2419 11.2419 12.1917 12.1917 12.2396 12.2396 12.5580 12.5580 13.1026 13.1026 13.4024 13.4024 13.6663 13.6663 14.7305 14.7305 17.7808 17.7808 18.2522 18.2522 18.6465 18.6465 19.0323 19.0323 k = 0.1822 0.3158 0.0000 ( 4447 PWs) bands (ev): 1.0867 1.0867 1.1091 1.1091 1.1174 1.1174 1.1335 1.1335 1.1447 1.1447 1.1805 1.1805 1.1961 1.1961 1.2102 1.2102 3.0436 3.0436 3.0814 3.0814 3.1308 3.1308 3.2134 3.2134 3.2300 3.2300 3.2822 3.2822 3.3405 3.3405 3.3849 3.3849 3.3984 3.3984 3.4355 3.4355 3.5158 3.5158 3.6198 3.6198 3.9465 3.9465 7.8367 7.8367 7.8489 7.8489 7.9402 7.9402 9.4364 9.4364 9.6027 9.6027 10.3557 10.3557 10.5395 10.5395 10.6283 10.6283 10.8847 10.8847 11.0225 11.0225 11.1731 11.1731 12.1796 12.1796 12.1978 12.1978 12.5464 12.5464 13.1812 13.1812 13.4740 13.4740 13.7134 13.7134 14.7284 14.7284 17.8796 17.8796 18.4568 18.4568 18.8139 18.8139 18.9888 18.9888 k = 0.1908 0.3308 0.0000 ( 4459 PWs) bands (ev): 1.0856 1.0856 1.1098 1.1098 1.1161 1.1161 1.1314 1.1314 1.1457 1.1457 1.1829 1.1829 1.1965 1.1965 1.2091 1.2091 3.0437 3.0437 3.0752 3.0752 3.1288 3.1288 3.2109 3.2109 3.2234 3.2234 3.2872 3.2872 3.3478 3.3478 3.3851 3.3851 3.4052 3.4052 3.4385 3.4385 3.5136 3.5136 3.6196 3.6196 4.0221 4.0221 7.8115 7.8115 7.8259 7.8259 7.9064 7.9064 9.4008 9.4008 9.6603 9.6603 10.3486 10.3486 10.4596 10.4596 10.5413 10.5413 10.8546 10.8546 11.0240 11.0240 11.1072 11.1072 12.1581 12.1581 12.1679 12.1679 12.5378 12.5378 13.2611 13.2611 13.5489 13.5489 13.7639 13.7639 14.7282 14.7282 17.9248 17.9248 18.6598 18.6598 18.9753 18.9753 18.9815 18.9815 k = 0.1995 0.3459 0.0000 ( 4455 PWs) bands (ev): 1.0844 1.0844 1.1104 1.1104 1.1148 1.1148 1.1295 1.1295 1.1465 1.1465 1.1854 1.1854 1.1969 1.1969 1.2081 1.2081 3.0444 3.0444 3.0692 3.0692 3.1269 3.1269 3.2080 3.2080 3.2162 3.2162 3.2925 3.2925 3.3550 3.3550 3.3857 3.3857 3.4122 3.4122 3.4412 3.4412 3.5114 3.5114 3.6188 3.6188 4.1016 4.1016 7.7729 7.7729 7.8039 7.8039 7.8761 7.8761 9.3738 9.3738 9.7124 9.7124 10.3179 10.3179 10.3393 10.3393 10.5239 10.5239 10.8242 10.8242 11.0295 11.0295 11.0439 11.0439 12.1209 12.1209 12.1570 12.1570 12.5314 12.5314 13.3414 13.3414 13.6271 13.6271 13.8181 13.8181 14.7298 14.7298 17.9045 17.9045 18.8600 18.8600 19.0088 19.0088 19.1478 19.1478 k = 0.2082 0.3609 0.0000 ( 4471 PWs) bands (ev): 1.0833 1.0833 1.1110 1.1110 1.1137 1.1137 1.1276 1.1276 1.1470 1.1470 1.1880 1.1880 1.1974 1.1974 1.2070 1.2070 3.0454 3.0454 3.0636 3.0636 3.1249 3.1249 3.2042 3.2042 3.2094 3.2094 3.2979 3.2979 3.3619 3.3619 3.3867 3.3867 3.4193 3.4193 3.4434 3.4434 3.5094 3.5094 3.6173 3.6173 4.1847 4.1847 7.7332 7.7332 7.7720 7.7720 7.8477 7.8477 9.3559 9.3559 9.7564 9.7564 10.1726 10.1726 10.3277 10.3277 10.5204 10.5204 10.7945 10.7945 10.9830 10.9830 11.0385 11.0385 12.0864 12.0864 12.1473 12.1473 12.5267 12.5267 13.4215 13.4215 13.7083 13.7083 13.8766 13.8766 14.7332 14.7332 17.8240 17.8240 19.0556 19.0556 19.0857 19.0857 19.3136 19.3136 k = 0.2169 0.3759 0.0000 ( 4455 PWs) bands (ev): 1.0824 1.0824 1.1112 1.1112 1.1129 1.1129 1.1259 1.1259 1.1472 1.1472 1.1906 1.1906 1.1979 1.1979 1.2061 1.2061 3.0468 3.0468 3.0585 3.0585 3.1230 3.1230 3.1984 3.1984 3.2043 3.2043 3.3035 3.3035 3.3686 3.3686 3.3880 3.3880 3.4264 3.4264 3.4452 3.4452 3.5076 3.5076 3.6154 3.6154 4.2715 4.2715 7.6926 7.6926 7.7342 7.7342 7.8176 7.8176 9.3474 9.3474 9.7900 9.7900 10.0289 10.0289 10.3137 10.3137 10.5278 10.5278 10.7664 10.7664 10.9249 10.9249 11.0501 11.0501 12.0548 12.0548 12.1392 12.1392 12.5234 12.5234 13.5004 13.5004 13.7925 13.7925 13.9398 13.9398 14.7384 14.7384 17.7007 17.7007 19.1914 19.1914 19.2445 19.2445 19.4785 19.4785 k = 0.2255 0.3910 0.0000 ( 4447 PWs) bands (ev): 1.0815 1.0815 1.1107 1.1107 1.1129 1.1129 1.1244 1.1244 1.1471 1.1471 1.1931 1.1931 1.1984 1.1984 1.2053 1.2053 3.0478 3.0478 3.0544 3.0544 3.1211 3.1211 3.1912 3.1912 3.2004 3.2004 3.3089 3.3089 3.3750 3.3750 3.3895 3.3895 3.4332 3.4332 3.4467 3.4467 3.5063 3.5063 3.6129 3.6129 4.3618 4.3618 7.6513 7.6513 7.6932 7.6932 7.7831 7.7831 9.3481 9.3481 9.8084 9.8084 9.8907 9.8907 10.2974 10.2974 10.5455 10.5455 10.7402 10.7402 10.8703 10.8703 11.0643 11.0643 12.0263 12.0263 12.1327 12.1327 12.5211 12.5211 13.5772 13.5772 13.8795 13.8795 14.0085 14.0085 14.7454 14.7454 17.5511 17.5511 19.3113 19.3113 19.4237 19.4237 19.6428 19.6428 k = 0.2342 0.4060 0.0000 ( 4463 PWs) bands (ev): 1.0806 1.0806 1.1099 1.1099 1.1132 1.1132 1.1230 1.1230 1.1466 1.1466 1.1951 1.1951 1.1991 1.1991 1.2048 1.2048 3.0463 3.0463 3.0537 3.0537 3.1192 3.1192 3.1837 3.1837 3.1967 3.1967 3.3143 3.3143 3.3810 3.3810 3.3913 3.3913 3.4384 3.4384 3.4488 3.4488 3.5055 3.5055 3.6100 3.6100 4.4555 4.4555 7.6094 7.6094 7.6507 7.6507 7.7435 7.7435 9.3574 9.3574 9.7380 9.7380 9.8320 9.8320 10.2787 10.2787 10.5706 10.5706 10.7163 10.7163 10.8214 10.8214 11.0805 11.0805 12.0010 12.0010 12.1278 12.1278 12.5199 12.5199 13.6510 13.6510 13.9690 13.9690 14.0832 14.0832 14.7545 14.7545 17.3867 17.3867 19.4349 19.4349 19.5901 19.5901 19.8066 19.8066 k = 0.2429 0.4211 0.0000 ( 4463 PWs) bands (ev): 1.0799 1.0799 1.1090 1.1090 1.1135 1.1135 1.1219 1.1219 1.1458 1.1458 1.1963 1.1963 1.2002 1.2002 1.2047 1.2047 3.0427 3.0427 3.0559 3.0559 3.1174 3.1174 3.1764 3.1764 3.1929 3.1929 3.3196 3.3196 3.3865 3.3865 3.3933 3.3933 3.4402 3.4402 3.4534 3.4534 3.5054 3.5054 3.6067 3.6067 4.5526 4.5526 7.5671 7.5671 7.6074 7.6074 7.6989 7.6989 9.3745 9.3745 9.6037 9.6037 9.8290 9.8290 10.2581 10.2581 10.5947 10.5947 10.6948 10.6948 10.7851 10.7851 11.0987 11.0987 11.9789 11.9789 12.1244 12.1244 12.5195 12.5195 13.7211 13.7211 14.0607 14.0607 14.1644 14.1644 14.7657 14.7657 17.2150 17.2150 19.5556 19.5556 19.7409 19.7409 19.9699 19.9703 k = 0.2516 0.4361 0.0000 ( 4467 PWs) bands (ev): 1.0792 1.0792 1.1083 1.1083 1.1139 1.1139 1.1209 1.1209 1.1447 1.1447 1.1965 1.1965 1.2017 1.2017 1.2054 1.2054 3.0390 3.0390 3.0590 3.0590 3.1154 3.1154 3.1696 3.1696 3.1889 3.1889 3.3247 3.3247 3.3915 3.3915 3.3956 3.3956 3.4392 3.4392 3.4598 3.4598 3.5061 3.5061 3.6029 3.6029 4.6532 4.6532 7.5248 7.5248 7.5639 7.5639 7.6499 7.6499 9.3984 9.3984 9.4697 9.4697 9.8196 9.8196 10.2359 10.2359 10.5997 10.5997 10.6757 10.6757 10.7764 10.7764 11.1186 11.1186 11.9601 11.9601 12.1225 12.1225 12.5200 12.5200 13.7872 13.7872 14.1543 14.1543 14.2521 14.2521 14.7795 14.7795 17.0411 17.0411 19.6689 19.6689 19.8747 19.8747 20.0032 20.0032 k = 0.2602 0.4511 0.0000 ( 4463 PWs) bands (ev): 1.0786 1.0786 1.1076 1.1076 1.1141 1.1141 1.1202 1.1202 1.1434 1.1434 1.1961 1.1961 1.2029 1.2029 1.2069 1.2069 3.0355 3.0355 3.0626 3.0626 3.1135 3.1135 3.1633 3.1633 3.1847 3.1847 3.3297 3.3297 3.3957 3.3957 3.3982 3.3982 3.4369 3.4369 3.4667 3.4667 3.5076 3.5076 3.5987 3.5987 4.7570 4.7570 7.4825 7.4825 7.5204 7.5204 7.5972 7.5972 9.3384 9.3384 9.4279 9.4279 9.8037 9.8037 10.2127 10.2127 10.5757 10.5757 10.6589 10.6589 10.8025 10.8025 11.1401 11.1401 11.9446 11.9446 12.1219 12.1219 12.5213 12.5213 13.8492 13.8492 14.2489 14.2489 14.3463 14.3463 14.7964 14.7964 16.8686 16.8686 19.7715 19.7715 19.9907 19.9907 20.0384 20.0384 k = 0.2689 0.4662 0.0000 ( 4447 PWs) bands (ev): 1.0781 1.0781 1.1071 1.1071 1.1143 1.1143 1.1198 1.1198 1.1419 1.1419 1.1954 1.1954 1.2037 1.2037 1.2089 1.2089 3.0324 3.0324 3.0665 3.0665 3.1114 3.1114 3.1578 3.1578 3.1804 3.1804 3.3345 3.3345 3.3990 3.3990 3.4009 3.4009 3.4339 3.4339 3.4733 3.4733 3.5100 3.5100 3.5942 3.5942 4.8641 4.8641 7.4404 7.4404 7.4771 7.4771 7.5417 7.5417 9.2103 9.2103 9.4618 9.4618 9.7827 9.7827 10.1892 10.1892 10.5348 10.5348 10.6442 10.6442 10.8484 10.8484 11.1629 11.1629 11.9322 11.9322 12.1223 12.1223 12.5236 12.5236 13.9071 13.9071 14.3434 14.3434 14.4464 14.4464 14.8175 14.8175 16.7007 16.7007 19.8606 19.8606 20.0774 20.0774 20.0884 20.0884 k = 0.2776 0.4812 0.0000 ( 4467 PWs) bands (ev): 1.0775 1.0775 1.1067 1.1067 1.1144 1.1144 1.1195 1.1195 1.1401 1.1401 1.1945 1.1945 1.2045 1.2045 1.2110 1.2110 3.0297 3.0297 3.0706 3.0706 3.1092 3.1092 3.1531 3.1531 3.1759 3.1759 3.3390 3.3390 3.4019 3.4019 3.4026 3.4026 3.4313 3.4313 3.4795 3.4795 3.5133 3.5133 3.5892 3.5892 4.9745 4.9745 7.3987 7.3987 7.4342 7.4342 7.4844 7.4844 9.0856 9.0856 9.4987 9.4987 9.7581 9.7581 10.1661 10.1661 10.4876 10.4876 10.6313 10.6313 10.9009 10.9009 11.1869 11.1869 11.9229 11.9229 12.1237 12.1237 12.5268 12.5268 13.9612 13.9612 14.4361 14.4361 14.5520 14.5520 14.8446 14.8446 16.5400 16.5400 19.9338 19.9338 20.1220 20.1220 20.1671 20.1671 k = 0.2862 0.4963 0.0000 ( 4467 PWs) bands (ev): 1.0771 1.0771 1.1065 1.1065 1.1145 1.1145 1.1194 1.1194 1.1382 1.1382 1.1936 1.1936 1.2052 1.2052 1.2131 1.2131 3.0274 3.0274 3.0749 3.0749 3.1068 3.1068 3.1494 3.1494 3.1713 3.1713 3.3433 3.3433 3.4022 3.4022 3.4047 3.4047 3.4298 3.4298 3.4849 3.4849 3.5175 3.5175 3.5839 3.5839 5.0881 5.0881 7.3576 7.3576 7.3912 7.3912 7.4265 7.4265 8.9646 8.9646 9.5371 9.5371 9.7311 9.7311 10.1445 10.1445 10.4381 10.4381 10.6201 10.6201 10.9534 10.9534 11.2121 11.2121 11.9165 11.9165 12.1257 12.1257 12.5310 12.5310 14.0118 14.0118 14.5238 14.5238 14.6624 14.6624 14.8807 14.8807 16.3889 16.3889 19.9902 19.9902 20.1727 20.1727 20.2262 20.2262 k = 0.2949 0.5113 0.0000 ( 4467 PWs) bands (ev): 1.0766 1.0766 1.1064 1.1064 1.1146 1.1146 1.1195 1.1195 1.1361 1.1361 1.1927 1.1927 1.2058 1.2058 1.2152 1.2152 3.0256 3.0256 3.0792 3.0792 3.1043 3.1043 3.1468 3.1468 3.1666 3.1666 3.3473 3.3473 3.3992 3.3992 3.4076 3.4076 3.4300 3.4300 3.4896 3.4896 3.5225 3.5225 3.5783 3.5783 5.2048 5.2048 7.3172 7.3172 7.3467 7.3467 7.3703 7.3703 8.8473 8.8473 9.5754 9.5754 9.7024 9.7024 10.1256 10.1256 10.3879 10.3879 10.6103 10.6103 11.0020 11.0020 11.2382 11.2382 11.9128 11.9128 12.1282 12.1282 12.5363 12.5363 14.0590 14.0590 14.6024 14.6024 14.7771 14.7771 14.9298 14.9298 16.2498 16.2498 20.0321 20.0321 20.2272 20.2272 20.2648 20.2648 k = 0.3036 0.5263 0.0000 ( 4467 PWs) bands (ev): 1.0762 1.0762 1.1064 1.1064 1.1148 1.1148 1.1196 1.1196 1.1340 1.1340 1.1918 1.1918 1.2065 1.2065 1.2171 1.2171 3.0242 3.0242 3.0834 3.0834 3.1016 3.1016 3.1454 3.1454 3.1618 3.1618 3.3510 3.3510 3.3941 3.3941 3.4105 3.4105 3.4315 3.4315 3.4935 3.4935 3.5282 3.5282 3.5723 3.5723 5.3246 5.3246 7.2777 7.2777 7.2957 7.2957 7.3215 7.3215 8.7339 8.7339 9.6116 9.6116 9.6727 9.6727 10.1109 10.1109 10.3378 10.3378 10.6017 10.6017 11.0437 11.0437 11.2651 11.2651 11.9116 11.9116 12.1311 12.1311 12.5426 12.5426 14.1030 14.1030 14.6679 14.6679 14.8955 14.8955 14.9958 14.9958 16.1252 16.1252 20.0633 20.0633 20.2816 20.2816 20.2827 20.2827 k = 0.3123 0.5414 0.0000 ( 4467 PWs) bands (ev): 1.0758 1.0758 1.1065 1.1065 1.1151 1.1151 1.1198 1.1198 1.1318 1.1318 1.1910 1.1910 1.2071 1.2071 1.2188 1.2188 3.0233 3.0233 3.0872 3.0872 3.0990 3.0990 3.1451 3.1451 3.1570 3.1570 3.3545 3.3545 3.3875 3.3875 3.4136 3.4136 3.4336 3.4336 3.4969 3.4969 3.5345 3.5345 3.5661 3.5661 5.4476 5.4476 7.2387 7.2387 7.2395 7.2395 7.2800 7.2800 8.6246 8.6246 9.6419 9.6419 9.6443 9.6443 10.1023 10.1023 10.2881 10.2881 10.5942 10.5942 11.0761 11.0761 11.2928 11.2928 11.9127 11.9127 12.1340 12.1340 12.5500 12.5500 14.1437 14.1437 14.7196 14.7196 15.0171 15.0171 15.0796 15.0796 16.0172 16.0172 20.0866 20.0866 20.2791 20.2791 20.3342 20.3342 k = 0.3209 0.5564 0.0000 ( 4475 PWs) bands (ev): 1.0753 1.0753 1.1066 1.1066 1.1154 1.1154 1.1200 1.1200 1.1296 1.1296 1.1902 1.1902 1.2077 1.2077 1.2204 1.2204 3.0229 3.0229 3.0904 3.0904 3.0967 3.0967 3.1460 3.1460 3.1521 3.1521 3.3575 3.3575 3.3800 3.3800 3.4167 3.4167 3.4357 3.4357 3.5000 3.5000 3.5408 3.5408 3.5598 3.5598 5.5735 5.5735 7.1809 7.1809 7.2020 7.2020 7.2417 7.2417 8.5195 8.5195 9.6124 9.6124 9.6692 9.6692 10.1016 10.1016 10.2393 10.2393 10.5876 10.5876 11.0969 11.0969 11.3211 11.3211 11.9159 11.9159 12.1370 12.1370 12.5585 12.5585 14.1814 14.1814 14.7603 14.7603 15.1411 15.1411 15.1779 15.1779 15.9284 15.9284 20.1039 20.1039 20.2555 20.2555 20.3822 20.3822 k = 0.3296 0.5714 0.0000 ( 4483 PWs) bands (ev): 1.0749 1.0749 1.1068 1.1068 1.1159 1.1159 1.1202 1.1202 1.1276 1.1276 1.1894 1.1894 1.2083 1.2083 1.2218 1.2218 3.0229 3.0229 3.0913 3.0913 3.0964 3.0964 3.1471 3.1471 3.1483 3.1483 3.3602 3.3602 3.3720 3.3720 3.4199 3.4199 3.4376 3.4376 3.5028 3.5028 3.5465 3.5465 3.5540 3.5540 5.7024 5.7024 7.1234 7.1234 7.1659 7.1659 7.2055 7.2055 8.4187 8.4187 9.5826 9.5826 9.6864 9.6864 10.1102 10.1102 10.1914 10.1914 10.5818 10.5818 11.1042 11.1042 11.3500 11.3500 11.9210 11.9210 12.1398 12.1398 12.5680 12.5680 14.2161 14.2161 14.7939 14.7939 15.2667 15.2667 15.2870 15.2870 15.8611 15.8611 20.1161 20.1161 20.2130 20.2130 20.4248 20.4248 k = 0.3383 0.5865 0.0000 ( 4495 PWs) bands (ev): 1.0745 1.0745 1.1071 1.1071 1.1162 1.1162 1.1203 1.1203 1.1258 1.1258 1.1887 1.1887 1.2088 1.2088 1.2230 1.2230 3.0234 3.0234 3.0896 3.0896 3.0984 3.0984 3.1424 3.1424 3.1512 3.1512 3.3620 3.3620 3.3640 3.3640 3.4232 3.4232 3.4391 3.4391 3.5055 3.5055 3.5448 3.5448 3.5555 3.5555 5.8342 5.8342 7.0671 7.0671 7.1313 7.1313 7.1709 7.1709 8.3222 8.3222 9.5533 9.5533 9.6948 9.6948 10.1285 10.1285 10.1447 10.1447 10.5766 10.5766 11.0964 11.0964 11.3792 11.3792 11.9277 11.9277 12.1424 12.1424 12.5784 12.5784 14.2481 14.2481 14.8234 14.8234 15.3917 15.3917 15.4038 15.4038 15.8181 15.8181 20.1238 20.1238 20.1538 20.1538 20.4609 20.4609 k = 0.3470 0.6015 0.0000 ( 4479 PWs) bands (ev): 1.0741 1.0741 1.1073 1.1073 1.1163 1.1163 1.1204 1.1204 1.1246 1.1246 1.1880 1.1880 1.2093 1.2093 1.2241 1.2241 3.0243 3.0243 3.0875 3.0875 3.1007 3.1007 3.1377 3.1377 3.1552 3.1552 3.3544 3.3544 3.3647 3.3647 3.4266 3.4266 3.4402 3.4402 3.5082 3.5082 3.5384 3.5384 3.5615 3.5615 5.9688 5.9688 7.0125 7.0125 7.0980 7.0980 7.1381 7.1381 8.2302 8.2302 9.5247 9.5247 9.6951 9.6951 10.0994 10.0994 10.1553 10.1553 10.5720 10.5720 11.0724 11.0724 11.4088 11.4088 11.9358 11.9358 12.1447 12.1447 12.5897 12.5897 14.2776 14.2776 14.8506 14.8506 15.5116 15.5116 15.5263 15.5263 15.8046 15.8046 20.0804 20.0804 20.1272 20.1272 20.4895 20.4895 k = 0.3556 0.6166 0.0000 ( 4471 PWs) bands (ev): 1.0737 1.0737 1.1075 1.1075 1.1158 1.1158 1.1203 1.1203 1.1244 1.1244 1.1874 1.1874 1.2098 1.2098 1.2250 1.2250 3.0257 3.0257 3.0855 3.0855 3.1027 3.1027 3.1331 3.1331 3.1599 3.1599 3.3454 3.3454 3.3663 3.3663 3.4299 3.4299 3.4406 3.4406 3.5110 3.5110 3.5316 3.5316 3.5676 3.5676 6.1062 6.1062 6.9598 6.9598 7.0664 7.0664 7.1069 7.1069 8.1428 8.1428 9.4970 9.4970 9.6889 9.6889 10.0556 10.0556 10.1886 10.1886 10.5680 10.5680 11.0318 11.0318 11.4386 11.4386 11.9450 11.9450 12.1466 12.1466 12.6017 12.6017 14.3053 14.3053 14.8765 14.8765 15.6149 15.6149 15.6533 15.6533 15.8317 15.8317 19.9953 19.9953 20.1265 20.1265 20.5094 20.5094 k = 0.3643 0.6316 0.0000 ( 4455 PWs) bands (ev): 1.0733 1.0733 1.1076 1.1076 1.1146 1.1146 1.1204 1.1204 1.1250 1.1250 1.1869 1.1869 1.2102 1.2102 1.2257 1.2257 3.0276 3.0276 3.0837 3.0837 3.1046 3.1046 3.1286 3.1286 3.1652 3.1652 3.3363 3.3363 3.3674 3.3674 3.4332 3.4332 3.4406 3.4406 3.5137 3.5137 3.5250 3.5250 3.5736 3.5736 6.2463 6.2463 6.9092 6.9092 7.0363 7.0363 7.0774 7.0774 8.0600 8.0600 9.4704 9.4704 9.6782 9.6782 10.0136 10.0136 10.2261 10.2261 10.5645 10.5645 10.9744 10.9744 11.4684 11.4684 11.9551 11.9551 12.1482 12.1482 12.6143 12.6143 14.3315 14.3315 14.9018 14.9018 15.6894 15.6894 15.7841 15.7841 15.9107 15.9107 19.9013 19.9013 20.1218 20.1218 20.5188 20.5188 k = 0.3730 0.6466 0.0000 ( 4451 PWs) bands (ev): 1.0730 1.0730 1.1076 1.1076 1.1131 1.1131 1.1205 1.1205 1.1260 1.1260 1.1865 1.1865 1.2107 1.2107 1.2263 1.2263 3.0298 3.0298 3.0821 3.0821 3.1063 3.1063 3.1243 3.1243 3.1710 3.1710 3.3271 3.3271 3.3681 3.3681 3.4364 3.4364 3.4400 3.4400 3.5150 3.5150 3.5200 3.5200 3.5793 3.5793 6.3891 6.3891 6.8610 6.8610 7.0080 7.0080 7.0496 7.0496 7.9820 7.9820 9.4449 9.4449 9.6646 9.6646 9.9733 9.9733 10.2660 10.2660 10.5614 10.5614 10.9008 10.9008 11.4981 11.4981 11.9659 11.9659 12.1494 12.1494 12.6273 12.6273 14.3566 14.3566 14.9268 14.9268 15.7477 15.7477 15.9181 15.9181 16.0274 16.0274 19.8008 19.8008 20.1129 20.1129 20.5160 20.5160 k = 0.3817 0.6617 0.0000 ( 4451 PWs) bands (ev): 1.0727 1.0727 1.1071 1.1071 1.1120 1.1120 1.1207 1.1207 1.1272 1.1272 1.1861 1.1861 1.2111 1.2111 1.2266 1.2266 3.0324 3.0324 3.0808 3.0808 3.1079 3.1079 3.1201 3.1201 3.1770 3.1770 3.3180 3.3180 3.3683 3.3683 3.4388 3.4388 3.4395 3.4395 3.5106 3.5106 3.5210 3.5210 3.5848 3.5848 6.5343 6.5343 6.8154 6.8154 6.9813 6.9813 7.0236 7.0236 7.9087 7.9087 9.4207 9.4207 9.6493 9.6493 9.9350 9.9350 10.3066 10.3066 10.5589 10.5589 10.8122 10.8122 11.5276 11.5276 11.9771 11.9771 12.1502 12.1502 12.6405 12.6405 14.3810 14.3810 14.9516 14.9516 15.8087 15.8087 16.0551 16.0551 16.1612 16.1612 19.6962 19.6962 20.0996 20.0996 20.4983 20.4983 k = 0.3903 0.6767 0.0000 ( 4444 PWs) bands (ev): 1.0724 1.0724 1.1060 1.1060 1.1114 1.1114 1.1208 1.1208 1.1286 1.1286 1.1857 1.1857 1.2115 1.2115 1.2269 1.2269 3.0354 3.0354 3.0797 3.0797 3.1094 3.1094 3.1162 3.1162 3.1833 3.1833 3.3089 3.3089 3.3680 3.3680 3.4374 3.4374 3.4422 3.4422 3.5049 3.5049 3.5238 3.5238 3.5898 3.5898 6.6820 6.6820 6.7725 6.7725 6.9565 6.9565 6.9993 6.9993 7.8404 7.8404 9.3977 9.3977 9.6334 9.6334 9.8988 9.8988 10.3468 10.3468 10.5569 10.5569 10.7099 10.7099 11.5567 11.5567 11.9885 11.9885 12.1506 12.1506 12.6538 12.6538 14.4046 14.4046 14.9764 14.9764 15.8793 15.8793 16.1945 16.1945 16.3031 16.3031 19.5893 19.5893 20.0812 20.0812 20.4615 20.4615 k = 0.3990 0.6917 0.0000 ( 4444 PWs) bands (ev): 1.0721 1.0721 1.1045 1.1045 1.1113 1.1113 1.1210 1.1210 1.1301 1.1301 1.1854 1.1854 1.2120 1.2120 1.2270 1.2270 3.0386 3.0386 3.0788 3.0788 3.1109 3.1109 3.1125 3.1125 3.1897 3.1897 3.3000 3.3000 3.3672 3.3672 3.4356 3.4356 3.4445 3.4445 3.4996 3.4996 3.5268 3.5268 3.5945 3.5945 6.7322 6.7322 6.8319 6.8319 6.9335 6.9335 6.9769 6.9769 7.7770 7.7770 9.3762 9.3762 9.6173 9.6173 9.8649 9.8649 10.3853 10.3853 10.5555 10.5555 10.5954 10.5954 11.5851 11.5851 11.9999 11.9999 12.1507 12.1507 12.6669 12.6669 14.4275 14.4275 15.0009 15.0009 15.9608 15.9608 16.3363 16.3363 16.4497 16.4497 19.4820 19.4820 20.0569 20.0569 20.3980 20.3980 k = 0.4077 0.7068 0.0000 ( 4436 PWs) bands (ev): 1.0718 1.0718 1.1029 1.1029 1.1114 1.1114 1.1211 1.1211 1.1315 1.1315 1.1852 1.1852 1.2124 1.2124 1.2269 1.2269 3.0421 3.0421 3.0781 3.0781 3.1090 3.1090 3.1124 3.1124 3.1961 3.1961 3.2913 3.2913 3.3659 3.3659 3.4335 3.4335 3.4463 3.4463 3.4951 3.4951 3.5298 3.5298 3.5989 3.5989 6.6951 6.6951 6.9118 6.9118 6.9562 6.9562 6.9846 6.9846 7.7185 7.7185 9.3559 9.3559 9.6016 9.6016 9.8333 9.8333 10.4215 10.4215 10.4704 10.4704 10.5551 10.5551 11.6127 11.6127 12.0112 12.0112 12.1505 12.1505 12.6798 12.6798 14.4495 14.4495 15.0252 15.0252 16.0520 16.0520 16.4799 16.4799 16.5996 16.5996 19.3756 19.3756 20.0252 20.0252 20.2649 20.2649 k = 0.4164 0.7218 0.0000 ( 4448 PWs) bands (ev): 1.0716 1.0716 1.1012 1.1012 1.1117 1.1117 1.1212 1.1212 1.1329 1.1329 1.1851 1.1851 1.2128 1.2128 1.2268 1.2268 3.0458 3.0458 3.0776 3.0776 3.1058 3.1058 3.1137 3.1137 3.2025 3.2025 3.2829 3.2829 3.3640 3.3640 3.4311 3.4311 3.4474 3.4474 3.4916 3.4916 3.5326 3.5326 3.6028 3.6028 6.6609 6.6609 6.8926 6.8926 6.9375 6.9375 7.1385 7.1385 7.6652 7.6652 9.3370 9.3370 9.5866 9.5866 9.8042 9.8042 10.3366 10.3366 10.4541 10.4541 10.5560 10.5560 11.6391 11.6391 12.0220 12.0220 12.1500 12.1500 12.6921 12.6921 14.4703 14.4703 15.0489 15.0489 16.1515 16.1515 16.6252 16.6252 16.7520 16.7520 19.2715 19.2715 19.9843 19.9843 20.1173 20.1173 k = 0.4164 0.7218 0.0000 ( 4448 PWs) bands (ev): 1.0716 1.0716 1.1012 1.1012 1.1117 1.1117 1.1212 1.1212 1.1329 1.1329 1.1851 1.1851 1.2128 1.2128 1.2268 1.2268 3.0458 3.0458 3.0776 3.0776 3.1058 3.1058 3.1137 3.1137 3.2025 3.2025 3.2829 3.2829 3.3640 3.3640 3.4311 3.4311 3.4474 3.4474 3.4916 3.4916 3.5326 3.5326 3.6028 3.6028 6.6609 6.6609 6.8926 6.8926 6.9375 6.9375 7.1385 7.1385 7.6652 7.6652 9.3370 9.3370 9.5866 9.5866 9.8042 9.8042 10.3366 10.3366 10.4541 10.4541 10.5560 10.5560 11.6391 11.6391 12.0220 12.0220 12.1500 12.1500 12.6921 12.6921 14.4703 14.4703 15.0489 15.0489 16.1515 16.1515 16.6252 16.6252 16.7520 16.7520 19.2715 19.2715 19.9843 19.9843 20.1173 20.1173 k = 0.4120 0.7142 0.0152 ( 4440 PWs) bands (ev): 1.0717 1.0717 1.1020 1.1020 1.1116 1.1116 1.1212 1.1212 1.1323 1.1323 1.1851 1.1851 1.2125 1.2125 1.2268 1.2268 3.0441 3.0441 3.0780 3.0780 3.1070 3.1070 3.1136 3.1136 3.1993 3.1993 3.2870 3.2870 3.3646 3.3646 3.4322 3.4322 3.4472 3.4472 3.4927 3.4927 3.5315 3.5315 3.6010 3.6010 6.6556 6.6556 6.9058 6.9058 6.9564 6.9564 7.0617 7.0617 7.7017 7.7017 9.3459 9.3459 9.5935 9.5935 9.8201 9.8201 10.4044 10.4044 10.4412 10.4412 10.5557 10.5557 11.6253 11.6253 12.0170 12.0170 12.1504 12.1504 12.6863 12.6863 14.4593 14.4593 15.0345 15.0345 16.0659 16.0659 16.5707 16.5707 16.6953 16.6953 19.3141 19.3141 19.9952 19.9952 20.1816 20.1816 k = 0.4076 0.7066 0.0304 ( 4446 PWs) bands (ev): 1.0719 1.0719 1.1028 1.1028 1.1115 1.1115 1.1213 1.1213 1.1316 1.1316 1.1852 1.1852 1.2122 1.2122 1.2267 1.2267 3.0426 3.0426 3.0786 3.0786 3.1071 3.1071 3.1147 3.1147 3.1960 3.1960 3.2911 3.2911 3.3644 3.3644 3.4328 3.4328 3.4477 3.4477 3.4925 3.4925 3.5312 3.5312 3.5992 3.5992 6.6207 6.6207 6.8963 6.8963 6.9860 6.9860 7.0159 7.0159 7.7575 7.7575 9.3540 9.3540 9.5995 9.5995 9.8396 9.8396 10.4168 10.4168 10.4848 10.4848 10.5567 10.5567 11.6101 11.6101 12.0127 12.0127 12.1508 12.1508 12.6809 12.6809 14.4466 14.4466 15.0135 15.0135 15.9314 15.9314 16.5244 16.5244 16.6944 16.6944 19.3391 19.3391 19.9936 19.9936 20.2283 20.2283 k = 0.4032 0.6991 0.0456 ( 4447 PWs) bands (ev): 1.0722 1.0722 1.1035 1.1035 1.1116 1.1116 1.1215 1.1215 1.1311 1.1311 1.1853 1.1853 1.2117 1.2117 1.2263 1.2263 3.0416 3.0416 3.0794 3.0794 3.1065 3.1065 3.1168 3.1168 3.1927 3.1927 3.2950 3.2950 3.3634 3.3634 3.4331 3.4331 3.4487 3.4487 3.4910 3.4910 3.5319 3.5319 3.5975 3.5975 6.5744 6.5744 6.8680 6.8680 6.9157 6.9157 7.0944 7.0944 7.8278 7.8278 9.3614 9.3614 9.6047 9.6047 9.8623 9.8623 10.4016 10.4016 10.5548 10.5548 10.5610 10.5610 11.5935 11.5935 12.0092 12.0092 12.1515 12.1515 12.6763 12.6763 14.4324 14.4324 14.9819 14.9819 15.7815 15.7815 16.4662 16.4662 16.7415 16.7415 19.3474 19.3474 19.9866 19.9866 20.2462 20.2462 k = 0.3988 0.6915 0.0608 ( 4449 PWs) bands (ev): 1.0726 1.0726 1.1041 1.1041 1.1117 1.1117 1.1217 1.1217 1.1308 1.1308 1.1854 1.1854 1.2111 1.2111 1.2258 1.2258 3.0409 3.0409 3.0804 3.0804 3.1057 3.1057 3.1194 3.1194 3.1896 3.1896 3.2987 3.2987 3.3618 3.3618 3.4328 3.4328 3.4503 3.4503 3.4881 3.4881 3.5336 3.5336 3.5960 3.5960 6.5248 6.5248 6.8299 6.8299 6.8478 6.8478 7.1818 7.1818 7.9083 7.9083 9.3678 9.3678 9.6093 9.6093 9.8882 9.8882 10.3861 10.3861 10.5618 10.5618 10.6304 10.6304 11.5756 11.5756 12.0066 12.0066 12.1523 12.1523 12.6726 12.6726 14.4164 14.4164 14.9337 14.9337 15.6401 15.6401 16.4044 16.4044 16.8125 16.8125 19.3401 19.3401 19.9746 19.9746 20.2429 20.2429 k = 0.3945 0.6839 0.0759 ( 4455 PWs) bands (ev): 1.0730 1.0730 1.1046 1.1046 1.1120 1.1120 1.1220 1.1220 1.1306 1.1306 1.1854 1.1854 1.2105 1.2105 1.2252 1.2252 3.0406 3.0406 3.0815 3.0815 3.1049 3.1049 3.1221 3.1221 3.1867 3.1867 3.3022 3.3022 3.3597 3.3597 3.4318 3.4318 3.4524 3.4524 3.4841 3.4841 3.5361 3.5361 3.5945 3.5945 6.4749 6.4749 6.7798 6.7798 6.7899 6.7899 7.2731 7.2731 7.9953 7.9953 9.3732 9.3732 9.6132 9.6132 9.9169 9.9169 10.3716 10.3716 10.5663 10.5663 10.7027 10.7027 11.5564 11.5564 12.0051 12.0051 12.1533 12.1533 12.6699 12.6699 14.3974 14.3974 14.8619 14.8619 15.5235 15.5235 16.3434 16.3434 16.8957 16.8957 19.3182 19.3182 19.9548 19.9548 20.2325 20.2325 k = 0.3901 0.6763 0.0911 ( 4457 PWs) bands (ev): 1.0735 1.0735 1.1049 1.1049 1.1123 1.1123 1.1223 1.1223 1.1306 1.1306 1.1854 1.1854 1.2097 1.2097 1.2243 1.2243 3.0407 3.0407 3.0825 3.0825 3.1044 3.1044 3.1247 3.1247 3.1841 3.1841 3.3054 3.3054 3.3574 3.3574 3.4301 3.4301 3.4548 3.4548 3.4796 3.4796 3.5390 3.5390 3.5933 3.5933 6.4260 6.4260 6.7188 6.7188 6.7435 6.7435 7.3665 7.3665 8.0865 8.0865 9.3773 9.3773 9.6168 9.6168 9.9481 9.9481 10.3586 10.3586 10.5719 10.5719 10.7733 10.7733 11.5362 11.5362 12.0047 12.0047 12.1548 12.1548 12.6685 12.6685 14.3722 14.3722 14.7650 14.7650 15.4408 15.4408 16.2848 16.2848 16.9863 16.9863 19.2826 19.2826 19.9242 19.9242 20.2206 20.2206 k = 0.3857 0.6687 0.1063 ( 4462 PWs) bands (ev): 1.0740 1.0740 1.1052 1.1052 1.1128 1.1128 1.1225 1.1225 1.1309 1.1309 1.1854 1.1854 1.2089 1.2089 1.2233 1.2233 3.0413 3.0413 3.0833 3.0833 3.1042 3.1042 3.1271 3.1271 3.1819 3.1819 3.3082 3.3082 3.3549 3.3549 3.4274 3.4274 3.4573 3.4573 3.4750 3.4750 3.5421 3.5421 3.5922 3.5922 6.3787 6.3787 6.6599 6.6599 6.6971 6.6971 7.4607 7.4607 8.1798 8.1798 9.3798 9.3798 9.6202 9.6202 9.9813 9.9813 10.3475 10.3475 10.5790 10.5790 10.8415 10.8415 11.5150 11.5150 12.0053 12.0053 12.1569 12.1569 12.6688 12.6688 14.3327 14.3327 14.6551 14.6551 15.3910 15.3910 16.2289 16.2289 17.0818 17.0818 19.2344 19.2344 19.8822 19.8822 20.2074 20.2074 k = 0.3813 0.6611 0.1215 ( 4462 PWs) bands (ev): 1.0747 1.0747 1.1054 1.1054 1.1133 1.1133 1.1227 1.1227 1.1313 1.1313 1.1853 1.1853 1.2080 1.2080 1.2222 1.2222 3.0422 3.0422 3.0838 3.0838 3.1045 3.1045 3.1292 3.1292 3.1803 3.1803 3.3105 3.3105 3.3527 3.3527 3.4238 3.4238 3.4592 3.4592 3.4713 3.4713 3.5452 3.5452 3.5913 3.5913 6.3334 6.3334 6.6042 6.6042 6.6511 6.6511 7.5548 7.5548 8.2741 8.2741 9.3808 9.3808 9.6238 9.6238 10.0163 10.0163 10.3387 10.3387 10.5874 10.5874 10.9064 10.9064 11.4931 11.4931 12.0069 12.0069 12.1599 12.1599 12.6708 12.6708 14.2618 14.2618 14.5590 14.5590 15.3665 15.3665 16.1762 16.1762 17.1803 17.1803 19.1741 19.1741 19.8305 19.8305 20.1889 20.1889 k = 0.3770 0.6535 0.1367 ( 4460 PWs) bands (ev): 1.0753 1.0753 1.1055 1.1055 1.1139 1.1139 1.1228 1.1228 1.1320 1.1320 1.1852 1.1852 1.2071 1.2071 1.2208 1.2208 3.0436 3.0436 3.0840 3.0840 3.1053 3.1053 3.1309 3.1309 3.1794 3.1794 3.3122 3.3122 3.3507 3.3507 3.4192 3.4192 3.4589 3.4589 3.4700 3.4700 3.5482 3.5482 3.5908 3.5908 6.2905 6.2905 6.5516 6.5516 6.6063 6.6063 7.6480 7.6480 8.3682 8.3682 9.3799 9.3799 9.6279 9.6279 10.0522 10.0522 10.3325 10.3325 10.5974 10.5974 10.9672 10.9672 11.4706 11.4706 12.0094 12.0094 12.1645 12.1645 12.6750 12.6750 14.1467 14.1467 14.4986 14.4986 15.3600 15.3600 16.1268 16.1268 17.2802 17.2802 19.1024 19.1024 19.7727 19.7727 20.1585 20.1585 k = 0.3726 0.6459 0.1519 ( 4456 PWs) bands (ev): 1.0760 1.0760 1.1056 1.1056 1.1146 1.1146 1.1229 1.1229 1.1329 1.1329 1.1850 1.1850 1.2061 1.2061 1.2194 1.2194 3.0454 3.0454 3.0837 3.0837 3.1068 3.1068 3.1321 3.1321 3.1793 3.1793 3.3132 3.3132 3.3491 3.3491 3.4135 3.4135 3.4560 3.4560 3.4716 3.4716 3.5508 3.5508 3.5905 3.5905 6.2499 6.2499 6.5024 6.5024 6.5631 6.5631 7.7393 7.7393 8.4613 8.4613 9.3773 9.3773 9.6327 9.6327 10.0885 10.0885 10.3290 10.3290 10.6090 10.6090 11.0230 11.0230 11.4478 11.4478 12.0123 12.0123 12.1713 12.1713 12.6815 12.6815 14.0002 14.0002 14.4675 14.4675 15.3666 15.3666 16.0808 16.0808 17.3800 17.3800 19.0204 19.0204 19.7121 19.7121 20.1096 20.1096 k = 0.3682 0.6383 0.1671 ( 4456 PWs) bands (ev): 1.0768 1.0768 1.1056 1.1056 1.1154 1.1154 1.1231 1.1231 1.1339 1.1339 1.1846 1.1846 1.2051 1.2051 1.2178 1.2178 3.0475 3.0475 3.0830 3.0830 3.1087 3.1087 3.1327 3.1327 3.1799 3.1799 3.3135 3.3135 3.3481 3.3481 3.4070 3.4070 3.4523 3.4523 3.4744 3.4744 3.5532 3.5532 3.5906 3.5906 6.2118 6.2118 6.4563 6.4563 6.5220 6.5220 7.8277 7.8277 8.5529 8.5529 9.3733 9.3733 9.6387 9.6387 10.1244 10.1244 10.3287 10.3287 10.6223 10.6223 11.0730 11.0730 11.4251 11.4251 12.0149 12.0149 12.1812 12.1812 12.6908 12.6908 13.8404 13.8404 14.4520 14.4520 15.3833 15.3833 16.0383 16.0383 17.4774 17.4774 18.9303 18.9303 19.6514 19.6514 20.0385 20.0385 k = 0.3638 0.6307 0.1823 ( 4457 PWs) bands (ev): 1.0775 1.0775 1.1055 1.1055 1.1163 1.1163 1.1232 1.1232 1.1350 1.1350 1.1842 1.1842 1.2040 1.2040 1.2162 1.2162 3.0500 3.0500 3.0822 3.0822 3.1109 3.1109 3.1329 3.1329 3.1814 3.1814 3.3130 3.3130 3.3475 3.3475 3.4000 3.4000 3.4484 3.4484 3.4776 3.4776 3.5552 3.5552 3.5910 3.5910 6.1763 6.1763 6.4135 6.4135 6.4833 6.4833 7.9118 7.9118 8.6423 8.6423 9.3686 9.3686 9.6459 9.6459 10.1587 10.1587 10.3318 10.3318 10.6373 10.6373 11.1161 11.1161 11.4031 11.4031 12.0166 12.0166 12.1955 12.1955 12.7029 12.7029 13.6775 13.6775 14.4447 14.4447 15.4087 15.4087 15.9993 15.9993 17.5691 17.5691 18.8357 18.8357 19.5917 19.5917 19.9468 19.9468 k = 0.3594 0.6232 0.1975 ( 4456 PWs) bands (ev): 1.0783 1.0783 1.1055 1.1055 1.1173 1.1173 1.1234 1.1234 1.1361 1.1361 1.1836 1.1836 1.2030 1.2030 1.2144 1.2144 3.0528 3.0528 3.0812 3.0812 3.1134 3.1134 3.1326 3.1326 3.1834 3.1834 3.3119 3.3119 3.3470 3.3470 3.3928 3.3928 3.4446 3.4446 3.4808 3.4808 3.5568 3.5568 3.5917 3.5917 6.1434 6.1434 6.3740 6.3740 6.4472 6.4472 7.9902 7.9902 8.7293 8.7293 9.3640 9.3640 9.6544 9.6544 10.1904 10.1904 10.3387 10.3387 10.6537 10.6537 11.1511 11.1511 11.3827 11.3827 12.0166 12.0166 12.2150 12.2150 12.7181 12.7181 13.5171 13.5171 14.4427 14.4427 15.4418 15.4418 15.9640 15.9640 17.6500 17.6500 18.7428 18.7428 19.5328 19.5328 19.8391 19.8391 k = 0.3551 0.6156 0.2127 ( 4458 PWs) bands (ev): 1.0790 1.0790 1.1054 1.1054 1.1184 1.1184 1.1237 1.1237 1.1373 1.1373 1.1828 1.1828 1.2019 1.2019 1.2126 1.2126 3.0558 3.0558 3.0801 3.0801 3.1160 3.1160 3.1320 3.1320 3.1860 3.1860 3.3103 3.3103 3.3462 3.3462 3.3859 3.3859 3.4409 3.4409 3.4840 3.4840 3.5581 3.5581 3.5927 3.5927 6.1132 6.1132 6.3376 6.3376 6.4140 6.4140 8.0611 8.0611 8.8134 8.8134 9.3609 9.3609 9.6643 9.6643 10.2181 10.2181 10.3500 10.3500 10.6712 10.6712 11.1765 11.1765 11.3653 11.3653 12.0142 12.0142 12.2403 12.2403 12.7361 12.7361 13.3634 13.3634 14.4442 14.4442 15.4820 15.4820 15.9325 15.9325 17.7120 17.7120 18.6607 18.6607 19.4727 19.4727 19.7218 19.7218 k = 0.3507 0.6080 0.2278 ( 4457 PWs) bands (ev): 1.0797 1.0797 1.1053 1.1053 1.1196 1.1196 1.1241 1.1241 1.1385 1.1385 1.1819 1.1819 1.2008 1.2008 1.2109 1.2109 3.0589 3.0589 3.0792 3.0792 3.1185 3.1185 3.1314 3.1314 3.1889 3.1889 3.3084 3.3084 3.3445 3.3445 3.3800 3.3800 3.4374 3.4374 3.4871 3.4871 3.5592 3.5592 3.5937 3.5937 6.0857 6.0857 6.3045 6.3045 6.3839 6.3839 8.1225 8.1225 8.8944 8.8944 9.3610 9.3610 9.6754 9.6754 10.2411 10.2411 10.3660 10.3660 10.6893 10.6893 11.1905 11.1905 11.3526 11.3526 12.0092 12.0092 12.2710 12.2710 12.7555 12.7555 13.2208 13.2208 14.4483 14.4483 15.5286 15.5286 15.9050 15.9050 17.7436 17.7436 18.6020 18.6020 19.4055 19.4055 19.6033 19.6033 k = 0.3463 0.6004 0.2430 ( 4465 PWs) bands (ev): 1.0804 1.0804 1.1052 1.1052 1.1209 1.1209 1.1245 1.1245 1.1397 1.1397 1.1808 1.1808 1.1996 1.1996 1.2091 1.2091 3.0622 3.0622 3.0784 3.0784 3.1208 3.1208 3.1310 3.1310 3.1920 3.1920 3.3064 3.3064 3.3410 3.3410 3.3759 3.3759 3.4340 3.4340 3.4899 3.4899 3.5600 3.5600 3.5949 3.5949 6.0609 6.0609 6.2745 6.2745 6.3569 6.3569 8.1723 8.1723 8.9720 8.9720 9.3662 9.3662 9.6878 9.6878 10.2592 10.2592 10.3864 10.3864 10.7075 10.7075 11.1921 11.1921 11.3457 11.3457 12.0015 12.0015 12.3055 12.3055 12.7721 12.7721 13.0978 13.0978 14.4544 14.4544 15.5808 15.5808 15.8821 15.8821 17.7340 17.7340 18.5777 18.5777 19.3204 19.3204 19.4966 19.4966 k = 0.3419 0.5928 0.2582 ( 4461 PWs) bands (ev): 1.0811 1.0811 1.1051 1.1051 1.1222 1.1222 1.1249 1.1249 1.1408 1.1408 1.1796 1.1796 1.1984 1.1984 1.2075 1.2075 3.0653 3.0653 3.0780 3.0780 3.1224 3.1224 3.1312 3.1312 3.1951 3.1951 3.3043 3.3043 3.3355 3.3355 3.3740 3.3740 3.4308 3.4308 3.4925 3.4925 3.5607 3.5607 3.5959 3.5959 6.0389 6.0389 6.2477 6.2477 6.3331 6.3331 8.2084 8.2084 9.0462 9.0462 9.3780 9.3780 9.7011 9.7011 10.2731 10.2731 10.4101 10.4101 10.7252 10.7252 11.1830 11.1830 11.3432 11.3432 11.9910 11.9910 12.3398 12.3398 12.7730 12.7730 13.0127 13.0127 14.4619 14.4619 15.6368 15.6368 15.8649 15.8649 17.6814 17.6814 18.5890 18.5890 19.2095 19.2095 19.4110 19.4110 k = 0.3376 0.5852 0.2734 ( 4461 PWs) bands (ev): 1.0817 1.0817 1.1050 1.1050 1.1236 1.1236 1.1255 1.1255 1.1419 1.1419 1.1783 1.1783 1.1971 1.1971 1.2059 1.2059 3.0680 3.0680 3.0784 3.0784 3.1231 3.1231 3.1323 3.1323 3.1981 3.1981 3.3023 3.3023 3.3285 3.3285 3.3738 3.3738 3.4279 3.4279 3.4948 3.4948 3.5612 3.5612 3.5969 3.5969 6.0197 6.0197 6.2239 6.2239 6.3127 6.3127 8.2291 8.2291 9.1165 9.1165 9.3980 9.3980 9.7154 9.7154 10.2836 10.2836 10.4360 10.4360 10.7416 10.7416 11.1664 11.1664 11.3425 11.3425 11.9779 11.9779 12.3645 12.3645 12.7449 12.7449 12.9894 12.9894 14.4703 14.4703 15.6919 15.6919 15.8571 15.8571 17.5955 17.5955 18.6234 18.6234 19.0830 19.0830 19.3395 19.3395 k = 0.3332 0.5776 0.2886 ( 4461 PWs) bands (ev): 1.0823 1.0823 1.1049 1.1049 1.1249 1.1249 1.1262 1.1262 1.1430 1.1430 1.1769 1.1769 1.1956 1.1956 1.2046 1.2046 3.0698 3.0698 3.0798 3.0798 3.1230 3.1230 3.1342 3.1342 3.2007 3.2007 3.3004 3.3004 3.3207 3.3207 3.3748 3.3748 3.4254 3.4254 3.4968 3.4968 3.5616 3.5616 3.5978 3.5978 6.0033 6.0033 6.2033 6.2033 6.2957 6.2957 8.2337 8.2337 9.1830 9.1830 9.4267 9.4267 9.7305 9.7305 10.2915 10.2915 10.4633 10.4633 10.7563 10.7563 11.1452 11.1452 11.3409 11.3409 11.9622 11.9622 12.3631 12.3631 12.7162 12.7162 13.0169 13.0169 14.4792 14.4792 15.7354 15.7354 15.8681 15.8681 17.4893 17.4893 18.6558 18.6558 18.9625 18.9625 19.2712 19.2712 k = 0.3288 0.5700 0.3038 ( 4465 PWs) bands (ev): 1.0829 1.0829 1.1047 1.1047 1.1259 1.1259 1.1273 1.1273 1.1440 1.1440 1.1754 1.1754 1.1940 1.1940 1.2035 1.2035 3.0707 3.0707 3.0824 3.0824 3.1224 3.1224 3.1365 3.1365 3.2029 3.2029 3.2985 3.2985 3.3126 3.3126 3.3765 3.3765 3.4233 3.4233 3.4985 3.4985 3.5620 3.5620 3.5984 3.5984 5.9897 5.9897 6.1856 6.1856 6.2821 6.2821 8.2219 8.2219 9.2457 9.2457 9.4636 9.4636 9.7463 9.7463 10.2971 10.2971 10.4915 10.4915 10.7691 10.7691 11.1216 11.1216 11.3371 11.3371 11.9440 11.9440 12.3242 12.3242 12.7226 12.7226 13.0713 13.0713 14.4882 14.4882 15.7550 15.7550 15.9077 15.9077 17.3741 17.3741 18.6373 18.6373 18.8902 18.8902 19.2020 19.2020 k = 0.3244 0.5624 0.3190 ( 4457 PWs) bands (ev): 1.0834 1.0834 1.1045 1.1045 1.1267 1.1267 1.1287 1.1287 1.1449 1.1449 1.1738 1.1738 1.1923 1.1923 1.2025 1.2025 3.0712 3.0712 3.0856 3.0856 3.1217 3.1217 3.1390 3.1390 3.2044 3.2044 3.2962 3.2962 3.3054 3.3054 3.3787 3.3787 3.4217 3.4217 3.4998 3.4998 3.5622 3.5622 3.5988 3.5988 5.9789 5.9789 6.1710 6.1710 6.2721 6.2721 8.1946 8.1946 9.3047 9.3047 9.5073 9.5073 9.7627 9.7627 10.3005 10.3005 10.5203 10.5203 10.7798 10.7798 11.0968 11.0968 11.3308 11.3308 11.9232 11.9232 12.2593 12.2593 12.7625 12.7625 13.1429 13.1429 14.4971 14.4971 15.7579 15.7579 15.9653 15.9653 17.2591 17.2591 18.5376 18.5376 18.8863 18.8863 19.1348 19.1348 k = 0.3200 0.5548 0.3342 ( 4457 PWs) bands (ev): 1.0839 1.0839 1.1044 1.1044 1.1274 1.1274 1.1302 1.1302 1.1457 1.1457 1.1722 1.1722 1.1907 1.1907 1.2016 1.2016 3.0716 3.0716 3.0891 3.0891 3.1209 3.1209 3.1415 3.1415 3.2050 3.2050 3.2913 3.2913 3.3016 3.3016 3.3810 3.3810 3.4206 3.4206 3.5009 3.5009 3.5624 3.5624 3.5990 3.5990 5.9710 5.9710 6.1594 6.1594 6.2656 6.2656 8.1530 8.1530 9.3606 9.3606 9.5557 9.5557 9.7797 9.7797 10.3018 10.3018 10.5496 10.5496 10.7888 10.7888 11.0717 11.0717 11.3218 11.3218 11.8997 11.8997 12.1858 12.1858 12.8215 12.8215 13.2283 13.2283 14.5055 14.5055 15.7552 15.7552 16.0242 16.0242 17.1529 17.1529 18.4022 18.4022 18.8888 18.8888 19.0820 19.0820 k = 0.3157 0.5473 0.3494 ( 4459 PWs) bands (ev): 1.0844 1.0844 1.1042 1.1042 1.1280 1.1280 1.1317 1.1317 1.1464 1.1464 1.1707 1.1707 1.1892 1.1892 1.2008 1.2008 3.0720 3.0720 3.0927 3.0927 3.1203 3.1203 3.1440 3.1440 3.2048 3.2048 3.2838 3.2838 3.3011 3.3011 3.3834 3.3834 3.4202 3.4202 3.5016 3.5016 3.5624 3.5624 3.5989 3.5989 5.9659 5.9659 6.1507 6.1507 6.2628 6.2628 8.0986 8.0986 9.4137 9.4137 9.6064 9.6064 9.7973 9.7973 10.3008 10.3008 10.5789 10.5789 10.7963 10.7963 11.0466 11.0466 11.3105 11.3105 11.8736 11.8736 12.1135 12.1135 12.8909 12.8909 13.3257 13.3257 14.5134 14.5134 15.7508 15.7508 16.0722 16.0722 17.0652 17.0652 18.2578 18.2578 18.8546 18.8546 19.0562 19.0562 k = 0.3113 0.5397 0.3646 ( 4463 PWs) bands (ev): 1.0849 1.0849 1.1040 1.1040 1.1286 1.1286 1.1332 1.1332 1.1469 1.1469 1.1691 1.1691 1.1878 1.1878 1.2000 1.2000 3.0725 3.0725 3.0961 3.0961 3.1198 3.1198 3.1464 3.1464 3.2036 3.2036 3.2758 3.2758 3.3021 3.3021 3.3857 3.3857 3.4206 3.4206 3.5021 3.5021 3.5624 3.5624 3.5986 3.5986 5.9637 5.9637 6.1449 6.1449 6.2635 6.2635 8.0328 8.0328 9.4644 9.4644 9.6574 9.6574 9.8155 9.8155 10.2974 10.2974 10.6080 10.6080 10.8032 10.8032 11.0221 11.0221 11.2975 11.2975 11.8447 11.8447 12.0468 12.0468 12.9669 12.9669 13.4337 13.4337 14.5206 14.5206 15.7451 15.7451 16.0984 16.0984 17.0071 17.0071 18.1129 18.1129 18.7895 18.7895 19.0377 19.0377 k = 0.3069 0.5321 0.3797 ( 4461 PWs) bands (ev): 1.0854 1.0854 1.1038 1.1038 1.1291 1.1291 1.1345 1.1345 1.1474 1.1474 1.1675 1.1675 1.1866 1.1866 1.1992 1.1992 3.0732 3.0732 3.0991 3.0991 3.1198 3.1198 3.1487 3.1487 3.2015 3.2015 3.2677 3.2677 3.3042 3.3042 3.3878 3.3878 3.4218 3.4218 3.5022 3.5022 3.5621 3.5621 3.5981 3.5981 5.9643 5.9643 6.1420 6.1420 6.2678 6.2678 7.9571 7.9571 9.5127 9.5127 9.7065 9.7065 9.8347 9.8347 10.2918 10.2918 10.6360 10.6360 10.8103 10.8103 10.9985 10.9985 11.2832 11.2832 11.8133 11.8133 11.9876 11.9876 13.0479 13.0479 13.5502 13.5502 14.5269 14.5269 15.7364 15.7364 16.0957 16.0957 16.9867 16.9867 17.9712 17.9712 18.7134 18.7134 18.9954 18.9954 k = 0.3025 0.5245 0.3949 ( 4453 PWs) bands (ev): 1.0859 1.0859 1.1035 1.1035 1.1297 1.1297 1.1357 1.1357 1.1478 1.1478 1.1660 1.1660 1.1857 1.1857 1.1985 1.1985 3.0741 3.0741 3.1015 3.1015 3.1204 3.1204 3.1509 3.1509 3.1988 3.1988 3.2596 3.2596 3.3071 3.3071 3.3893 3.3893 3.4239 3.4239 3.5022 3.5022 3.5618 3.5618 3.5973 3.5973 5.9678 5.9678 6.1419 6.1419 6.2758 6.2758 7.8728 7.8728 9.5587 9.5587 9.7520 9.7520 9.8554 9.8554 10.2840 10.2840 10.6619 10.6619 10.8188 10.8188 10.9758 10.9758 11.2682 11.2682 11.7802 11.7802 11.9359 11.9359 13.1335 13.1335 13.6730 13.6730 14.5324 14.5324 15.7205 15.7205 16.0674 16.0674 17.0025 17.0025 17.8362 17.8362 18.6362 18.6362 18.9196 18.9196 k = 0.2982 0.5169 0.4101 ( 4456 PWs) bands (ev): 1.0864 1.0864 1.1033 1.1033 1.1302 1.1302 1.1366 1.1366 1.1481 1.1481 1.1646 1.1646 1.1850 1.1850 1.1977 1.1977 3.0752 3.0752 3.1030 3.1030 3.1218 3.1218 3.1531 3.1531 3.1955 3.1955 3.2517 3.2517 3.3106 3.3106 3.3903 3.3903 3.4269 3.4269 3.5020 3.5020 3.5614 3.5614 3.5963 3.5963 5.9741 5.9741 6.1445 6.1445 6.2874 6.2874 7.7810 7.7810 9.6024 9.6024 9.7918 9.7918 9.8789 9.8789 10.2744 10.2744 10.6840 10.6840 10.8304 10.8304 10.9542 10.9542 11.2530 11.2530 11.7467 11.7467 11.8910 11.8910 13.2235 13.2235 13.8000 13.8000 14.5371 14.5371 15.6901 15.6901 16.0287 16.0287 17.0422 17.0422 17.7129 17.7129 18.5620 18.5620 18.8212 18.8212 k = 0.2938 0.5093 0.4253 ( 4454 PWs) bands (ev): 1.0869 1.0869 1.1031 1.1031 1.1307 1.1307 1.1373 1.1373 1.1484 1.1484 1.1631 1.1631 1.1847 1.1847 1.1969 1.1969 3.0763 3.0763 3.1036 3.1036 3.1242 3.1242 3.1551 3.1551 3.1919 3.1919 3.2438 3.2438 3.3146 3.3146 3.3907 3.3907 3.4308 3.4308 3.5016 3.5016 3.5609 3.5609 3.5951 3.5951 5.9833 5.9833 6.1499 6.1499 6.3026 6.3026 7.6828 7.6828 9.6435 9.6435 9.8240 9.8240 9.9059 9.9059 10.2632 10.2632 10.7011 10.7011 10.8458 10.8458 10.9342 10.9342 11.2380 11.2380 11.7142 11.7142 11.8513 11.8513 13.3180 13.3180 13.9281 13.9281 14.5412 14.5412 15.6370 15.6370 15.9987 15.9987 17.0851 17.0851 17.6108 17.6108 18.4929 18.4929 18.7139 18.7139 k = 0.2894 0.5017 0.4405 ( 4450 PWs) bands (ev): 1.0874 1.0874 1.1028 1.1028 1.1311 1.1311 1.1376 1.1376 1.1487 1.1487 1.1618 1.1618 1.1847 1.1847 1.1961 1.1961 3.0776 3.0776 3.1034 3.1034 3.1274 3.1274 3.1571 3.1571 3.1882 3.1882 3.2359 3.2359 3.3190 3.3190 3.3904 3.3904 3.4354 3.4354 3.5010 3.5010 3.5604 3.5604 3.5937 3.5937 5.9953 5.9953 6.1579 6.1579 6.3214 6.3214 7.5792 7.5792 9.6820 9.6820 9.8487 9.8487 9.9362 9.9362 10.2508 10.2508 10.7127 10.7127 10.8638 10.8638 10.9171 10.9171 11.2234 11.2234 11.6841 11.6841 11.8157 11.8157 13.4167 13.4167 14.0543 14.0543 14.5453 14.5453 15.5597 15.5597 15.9877 15.9877 17.1036 17.1036 17.5473 17.5473 18.4273 18.4273 18.6103 18.6103 k = 0.2850 0.4941 0.4557 ( 4448 PWs) bands (ev): 1.0879 1.0879 1.1026 1.1026 1.1315 1.1315 1.1377 1.1377 1.1492 1.1492 1.1605 1.1605 1.1849 1.1849 1.1953 1.1953 3.0789 3.0789 3.1027 3.1027 3.1312 3.1312 3.1590 3.1590 3.1846 3.1846 3.2282 3.2282 3.3237 3.3237 3.3895 3.3895 3.4405 3.4405 3.5002 3.5002 3.5599 3.5599 3.5920 3.5920 6.0101 6.0101 6.1683 6.1683 6.3438 6.3438 7.4712 7.4712 9.7178 9.7178 9.8674 9.8674 9.9678 9.9678 10.2379 10.2379 10.7197 10.7197 10.8737 10.8737 10.9127 10.9127 11.2094 11.2094 11.6577 11.6577 11.7830 11.7830 13.5195 13.5195 14.1740 14.1740 14.5506 14.5506 15.4647 15.4647 15.9958 15.9958 17.0748 17.0748 17.5367 17.5367 18.3564 18.3564 18.5278 18.5278 k = 0.2806 0.4865 0.4709 ( 4450 PWs) bands (ev): 1.0884 1.0884 1.1023 1.1023 1.1319 1.1319 1.1374 1.1374 1.1497 1.1497 1.1593 1.1593 1.1853 1.1853 1.1945 1.1945 3.0803 3.0803 3.1017 3.1017 3.1353 3.1353 3.1608 3.1608 3.1812 3.1812 3.2204 3.2204 3.3285 3.3285 3.3880 3.3880 3.4460 3.4460 3.4992 3.4992 3.5596 3.5596 3.5901 3.5901 6.0277 6.0277 6.1810 6.1810 6.3697 6.3697 7.3598 7.3598 9.7507 9.7507 9.8817 9.8817 9.9986 9.9986 10.2246 10.2246 10.7236 10.7236 10.8635 10.8635 10.9313 10.9313 11.1959 11.1959 11.6355 11.6355 11.7527 11.7527 13.6258 13.6258 14.2809 14.2809 14.5602 14.5602 15.3605 15.3605 16.0195 16.0195 17.0064 17.0064 17.5637 17.5637 18.2679 18.2679 18.4865 18.4865 k = 0.2763 0.4790 0.4861 ( 4454 PWs) bands (ev): 1.0890 1.0890 1.1020 1.1020 1.1322 1.1322 1.1370 1.1370 1.1502 1.1502 1.1583 1.1583 1.1859 1.1859 1.1937 1.1937 3.0817 3.0817 3.1004 3.1004 3.1398 3.1398 3.1625 3.1625 3.1782 3.1782 3.2128 3.2128 3.3335 3.3335 3.3860 3.3860 3.4516 3.4516 3.4980 3.4980 3.5596 3.5596 3.5880 3.5880 6.0481 6.0481 6.1955 6.1955 6.3991 6.3991 7.2461 7.2461 9.7807 9.7807 9.8926 9.8926 10.0276 10.0276 10.2115 10.2115 10.7259 10.7259 10.8468 10.8468 10.9577 10.9577 11.1827 11.1827 11.6179 11.6179 11.7246 11.7246 13.7350 13.7350 14.3641 14.3641 14.5809 14.5809 15.2535 15.2535 16.0563 16.0563 16.9205 16.9205 17.6002 17.6002 18.1660 18.1660 18.4886 18.4886 k = 0.2719 0.4714 0.5013 ( 4454 PWs) bands (ev): 1.0895 1.0895 1.1017 1.1017 1.1324 1.1324 1.1365 1.1365 1.1506 1.1506 1.1575 1.1575 1.1864 1.1864 1.1930 1.1930 3.0830 3.0830 3.0991 3.0991 3.1445 3.1445 3.1641 3.1641 3.1757 3.1757 3.2052 3.2052 3.3385 3.3385 3.3834 3.3834 3.4573 3.4573 3.4965 3.4965 3.5599 3.5599 3.5856 3.5856 6.0712 6.0712 6.2114 6.2114 6.4320 6.4320 7.1313 7.1313 9.8075 9.8075 9.9004 9.9004 10.0541 10.0541 10.1989 10.1989 10.7276 10.7276 10.8292 10.8292 10.9853 10.9853 11.1697 11.1697 11.6052 11.6052 11.6986 11.6986 13.8459 13.8459 14.4122 14.4122 14.6201 14.6201 15.1482 15.1482 16.1050 16.1050 16.8311 16.8311 17.6302 17.6302 18.0616 18.0616 18.5267 18.5267 k = 0.2675 0.4638 0.5165 ( 4456 PWs) bands (ev): 1.0900 1.0900 1.1014 1.1014 1.1326 1.1326 1.1360 1.1360 1.1509 1.1509 1.1569 1.1569 1.1870 1.1870 1.1924 1.1924 3.0843 3.0843 3.0977 3.0977 3.1492 3.1492 3.1656 3.1656 3.1737 3.1737 3.1977 3.1977 3.3435 3.3435 3.3803 3.3803 3.4628 3.4628 3.4948 3.4948 3.5606 3.5606 3.5831 3.5831 6.0971 6.0971 6.2277 6.2277 6.4683 6.4683 7.0170 7.0170 9.8312 9.8312 9.9051 9.9051 10.0778 10.0778 10.1868 10.1868 10.7297 10.7297 10.8119 10.8119 11.0122 11.0122 11.1565 11.1565 11.5972 11.5972 11.6749 11.6749 13.9570 13.9570 14.4276 14.4276 14.6715 14.6715 15.0487 15.0487 16.1645 16.1645 16.7444 16.7444 17.6492 17.6492 17.9616 17.9616 18.5932 18.5932 k = 0.2631 0.4562 0.5316 ( 4458 PWs) bands (ev): 1.0905 1.0905 1.1011 1.1011 1.1327 1.1327 1.1356 1.1356 1.1511 1.1511 1.1566 1.1566 1.1874 1.1874 1.1920 1.1920 3.0855 3.0855 3.0964 3.0964 3.1540 3.1540 3.1668 3.1668 3.1726 3.1726 3.1904 3.1904 3.3486 3.3486 3.3767 3.3767 3.4680 3.4680 3.4927 3.4927 3.5619 3.5619 3.5804 3.5804 6.1256 6.1256 6.2426 6.2426 6.5079 6.5079 6.9055 6.9055 9.8516 9.8516 9.9067 9.9067 10.0986 10.0986 10.1753 10.1753 10.7330 10.7330 10.7955 10.7955 11.0375 11.0375 11.1430 11.1430 11.5937 11.5937 11.6536 11.6536 14.0656 14.0656 14.4223 14.4223 14.7190 14.7190 14.9593 14.9593 16.2330 16.2330 16.6632 16.6632 17.6600 17.6600 17.8708 17.8708 18.6793 18.6793 k = 0.2588 0.4486 0.5468 ( 4456 PWs) bands (ev): 1.0909 1.0909 1.1008 1.1008 1.1327 1.1327 1.1353 1.1353 1.1511 1.1511 1.1564 1.1564 1.1875 1.1875 1.1919 1.1919 3.0866 3.0866 3.0952 3.0952 3.1587 3.1587 3.1675 3.1675 3.1725 3.1725 3.1834 3.1834 3.3536 3.3536 3.3727 3.3727 3.4728 3.4728 3.4904 3.4904 3.5636 3.5636 3.5775 3.5775 6.1567 6.1567 6.2527 6.2527 6.5508 6.5508 6.8006 6.8006 9.8686 9.8686 9.9053 9.9053 10.1165 10.1165 10.1643 10.1643 10.7379 10.7379 10.7804 10.7804 11.0606 11.0606 11.1288 11.1288 11.5946 11.5946 11.6353 11.6353 14.1679 14.1679 14.4026 14.4026 14.7539 14.7539 14.8856 14.8856 16.3072 16.3072 16.5881 16.5881 17.6677 17.6677 17.7939 17.7939 18.7768 18.7768 k = 0.2544 0.4410 0.5620 ( 4459 PWs) bands (ev): 1.0913 1.0913 1.1004 1.1004 1.1325 1.1325 1.1352 1.1352 1.1510 1.1510 1.1564 1.1564 1.1873 1.1873 1.1921 1.1921 3.0875 3.0875 3.0943 3.0943 3.1628 3.1628 3.1675 3.1675 3.1736 3.1736 3.1771 3.1771 3.3585 3.3585 3.3684 3.3684 3.4769 3.4769 3.4878 3.4878 3.5658 3.5658 3.5747 3.5747 6.1904 6.1904 6.2515 6.2515 6.5969 6.5969 6.7095 6.7095 9.8823 9.8823 9.9009 9.9009 10.1313 10.1313 10.1536 10.1536 10.7449 10.7449 10.7670 10.7670 11.0810 11.0810 11.1140 11.1140 11.5992 11.5992 11.6201 11.6201 14.2570 14.2570 14.3698 14.3698 14.7760 14.7760 14.8328 14.8328 16.3821 16.3821 16.5185 16.5185 17.6782 17.6782 17.7352 17.7352 18.8783 18.8783 k = 0.2500 0.4334 0.5772 ( 4456 PWs) bands (ev): 1.0917 1.0917 1.1000 1.1000 1.1322 1.1322 1.1354 1.1354 1.1509 1.1509 1.1566 1.1566 1.1870 1.1870 1.1925 1.1925 3.0880 3.0880 3.0937 3.0937 3.1646 3.1646 3.1677 3.1677 3.1715 3.1715 3.1770 3.1770 3.3618 3.3618 3.3652 3.3652 3.4802 3.4802 3.4850 3.4850 3.5673 3.5673 3.5729 3.5729 6.2256 6.2256 6.2296 6.2296 6.6428 6.6428 6.6461 6.6461 9.8921 9.8921 9.8942 9.8942 10.1427 10.1427 10.1437 10.1437 10.7539 10.7539 10.7558 10.7558 11.0980 11.0980 11.0988 11.0988 11.6063 11.6063 11.6096 11.6096 14.3217 14.3217 14.3256 14.3256 14.7971 14.7971 14.7994 14.7994 16.4517 16.4517 16.4525 16.4525 17.6968 17.6968 17.6987 17.6987 18.9773 18.9775 k = 0.2500 0.4334 0.5772 ( 4456 PWs) bands (ev): 1.0917 1.0917 1.1000 1.1000 1.1322 1.1322 1.1354 1.1354 1.1509 1.1509 1.1566 1.1566 1.1870 1.1870 1.1925 1.1925 3.0880 3.0880 3.0937 3.0937 3.1646 3.1646 3.1677 3.1677 3.1715 3.1715 3.1770 3.1770 3.3618 3.3618 3.3652 3.3652 3.4802 3.4802 3.4850 3.4850 3.5673 3.5673 3.5729 3.5729 6.2256 6.2256 6.2296 6.2296 6.6428 6.6428 6.6461 6.6461 9.8921 9.8921 9.8942 9.8942 10.1427 10.1427 10.1437 10.1437 10.7539 10.7539 10.7558 10.7558 11.0980 11.0980 11.0988 11.0988 11.6063 11.6063 11.6096 11.6096 14.3217 14.3217 14.3256 14.3256 14.7971 14.7971 14.7994 14.7994 16.4517 16.4517 16.4525 16.4525 17.6968 17.6968 17.6987 17.6987 18.9773 18.9773 k = 0.2396 0.4394 0.5652 ( 4456 PWs) bands (ev): 1.0917 1.0917 1.1000 1.1000 1.1321 1.1321 1.1355 1.1355 1.1509 1.1509 1.1566 1.1566 1.1870 1.1870 1.1925 1.1925 3.0877 3.0877 3.0939 3.0939 3.1621 3.1621 3.1677 3.1677 3.1726 3.1726 3.1786 3.1786 3.3584 3.3584 3.3685 3.3685 3.4798 3.4798 3.4849 3.4849 3.5672 3.5672 3.5732 3.5732 6.2165 6.2165 6.2205 6.2205 6.6539 6.6539 6.6572 6.6572 9.8865 9.8865 9.8984 9.8984 10.1427 10.1427 10.1437 10.1437 10.7480 10.7480 10.7606 10.7606 11.0861 11.0861 11.1083 11.1083 11.5993 11.5993 11.6195 11.6195 14.2923 14.2923 14.3292 14.3292 14.7754 14.7754 14.8373 14.8373 16.4418 16.4418 16.4561 16.4561 17.6811 17.6811 17.7373 17.7373 18.9685 18.9685 k = 0.2292 0.4454 0.5532 ( 4458 PWs) bands (ev): 1.0917 1.0917 1.0999 1.0999 1.1321 1.1321 1.1357 1.1357 1.1510 1.1510 1.1567 1.1567 1.1868 1.1868 1.1926 1.1926 3.0871 3.0871 3.0945 3.0945 3.1579 3.1579 3.1671 3.1671 3.1744 3.1744 3.1827 3.1827 3.3535 3.3535 3.3727 3.3727 3.4787 3.4787 3.4846 3.4846 3.5671 3.5671 3.5742 3.5742 6.1917 6.1917 6.1956 6.1956 6.6849 6.6849 6.6880 6.6880 9.8786 9.8786 9.9019 9.9019 10.1426 10.1426 10.1437 10.1437 10.7398 10.7398 10.7650 10.7650 11.0720 11.0720 11.1151 11.1151 11.5943 11.5943 11.6332 11.6332 14.2428 14.2428 14.3043 14.3043 14.7735 14.7735 14.8844 14.8844 16.4261 16.4261 16.4541 16.4541 17.6864 17.6864 17.7990 17.7990 18.9591 18.9591 k = 0.2188 0.4514 0.5411 ( 4458 PWs) bands (ev): 1.0916 1.0916 1.0998 1.0998 1.1320 1.1320 1.1360 1.1360 1.1512 1.1512 1.1569 1.1569 1.1867 1.1867 1.1926 1.1926 3.0863 3.0863 3.0951 3.0951 3.1535 3.1535 3.1662 3.1662 3.1764 3.1764 3.1878 3.1878 3.3485 3.3485 3.3766 3.3766 3.4770 3.4770 3.4840 3.4840 3.5671 3.5671 3.5756 3.5756 6.1566 6.1566 6.1603 6.1603 6.7303 6.7303 6.7333 6.7333 9.8695 9.8695 9.9038 9.9038 10.1424 10.1424 10.1438 10.1438 10.7304 10.7304 10.7681 10.7681 11.0566 11.0566 11.1184 11.1184 11.5933 11.5933 11.6489 11.6489 14.1812 14.1812 14.2528 14.2528 14.7898 14.7898 14.9330 14.9330 16.4071 16.4071 16.4481 16.4481 17.7104 17.7104 17.8807 17.8807 18.9528 18.9528 k = 0.2083 0.4574 0.5291 ( 4460 PWs) bands (ev): 1.0915 1.0915 1.0997 1.0997 1.1319 1.1319 1.1364 1.1364 1.1514 1.1514 1.1572 1.1572 1.1865 1.1865 1.1927 1.1927 3.0854 3.0854 3.0957 3.0957 3.1494 3.1494 3.1653 3.1653 3.1785 3.1785 3.1931 3.1931 3.3436 3.3436 3.3800 3.3800 3.4750 3.4750 3.4830 3.4830 3.5672 3.5672 3.5774 3.5774 6.1156 6.1156 6.1192 6.1192 6.7855 6.7855 6.7883 6.7883 9.8592 9.8592 9.9040 9.9040 10.1420 10.1420 10.1442 10.1442 10.7195 10.7195 10.7698 10.7698 11.0406 11.0406 11.1178 11.1178 11.5968 11.5968 11.6663 11.6663 14.1113 14.1113 14.1824 14.1824 14.8169 14.8169 14.9791 14.9791 16.3871 16.3871 16.4409 16.4409 17.7484 17.7484 17.9797 17.9797 18.9529 18.9529 k = 0.1979 0.4635 0.5171 ( 4460 PWs) bands (ev): 1.0913 1.0913 1.0995 1.0995 1.1318 1.1318 1.1369 1.1369 1.1516 1.1516 1.1575 1.1575 1.1862 1.1862 1.1927 1.1927 3.0845 3.0845 3.0960 3.0960 3.1456 3.1456 3.1645 3.1645 3.1809 3.1809 3.1986 3.1986 3.3389 3.3389 3.3827 3.3827 3.4728 3.4728 3.4815 3.4815 3.5675 3.5675 3.5793 3.5793 6.0720 6.0720 6.0754 6.0754 6.8471 6.8471 6.8498 6.8498 9.8478 9.8478 9.9022 9.9022 10.1413 10.1413 10.1449 10.1449 10.7070 10.7070 10.7701 10.7701 11.0243 11.0243 11.1132 11.1132 11.6050 11.6050 11.6850 11.6850 14.0356 14.0356 14.0999 14.0999 14.8486 14.8486 15.0200 15.0200 16.3684 16.3684 16.4353 16.4353 17.7950 17.7950 18.0928 18.0928 18.9628 18.9628 k = 0.1875 0.4695 0.5051 ( 4464 PWs) bands (ev): 1.0912 1.0912 1.0993 1.0993 1.1316 1.1316 1.1375 1.1375 1.1519 1.1519 1.1579 1.1579 1.1860 1.1860 1.1927 1.1927 3.0837 3.0837 3.0961 3.0961 3.1424 3.1424 3.1637 3.1637 3.1834 3.1834 3.2039 3.2039 3.3344 3.3344 3.3847 3.3847 3.4706 3.4706 3.4797 3.4797 3.5679 3.5679 3.5814 3.5814 6.0276 6.0276 6.0310 6.0310 6.9133 6.9133 6.9158 6.9158 9.8353 9.8353 9.8983 9.8983 10.1405 10.1405 10.1459 10.1459 10.6928 10.6928 10.7688 10.7688 11.0084 11.0084 11.1050 11.1050 11.6179 11.6179 11.7050 11.7050 13.9557 13.9557 14.0100 14.0100 14.8810 14.8810 15.0545 15.0545 16.3529 16.3529 16.4341 16.4341 17.8442 17.8442 18.2169 18.2169 18.9694 18.9694 k = 0.1771 0.4755 0.4930 ( 4458 PWs) bands (ev): 1.0910 1.0910 1.0991 1.0991 1.1315 1.1315 1.1381 1.1381 1.1522 1.1522 1.1583 1.1583 1.1859 1.1859 1.1927 1.1927 3.0829 3.0829 3.0958 3.0958 3.1399 3.1399 3.1630 3.1630 3.1862 3.1862 3.2090 3.2090 3.3303 3.3303 3.3859 3.3859 3.4684 3.4684 3.4774 3.4774 3.5686 3.5686 3.5835 3.5835 5.9837 5.9837 5.9869 5.9869 6.9826 6.9826 6.9850 6.9850 9.8216 9.8216 9.8923 9.8923 10.1394 10.1394 10.1471 10.1471 10.6769 10.6769 10.7658 10.7658 10.9931 10.9931 11.0935 11.0935 11.6354 11.6354 11.7261 11.7261 13.8728 13.8728 13.9155 13.9155 14.9119 14.9119 15.0820 15.0820 16.3418 16.3418 16.4389 16.4389 17.8910 17.8910 18.3489 18.3489 18.9590 18.9590 k = 0.1667 0.4815 0.4810 ( 4462 PWs) bands (ev): 1.0909 1.0909 1.0989 1.0989 1.1314 1.1314 1.1386 1.1386 1.1525 1.1525 1.1588 1.1588 1.1857 1.1857 1.1926 1.1926 3.0821 3.0821 3.0951 3.0951 3.1379 3.1379 3.1623 3.1623 3.1892 3.1892 3.2137 3.2137 3.3268 3.3268 3.3863 3.3863 3.4665 3.4665 3.4749 3.4749 3.5694 3.5694 3.5856 3.5856 5.9408 5.9408 5.9439 5.9439 7.0541 7.0541 7.0564 7.0564 9.8069 9.8069 9.8841 9.8841 10.1382 10.1382 10.1487 10.1487 10.6593 10.6593 10.7606 10.7606 10.9788 10.9788 11.0795 11.0795 11.6571 11.6571 11.7484 11.7484 13.7878 13.7878 13.8186 13.8186 14.9399 14.9399 15.1023 15.1023 16.3361 16.3361 16.4506 16.4506 17.9314 17.9314 18.4845 18.4845 18.9508 18.9508 k = 0.1562 0.4875 0.4690 ( 4466 PWs) bands (ev): 1.0907 1.0907 1.0987 1.0987 1.1312 1.1312 1.1392 1.1392 1.1528 1.1528 1.1594 1.1594 1.1856 1.1856 1.1925 1.1925 3.0814 3.0814 3.0940 3.0940 3.1366 3.1366 3.1616 3.1616 3.1924 3.1924 3.2181 3.2181 3.3238 3.3238 3.3857 3.3857 3.4647 3.4647 3.4722 3.4722 3.5703 3.5703 3.5876 3.5876 5.8996 5.8996 5.9026 5.9026 7.1272 7.1272 7.1294 7.1294 9.7911 9.7911 9.8735 9.8735 10.1368 10.1368 10.1504 10.1504 10.6401 10.6401 10.7533 10.7533 10.9658 10.9658 11.0639 11.0639 11.6825 11.6825 11.7718 11.7718 13.7016 13.7016 13.7205 13.7205 14.9645 14.9645 15.1161 15.1161 16.3364 16.3364 16.4694 16.4694 17.9633 17.9633 18.6162 18.6162 18.9507 18.9507 k = 0.1458 0.4935 0.4570 ( 4468 PWs) bands (ev): 1.0906 1.0906 1.0986 1.0986 1.1311 1.1311 1.1396 1.1396 1.1531 1.1531 1.1600 1.1600 1.1856 1.1856 1.1924 1.1924 3.0807 3.0807 3.0926 3.0926 3.1358 3.1358 3.1610 3.1610 3.1958 3.1958 3.2221 3.2221 3.3215 3.3215 3.3844 3.3844 3.4630 3.4630 3.4693 3.4693 3.5714 3.5714 3.5896 3.5896 5.8603 5.8603 5.8632 5.8632 7.2012 7.2012 7.2034 7.2034 9.7742 9.7742 9.8605 9.8605 10.1353 10.1353 10.1522 10.1522 10.6194 10.6194 10.7435 10.7435 10.9543 10.9543 11.0475 11.0475 11.7112 11.7112 11.7964 11.7964 13.6147 13.6147 13.6225 13.6225 14.9855 14.9855 15.1240 15.1240 16.3426 16.3426 16.4945 16.4945 17.9866 17.9866 18.7259 18.7259 18.9748 18.9748 k = 0.1354 0.4995 0.4449 ( 4468 PWs) bands (ev): 1.0904 1.0904 1.0984 1.0984 1.1310 1.1310 1.1400 1.1400 1.1535 1.1535 1.1606 1.1606 1.1856 1.1856 1.1922 1.1922 3.0801 3.0801 3.0910 3.0910 3.1355 3.1355 3.1604 3.1604 3.1993 3.1993 3.2255 3.2255 3.3200 3.3200 3.3822 3.3822 3.4614 3.4614 3.4664 3.4664 3.5727 3.5727 3.5914 3.5914 5.8232 5.8232 5.8260 5.8260 7.2754 7.2754 7.2779 7.2779 9.7562 9.7562 9.8451 9.8451 10.1337 10.1337 10.1541 10.1541 10.5978 10.5978 10.7311 10.7311 10.9444 10.9444 11.0311 11.0311 11.7429 11.7429 11.8222 11.8222 13.5249 13.5249 13.5285 13.5285 15.0027 15.0027 15.1271 15.1271 16.3548 16.3548 16.5250 16.5250 18.0028 18.0028 18.7850 18.7850 19.0492 19.0492 k = 0.1250 0.5055 0.4329 ( 4462 PWs) bands (ev): 1.0903 1.0903 1.0983 1.0983 1.1309 1.1309 1.1403 1.1403 1.1538 1.1538 1.1613 1.1613 1.1857 1.1857 1.1920 1.1920 3.0795 3.0795 3.0892 3.0892 3.1356 3.1356 3.1598 3.1598 3.2030 3.2030 3.2283 3.2283 3.3193 3.3193 3.3795 3.3795 3.4596 3.4596 3.4637 3.4637 3.5741 3.5741 3.5930 3.5930 5.7884 5.7884 5.7912 5.7912 7.3495 7.3495 7.3521 7.3521 9.7372 9.7372 9.8272 9.8272 10.1321 10.1321 10.1558 10.1558 10.5757 10.5757 10.7160 10.7160 10.9360 10.9360 11.0153 11.0153 11.7772 11.7772 11.8493 11.8493 13.4298 13.4298 13.4422 13.4422 15.0165 15.0165 15.1264 15.1264 16.3724 16.3724 16.5592 16.5592 18.0142 18.0142 18.7994 18.7994 19.1646 19.1646 k = 0.1146 0.5115 0.4209 ( 4466 PWs) bands (ev): 1.0903 1.0903 1.0982 1.0982 1.1309 1.1309 1.1404 1.1404 1.1543 1.1543 1.1619 1.1619 1.1858 1.1858 1.1917 1.1917 3.0789 3.0789 3.0874 3.0874 3.1360 3.1360 3.1591 3.1591 3.2067 3.2067 3.2306 3.2306 3.3193 3.3193 3.3762 3.3762 3.4574 3.4574 3.4616 3.4616 3.5756 3.5756 3.5944 3.5944 5.7561 5.7561 5.7589 5.7589 7.4227 7.4227 7.4257 7.4257 9.7172 9.7172 9.8070 9.8070 10.1305 10.1305 10.1572 10.1572 10.5539 10.5539 10.6985 10.6985 10.9292 10.9292 11.0008 11.0008 11.8137 11.8137 11.8776 11.8776 13.3369 13.3369 13.3573 13.3573 15.0272 15.0272 15.1229 15.1229 16.3950 16.3950 16.5955 16.5955 18.0232 18.0232 18.7952 18.7952 19.2899 19.2899 k = 0.1042 0.5175 0.4089 ( 4464 PWs) bands (ev): 1.0902 1.0902 1.0981 1.0981 1.1308 1.1308 1.1403 1.1403 1.1548 1.1548 1.1626 1.1626 1.1860 1.1860 1.1914 1.1914 3.0783 3.0783 3.0857 3.0857 3.1366 3.1366 3.1584 3.1584 3.2105 3.2105 3.2324 3.2324 3.3201 3.3201 3.3726 3.3726 3.4547 3.4547 3.4598 3.4598 3.5772 3.5772 3.5956 3.5956 5.7264 5.7264 5.7291 5.7291 7.4945 7.4945 7.4978 7.4978 9.6964 9.6964 9.7844 9.7844 10.1291 10.1291 10.1582 10.1582 10.5329 10.5329 10.6788 10.6788 10.9237 10.9237 10.9877 10.9877 11.8520 11.8520 11.9072 11.9072 13.2469 13.2469 13.2741 13.2741 15.0353 15.0353 15.1175 15.1175 16.4216 16.4216 16.6322 16.6322 18.0323 18.0323 18.7835 18.7835 19.4073 19.4073 k = 0.0938 0.5235 0.3968 ( 4456 PWs) bands (ev): 1.0902 1.0902 1.0980 1.0980 1.1308 1.1308 1.1401 1.1401 1.1554 1.1554 1.1631 1.1631 1.1862 1.1862 1.1912 1.1912 3.0776 3.0776 3.0842 3.0842 3.1374 3.1374 3.1577 3.1577 3.2142 3.2142 3.2338 3.2338 3.3214 3.3214 3.3688 3.3688 3.4520 3.4520 3.4583 3.4583 3.5789 3.5789 3.5965 3.5965 5.6993 5.6993 5.7020 5.7020 7.5641 7.5641 7.5678 7.5678 9.6749 9.6749 9.7598 9.7598 10.1278 10.1278 10.1585 10.1585 10.5136 10.5136 10.6574 10.6574 10.9195 10.9195 10.9761 10.9761 11.8919 11.8919 11.9380 11.9380 13.1604 13.1604 13.1931 13.1931 15.0412 15.0412 15.1109 15.1109 16.4517 16.4517 16.6675 16.6675 18.0436 18.0436 18.7676 18.7676 19.5055 19.5055 k = 0.0833 0.5295 0.3848 ( 4464 PWs) bands (ev): 1.0901 1.0901 1.0980 1.0980 1.1309 1.1309 1.1398 1.1398 1.1561 1.1561 1.1636 1.1636 1.1864 1.1864 1.1909 1.1909 3.0769 3.0769 3.0828 3.0828 3.1382 3.1382 3.1568 3.1568 3.2179 3.2179 3.2348 3.2348 3.3231 3.3231 3.3648 3.3648 3.4493 3.4493 3.4568 3.4568 3.5806 3.5806 3.5972 3.5972 5.6749 5.6749 5.6776 5.6776 7.6307 7.6307 7.6347 7.6347 9.6533 9.6533 9.7335 9.7335 10.1268 10.1268 10.1582 10.1582 10.4967 10.4967 10.6348 10.6348 10.9165 10.9165 10.9661 10.9661 11.9329 11.9329 11.9700 11.9700 13.0781 13.0781 13.1148 13.1148 15.0454 15.0454 15.1038 15.1038 16.4843 16.4843 16.6998 16.6998 18.0589 18.0589 18.7478 18.7478 19.5761 19.5761 k = 0.0729 0.5356 0.3728 ( 4460 PWs) bands (ev): 1.0901 1.0901 1.0980 1.0980 1.1310 1.1310 1.1394 1.1394 1.1568 1.1568 1.1639 1.1639 1.1866 1.1866 1.1907 1.1907 3.0763 3.0763 3.0816 3.0816 3.1392 3.1392 3.1559 3.1559 3.2214 3.2214 3.2357 3.2357 3.3251 3.3251 3.3609 3.3609 3.4469 3.4469 3.4551 3.4551 3.5824 3.5824 3.5977 3.5977 5.6533 5.6533 5.6560 5.6560 7.6936 7.6936 7.6978 7.6978 9.6319 9.6319 9.7059 9.7059 10.1261 10.1261 10.1571 10.1571 10.4827 10.4827 10.6119 10.6119 10.9145 10.9145 10.9574 10.9574 11.9746 11.9746 12.0028 12.0028 13.0005 13.0005 13.0396 13.0396 15.0482 15.0482 15.0965 15.0965 16.5186 16.5186 16.7275 16.7275 18.0797 18.0797 18.7238 18.7238 19.6168 19.6168 k = 0.0625 0.5416 0.3608 ( 4458 PWs) bands (ev): 1.0901 1.0901 1.0980 1.0980 1.1311 1.1311 1.1389 1.1389 1.1576 1.1576 1.1642 1.1642 1.1868 1.1868 1.1904 1.1904 3.0756 3.0756 3.0806 3.0806 3.1403 3.1403 3.1549 3.1549 3.2246 3.2246 3.2363 3.2363 3.3273 3.3273 3.3572 3.3572 3.4449 3.4449 3.4534 3.4534 3.5842 3.5842 3.5979 3.5979 5.6346 5.6346 5.6372 5.6372 7.7516 7.7516 7.7559 7.7559 9.6115 9.6115 9.6779 9.6779 10.1258 10.1258 10.1552 10.1552 10.4719 10.4719 10.5890 10.5890 10.9134 10.9134 10.9498 10.9498 12.0163 12.0163 12.0361 12.0361 12.9284 12.9284 12.9683 12.9683 15.0502 15.0502 15.0894 15.0894 16.5538 16.5538 16.7494 16.7494 18.1071 18.1071 18.6946 18.6946 19.6329 19.6329 k = 0.0521 0.5476 0.3487 ( 4462 PWs) bands (ev): 1.0902 1.0902 1.0979 1.0979 1.1313 1.1313 1.1384 1.1384 1.1584 1.1584 1.1642 1.1642 1.1870 1.1870 1.1902 1.1902 3.0749 3.0749 3.0798 3.0798 3.1413 3.1413 3.1538 3.1538 3.2276 3.2276 3.2369 3.2369 3.3295 3.3295 3.3536 3.3536 3.4434 3.4434 3.4516 3.4516 3.5860 3.5860 3.5979 3.5979 5.6186 5.6186 5.6212 5.6212 7.8036 7.8036 7.8080 7.8080 9.5928 9.5928 9.6504 9.6504 10.1260 10.1260 10.1526 10.1526 10.4648 10.4648 10.5669 10.5669 10.9131 10.9131 10.9433 10.9433 12.0571 12.0571 12.0694 12.0694 12.8627 12.8627 12.9017 12.9017 15.0517 15.0517 15.0828 15.0828 16.5889 16.5889 16.7646 16.7646 18.1415 18.1415 18.6594 18.6594 19.6346 19.6346 k = 0.0417 0.5536 0.3367 ( 4456 PWs) bands (ev): 1.0902 1.0902 1.0980 1.0980 1.1315 1.1315 1.1379 1.1379 1.1593 1.1593 1.1641 1.1641 1.1872 1.1872 1.1901 1.1901 3.0744 3.0744 3.0792 3.0792 3.1425 3.1425 3.1527 3.1527 3.2302 3.2302 3.2373 3.2373 3.3316 3.3316 3.3503 3.3503 3.4423 3.4423 3.4498 3.4498 3.5877 3.5877 3.5976 3.5976 5.6055 5.6055 5.6081 5.6081 7.8486 7.8486 7.8528 7.8528 9.5767 9.5767 9.6244 9.6244 10.1267 10.1267 10.1494 10.1494 10.4614 10.4614 10.5460 10.5460 10.9135 10.9135 10.9376 10.9376 12.0956 12.0956 12.1017 12.1017 12.8049 12.8049 12.8408 12.8408 15.0529 15.0529 15.0768 15.0768 16.6234 16.6234 16.7726 16.7726 18.1829 18.1829 18.6178 18.6178 19.6317 19.6317 k = 0.0312 0.5596 0.3247 ( 4454 PWs) bands (ev): 1.0902 1.0902 1.0980 1.0980 1.1317 1.1317 1.1374 1.1374 1.1601 1.1601 1.1639 1.1639 1.1873 1.1873 1.1899 1.1899 3.0739 3.0739 3.0787 3.0787 3.1436 3.1436 3.1516 3.1516 3.2324 3.2324 3.2376 3.2376 3.3337 3.3337 3.3473 3.3473 3.4418 3.4418 3.4480 3.4480 3.5894 3.5894 3.5971 3.5971 5.5953 5.5953 5.5979 5.5979 7.8854 7.8854 7.8891 7.8891 9.5643 9.5643 9.6010 9.6010 10.1280 10.1280 10.1458 10.1458 10.4615 10.4615 10.5267 10.5267 10.9146 10.9146 10.9326 10.9326 12.1298 12.1298 12.1318 12.1318 12.7567 12.7567 12.7873 12.7873 15.0542 15.0542 15.0715 15.0715 16.6562 16.6562 16.7735 16.7735 18.2307 18.2307 18.5699 18.5699 19.6313 19.6313 k = 0.0208 0.5656 0.3127 ( 4444 PWs) bands (ev): 1.0902 1.0902 1.0980 1.0980 1.1318 1.1318 1.1370 1.1370 1.1609 1.1609 1.1636 1.1636 1.1875 1.1875 1.1898 1.1898 3.0736 3.0736 3.0783 3.0783 3.1447 3.1447 3.1504 3.1504 3.2342 3.2342 3.2377 3.2377 3.3357 3.3357 3.3446 3.3446 3.4418 3.4418 3.4462 3.4462 3.5909 3.5909 3.5965 3.5965 5.5880 5.5880 5.5907 5.5907 7.9127 7.9127 7.9158 7.9158 9.5565 9.5565 9.5815 9.5815 10.1299 10.1299 10.1422 10.1422 10.4651 10.4651 10.5093 10.5093 10.9163 10.9163 10.9282 10.9282 12.1564 12.1564 12.1580 12.1580 12.7208 12.7208 12.7436 12.7436 15.0556 15.0556 15.0669 15.0669 16.6865 16.6865 16.7674 16.7674 18.2839 18.2839 18.5166 18.5166 19.6373 19.6373 k = 0.0104 0.5716 0.3006 ( 4434 PWs) bands (ev): 1.0902 1.0902 1.0980 1.0980 1.1320 1.1320 1.1368 1.1368 1.1617 1.1617 1.1631 1.1631 1.1876 1.1876 1.1897 1.1897 3.0734 3.0734 3.0781 3.0781 3.1457 3.1457 3.1495 3.1495 3.2354 3.2354 3.2376 3.2376 3.3376 3.3376 3.3422 3.3422 3.4422 3.4422 3.4448 3.4448 3.5921 3.5921 3.5958 3.5958 5.5837 5.5837 5.5863 5.5863 7.9296 7.9296 7.9322 7.9322 9.5541 9.5541 9.5667 9.5667 10.1323 10.1323 10.1386 10.1386 10.4719 10.4719 10.4943 10.4943 10.9185 10.9185 10.9245 10.9245 12.1742 12.1742 12.1757 12.1757 12.7002 12.7002 12.7125 12.7125 15.0575 15.0575 15.0632 15.0632 16.7137 16.7137 16.7549 16.7549 18.3410 18.3410 18.4594 18.4594 19.6514 19.6514 k = 0.0000 0.5776 0.2886 ( 4422 PWs) bands (ev): 1.0903 1.0903 1.0980 1.0980 1.1320 1.1320 1.1367 1.1367 1.1621 1.1621 1.1628 1.1628 1.1877 1.1877 1.1896 1.1896 3.0734 3.0734 3.0781 3.0781 3.1461 3.1461 3.1490 3.1490 3.2359 3.2359 3.2375 3.2375 3.3391 3.3391 3.3406 3.3406 3.4427 3.4427 3.4439 3.4439 3.5927 3.5927 3.5954 3.5954 5.5822 5.5822 5.5848 5.5848 7.9353 7.9353 7.9377 7.9377 9.5568 9.5568 9.5581 9.5581 10.1348 10.1348 10.1356 10.1356 10.4816 10.4816 10.4818 10.4818 10.9211 10.9211 10.9213 10.9213 12.1811 12.1811 12.1814 12.1814 12.6968 12.6968 12.6980 12.6980 15.0593 15.0593 15.0607 15.0607 16.7360 16.7360 16.7376 16.7376 18.3997 18.3997 18.4006 18.4006 19.6732 19.6735 k = 0.0000 0.5776 0.2886 ( 4422 PWs) bands (ev): 1.0903 1.0903 1.0980 1.0980 1.1320 1.1320 1.1367 1.1367 1.1621 1.1621 1.1628 1.1628 1.1877 1.1877 1.1896 1.1896 3.0734 3.0734 3.0781 3.0781 3.1461 3.1461 3.1490 3.1490 3.2359 3.2359 3.2375 3.2375 3.3391 3.3391 3.3406 3.3406 3.4427 3.4427 3.4439 3.4439 3.5927 3.5927 3.5954 3.5954 5.5822 5.5822 5.5848 5.5848 7.9353 7.9353 7.9377 7.9377 9.5568 9.5568 9.5581 9.5581 10.1348 10.1348 10.1356 10.1356 10.4816 10.4816 10.4818 10.4818 10.9211 10.9211 10.9213 10.9213 12.1811 12.1811 12.1814 12.1814 12.6968 12.6968 12.6980 12.6980 15.0593 15.0593 15.0607 15.0607 16.7360 16.7360 16.7376 16.7376 18.3997 18.3997 18.4006 18.4006 19.6731 19.6739 k =-0.0139 0.5728 0.2982 ( 4436 PWs) bands (ev): 1.0901 1.0901 1.0981 1.0981 1.1319 1.1319 1.1367 1.1367 1.1600 1.1600 1.1648 1.1648 1.1876 1.1876 1.1899 1.1899 3.0732 3.0732 3.0783 3.0783 3.1428 3.1428 3.1521 3.1521 3.2301 3.2301 3.2435 3.2435 3.3366 3.3366 3.3435 3.3435 3.4411 3.4411 3.4456 3.4456 3.5907 3.5907 3.5971 3.5971 5.5821 5.5821 5.5882 5.5882 7.8935 7.8935 7.9772 7.9772 9.4965 9.4965 9.6109 9.6109 10.0894 10.0894 10.1832 10.1832 10.4718 10.4718 10.4929 10.4929 10.8952 10.8952 10.9489 10.9489 12.1605 12.1605 12.2054 12.2054 12.6539 12.6539 12.7441 12.7441 14.8732 14.8732 15.2524 15.2524 16.6390 16.6390 16.8196 16.8196 18.3642 18.3642 18.4451 18.4451 19.5944 19.5944 k =-0.0278 0.5680 0.3078 ( 4444 PWs) bands (ev): 1.0898 1.0898 1.0984 1.0984 1.1314 1.1314 1.1367 1.1367 1.1576 1.1576 1.1671 1.1671 1.1875 1.1875 1.1906 1.1906 3.0727 3.0727 3.0787 3.0787 3.1381 3.1381 3.1557 3.1557 3.2238 3.2238 3.2503 3.2503 3.3340 3.3340 3.3474 3.3474 3.4390 3.4390 3.4479 3.4479 3.5875 3.5875 3.5994 3.5994 5.5845 5.5845 5.5956 5.5956 7.8490 7.8490 8.0148 8.0148 9.4305 9.4305 9.6551 9.6551 10.0454 10.0454 10.2323 10.2323 10.4629 10.4629 10.5065 10.5065 10.8712 10.8712 10.9779 10.9779 12.1431 12.1431 12.2324 12.2324 12.6151 12.6151 12.7929 12.7929 14.6936 14.6936 15.4487 15.4487 16.5302 16.5302 16.8845 16.8845 18.3362 18.3362 18.4991 18.4991 19.5246 19.5246 k =-0.0416 0.5632 0.3175 ( 4456 PWs) bands (ev): 1.0894 1.0894 1.0988 1.0988 1.1307 1.1307 1.1366 1.1366 1.1553 1.1553 1.1693 1.1693 1.1875 1.1875 1.1916 1.1916 3.0722 3.0722 3.0791 3.0791 3.1335 3.1335 3.1586 3.1586 3.2180 3.2180 3.2569 3.2569 3.3321 3.3321 3.3515 3.3515 3.4371 3.4371 3.4501 3.4501 3.5840 3.5840 3.6015 3.6015 5.5900 5.5900 5.6064 5.6064 7.8035 7.8035 8.0482 8.0482 9.3622 9.3622 9.6895 9.6895 10.0022 10.0022 10.2789 10.2789 10.4552 10.4552 10.5252 10.5252 10.8493 10.8493 11.0079 11.0079 12.1290 12.1290 12.2606 12.2606 12.5832 12.5832 12.8426 12.8426 14.5228 14.5228 15.6466 15.6466 16.4148 16.4148 16.9296 16.9296 18.3136 18.3136 18.5620 18.5620 19.4680 19.4680 k =-0.0555 0.5584 0.3271 ( 4458 PWs) bands (ev): 1.0888 1.0888 1.0993 1.0993 1.1298 1.1298 1.1365 1.1365 1.1529 1.1529 1.1714 1.1714 1.1878 1.1878 1.1928 1.1928 3.0717 3.0717 3.0795 3.0795 3.1291 3.1291 3.1606 3.1606 3.2130 3.2130 3.2634 3.2634 3.3310 3.3310 3.3558 3.3558 3.4355 3.4355 3.4524 3.4524 3.5804 3.5804 3.6032 3.6032 5.5989 5.5989 5.6205 5.6205 7.7574 7.7574 8.0761 8.0761 9.2943 9.2943 9.7144 9.7144 9.9589 9.9589 10.3166 10.3166 10.4495 10.4495 10.5532 10.5532 10.8295 10.8295 11.0385 11.0385 12.1179 12.1179 12.2865 12.2865 12.5625 12.5625 12.8918 12.8918 14.3628 14.3628 15.8401 15.8401 16.3002 16.3002 16.9549 16.9549 18.2920 18.2920 18.6337 18.6337 19.4281 19.4281 k =-0.0694 0.5536 0.3367 ( 4465 PWs) bands (ev): 1.0881 1.0881 1.0998 1.0998 1.1287 1.1287 1.1363 1.1363 1.1507 1.1507 1.1734 1.1734 1.1883 1.1883 1.1941 1.1941 3.0712 3.0712 3.0795 3.0795 3.1251 3.1251 3.1612 3.1612 3.2088 3.2088 3.2695 3.2695 3.3308 3.3308 3.3601 3.3601 3.4340 3.4340 3.4547 3.4547 3.5765 3.5765 3.6046 3.6046 5.6110 5.6110 5.6378 5.6378 7.7111 7.7111 8.0971 8.0971 9.2296 9.2296 9.7305 9.7305 9.9148 9.9148 10.3395 10.3395 10.4461 10.4461 10.5942 10.5942 10.8119 10.8119 11.0692 11.0692 12.1095 12.1095 12.3043 12.3043 12.5595 12.5595 12.9385 12.9385 14.2162 14.2162 15.9943 15.9943 16.2218 16.2218 16.9625 16.9625 18.2668 18.2668 18.7135 18.7135 19.4074 19.4074 k =-0.0833 0.5488 0.3463 ( 4463 PWs) bands (ev): 1.0874 1.0874 1.1004 1.1004 1.1274 1.1274 1.1360 1.1360 1.1485 1.1485 1.1751 1.1751 1.1890 1.1890 1.1956 1.1956 3.0709 3.0709 3.0791 3.0791 3.1218 3.1218 3.1606 3.1606 3.2055 3.2055 3.2751 3.2751 3.3317 3.3317 3.3643 3.3643 3.4329 3.4329 3.4570 3.4570 3.5726 3.5726 3.6056 3.6056 5.6265 5.6265 5.6583 5.6583 7.6649 7.6649 8.1094 8.1094 9.1704 9.1704 9.7388 9.7388 9.8698 9.8698 10.3474 10.3474 10.4440 10.4440 10.6466 10.6466 10.7971 10.7971 11.0995 11.0995 12.1034 12.1034 12.3084 12.3084 12.5803 12.5803 12.9798 12.9798 14.0867 14.0867 15.9741 15.9741 16.3138 16.3138 16.9573 16.9573 18.2342 18.2342 18.8004 18.8004 19.4067 19.4067 k =-0.0972 0.5440 0.3560 ( 4467 PWs) bands (ev): 1.0867 1.0867 1.1010 1.1010 1.1261 1.1261 1.1356 1.1356 1.1465 1.1465 1.1767 1.1767 1.1900 1.1900 1.1972 1.1972 3.0706 3.0706 3.0781 3.0781 3.1192 3.1192 3.1585 3.1585 3.2030 3.2030 3.2802 3.2802 3.3335 3.3335 3.3683 3.3683 3.4321 3.4321 3.4593 3.4593 3.5686 3.5686 3.6063 3.6063 5.6453 5.6453 5.6821 5.6821 7.6191 7.6191 8.1114 8.1114 9.1188 9.1188 9.7395 9.7395 9.8251 9.8251 10.3453 10.3453 10.4410 10.4410 10.7022 10.7022 10.7883 10.7883 11.1291 11.1291 12.0990 12.0990 12.2992 12.2992 12.6249 12.6249 13.0117 13.0117 13.9790 13.9790 15.8631 15.8631 16.4870 16.4870 16.9481 16.9481 18.1934 18.1934 18.8924 18.8924 19.4247 19.4247 k =-0.1110 0.5392 0.3656 ( 4465 PWs) bands (ev): 1.0860 1.0860 1.1016 1.1016 1.1247 1.1247 1.1351 1.1351 1.1446 1.1446 1.1781 1.1781 1.1911 1.1911 1.1988 1.1988 3.0703 3.0703 3.0767 3.0767 3.1176 3.1176 3.1554 3.1554 3.2011 3.2011 3.2849 3.2849 3.3363 3.3363 3.3721 3.3721 3.4318 3.4318 3.4617 3.4617 3.5646 3.5646 3.6065 3.6065 5.6675 5.6675 5.7091 5.7091 7.5738 7.5738 8.1019 8.1019 9.0759 9.0759 9.7291 9.7291 9.7853 9.7853 10.3377 10.3377 10.4358 10.4358 10.7362 10.7362 10.8053 10.8053 11.1573 11.1573 12.0959 12.0959 12.2817 12.2817 12.6887 12.6887 13.0292 13.0292 13.8986 13.8986 15.7410 15.7410 16.6412 16.6412 16.9581 16.9581 18.1463 18.1463 18.9867 18.9867 19.4583 19.4583 k =-0.1249 0.5344 0.3752 ( 4472 PWs) bands (ev): 1.0852 1.0852 1.1022 1.1022 1.1233 1.1233 1.1345 1.1345 1.1429 1.1429 1.1793 1.1793 1.1924 1.1924 1.2006 1.2006 3.0694 3.0694 3.0754 3.0754 3.1168 3.1168 3.1515 3.1515 3.1994 3.1994 3.2892 3.2892 3.3398 3.3398 3.3756 3.3756 3.4319 3.4319 3.4641 3.4641 3.5606 3.5606 3.6064 3.6064 5.6930 5.6930 5.7394 5.7394 7.5293 7.5293 8.0806 8.0806 9.0418 9.0418 9.6988 9.6988 9.7608 9.7608 10.3273 10.3273 10.4278 10.4278 10.7345 10.7345 10.8582 10.8582 11.1838 11.1838 12.0936 12.0936 12.2606 12.2606 12.7673 12.7673 13.0278 13.0278 13.8507 13.8507 15.6189 15.6189 16.7155 16.7155 17.0375 17.0375 18.0980 18.0980 19.0804 19.0804 19.5037 19.5037 k =-0.1388 0.5295 0.3848 ( 4467 PWs) bands (ev): 1.0844 1.0844 1.1028 1.1028 1.1219 1.1219 1.1337 1.1337 1.1413 1.1413 1.1804 1.1804 1.1938 1.1938 1.2024 1.2024 3.0676 3.0676 3.0747 3.0747 3.1168 3.1168 3.1471 3.1471 3.1977 3.1977 3.2932 3.2932 3.3438 3.3438 3.3788 3.3788 3.4324 3.4324 3.4666 3.4666 3.5567 3.5567 3.6059 3.6059 5.7218 5.7218 5.7729 5.7729 7.4857 7.4857 8.0477 8.0477 9.0151 9.0151 9.6546 9.6546 9.7475 9.7475 10.3155 10.3155 10.4168 10.4168 10.7235 10.7235 10.9184 10.9184 11.2079 11.2079 12.0913 12.0913 12.2389 12.2389 12.8581 12.8581 13.0069 13.0069 13.8367 13.8367 15.5002 15.5002 16.7103 16.7103 17.1785 17.1785 18.0573 18.0573 19.1708 19.1708 19.5568 19.5568 k =-0.1527 0.5247 0.3944 ( 4463 PWs) bands (ev): 1.0836 1.0836 1.1033 1.1033 1.1206 1.1206 1.1327 1.1327 1.1399 1.1399 1.1813 1.1813 1.1953 1.1953 1.2042 1.2042 3.0648 3.0648 3.0749 3.0749 3.1173 3.1173 3.1425 3.1425 3.1958 3.1958 3.2970 3.2970 3.3478 3.3478 3.3819 3.3819 3.4333 3.4333 3.4691 3.4691 3.5531 3.5531 3.6050 3.6050 5.7539 5.7539 5.8097 5.8097 7.4431 7.4431 8.0047 8.0047 8.9930 8.9930 9.6075 9.6075 9.7366 9.7366 10.3032 10.3032 10.4027 10.4027 10.7104 10.7104 10.9767 10.9767 11.2292 11.2292 12.0882 12.0882 12.2183 12.2183 12.9552 12.9552 12.9747 12.9747 13.8530 13.8530 15.3867 15.3867 16.6747 16.6747 17.3186 17.3186 18.0404 18.0404 19.2552 19.2552 19.6140 19.6140 k =-0.1665 0.5199 0.4041 ( 4469 PWs) bands (ev): 1.0828 1.0828 1.1038 1.1038 1.1193 1.1193 1.1316 1.1316 1.1387 1.1387 1.1820 1.1820 1.1968 1.1968 1.2061 1.2061 3.0615 3.0615 3.0755 3.0755 3.1183 3.1183 3.1378 3.1378 3.1936 3.1936 3.3007 3.3007 3.3515 3.3515 3.3851 3.3851 3.4346 3.4346 3.4716 3.4716 3.5497 3.5497 3.6038 3.6038 5.7892 5.7892 5.8498 5.8498 7.4017 7.4017 7.9534 7.9534 8.9717 8.9717 9.5621 9.5621 9.7257 9.7257 10.2907 10.2907 10.3856 10.3856 10.6966 10.6966 11.0308 11.0308 11.2474 11.2474 12.0835 12.0835 12.2002 12.2002 12.9230 12.9230 13.0723 13.0723 13.8928 13.8928 15.2799 15.2799 16.6287 16.6287 17.4148 17.4148 18.0726 18.0726 19.3318 19.3318 19.6720 19.6720 k =-0.1804 0.5151 0.4137 ( 4464 PWs) bands (ev): 1.0820 1.0820 1.1043 1.1043 1.1181 1.1181 1.1304 1.1304 1.1377 1.1377 1.1827 1.1827 1.1983 1.1983 1.2080 1.2080 3.0581 3.0581 3.0765 3.0765 3.1196 3.1196 3.1333 3.1333 3.1911 3.1911 3.3044 3.3044 3.3545 3.3545 3.3885 3.3885 3.4362 3.4362 3.4740 3.4740 3.5466 3.5466 3.6023 3.6023 5.8278 5.8278 5.8932 5.8932 7.3614 7.3614 7.8959 7.8959 8.9469 8.9469 9.5215 9.5215 9.7146 9.7146 10.2784 10.2784 10.3656 10.3656 10.6825 10.6825 11.0791 11.0791 11.2625 11.2625 12.0764 12.0764 12.1857 12.1857 12.8747 12.8747 13.1920 13.1920 13.9494 13.9494 15.1813 15.1813 16.5791 16.5791 17.4457 17.4457 18.1700 18.1700 19.3988 19.3988 19.7287 19.7287 k =-0.1943 0.5103 0.4233 ( 4456 PWs) bands (ev): 1.0812 1.0812 1.1048 1.1048 1.1170 1.1170 1.1292 1.1292 1.1368 1.1368 1.1833 1.1833 1.1997 1.1997 1.2098 1.2098 3.0548 3.0548 3.0776 3.0776 3.1208 3.1208 3.1291 3.1291 3.1884 3.1884 3.3079 3.3079 3.3566 3.3566 3.3924 3.3924 3.4381 3.4381 3.4762 3.4762 3.5440 3.5440 3.6005 3.6005 5.8694 5.8694 5.9400 5.9400 7.3225 7.3225 7.8340 7.8340 8.9143 8.9143 9.4880 9.4880 9.7034 9.7034 10.2660 10.2660 10.3432 10.3432 10.6685 10.6685 11.1198 11.1198 11.2753 11.2753 12.0666 12.0666 12.1751 12.1751 12.8283 12.8283 13.3193 13.3193 14.0179 14.0179 15.0920 15.0920 16.5287 16.5287 17.4242 17.4242 18.3180 18.3180 19.4553 19.4553 19.7829 19.7829 k =-0.2082 0.5055 0.4329 ( 4457 PWs) bands (ev): 1.0804 1.0804 1.1052 1.1052 1.1161 1.1161 1.1279 1.1279 1.1359 1.1359 1.1838 1.1838 1.2011 1.2011 1.2117 1.2117 3.0516 3.0516 3.0789 3.0789 3.1211 3.1211 3.1262 3.1262 3.1856 3.1856 3.3113 3.3113 3.3577 3.3577 3.3968 3.3968 3.4401 3.4401 3.4780 3.4780 3.5420 3.5420 3.5985 3.5985 5.9140 5.9140 5.9900 5.9900 7.2850 7.2850 7.7693 7.7693 8.8709 8.8709 9.4629 9.4629 9.6926 9.6926 10.2527 10.2527 10.3200 10.3200 10.6549 10.6549 11.1501 11.1501 11.2882 11.2882 12.0549 12.0549 12.1681 12.1681 12.7865 12.7865 13.4527 13.4527 14.0945 14.0945 15.0134 15.0134 16.4795 16.4795 17.3740 17.3740 18.4914 18.4914 19.5010 19.5010 19.8340 19.8340 k =-0.2221 0.5007 0.4425 ( 4450 PWs) bands (ev): 1.0795 1.0795 1.1056 1.1056 1.1153 1.1153 1.1267 1.1267 1.1351 1.1351 1.1842 1.1842 1.2024 1.2024 1.2135 1.2135 3.0486 3.0486 3.0802 3.0802 3.1187 3.1187 3.1263 3.1263 3.1828 3.1828 3.3145 3.3145 3.3580 3.3580 3.4016 3.4016 3.4422 3.4422 3.4794 3.4794 3.5405 3.5405 3.5964 3.5964 5.9616 5.9616 6.0435 6.0435 7.2489 7.2489 7.7030 7.7030 8.8156 8.8156 9.4461 9.4461 9.6823 9.6823 10.2362 10.2362 10.2989 10.2989 10.6418 10.6418 11.1660 11.1660 11.3046 11.3046 12.0423 12.0423 12.1637 12.1637 12.7508 12.7508 13.5903 13.5903 14.1768 14.1768 14.9470 14.9470 16.4328 16.4328 17.3099 17.3099 18.6740 18.6740 19.5363 19.5363 19.8821 19.8821 k =-0.2359 0.4959 0.4522 ( 4445 PWs) bands (ev): 1.0787 1.0787 1.1060 1.1060 1.1146 1.1146 1.1255 1.1255 1.1343 1.1343 1.1846 1.1846 1.2036 1.2036 1.2153 1.2153 3.0459 3.0459 3.0815 3.0815 3.1153 3.1153 3.1276 3.1276 3.1801 3.1801 3.3173 3.3173 3.3576 3.3576 3.4067 3.4067 3.4443 3.4443 3.4803 3.4803 3.5396 3.5396 3.5942 3.5942 6.0119 6.0119 6.1003 6.1003 7.2143 7.2143 7.6362 7.6362 8.7488 8.7488 9.4358 9.4358 9.6730 9.6730 10.2134 10.2134 10.2839 10.2839 10.6295 10.6295 11.1652 11.1652 11.3267 11.3267 12.0300 12.0300 12.1609 12.1609 12.7215 12.7215 13.7297 13.7297 14.2632 14.2632 14.8946 14.8946 16.3898 16.3898 17.2395 17.2395 18.8562 18.8562 19.5626 19.5626 19.9272 19.9272 k =-0.2498 0.4911 0.4618 ( 4457 PWs) bands (ev): 1.0779 1.0779 1.1063 1.1063 1.1140 1.1140 1.1244 1.1244 1.1335 1.1335 1.1849 1.1849 1.2047 1.2047 1.2169 1.2169 3.0435 3.0435 3.0828 3.0828 3.1120 3.1120 3.1289 3.1289 3.1777 3.1777 3.3196 3.3196 3.3569 3.3569 3.4116 3.4116 3.4465 3.4465 3.4807 3.4807 3.5392 3.5392 3.5922 3.5922 6.0649 6.0649 6.1605 6.1605 7.1812 7.1812 7.5696 7.5696 8.6720 8.6720 9.4300 9.4300 9.6647 9.6647 10.1837 10.1837 10.2763 10.2763 10.6181 10.6181 11.1493 11.1493 11.3530 11.3530 12.0189 12.0189 12.1590 12.1590 12.6985 12.6985 13.8673 13.8673 14.3527 14.3527 14.8587 14.8587 16.3517 16.3517 17.1666 17.1666 19.0316 19.0316 19.5823 19.5823 19.9692 19.9692 k =-0.2637 0.4863 0.4714 ( 4459 PWs) bands (ev): 1.0771 1.0771 1.1065 1.1065 1.1136 1.1136 1.1235 1.1235 1.1328 1.1328 1.1851 1.1851 1.2058 1.2058 1.2185 1.2185 3.0414 3.0414 3.0838 3.0838 3.1092 3.1092 3.1298 3.1298 3.1758 3.1758 3.3211 3.3211 3.3561 3.3561 3.4164 3.4164 3.4485 3.4485 3.4809 3.4809 3.5390 3.5390 3.5904 3.5904 6.1202 6.1202 6.2241 6.2241 7.1497 7.1497 7.5038 7.5038 8.5873 8.5873 9.4262 9.4262 9.6576 9.6576 10.1496 10.1496 10.2748 10.2748 10.6076 10.6076 11.1207 11.1207 11.3812 11.3812 12.0097 12.0097 12.1577 12.1577 12.6812 12.6812 13.9979 13.9979 14.4447 14.4447 14.8430 14.8430 16.3197 16.3197 17.0933 17.0933 19.1934 19.1934 19.5996 19.5996 20.0081 20.0081 k =-0.2776 0.4815 0.4810 ( 4451 PWs) bands (ev): 1.0763 1.0763 1.1066 1.1066 1.1132 1.1132 1.1227 1.1227 1.1321 1.1321 1.1853 1.1853 1.2068 1.2068 1.2200 1.2200 3.0398 3.0398 3.0845 3.0845 3.1069 3.1069 3.1303 3.1303 3.1748 3.1748 3.3216 3.3216 3.3558 3.3558 3.4208 3.4208 3.4502 3.4502 3.4812 3.4812 3.5387 3.5387 3.5890 3.5890 6.1777 6.1777 6.2911 6.2911 7.1199 7.1199 7.4392 7.4392 8.4964 8.4964 9.4230 9.4230 9.6516 9.6516 10.1130 10.1130 10.2781 10.2781 10.5981 10.5981 11.0815 11.0815 11.4096 11.4096 12.0024 12.0024 12.1566 12.1566 12.6690 12.6690 14.1141 14.1141 14.5384 14.5384 14.8530 14.8530 16.2950 16.2950 17.0211 17.0211 19.3313 19.3313 19.6226 19.6226 20.0441 20.0441 k =-0.2915 0.4767 0.4906 ( 4456 PWs) bands (ev): 1.0756 1.0756 1.1067 1.1067 1.1129 1.1129 1.1221 1.1221 1.1314 1.1314 1.1854 1.1854 1.2077 1.2077 1.2214 1.2214 3.0386 3.0386 3.0847 3.0847 3.1052 3.1052 3.1300 3.1300 3.1746 3.1746 3.3210 3.3210 3.3560 3.3560 3.4247 3.4247 3.4513 3.4513 3.4819 3.4819 3.5382 3.5382 3.5883 3.5883 6.2370 6.2370 6.3614 6.3614 7.0916 7.0916 7.3760 7.3760 8.4011 8.4011 9.4190 9.4190 9.6463 9.6463 10.0755 10.0755 10.2855 10.2855 10.5896 10.5896 11.0329 11.0329 11.4376 11.4376 11.9973 11.9973 12.1557 12.1557 12.6612 12.6612 14.2087 14.2087 14.6308 14.6308 14.8964 14.8964 16.2792 16.2792 16.9510 16.9510 19.4273 19.4273 19.6669 19.6669 20.0776 20.0776 k =-0.3053 0.4719 0.5003 ( 4459 PWs) bands (ev): 1.0749 1.0749 1.1066 1.1066 1.1125 1.1125 1.1217 1.1217 1.1308 1.1308 1.1855 1.1855 1.2085 1.2085 1.2226 1.2226 3.0378 3.0378 3.0845 3.0845 3.1043 3.1043 3.1289 3.1289 3.1754 3.1754 3.3191 3.3191 3.3569 3.3569 3.4279 3.4279 3.4517 3.4517 3.4832 3.4832 3.5373 3.5373 3.5882 3.5882 6.2977 6.2977 6.4351 6.4351 7.0651 7.0651 7.3144 7.3144 8.3032 8.3032 9.4139 9.4139 9.6414 9.6414 10.0380 10.0380 10.2965 10.2965 10.5821 10.5821 10.9760 10.9760 11.4646 11.4646 11.9943 11.9943 12.1548 12.1548 12.6569 12.6569 14.2786 14.2786 14.7150 14.7150 14.9804 14.9804 16.2734 16.2734 16.8839 16.8839 19.4715 19.4715 19.7402 19.7402 20.1094 20.1094 k =-0.3192 0.4671 0.5099 ( 4461 PWs) bands (ev): 1.0742 1.0742 1.1064 1.1064 1.1122 1.1122 1.1215 1.1215 1.1304 1.1304 1.1855 1.1855 1.2092 1.2092 1.2237 1.2237 3.0374 3.0374 3.0838 3.0838 3.1041 3.1041 3.1272 3.1272 3.1772 3.1772 3.3163 3.3163 3.3584 3.3584 3.4304 3.4304 3.4514 3.4514 3.4853 3.4853 3.5358 3.5358 3.5887 3.5887 6.3592 6.3592 6.5121 6.5121 7.0402 7.0402 7.2545 7.2545 8.2043 8.2043 9.4073 9.4073 9.6365 9.6365 10.0013 10.0013 10.3107 10.3107 10.5755 10.5755 10.9118 10.9118 11.4907 11.4907 11.9932 11.9932 12.1540 12.1540 12.6558 12.6558 14.3271 14.3271 14.7870 14.7870 15.1024 15.1024 16.2792 16.2792 16.8205 16.8205 19.4820 19.4820 19.8221 19.8221 20.1408 20.1408 k =-0.3331 0.4623 0.5195 ( 4459 PWs) bands (ev): 1.0736 1.0736 1.1061 1.1061 1.1118 1.1118 1.1213 1.1213 1.1301 1.1301 1.1855 1.1855 1.2099 1.2099 1.2246 1.2246 3.0374 3.0374 3.0828 3.0828 3.1045 3.1045 3.1249 3.1249 3.1797 3.1797 3.3126 3.3126 3.3601 3.3601 3.4323 3.4323 3.4506 3.4506 3.4878 3.4878 3.5341 3.5341 3.5899 3.5899 6.4209 6.4209 6.5924 6.5924 7.0169 7.0169 7.1962 7.1962 8.1062 8.1062 9.3995 9.3995 9.6313 9.6313 9.9660 9.9660 10.3276 10.3276 10.5698 10.5698 10.8413 10.8413 11.5156 11.5156 11.9939 11.9939 12.1532 12.1532 12.6570 12.6570 14.3610 14.3610 14.8483 14.8483 15.2510 15.2510 16.2976 16.2976 16.7620 16.7620 19.4765 19.4765 19.8932 19.8932 20.1726 20.1726 k =-0.3470 0.4574 0.5291 ( 4459 PWs) bands (ev): 1.0731 1.0731 1.1056 1.1056 1.1116 1.1116 1.1213 1.1213 1.1301 1.1301 1.1855 1.1855 1.2106 1.2106 1.2254 1.2254 3.0378 3.0378 3.0817 3.0817 3.1052 3.1052 3.1223 3.1223 3.1828 3.1828 3.3083 3.3083 3.3619 3.3619 3.4336 3.4336 3.4494 3.4494 3.4905 3.4905 3.5322 3.5322 3.5916 3.5916 6.4817 6.4817 6.6758 6.6758 6.9952 6.9952 7.1396 7.1396 8.0109 8.0109 9.3907 9.3907 9.6255 9.6255 9.9325 9.9325 10.3466 10.3466 10.5650 10.5650 10.7653 10.7653 11.5394 11.5394 11.9960 11.9960 12.1526 12.1526 12.6602 12.6602 14.3862 14.3862 14.9008 14.9008 15.4147 15.4147 16.3292 16.3292 16.7098 16.7098 19.4620 19.4620 19.9461 19.9461 20.2044 20.2044 k =-0.3608 0.4526 0.5387 ( 4457 PWs) bands (ev): 1.0727 1.0727 1.1050 1.1050 1.1114 1.1114 1.1213 1.1213 1.1303 1.1303 1.1854 1.1854 1.2111 1.2111 1.2260 1.2260 3.0387 3.0387 3.0806 3.0806 3.1061 3.1061 3.1195 3.1195 3.1864 3.1864 3.3036 3.3036 3.3634 3.3634 3.4342 3.4342 3.4483 3.4483 3.4927 3.4927 3.5307 3.5307 3.5935 3.5935 6.5400 6.5400 6.7624 6.7624 6.9749 6.9749 7.0847 7.0847 7.9205 7.9205 9.3810 9.3810 9.6191 9.6191 9.9012 9.9012 10.3671 10.3671 10.5611 10.5611 10.6849 10.6849 11.5619 11.5619 11.9995 11.9995 12.1519 12.1519 12.6648 12.6648 14.4068 14.4068 14.9449 14.9449 15.5858 15.5858 16.3737 16.3737 16.6663 16.6663 19.4407 19.4407 19.9808 19.9808 20.2329 20.2329 k =-0.3747 0.4478 0.5484 ( 4449 PWs) bands (ev): 1.0723 1.0723 1.1042 1.1042 1.1114 1.1114 1.1212 1.1212 1.1307 1.1307 1.1854 1.1854 1.2117 1.2117 1.2264 1.2264 3.0399 3.0399 3.0796 3.0796 3.1070 3.1070 3.1168 3.1168 3.1902 3.1902 3.2986 3.2986 3.3646 3.3646 3.4341 3.4341 3.4475 3.4475 3.4940 3.4940 3.5298 3.5298 3.5957 3.5957 6.5933 6.5933 6.8518 6.8518 6.9556 6.9556 7.0327 7.0327 7.8377 7.8377 9.3706 9.3706 9.6119 9.6119 9.8725 9.8725 10.3886 10.3886 10.5581 10.5581 10.6012 10.6012 11.5832 11.5832 12.0040 12.0040 12.1514 12.1514 12.6707 12.6707 14.4249 14.4249 14.9810 14.9810 15.7572 15.7572 16.4288 16.4288 16.6367 16.6367 19.4126 19.4126 20.0002 20.0002 20.2516 20.2516 k =-0.3886 0.4430 0.5580 ( 4450 PWs) bands (ev): 1.0720 1.0720 1.1032 1.1032 1.1114 1.1114 1.1212 1.1212 1.1313 1.1313 1.1853 1.1853 1.2121 1.2121 1.2267 1.2267 3.0416 3.0416 3.0787 3.0787 3.1076 3.1076 3.1145 3.1145 3.1943 3.1943 3.2934 3.2934 3.3651 3.3651 3.4335 3.4335 3.4470 3.4470 3.4942 3.4942 3.5300 3.5300 3.5981 3.5981 6.6373 6.6373 6.9314 6.9314 6.9478 6.9478 6.9872 6.9872 7.7654 7.7654 9.3598 9.3598 9.6041 9.6041 9.8466 9.8466 10.4101 10.4101 10.5148 10.5148 10.5564 10.5564 11.6032 11.6032 12.0094 12.0094 12.1509 12.1509 12.6773 12.6773 14.4414 14.4414 15.0096 15.0096 15.9199 15.9199 16.4889 16.4889 16.6323 16.6323 19.3764 19.3764 20.0072 20.0072 20.2486 20.2486 k =-0.4025 0.4382 0.5676 ( 4440 PWs) bands (ev): 1.0717 1.0717 1.1022 1.1022 1.1115 1.1115 1.1212 1.1212 1.1321 1.1321 1.1852 1.1852 1.2125 1.2125 1.2268 1.2268 3.0436 3.0436 3.0780 3.0780 3.1074 3.1074 3.1134 3.1134 3.1984 3.1984 3.2882 3.2882 3.3650 3.3650 3.4325 3.4325 3.4470 3.4470 3.4933 3.4933 3.5310 3.5310 3.6004 3.6004 6.6639 6.6639 6.9109 6.9109 6.9545 6.9545 7.0408 7.0408 7.7069 7.7069 9.3486 9.3486 9.5956 9.5956 9.8237 9.8237 10.4195 10.4195 10.4391 10.4391 10.5555 10.5555 11.6219 11.6219 12.0154 12.0154 12.1504 12.1504 12.6845 12.6845 14.4566 14.4566 15.0318 15.0318 16.0584 16.0584 16.5486 16.5486 16.6706 16.6706 19.3302 19.3302 20.0029 20.0029 20.2018 20.2018 k =-0.4164 0.4334 0.5772 ( 4448 PWs) bands (ev): 1.0716 1.0716 1.1012 1.1012 1.1117 1.1117 1.1212 1.1212 1.1329 1.1329 1.1851 1.1851 1.2128 1.2128 1.2268 1.2268 3.0458 3.0458 3.0776 3.0776 3.1058 3.1058 3.1137 3.1137 3.2025 3.2025 3.2829 3.2829 3.3640 3.3640 3.4311 3.4311 3.4474 3.4474 3.4916 3.4916 3.5326 3.5326 3.6028 3.6028 6.6609 6.6609 6.8926 6.8926 6.9375 6.9375 7.1385 7.1385 7.6652 7.6652 9.3370 9.3370 9.5866 9.5866 9.8042 9.8042 10.3366 10.3366 10.4541 10.4541 10.5560 10.5560 11.6391 11.6391 12.0220 12.0220 12.1500 12.1500 12.6921 12.6921 14.4703 14.4703 15.0489 15.0489 16.1515 16.1515 16.6252 16.6252 16.7520 16.7520 19.2715 19.2715 19.9843 19.9843 20.1173 20.1173 k =-0.4164 0.4334 0.5772 ( 4448 PWs) bands (ev): 1.0716 1.0716 1.1012 1.1012 1.1117 1.1117 1.1212 1.1212 1.1329 1.1329 1.1851 1.1851 1.2128 1.2128 1.2268 1.2268 3.0458 3.0458 3.0776 3.0776 3.1058 3.1058 3.1137 3.1137 3.2025 3.2025 3.2829 3.2829 3.3640 3.3640 3.4311 3.4311 3.4474 3.4474 3.4916 3.4916 3.5326 3.5326 3.6028 3.6028 6.6609 6.6609 6.8926 6.8926 6.9375 6.9375 7.1385 7.1385 7.6652 7.6652 9.3370 9.3370 9.5866 9.5866 9.8042 9.8042 10.3366 10.3366 10.4541 10.4541 10.5560 10.5560 11.6391 11.6391 12.0220 12.0220 12.1500 12.1500 12.6921 12.6921 14.4703 14.4703 15.0489 15.0489 16.1515 16.1515 16.6252 16.6252 16.7520 16.7520 19.2715 19.2715 19.9843 19.9843 20.1173 20.1173 k =-0.4247 0.4189 0.5772 ( 4436 PWs) bands (ev): 1.0714 1.0714 1.0996 1.0996 1.1120 1.1120 1.1213 1.1213 1.1342 1.1342 1.1849 1.1849 1.2133 1.2133 1.2266 1.2266 3.0495 3.0495 3.0772 3.0772 3.1030 3.1030 3.1150 3.1150 3.2087 3.2087 3.2752 3.2752 3.3617 3.3617 3.4288 3.4288 3.4477 3.4477 3.4892 3.4892 3.5353 3.5353 3.6063 3.6063 6.6310 6.6310 6.8757 6.8757 6.9211 6.9211 7.2888 7.2888 7.6186 7.6186 9.3200 9.3200 9.5731 9.5731 9.7785 9.7785 10.2010 10.2010 10.4810 10.4810 10.5592 10.5592 11.6633 11.6633 12.0319 12.0319 12.1493 12.1493 12.7034 12.7034 14.4891 14.4891 15.0711 15.0711 16.2531 16.2531 16.7664 16.7664 16.9009 16.9009 19.1739 19.1739 19.9342 19.9342 19.9728 19.9728 k =-0.4331 0.4044 0.5772 ( 4440 PWs) bands (ev): 1.0712 1.0712 1.0982 1.0982 1.1123 1.1123 1.1214 1.1214 1.1354 1.1354 1.1848 1.1848 1.2137 1.2137 1.2263 1.2263 3.0533 3.0533 3.0770 3.0770 3.1004 3.1004 3.1163 3.1163 3.2146 3.2146 3.2679 3.2679 3.3589 3.3589 3.4264 3.4264 3.4475 3.4475 3.4879 3.4879 3.5378 3.5378 3.6093 3.6093 6.6040 6.6040 6.8606 6.8606 6.9064 6.9064 7.4404 7.4404 7.5769 7.5769 9.3039 9.3039 9.5606 9.5606 9.7553 9.7553 10.0603 10.0603 10.5013 10.5013 10.5662 10.5662 11.6859 11.6859 12.0411 12.0411 12.1485 12.1485 12.7139 12.7139 14.5064 14.5064 15.0923 15.0923 16.3581 16.3581 16.9082 16.9082 17.0512 17.0512 19.0795 19.0795 19.8245 19.8245 19.8289 19.8289 k =-0.4415 0.3899 0.5772 ( 4440 PWs) bands (ev): 1.0710 1.0710 1.0968 1.0968 1.1126 1.1126 1.1214 1.1214 1.1365 1.1365 1.1848 1.1848 1.2142 1.2142 1.2259 1.2259 3.0570 3.0570 3.0768 3.0768 3.0981 3.0981 3.1174 3.1174 3.2204 3.2204 3.2611 3.2611 3.3558 3.3558 3.4241 3.4241 3.4467 3.4467 3.4873 3.4873 3.5401 3.5401 3.6120 3.6120 6.5801 6.5801 6.8473 6.8473 6.8935 6.8935 7.5387 7.5387 7.5945 7.5945 9.2884 9.2884 9.5494 9.5494 9.7347 9.7347 9.9164 9.9164 10.5141 10.5141 10.5780 10.5780 11.7068 11.7068 12.0496 12.0496 12.1476 12.1476 12.7234 12.7234 14.5220 14.5220 15.1122 15.1122 16.4639 16.4639 17.0500 17.0500 17.2026 17.2026 18.9885 18.9885 19.6515 19.6515 19.6880 19.6880 k =-0.4498 0.3754 0.5772 ( 4444 PWs) bands (ev): 1.0709 1.0709 1.0957 1.0957 1.1129 1.1129 1.1215 1.1215 1.1375 1.1375 1.1848 1.1848 1.2146 1.2146 1.2255 1.2255 3.0607 3.0607 3.0766 3.0766 3.0960 3.0960 3.1185 3.1185 3.2259 3.2259 3.2548 3.2548 3.3524 3.3524 3.4220 3.4220 3.4457 3.4457 3.4873 3.4873 3.5421 3.5421 3.6144 3.6144 6.5592 6.5592 6.8357 6.8357 6.8823 6.8823 7.5072 7.5072 7.7474 7.7474 9.2725 9.2725 9.5395 9.5395 9.7166 9.7166 9.7715 9.7715 10.5208 10.5208 10.5928 10.5928 11.7255 11.7255 12.0571 12.0571 12.1466 12.1466 12.7320 12.7320 14.5358 14.5358 15.1304 15.1304 16.5678 16.5678 17.1909 17.1909 17.3546 17.3546 18.9004 18.9004 19.4769 19.4769 19.5537 19.5537 k =-0.4582 0.3609 0.5772 ( 4436 PWs) bands (ev): 1.0708 1.0708 1.0946 1.0946 1.1132 1.1132 1.1215 1.1215 1.1384 1.1384 1.1847 1.1847 1.2151 1.2151 1.2251 1.2251 3.0641 3.0641 3.0766 3.0766 3.0943 3.0943 3.1195 3.1195 3.2311 3.2311 3.2493 3.2493 3.3490 3.3490 3.4201 3.4201 3.4446 3.4446 3.4877 3.4877 3.5439 3.5439 3.6164 3.6164 6.5415 6.5415 6.8259 6.8259 6.8728 6.8728 7.4800 7.4800 7.9009 7.9009 9.2540 9.2540 9.5311 9.5311 9.6290 9.6290 9.7014 9.7014 10.5241 10.5241 10.6079 10.6079 11.7419 11.7419 12.0637 12.0637 12.1456 12.1456 12.7394 12.7394 14.5477 14.5477 15.1467 15.1467 16.6663 16.6663 17.3293 17.3293 17.5064 17.5064 18.8143 18.8143 19.3041 19.3041 19.4297 19.4297 k =-0.4665 0.3464 0.5772 ( 4436 PWs) bands (ev): 1.0707 1.0707 1.0938 1.0938 1.1135 1.1135 1.1216 1.1216 1.1391 1.1391 1.1847 1.1847 1.2155 1.2155 1.2247 1.2247 3.0672 3.0672 3.0765 3.0765 3.0927 3.0927 3.1203 3.1203 3.2356 3.2356 3.2446 3.2446 3.3456 3.3456 3.4184 3.4184 3.4435 3.4435 3.4883 3.4883 3.5454 3.5454 3.6180 3.6180 6.5270 6.5270 6.8178 6.8178 6.8650 6.8650 7.4577 7.4577 8.0532 8.0532 9.2267 9.2267 9.4972 9.4972 9.5240 9.5240 9.6887 9.6887 10.5257 10.5257 10.6215 10.6215 11.7558 11.7558 12.0692 12.0692 12.1447 12.1447 12.7457 12.7457 14.5575 14.5575 15.1606 15.1606 16.7557 16.7557 17.4630 17.4630 17.6567 17.6567 18.7292 18.7292 19.1355 19.1355 19.3207 19.3207 k =-0.4749 0.3319 0.5772 ( 4428 PWs) bands (ev): 1.0706 1.0706 1.0931 1.0931 1.1137 1.1137 1.1216 1.1216 1.1396 1.1396 1.1848 1.1848 1.2159 1.2159 1.2243 1.2243 3.0698 3.0698 3.0764 3.0764 3.0915 3.0915 3.1209 3.1209 3.2395 3.2395 3.2409 3.2409 3.3426 3.3426 3.4170 3.4170 3.4427 3.4427 3.4889 3.4889 3.5466 3.5466 3.6192 3.6192 6.5157 6.5157 6.8116 6.8116 6.8590 6.8590 7.4403 7.4403 8.2022 8.2022 9.1746 9.1746 9.3946 9.3946 9.5185 9.5185 9.6788 9.6788 10.5265 10.5265 10.6325 10.6325 11.7668 11.7668 12.0735 12.0735 12.1439 12.1439 12.7506 12.7506 14.5652 14.5652 15.1718 15.1718 16.8319 16.8319 17.5880 17.5880 17.8026 17.8026 18.6456 18.6456 18.9746 18.9746 19.2312 19.2312 k =-0.4833 0.3174 0.5772 ( 4428 PWs) bands (ev): 1.0706 1.0706 1.0927 1.0927 1.1138 1.1138 1.1216 1.1216 1.1400 1.1400 1.1848 1.1848 1.2162 1.2162 1.2240 1.2240 3.0719 3.0719 3.0763 3.0763 3.0905 3.0905 3.1214 3.1214 3.2380 3.2380 3.2425 3.2425 3.3402 3.3402 3.4160 3.4160 3.4420 3.4420 3.4894 3.4894 3.5474 3.5474 3.6201 3.6201 6.5076 6.5076 6.8071 6.8071 6.8546 6.8546 7.4279 7.4279 8.3425 8.3425 9.0853 9.0853 9.3392 9.3392 9.5146 9.5146 9.6717 9.6717 10.5269 10.5269 10.6406 10.6406 11.7748 11.7748 12.0767 12.0767 12.1433 12.1433 12.7541 12.7541 14.5707 14.5707 15.1800 15.1800 16.8904 16.8904 17.6967 17.6967 17.9381 17.9381 18.5678 18.5678 18.8282 18.8282 19.1653 19.1653 k =-0.4916 0.3029 0.5772 ( 4428 PWs) bands (ev): 1.0706 1.0706 1.0924 1.0924 1.1139 1.1139 1.1216 1.1216 1.1402 1.1402 1.1848 1.1848 1.2164 1.2164 1.2238 1.2238 3.0733 3.0733 3.0762 3.0762 3.0899 3.0899 3.1217 3.1217 3.2363 3.2363 3.2444 3.2444 3.3387 3.3387 3.4154 3.4154 3.4416 3.4416 3.4897 3.4897 3.5479 3.5479 3.6207 3.6207 6.5027 6.5027 6.8044 6.8044 6.8521 6.8521 7.4204 7.4204 8.4595 8.4595 8.9876 8.9876 9.3172 9.3172 9.5122 9.5122 9.6674 9.6674 10.5271 10.5271 10.6455 10.6455 11.7797 11.7797 12.0786 12.0786 12.1429 12.1429 12.7563 12.7563 14.5740 14.5740 15.1850 15.1850 16.9274 16.9274 17.7757 17.7757 18.0467 18.0467 18.5077 18.5077 18.7127 18.7127 19.1253 19.1253 k =-0.5000 0.2884 0.5772 ( 4408 PWs) bands (ev): 1.0706 1.0706 1.0923 1.0923 1.1139 1.1139 1.1216 1.1216 1.1403 1.1403 1.1848 1.1848 1.2165 1.2165 1.2237 1.2237 3.0738 3.0738 3.0761 3.0761 3.0897 3.0897 3.1218 3.1218 3.2357 3.2357 3.2450 3.2450 3.3381 3.3381 3.4152 3.4152 3.4415 3.4415 3.4898 3.4898 3.5481 3.5481 3.6209 3.6209 6.5011 6.5011 6.8035 6.8035 6.8512 6.8512 7.4179 7.4179 8.5118 8.5118 8.9402 8.9402 9.3115 9.3115 9.5114 9.5114 9.6660 9.6660 10.5271 10.5271 10.6472 10.6472 11.7813 11.7813 12.0792 12.0792 12.1428 12.1428 12.7570 12.7570 14.5751 14.5751 15.1867 15.1867 16.9401 16.9401 17.8057 17.8057 18.0925 18.0925 18.4840 18.4840 18.6647 18.6647 19.1119 19.1119 k = 0.0000 0.0000 0.5772 ( 4464 PWs) bands (ev): 1.0863 1.0863 1.1093 1.1093 1.1094 1.1094 1.1423 1.1423 1.1612 1.1612 1.1711 1.1711 1.1773 1.1773 1.2120 1.2120 3.0940 3.0940 3.1456 3.1456 3.1519 3.1519 3.1775 3.1775 3.2296 3.2296 3.2433 3.2433 3.2817 3.2817 3.3019 3.3019 3.3574 3.3574 3.5091 3.5091 3.5698 3.5698 3.5789 3.5789 5.0919 5.0919 5.1217 5.1217 7.8662 7.8662 8.7725 8.7725 9.2135 9.2135 9.3488 9.3488 10.2511 10.2511 10.2649 10.2649 10.9158 10.9158 11.0126 11.0126 11.7624 11.7624 12.0408 12.0408 12.1407 12.1407 12.1560 12.1560 12.6490 12.6490 13.3500 13.3500 13.6388 13.6388 14.9731 14.9731 15.4938 15.4938 15.7674 15.7674 18.1268 18.1268 19.0008 19.0008 19.7020 19.7020 k = 0.0086 0.0149 0.5772 ( 4464 PWs) bands (ev): 1.0863 1.0863 1.1087 1.1087 1.1101 1.1101 1.1423 1.1423 1.1611 1.1611 1.1712 1.1712 1.1771 1.1771 1.2120 1.2120 3.0940 3.0940 3.1452 3.1452 3.1518 3.1518 3.1773 3.1773 3.2293 3.2293 3.2435 3.2435 3.2819 3.2819 3.3030 3.3030 3.3571 3.3571 3.5088 3.5088 3.5697 3.5697 3.5793 3.5793 5.0938 5.0938 5.1230 5.1230 7.8636 7.8636 8.7745 8.7745 9.2088 9.2088 9.3505 9.3505 10.2106 10.2106 10.3011 10.3011 10.8975 10.8975 11.0348 11.0348 11.7529 11.7529 12.0337 12.0337 12.1270 12.1270 12.1804 12.1804 12.6404 12.6404 13.3614 13.3614 13.6498 13.6498 14.9724 14.9724 15.4742 15.4742 15.7904 15.7904 18.1141 18.1141 18.9934 18.9934 19.6603 19.6603 k = 0.0172 0.0299 0.5772 ( 4464 PWs) bands (ev): 1.0863 1.0863 1.1081 1.1081 1.1108 1.1108 1.1424 1.1424 1.1606 1.1606 1.1716 1.1716 1.1766 1.1766 1.2122 1.2122 3.0939 3.0939 3.1439 3.1439 3.1515 3.1515 3.1766 3.1766 3.2286 3.2286 3.2442 3.2442 3.2826 3.2826 3.3061 3.3061 3.3562 3.3562 3.5080 3.5080 3.5696 3.5696 3.5804 3.5804 5.0994 5.0994 5.1269 5.1269 7.8556 7.8556 8.7805 8.7805 9.1946 9.1946 9.3552 9.3552 10.1609 10.1609 10.3384 10.3384 10.8636 10.8636 11.0796 11.0796 11.7269 11.7269 12.0191 12.0191 12.1073 12.1073 12.2240 12.2240 12.6161 12.6161 13.3940 13.3940 13.6823 13.6823 14.9703 14.9703 15.4284 15.4284 15.8466 15.8466 18.0773 18.0773 18.9715 18.9715 19.5626 19.5626 k = 0.0259 0.0448 0.5772 ( 4470 PWs) bands (ev): 1.0863 1.0863 1.1075 1.1075 1.1116 1.1116 1.1426 1.1426 1.1599 1.1599 1.1720 1.1720 1.1758 1.1758 1.2124 1.2124 3.0938 3.0938 3.1419 3.1419 3.1510 3.1510 3.1755 3.1755 3.2274 3.2274 3.2453 3.2453 3.2840 3.2840 3.3107 3.3107 3.3548 3.3548 3.5067 3.5067 3.5693 3.5693 3.5821 3.5821 5.1087 5.1087 5.1335 5.1335 7.8422 7.8422 8.7904 8.7904 9.1711 9.1711 9.3624 9.3624 10.1098 10.1098 10.3707 10.3707 10.8292 10.8292 11.1306 11.1306 11.6892 11.6892 12.0032 12.0032 12.0817 12.0817 12.2769 12.2769 12.5799 12.5799 13.4439 13.4439 13.7349 13.7349 14.9664 14.9664 15.3728 15.3728 15.9198 15.9198 18.0189 18.0189 18.9359 18.9359 19.4434 19.4434 k = 0.0345 0.0598 0.5772 ( 4470 PWs) bands (ev): 1.0864 1.0864 1.1070 1.1070 1.1125 1.1125 1.1428 1.1428 1.1590 1.1590 1.1726 1.1726 1.1748 1.1748 1.2128 1.2128 3.0937 3.0937 3.1393 3.1393 3.1504 3.1504 3.1740 3.1740 3.2259 3.2259 3.2468 3.2468 3.2863 3.2863 3.3164 3.3164 3.3531 3.3531 3.5049 3.5049 3.5689 3.5689 3.5845 3.5845 5.1217 5.1217 5.1428 5.1428 7.8236 7.8236 8.8043 8.8043 9.1381 9.1381 9.3716 9.3716 10.0596 10.0596 10.3979 10.3979 10.7975 10.7975 11.1825 11.1825 11.6455 11.6455 11.9853 11.9853 12.0519 12.0519 12.3350 12.3350 12.5361 12.5361 13.5070 13.5070 13.8052 13.8052 14.9605 14.9605 15.3159 15.3159 16.0026 16.0026 17.9429 17.9429 18.8883 18.8883 19.3188 19.3188 k = 0.0431 0.0747 0.5772 ( 4470 PWs) bands (ev): 1.0864 1.0864 1.1065 1.1065 1.1134 1.1134 1.1430 1.1430 1.1579 1.1579 1.1731 1.1731 1.1737 1.1737 1.2131 1.2131 3.0936 3.0936 3.1362 3.1362 3.1497 3.1497 3.1720 3.1720 3.2242 3.2242 3.2488 3.2488 3.2893 3.2893 3.3227 3.3227 3.3514 3.3514 3.5027 3.5027 3.5684 3.5684 3.5873 3.5873 5.1381 5.1381 5.1550 5.1550 7.7997 7.7997 8.8220 8.8220 9.0951 9.0951 9.3827 9.3827 10.0125 10.0125 10.4202 10.4202 10.7695 10.7695 11.2319 11.2319 11.6005 11.6005 11.9604 11.9604 12.0232 12.0232 12.3958 12.3958 12.4880 12.4880 13.5799 13.5799 13.8909 13.8909 14.9522 14.9522 15.2614 15.2614 16.0920 16.0920 17.8531 17.8531 18.8305 18.8305 19.1956 19.1956 k = 0.0517 0.0897 0.5772 ( 4468 PWs) bands (ev): 1.0865 1.0865 1.1060 1.1060 1.1144 1.1144 1.1434 1.1434 1.1568 1.1568 1.1720 1.1720 1.1740 1.1740 1.2134 1.2134 3.0936 3.0936 3.1327 3.1327 3.1489 3.1489 3.1696 3.1696 3.2224 3.2224 3.2510 3.2510 3.2928 3.2928 3.3291 3.3291 3.3503 3.3503 3.5001 3.5001 3.5677 3.5677 3.5905 3.5905 5.1573 5.1573 5.1709 5.1709 7.7706 7.7706 8.8432 8.8432 9.0420 9.0420 9.3953 9.3953 9.9702 9.9702 10.4375 10.4375 10.7454 10.7454 11.2751 11.2751 11.5584 11.5584 11.9233 11.9233 12.0013 12.0013 12.4352 12.4352 12.4612 12.4612 13.6600 13.6600 13.9893 13.9893 14.9410 14.9410 15.2119 15.2119 16.1869 16.1869 17.7532 17.7532 18.7645 18.7645 19.0769 19.0769 k = 0.0603 0.1046 0.5772 ( 4472 PWs) bands (ev): 1.0866 1.0866 1.1055 1.1055 1.1155 1.1155 1.1438 1.1438 1.1555 1.1555 1.1704 1.1704 1.1747 1.1747 1.2137 1.2137 3.0936 3.0936 3.1290 3.1290 3.1481 3.1481 3.1668 3.1668 3.2206 3.2206 3.2535 3.2535 3.2964 3.2964 3.3345 3.3345 3.3509 3.3509 3.4971 3.4971 3.5669 3.5669 3.5939 3.5939 5.1781 5.1781 5.1917 5.1917 7.7364 7.7364 8.8668 8.8668 8.9800 8.9800 9.4097 9.4097 9.9342 9.9342 10.4497 10.4497 10.7258 10.7258 11.3073 11.3073 11.5241 11.5241 11.8757 11.8757 11.9852 11.9852 12.3859 12.3859 12.5239 12.5239 13.7455 13.7455 14.0976 14.0976 14.9266 14.9266 15.1691 15.1691 16.2869 16.2869 17.6465 17.6465 18.6924 18.6924 18.9642 18.9642 k = 0.0690 0.1196 0.5772 ( 4476 PWs) bands (ev): 1.0867 1.0867 1.1050 1.1050 1.1166 1.1166 1.1442 1.1442 1.1542 1.1542 1.1688 1.1688 1.1754 1.1754 1.2139 1.2139 3.0938 3.0938 3.1252 3.1252 3.1472 3.1472 3.1637 3.1637 3.2188 3.2188 3.2562 3.2562 3.2996 3.2996 3.3378 3.3378 3.3547 3.3547 3.4939 3.4939 3.5658 3.5658 3.5974 3.5974 5.1995 5.1995 5.2183 5.2183 7.6972 7.6972 8.8777 8.8777 8.9245 8.9245 9.4256 9.4256 9.9050 9.9050 10.4563 10.4563 10.7113 10.7113 11.3223 11.3223 11.5032 11.5032 11.8220 11.8220 11.9715 11.9715 12.3357 12.3357 12.5890 12.5890 13.8351 13.8351 14.2127 14.2127 14.9098 14.9098 15.1340 15.1340 16.3919 16.3919 17.5358 17.5358 18.6161 18.6161 18.8583 18.8583 k = 0.0776 0.1345 0.5772 ( 4466 PWs) bands (ev): 1.0869 1.0869 1.1046 1.1046 1.1177 1.1177 1.1448 1.1448 1.1529 1.1529 1.1670 1.1670 1.1760 1.1760 1.2140 1.2140 3.0941 3.0941 3.1213 3.1213 3.1464 3.1464 3.1604 3.1604 3.2170 3.2170 3.2591 3.2591 3.3018 3.3018 3.3400 3.3400 3.3613 3.3613 3.4905 3.4905 3.5646 3.5646 3.6008 3.6008 5.2225 5.2225 5.2499 5.2499 7.6531 7.6531 8.8128 8.8128 8.9396 8.9396 9.4433 9.4433 9.8826 9.8826 10.4572 10.4572 10.7026 10.7026 11.3169 11.3169 11.4980 11.4980 11.7648 11.7648 11.9583 11.9583 12.2866 12.2866 12.6553 12.6553 13.9279 13.9279 14.3306 14.3306 14.8931 14.8931 15.1067 15.1067 16.5018 16.5018 17.4235 17.4235 18.5374 18.5374 18.7591 18.7591 k = 0.0862 0.1495 0.5772 ( 4452 PWs) bands (ev): 1.0871 1.0871 1.1041 1.1041 1.1189 1.1189 1.1453 1.1453 1.1515 1.1515 1.1653 1.1653 1.1766 1.1766 1.2140 1.2140 3.0946 3.0946 3.1176 3.1176 3.1455 3.1455 3.1570 3.1570 3.2152 3.2152 3.2619 3.2619 3.3026 3.3026 3.3429 3.3429 3.3690 3.3690 3.4870 3.4870 3.5631 3.5631 3.6041 3.6041 5.2477 5.2477 5.2858 5.2858 7.6043 7.6043 8.7238 8.7238 8.9744 8.9744 9.4627 9.4627 9.8664 9.8664 10.4522 10.4522 10.6999 10.6999 11.2973 11.2973 11.5013 11.5013 11.7061 11.7061 11.9447 11.9447 12.2388 12.2388 12.7226 12.7226 14.0230 14.0230 14.4449 14.4449 14.8827 14.8827 15.0862 15.0862 16.6166 16.6166 17.3120 17.3120 18.4581 18.4581 18.6665 18.6665 k = 0.0948 0.1644 0.5772 ( 4472 PWs) bands (ev): 1.0874 1.0874 1.1035 1.1035 1.1201 1.1201 1.1459 1.1459 1.1502 1.1502 1.1636 1.1636 1.1772 1.1772 1.2138 1.2138 3.0952 3.0952 3.1139 3.1139 3.1445 3.1445 3.1535 3.1535 3.2134 3.2134 3.2645 3.2645 3.3019 3.3019 3.3472 3.3472 3.3771 3.3771 3.4836 3.4836 3.5614 3.5614 3.6071 3.6071 5.2755 5.2755 5.3257 5.3257 7.5511 7.5511 8.6269 8.6269 9.0144 9.0144 9.4838 9.4838 9.8559 9.8559 10.4422 10.4422 10.7028 10.7028 11.2715 11.2715 11.5028 11.5028 11.6486 11.6486 11.9299 11.9299 12.1925 12.1925 12.7910 12.7910 14.1198 14.1198 14.5439 14.5439 14.8897 14.8897 15.0711 15.0711 16.7364 16.7364 17.2040 17.2040 18.3797 18.3797 18.5797 18.5797 k = 0.1034 0.1793 0.5772 ( 4464 PWs) bands (ev): 1.0877 1.0877 1.1030 1.1030 1.1213 1.1213 1.1465 1.1465 1.1489 1.1489 1.1619 1.1619 1.1778 1.1778 1.2134 1.2134 3.0961 3.0961 3.1105 3.1105 3.1432 3.1432 3.1505 3.1505 3.2116 3.2116 3.2666 3.2666 3.3006 3.3006 3.3530 3.3530 3.3851 3.3851 3.4803 3.4803 3.5596 3.5596 3.6097 3.6097 5.3059 5.3059 5.3695 5.3695 7.4937 7.4937 8.5243 8.5243 9.0582 9.0582 9.5065 9.5065 9.8502 9.8502 10.4281 10.4281 10.7104 10.7104 11.2444 11.2444 11.4927 11.4927 11.5980 11.5980 11.9136 11.9136 12.1477 12.1477 12.8608 12.8608 14.2175 14.2175 14.6106 14.6106 14.9296 14.9296 15.0613 15.0613 16.8609 16.8609 17.1022 17.1022 18.3038 18.3038 18.4983 18.4983 k = 0.1121 0.1943 0.5772 ( 4470 PWs) bands (ev): 1.0881 1.0881 1.1025 1.1025 1.1225 1.1225 1.1468 1.1468 1.1479 1.1479 1.1602 1.1602 1.1783 1.1783 1.2130 1.2130 3.0971 3.0971 3.1075 3.1075 3.1411 3.1411 3.1483 3.1483 3.2097 3.2097 3.2677 3.2677 3.2993 3.2993 3.3596 3.3596 3.3927 3.3927 3.4776 3.4776 3.5575 3.5575 3.6118 3.6118 5.3390 5.3390 5.4172 5.4172 7.4325 7.4325 8.4174 8.4174 9.1054 9.1054 9.5309 9.5309 9.8486 9.8486 10.4113 10.4113 10.7218 10.7218 11.2179 11.2179 11.4611 11.4611 11.5626 11.5626 11.8952 11.8952 12.1041 12.1041 12.9321 12.9321 14.3149 14.3149 14.6406 14.6406 14.9965 14.9965 15.0645 15.0645 16.9824 16.9824 17.0176 17.0176 18.2313 18.2313 18.4216 18.4216 k = 0.1207 0.2092 0.5772 ( 4462 PWs) bands (ev): 1.0886 1.0886 1.1019 1.1019 1.1237 1.1237 1.1460 1.1460 1.1482 1.1482 1.1586 1.1586 1.1788 1.1788 1.2123 1.2123 3.0979 3.0979 3.1052 3.1052 3.1380 3.1380 3.1471 3.1471 3.2077 3.2077 3.2674 3.2674 3.2989 3.2989 3.3670 3.3670 3.3994 3.3994 3.4755 3.4755 3.5552 3.5552 3.6135 3.6135 5.3748 5.3748 5.4686 5.4686 7.3678 7.3678 8.3074 8.3074 9.1558 9.1558 9.5569 9.5569 9.8505 9.8505 10.3927 10.3927 10.7361 10.7361 11.1929 11.1929 11.4102 11.4102 11.5402 11.5402 11.8744 11.8744 12.0615 12.0615 13.0050 13.0050 14.4102 14.4102 14.6499 14.6499 15.0243 15.0243 15.1279 15.1279 16.9276 16.9276 17.1274 17.1274 18.1630 18.1630 18.3492 18.3492 k = 0.1293 0.2242 0.5772 ( 4458 PWs) bands (ev): 1.0891 1.0891 1.1013 1.1013 1.1248 1.1248 1.1449 1.1449 1.1488 1.1488 1.1572 1.1572 1.1792 1.1792 1.2115 1.2115 3.0976 3.0976 3.1047 3.1047 3.1344 3.1344 3.1467 3.1467 3.2056 3.2056 3.2653 3.2653 3.2999 3.2999 3.3748 3.3748 3.4049 3.4049 3.4746 3.4746 3.5527 3.5527 3.6146 3.6146 5.4134 5.4134 5.5237 5.5237 7.3000 7.3000 8.1952 8.1952 9.2092 9.2092 9.5844 9.5844 9.8555 9.8555 10.3732 10.3732 10.7525 10.7525 11.1695 11.1695 11.3510 11.3510 11.5203 11.5203 11.8514 11.8514 12.0196 12.0196 13.0797 13.0797 14.4993 14.4993 14.6559 14.6559 15.0229 15.0229 15.2229 15.2229 16.8675 16.8675 17.2652 17.2652 18.0992 18.0992 18.2807 18.2807 k = 0.1379 0.2391 0.5772 ( 4456 PWs) bands (ev): 1.0897 1.0897 1.1007 1.1007 1.1259 1.1259 1.1439 1.1439 1.1493 1.1493 1.1559 1.1559 1.1797 1.1797 1.2106 1.2106 3.0960 3.0960 3.1060 3.1060 3.1306 3.1306 3.1467 3.1467 3.2034 3.2034 3.2616 3.2616 3.3021 3.3021 3.3828 3.3828 3.4089 3.4089 3.4752 3.4752 3.5501 3.5501 3.6151 3.6151 5.4548 5.4548 5.5825 5.5825 7.2293 7.2293 8.0813 8.0813 9.2651 9.2651 9.6133 9.6133 9.8630 9.8630 10.3534 10.3534 10.7707 10.7707 11.1474 11.1474 11.2894 11.2894 11.4981 11.4981 11.8263 11.8263 11.9782 11.9782 13.1562 13.1562 14.5694 14.5694 14.6758 14.6758 15.0189 15.0189 15.3111 15.3111 16.8315 16.8315 17.4064 17.4064 18.0401 18.0401 18.2156 18.2156 k = 0.1466 0.2541 0.5772 ( 4448 PWs) bands (ev): 1.0903 1.0903 1.1001 1.1001 1.1268 1.1268 1.1430 1.1430 1.1497 1.1497 1.1549 1.1549 1.1801 1.1801 1.2095 1.2095 3.0941 3.0941 3.1083 3.1083 3.1267 3.1267 3.1470 3.1470 3.2012 3.2012 3.2568 3.2568 3.3053 3.3053 3.3908 3.3908 3.4111 3.4111 3.4774 3.4774 3.5473 3.5473 3.6150 3.6150 5.4990 5.4990 5.6449 5.6449 7.1564 7.1564 7.9666 7.9666 9.3234 9.3234 9.6434 9.6434 9.8728 9.8728 10.3336 10.3336 10.7900 10.7900 11.1261 11.1261 11.2276 11.2276 11.4721 11.4721 11.7996 11.7996 11.9373 11.9373 13.2348 13.2348 14.6029 14.6029 14.7266 14.7266 15.0158 15.0158 15.3829 15.3829 16.8253 16.8253 17.5478 17.5478 17.9859 17.9859 18.1532 18.1532 k = 0.1552 0.2690 0.5772 ( 4452 PWs) bands (ev): 1.0910 1.0910 1.0994 1.0994 1.1276 1.1276 1.1423 1.1423 1.1498 1.1498 1.1544 1.1544 1.1805 1.1805 1.2083 1.2083 3.0923 3.0923 3.1113 3.1113 3.1228 3.1228 3.1476 3.1476 3.1988 3.1988 3.2513 3.2513 3.3091 3.3091 3.3984 3.3984 3.4120 3.4120 3.4811 3.4811 3.5445 3.5445 3.6142 3.6142 5.5459 5.5459 5.7108 5.7108 7.0814 7.0814 7.8514 7.8514 9.3834 9.3834 9.6746 9.6746 9.8846 9.8846 10.3141 10.3141 10.8102 10.8102 11.1049 11.1049 11.1670 11.1670 11.4423 11.4423 11.7720 11.7720 11.8971 11.8971 13.3154 13.3154 14.6155 14.6155 14.7885 14.7885 15.0148 15.0148 15.4366 15.4366 16.8512 16.8512 17.6817 17.6817 17.9380 17.9380 18.0929 18.0929 k = 0.1638 0.2840 0.5772 ( 4464 PWs) bands (ev): 1.0917 1.0917 1.0987 1.0987 1.1283 1.1283 1.1417 1.1417 1.1496 1.1496 1.1543 1.1543 1.1809 1.1809 1.2070 1.2070 3.0907 3.0907 3.1148 3.1148 3.1190 3.1190 3.1484 3.1484 3.1962 3.1962 3.2451 3.2451 3.3133 3.3133 3.4038 3.4038 3.4136 3.4136 3.4859 3.4859 3.5416 3.5416 3.6129 3.6129 5.5956 5.5956 5.7801 5.7801 7.0048 7.0048 7.7363 7.7363 9.4447 9.4447 9.7067 9.7067 9.8983 9.8983 10.2952 10.2952 10.8306 10.8306 11.0821 11.0821 11.1097 11.1097 11.4091 11.4091 11.7443 11.7443 11.8579 11.8579 13.3982 13.3982 14.6242 14.6242 14.8381 14.8381 15.0152 15.0152 15.4786 15.4786 16.9060 16.9060 17.7763 17.7763 17.9102 17.9102 18.0387 18.0387 k = 0.1724 0.2989 0.5772 ( 4468 PWs) bands (ev): 1.0925 1.0925 1.0981 1.0981 1.1288 1.1288 1.1412 1.1412 1.1491 1.1491 1.1546 1.1546 1.1813 1.1813 1.2056 1.2056 3.0893 3.0893 3.1153 3.1153 3.1187 3.1187 3.1494 3.1494 3.1937 3.1937 3.2386 3.2386 3.3178 3.3178 3.4040 3.4040 3.4191 3.4191 3.4913 3.4913 3.5389 3.5389 3.6109 3.6109 5.6480 5.6480 5.8528 5.8528 6.9270 6.9270 7.6215 7.6215 9.5066 9.5066 9.7393 9.7393 9.9138 9.9138 10.2769 10.2769 10.8502 10.8502 11.0476 11.0476 11.0663 11.0663 11.3735 11.3735 11.7171 11.7171 11.8202 11.8202 13.4830 13.4830 14.6333 14.6333 14.8674 14.8674 15.0116 15.0116 15.5217 15.5217 16.9797 16.9797 17.7676 17.7676 17.9132 17.9132 18.0187 18.0187 k = 0.1810 0.3139 0.5772 ( 4458 PWs) bands (ev): 1.0933 1.0933 1.0974 1.0974 1.1292 1.1292 1.1407 1.1407 1.1487 1.1487 1.1551 1.1551 1.1817 1.1817 1.2041 1.2041 3.0883 3.0883 3.1117 3.1117 3.1230 3.1230 3.1506 3.1506 3.1910 3.1910 3.2319 3.2319 3.3225 3.3225 3.4014 3.4014 3.4267 3.4267 3.4966 3.4966 3.5368 3.5368 3.6083 3.6083 5.7030 5.7030 5.9287 5.9287 6.8484 6.8484 7.5074 7.5074 9.5680 9.5680 9.7719 9.7719 9.9311 9.9311 10.2594 10.2594 10.8661 10.8661 11.0022 11.0022 11.0379 11.0379 11.3365 11.3365 11.6912 11.6912 11.7845 11.7845 13.5699 13.5699 14.6435 14.6435 14.8786 14.8786 14.9940 14.9940 15.5781 15.5781 17.0551 17.0551 17.7087 17.7087 17.8833 17.8833 18.0315 18.0315 k = 0.1897 0.3288 0.5772 ( 4454 PWs) bands (ev): 1.0942 1.0942 1.0967 1.0967 1.1294 1.1294 1.1402 1.1402 1.1485 1.1485 1.1556 1.1556 1.1822 1.1822 1.2026 1.2026 3.0875 3.0875 3.1084 3.1084 3.1277 3.1277 3.1521 3.1521 3.1883 3.1883 3.2250 3.2250 3.3274 3.3274 3.3977 3.3977 3.4346 3.4346 3.5007 3.5007 3.5359 3.5359 3.6052 3.6052 5.7606 5.7606 6.0078 6.0078 6.7693 6.7693 7.3942 7.3942 9.6278 9.6278 9.8039 9.8039 9.9506 9.9506 10.2429 10.2429 10.8699 10.8699 10.9704 10.9704 11.0080 11.0080 11.2998 11.2998 11.6675 11.6675 11.7513 11.7513 13.6589 13.6589 14.6545 14.6545 14.8771 14.8771 14.9576 14.9576 15.6530 15.6530 17.1058 17.1058 17.6538 17.6538 17.8483 17.8483 18.0476 18.0476 k = 0.1983 0.3437 0.5772 ( 4466 PWs) bands (ev): 1.0950 1.0950 1.0960 1.0960 1.1296 1.1296 1.1396 1.1396 1.1485 1.1485 1.1561 1.1561 1.1827 1.1827 1.2010 1.2010 3.0871 3.0871 3.1052 3.1052 3.1327 3.1327 3.1537 3.1537 3.1855 3.1855 3.2179 3.2179 3.3323 3.3323 3.3935 3.3935 3.4424 3.4424 3.5029 3.5029 3.5368 3.5368 3.6015 3.6015 5.8208 5.8208 6.0901 6.0901 6.6900 6.6900 7.2822 7.2822 9.6845 9.6845 9.8341 9.8341 9.9727 9.9727 10.2275 10.2275 10.8512 10.8512 10.9636 10.9636 10.9759 10.9759 11.2647 11.2647 11.6467 11.6467 11.7207 11.7207 13.7498 13.7498 14.6647 14.6647 14.8632 14.8632 14.9102 14.9102 15.7443 15.7443 17.1031 17.1031 17.6302 17.6302 17.8178 17.8178 18.0871 18.0871 k = 0.2069 0.3587 0.5772 ( 4462 PWs) bands (ev): 1.0953 1.0953 1.0959 1.0959 1.1299 1.1299 1.1390 1.1390 1.1488 1.1488 1.1565 1.1565 1.1832 1.1832 1.1994 1.1994 3.0869 3.0869 3.1022 3.1022 3.1380 3.1380 3.1556 3.1556 3.1827 3.1827 3.2108 3.2108 3.3373 3.3373 3.3889 3.3889 3.4501 3.4501 3.5027 3.5027 3.5399 3.5399 3.5973 3.5973 5.8833 5.8833 6.1753 6.1753 6.6108 6.6108 7.1717 7.1717 9.7365 9.7365 9.8609 9.8609 9.9981 9.9981 10.2133 10.2133 10.8195 10.8195 10.9336 10.9336 10.9813 10.9813 11.2321 11.2321 11.6294 11.6294 11.6931 11.6931 13.8426 13.8426 14.6694 14.6694 14.8223 14.8223 14.8781 14.8781 15.8477 15.8477 17.0427 17.0427 17.6363 17.6363 17.7910 17.7910 18.1650 18.1650 k = 0.2155 0.3736 0.5772 ( 4462 PWs) bands (ev): 1.0946 1.0946 1.0967 1.0967 1.1302 1.1302 1.1382 1.1382 1.1491 1.1491 1.1568 1.1568 1.1838 1.1838 1.1978 1.1978 3.0870 3.0870 3.0995 3.0995 3.1437 3.1437 3.1576 3.1576 3.1799 3.1799 3.2037 3.2037 3.3424 3.3424 3.3842 3.3842 3.4576 3.4576 3.5003 3.5003 3.5448 3.5448 3.5926 3.5926 5.9482 5.9482 6.2634 6.2634 6.5321 6.5321 7.0627 7.0627 9.7824 9.7824 9.8823 9.8823 10.0271 10.0271 10.2004 10.2004 10.7883 10.7883 10.8920 10.8920 11.0017 11.0017 11.2023 11.2023 11.6162 11.6162 11.6687 11.6687 13.9369 13.9369 14.6526 14.6526 14.7768 14.7768 14.8609 14.8609 15.9596 15.9596 16.9455 16.9455 17.6513 17.6513 17.7670 17.7670 18.2830 18.2830 k = 0.2241 0.3886 0.5772 ( 4460 PWs) bands (ev): 1.0939 1.0939 1.0976 1.0976 1.1305 1.1305 1.1375 1.1375 1.1496 1.1496 1.1570 1.1570 1.1846 1.1846 1.1963 1.1963 3.0874 3.0874 3.0970 3.0970 3.1495 3.1495 3.1599 3.1599 3.1771 3.1771 3.1966 3.1966 3.3475 3.3475 3.3793 3.3793 3.4649 3.4649 3.4966 3.4966 3.5507 3.5507 3.5875 3.5875 6.0153 6.0153 6.3543 6.3543 6.4541 6.4541 6.9555 6.9555 9.8212 9.8212 9.8967 9.8967 10.0587 10.0587 10.1883 10.1883 10.7635 10.7635 10.8496 10.8496 11.0248 11.0248 11.1747 11.1747 11.6074 11.6074 11.6476 11.6476 14.0326 14.0326 14.5946 14.5946 14.7631 14.7631 14.8455 14.8455 16.0777 16.0777 16.8302 16.8302 17.6647 17.6647 17.7456 17.7456 18.4327 18.4327 k = 0.2328 0.4035 0.5772 ( 4468 PWs) bands (ev): 1.0932 1.0932 1.0984 1.0984 1.1310 1.1310 1.1367 1.1367 1.1501 1.1501 1.1570 1.1570 1.1853 1.1853 1.1949 1.1949 3.0879 3.0879 3.0951 3.0951 3.1553 3.1553 3.1626 3.1626 3.1742 3.1742 3.1897 3.1897 3.3526 3.3526 3.3743 3.3743 3.4718 3.4718 3.4919 3.4919 3.5570 3.5570 3.5821 3.5821 6.0845 6.0845 6.3770 6.3770 6.4480 6.4480 6.8503 6.8503 9.8527 9.8527 9.9033 9.9033 10.0904 10.0904 10.1760 10.1760 10.7485 10.7485 10.8100 10.8100 11.0490 11.0490 11.1487 11.1487 11.6033 11.6033 11.6301 11.6301 14.1293 14.1293 14.5116 14.5116 14.7701 14.7701 14.8297 14.8297 16.1999 16.1999 16.7067 16.7067 17.6758 17.6758 17.7269 17.7269 18.6037 18.6037 k = 0.2414 0.4185 0.5772 ( 4456 PWs) bands (ev): 1.0924 1.0924 1.0992 1.0992 1.1315 1.1315 1.1361 1.1361 1.1505 1.1505 1.1569 1.1569 1.1862 1.1862 1.1936 1.1936 3.0882 3.0882 3.0938 3.0938 3.1605 3.1605 3.1661 3.1661 3.1713 3.1713 3.1831 3.1831 3.3576 3.3576 3.3694 3.3694 3.4783 3.4783 3.4866 3.4866 3.5632 3.5632 3.5766 3.5766 6.1556 6.1556 6.3012 6.3012 6.5441 6.5441 6.7471 6.7471 9.8769 9.8769 9.9018 9.9018 10.1192 10.1192 10.1617 10.1617 10.7456 10.7456 10.7769 10.7769 11.0735 11.0735 11.1234 11.1234 11.6038 11.6038 11.6165 11.6165 14.2266 14.2266 14.4194 14.4194 14.7835 14.7835 14.8136 14.8136 16.3252 16.3252 16.5797 16.5797 17.6865 17.6865 17.7108 17.7108 18.7878 18.7878 k = 0.2500 0.4334 0.5772 ( 4456 PWs) bands (ev): 1.0917 1.0917 1.1000 1.1000 1.1322 1.1322 1.1354 1.1354 1.1509 1.1509 1.1566 1.1566 1.1870 1.1870 1.1925 1.1925 3.0880 3.0880 3.0937 3.0937 3.1646 3.1646 3.1677 3.1677 3.1715 3.1715 3.1770 3.1770 3.3618 3.3618 3.3652 3.3652 3.4802 3.4802 3.4850 3.4850 3.5673 3.5673 3.5729 3.5729 6.2256 6.2256 6.2296 6.2296 6.6428 6.6428 6.6461 6.6461 9.8921 9.8921 9.8942 9.8942 10.1427 10.1427 10.1437 10.1437 10.7539 10.7539 10.7558 10.7558 11.0980 11.0980 11.0988 11.0988 11.6063 11.6063 11.6096 11.6096 14.3217 14.3217 14.3256 14.3256 14.7971 14.7971 14.7994 14.7994 16.4517 16.4517 16.4525 16.4525 17.6968 17.6968 17.6987 17.6987 18.9772 18.9774 Writing output data file Tl2Pt.save init_run : 0.85s CPU 1.05s WALL ( 1 calls) electrons : 399.05s CPU 405.07s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 399.04s CPU 405.06s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.12s CPU 0.19s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 301 calls) cegterg : 374.61s CPU 378.87s WALL ( 653 calls) Called by sum_band: Called by *egterg: h_psi : 201.77s CPU 204.83s WALL ( 10495 calls) s_psi : 15.95s CPU 15.87s WALL ( 10495 calls) g_psi : 0.42s CPU 0.46s WALL ( 9541 calls) cdiaghg : 132.13s CPU 133.60s WALL ( 9842 calls) cegterg:over : 17.28s CPU 17.24s WALL ( 9541 calls) cegterg:upda : 13.30s CPU 13.38s WALL ( 9541 calls) cegterg:last : 8.13s CPU 8.05s WALL ( 1548 calls) cdiaghg:chol : 7.77s CPU 7.83s WALL ( 9842 calls) cdiaghg:inve : 5.51s CPU 5.62s WALL ( 9842 calls) cdiaghg:para : 9.40s CPU 9.70s WALL ( 19684 calls) Called by h_psi: h_psi:vloc : 168.14s CPU 170.97s WALL ( 10495 calls) h_psi:vnl : 33.08s CPU 33.30s WALL ( 10495 calls) add_vuspsi : 18.29s CPU 18.50s WALL ( 10495 calls) General routines calbec : 14.77s CPU 14.77s WALL ( 10495 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 155.29s CPU 158.22s WALL ( 1516720 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.23s CPU 0.37s WALL ( 602 calls) Parallel routines fft_scatter : 48.40s CPU 48.81s WALL ( 1516743 calls) PWSCF : 7m 4.02s CPU 7m34.51s WALL This run was terminated on: 21:21:51 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=