Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:10: 2 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: ./SrxSiPdx2.save/ file Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S 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 129 55 16 3693 1043 163 Max 131 56 17 3694 1060 165 Sum 4651 2009 583 132957 37801 5897 bravais-lattice index = 14 lattice parameter (alat) = 10.9656 a.u. unit-cell volume = 619.0164 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 54.00 number of Kohn-Sham states= 64 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 545.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.965605 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.724160 celldm(5)= -0.724160 celldm(6)= 0.448320 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.448320 0.893873 0.000000 ) a(3) = ( -0.724160 -0.446936 0.525205 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.501548 0.952010 ) b(2) = ( 0.000000 1.118727 0.952010 ) b(3) = ( 0.000000 0.000000 1.904020 ) PseudoPot. # 1 for Pd read from file: /users/gautes/Pseudo/Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 7926b04c0aa9b348bf6cb39d90ce6236 Pseudo is Ultrasoft + core correction, Zval = 18.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1235 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 Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 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 1221 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 Pd 18.00 106.42000 Pd( 1.00) Si 4.00 28.08550 Si( 1.00) Sr 10.00 87.62000 Sr( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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= 341 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029326 k( 2) = ( 0.0000000 0.0000000 0.0183079), wk = 0.0029326 k( 3) = ( 0.0000000 0.0000000 0.0366158), wk = 0.0029326 k( 4) = ( 0.0000000 0.0000000 0.0549236), wk = 0.0029326 k( 5) = ( 0.0000000 0.0000000 0.0732315), wk = 0.0029326 k( 6) = ( 0.0000000 0.0000000 0.0915394), wk = 0.0029326 k( 7) = ( 0.0000000 0.0000000 0.1098473), wk = 0.0029326 k( 8) = ( 0.0000000 0.0000000 0.1281552), wk = 0.0029326 k( 9) = ( 0.0000000 0.0000000 0.1464631), wk = 0.0029326 k( 10) = ( 0.0000000 0.0000000 0.1647710), wk = 0.0029326 k( 11) = ( 0.0000000 0.0000000 0.1830789), wk = 0.0029326 k( 12) = ( 0.0000000 0.0000000 0.2013867), wk = 0.0029326 k( 13) = ( 0.0000000 0.0000000 0.2196946), wk = 0.0029326 k( 14) = ( 0.0000000 0.0000000 0.2380025), wk = 0.0029326 k( 15) = ( 0.0000000 0.0000000 0.2563104), wk = 0.0029326 k( 16) = ( 0.0000000 0.0000000 0.2746183), wk = 0.0029326 k( 17) = ( 0.0000000 0.0000000 0.2929261), wk = 0.0029326 k( 18) = ( 0.0000000 0.0000000 0.3112340), wk = 0.0029326 k( 19) = ( 0.0000000 0.0000000 0.3295419), wk = 0.0029326 k( 20) = ( 0.0000000 0.0000000 0.3478498), wk = 0.0029326 k( 21) = ( 0.0000000 0.0000000 0.3661577), wk = 0.0029326 k( 22) = ( 0.0000000 0.0000000 0.3844656), wk = 0.0029326 k( 23) = ( 0.0000000 0.0000000 0.4027735), wk = 0.0029326 k( 24) = ( 0.0000000 0.0000000 0.4210813), wk = 0.0029326 k( 25) = ( 0.0000000 0.0000000 0.4393892), wk = 0.0029326 k( 26) = ( 0.0000000 0.0000000 0.4576971), wk = 0.0029326 k( 27) = ( 0.0000000 0.0000000 0.4760050), wk = 0.0029326 k( 28) = ( 0.0000000 0.0000000 0.4943129), wk = 0.0029326 k( 29) = ( 0.0000000 0.0000000 0.5126208), wk = 0.0029326 k( 30) = ( 0.0000000 0.0000000 0.5309286), wk = 0.0029326 k( 31) = ( 0.0000000 0.0000000 0.5492365), wk = 0.0029326 k( 32) = ( 0.0000000 0.0000000 0.5675444), wk = 0.0029326 k( 33) = ( 0.0000000 0.0000000 0.5858523), wk = 0.0029326 k( 34) = ( 0.0000000 0.0000000 0.6041602), wk = 0.0029326 k( 35) = ( 0.0000000 0.0000000 0.6224681), wk = 0.0029326 k( 36) = ( 0.0000000 0.0000000 0.6407760), wk = 0.0029326 k( 37) = ( 0.0000000 0.0000000 0.6590838), wk = 0.0029326 k( 38) = ( 0.0000000 0.0000000 0.6773917), wk = 0.0029326 k( 39) = ( 0.0000000 0.0000000 0.6956996), wk = 0.0029326 k( 40) = ( 0.0000000 0.0000000 0.7140075), wk = 0.0029326 k( 41) = ( 0.0000000 0.0000000 0.7323154), wk = 0.0029326 k( 42) = ( 0.0000000 0.0000000 0.7506233), wk = 0.0029326 k( 43) = ( 0.0000000 0.0000000 0.7689311), wk = 0.0029326 k( 44) = ( 0.0000000 0.0000000 0.7872390), wk = 0.0029326 k( 45) = ( 0.0000000 0.0000000 0.8055469), wk = 0.0029326 k( 46) = ( 0.0000000 0.0000000 0.8238548), wk = 0.0029326 k( 47) = ( 0.0000000 0.0000000 0.8421627), wk = 0.0029326 k( 48) = ( 0.0000000 0.0000000 0.8604706), wk = 0.0029326 k( 49) = ( 0.0000000 0.0000000 0.8787784), wk = 0.0029326 k( 50) = ( 0.0000000 0.0000000 0.8970863), wk = 0.0029326 k( 51) = ( 0.0000000 0.0000000 0.9153942), wk = 0.0029326 k( 52) = ( 0.0000000 0.0000000 0.9337021), wk = 0.0029326 k( 53) = ( 0.0000000 0.0000000 0.9520100), wk = 0.0029326 k( 54) = ( 0.0000000 0.0000000 0.9520100), wk = 0.0029326 k( 55) = ( -0.0095227 0.0154295 0.9520100), wk = 0.0029326 k( 56) = ( -0.0190455 0.0308590 0.9520100), wk = 0.0029326 k( 57) = ( -0.0285682 0.0462884 0.9520100), wk = 0.0029326 k( 58) = ( -0.0380910 0.0617179 0.9520100), wk = 0.0029326 k( 59) = ( -0.0476138 0.0771474 0.9520100), wk = 0.0029326 k( 60) = ( -0.0571365 0.0925769 0.9520100), wk = 0.0029326 k( 61) = ( -0.0666593 0.1080063 0.9520100), wk = 0.0029326 k( 62) = ( -0.0761820 0.1234358 0.9520100), wk = 0.0029326 k( 63) = ( -0.0857047 0.1388653 0.9520100), wk = 0.0029326 k( 64) = ( -0.0952275 0.1542948 0.9520100), wk = 0.0029326 k( 65) = ( -0.0952275 0.1542948 0.9520100), wk = 0.0029326 k( 66) = ( -0.1019737 0.1652255 0.9391651), wk = 0.0029326 k( 67) = ( -0.1087199 0.1761562 0.9263202), wk = 0.0029326 k( 68) = ( -0.1154661 0.1870869 0.9134752), wk = 0.0029326 k( 69) = ( -0.1222123 0.1980176 0.9006303), wk = 0.0029326 k( 70) = ( -0.1289585 0.2089483 0.8877854), wk = 0.0029326 k( 71) = ( -0.1357048 0.2198791 0.8749405), wk = 0.0029326 k( 72) = ( -0.1424510 0.2308098 0.8620956), wk = 0.0029326 k( 73) = ( -0.1491972 0.2417405 0.8492507), wk = 0.0029326 k( 74) = ( -0.1559434 0.2526712 0.8364057), wk = 0.0029326 k( 75) = ( -0.1626896 0.2636019 0.8235608), wk = 0.0029326 k( 76) = ( -0.1694358 0.2745326 0.8107159), wk = 0.0029326 k( 77) = ( -0.1761820 0.2854633 0.7978710), wk = 0.0029326 k( 78) = ( -0.1829282 0.2963941 0.7850261), wk = 0.0029326 k( 79) = ( -0.1896744 0.3073248 0.7721812), wk = 0.0029326 k( 80) = ( -0.1964206 0.3182555 0.7593362), wk = 0.0029326 k( 81) = ( -0.2031668 0.3291862 0.7464913), wk = 0.0029326 k( 82) = ( -0.2099130 0.3401169 0.7336464), wk = 0.0029326 k( 83) = ( -0.2166592 0.3510476 0.7208015), wk = 0.0029326 k( 84) = ( -0.2234055 0.3619784 0.7079566), wk = 0.0029326 k( 85) = ( -0.2301517 0.3729091 0.6951117), wk = 0.0029326 k( 86) = ( -0.2368979 0.3838398 0.6822668), wk = 0.0029326 k( 87) = ( -0.2436441 0.3947705 0.6694219), wk = 0.0029326 k( 88) = ( -0.2503903 0.4057012 0.6565769), wk = 0.0029326 k( 89) = ( -0.2571365 0.4166319 0.6437320), wk = 0.0029326 k( 90) = ( -0.2638827 0.4275626 0.6308871), wk = 0.0029326 k( 91) = ( -0.2706289 0.4384934 0.6180422), wk = 0.0029326 k( 92) = ( -0.2773751 0.4494241 0.6051973), wk = 0.0029326 k( 93) = ( -0.2841213 0.4603548 0.5923524), wk = 0.0029326 k( 94) = ( -0.2908675 0.4712855 0.5795074), wk = 0.0029326 k( 95) = ( -0.2976138 0.4822162 0.5666625), wk = 0.0029326 k( 96) = ( -0.2976138 0.4822162 0.5666625), wk = 0.0029326 k( 97) = ( -0.2908498 0.4712567 0.5537838), wk = 0.0029326 k( 98) = ( -0.2840858 0.4602973 0.5409051), wk = 0.0029326 k( 99) = ( -0.2773219 0.4493378 0.5280264), wk = 0.0029326 k( 100) = ( -0.2705579 0.4383784 0.5151477), wk = 0.0029326 k( 101) = ( -0.2637940 0.4274189 0.5022691), wk = 0.0029326 k( 102) = ( -0.2570301 0.4164595 0.4893904), wk = 0.0029326 k( 103) = ( -0.2502661 0.4055000 0.4765117), wk = 0.0029326 k( 104) = ( -0.2435022 0.3945405 0.4636330), wk = 0.0029326 k( 105) = ( -0.2367382 0.3835811 0.4507543), wk = 0.0029326 k( 106) = ( -0.2299743 0.3726216 0.4378756), wk = 0.0029326 k( 107) = ( -0.2232103 0.3616622 0.4249969), wk = 0.0029326 k( 108) = ( -0.2164464 0.3507027 0.4121182), wk = 0.0029326 k( 109) = ( -0.2096824 0.3397432 0.3992395), wk = 0.0029326 k( 110) = ( -0.2029185 0.3287838 0.3863608), wk = 0.0029326 k( 111) = ( -0.1961545 0.3178243 0.3734821), wk = 0.0029326 k( 112) = ( -0.1893906 0.3068649 0.3606034), wk = 0.0029326 k( 113) = ( -0.1826266 0.2959054 0.3477247), wk = 0.0029326 k( 114) = ( -0.1758627 0.2849459 0.3348460), wk = 0.0029326 k( 115) = ( -0.1690987 0.2739865 0.3219673), wk = 0.0029326 k( 116) = ( -0.1623348 0.2630270 0.3090886), wk = 0.0029326 k( 117) = ( -0.1555708 0.2520676 0.2962099), wk = 0.0029326 k( 118) = ( -0.1488069 0.2411081 0.2833313), wk = 0.0029326 k( 119) = ( -0.1420429 0.2301487 0.2704526), wk = 0.0029326 k( 120) = ( -0.1352790 0.2191892 0.2575739), wk = 0.0029326 k( 121) = ( -0.1285150 0.2082297 0.2446952), wk = 0.0029326 k( 122) = ( -0.1217511 0.1972703 0.2318165), wk = 0.0029326 k( 123) = ( -0.1149871 0.1863108 0.2189378), wk = 0.0029326 k( 124) = ( -0.1082232 0.1753513 0.2060591), wk = 0.0029326 k( 125) = ( -0.1014592 0.1643919 0.1931804), wk = 0.0029326 k( 126) = ( -0.0946953 0.1534324 0.1803017), wk = 0.0029326 k( 127) = ( -0.0879313 0.1424730 0.1674230), wk = 0.0029326 k( 128) = ( -0.0811674 0.1315135 0.1545443), wk = 0.0029326 k( 129) = ( -0.0744034 0.1205541 0.1416656), wk = 0.0029326 k( 130) = ( -0.0676395 0.1095946 0.1287869), wk = 0.0029326 k( 131) = ( -0.0608755 0.0986351 0.1159082), wk = 0.0029326 k( 132) = ( -0.0541116 0.0876757 0.1030295), wk = 0.0029326 k( 133) = ( -0.0473476 0.0767162 0.0901509), wk = 0.0029326 k( 134) = ( -0.0405837 0.0657568 0.0772722), wk = 0.0029326 k( 135) = ( -0.0338197 0.0547973 0.0643935), wk = 0.0029326 k( 136) = ( -0.0270558 0.0438378 0.0515148), wk = 0.0029326 k( 137) = ( -0.0202919 0.0328784 0.0386361), wk = 0.0029326 k( 138) = ( -0.0135279 0.0219189 0.0257574), wk = 0.0029326 k( 139) = ( -0.0067640 0.0109595 0.0128787), wk = 0.0029326 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029326 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029326 k( 142) = ( 0.0156250 0.0096434 -0.0000000), wk = 0.0029326 k( 143) = ( 0.0312500 0.0192868 -0.0000000), wk = 0.0029326 k( 144) = ( 0.0468750 0.0289303 -0.0000000), wk = 0.0029326 k( 145) = ( 0.0625000 0.0385737 -0.0000000), wk = 0.0029326 k( 146) = ( 0.0781250 0.0482171 -0.0000000), wk = 0.0029326 k( 147) = ( 0.0937500 0.0578605 -0.0000000), wk = 0.0029326 k( 148) = ( 0.1093750 0.0675040 -0.0000000), wk = 0.0029326 k( 149) = ( 0.1250000 0.0771474 -0.0000000), wk = 0.0029326 k( 150) = ( 0.1406250 0.0867908 -0.0000000), wk = 0.0029326 k( 151) = ( 0.1562500 0.0964342 -0.0000000), wk = 0.0029326 k( 152) = ( 0.1718750 0.1060777 -0.0000000), wk = 0.0029326 k( 153) = ( 0.1875000 0.1157211 -0.0000000), wk = 0.0029326 k( 154) = ( 0.2031250 0.1253645 -0.0000000), wk = 0.0029326 k( 155) = ( 0.2187500 0.1350079 -0.0000000), wk = 0.0029326 k( 156) = ( 0.2343750 0.1446513 -0.0000000), wk = 0.0029326 k( 157) = ( 0.2500000 0.1542948 -0.0000000), wk = 0.0029326 k( 158) = ( 0.2656250 0.1639382 -0.0000000), wk = 0.0029326 k( 159) = ( 0.2812500 0.1735816 -0.0000000), wk = 0.0029326 k( 160) = ( 0.2968750 0.1832250 -0.0000000), wk = 0.0029326 k( 161) = ( 0.3125000 0.1928685 -0.0000000), wk = 0.0029326 k( 162) = ( 0.3281250 0.2025119 -0.0000000), wk = 0.0029326 k( 163) = ( 0.3437500 0.2121553 -0.0000000), wk = 0.0029326 k( 164) = ( 0.3593750 0.2217987 -0.0000000), wk = 0.0029326 k( 165) = ( 0.3750000 0.2314421 -0.0000000), wk = 0.0029326 k( 166) = ( 0.3906250 0.2410856 -0.0000000), wk = 0.0029326 k( 167) = ( 0.4062500 0.2507290 -0.0000000), wk = 0.0029326 k( 168) = ( 0.4218750 0.2603724 -0.0000000), wk = 0.0029326 k( 169) = ( 0.4375000 0.2700158 -0.0000000), wk = 0.0029326 k( 170) = ( 0.4531250 0.2796593 -0.0000000), wk = 0.0029326 k( 171) = ( 0.4687500 0.2893027 -0.0000000), wk = 0.0029326 k( 172) = ( 0.4843750 0.2989461 -0.0000000), wk = 0.0029326 k( 173) = ( 0.5000000 0.3085895 -0.0000000), wk = 0.0029326 k( 174) = ( 0.5000000 0.3085895 -0.0000000), wk = 0.0029326 k( 175) = ( 0.4932538 0.3195203 0.0128449), wk = 0.0029326 k( 176) = ( 0.4865076 0.3304510 0.0256898), wk = 0.0029326 k( 177) = ( 0.4797614 0.3413817 0.0385348), wk = 0.0029326 k( 178) = ( 0.4730152 0.3523124 0.0513797), wk = 0.0029326 k( 179) = ( 0.4662690 0.3632431 0.0642246), wk = 0.0029326 k( 180) = ( 0.4595227 0.3741738 0.0770695), wk = 0.0029326 k( 181) = ( 0.4527765 0.3851045 0.0899144), wk = 0.0029326 k( 182) = ( 0.4460303 0.3960353 0.1027593), wk = 0.0029326 k( 183) = ( 0.4392841 0.4069660 0.1156042), wk = 0.0029326 k( 184) = ( 0.4325379 0.4178967 0.1284491), wk = 0.0029326 k( 185) = ( 0.4257917 0.4288274 0.1412941), wk = 0.0029326 k( 186) = ( 0.4190455 0.4397581 0.1541390), wk = 0.0029326 k( 187) = ( 0.4122993 0.4506888 0.1669839), wk = 0.0029326 k( 188) = ( 0.4055531 0.4616195 0.1798288), wk = 0.0029326 k( 189) = ( 0.3988069 0.4725503 0.1926737), wk = 0.0029326 k( 190) = ( 0.3920607 0.4834810 0.2055186), wk = 0.0029326 k( 191) = ( 0.3853145 0.4944117 0.2183636), wk = 0.0029326 k( 192) = ( 0.3785682 0.5053424 0.2312085), wk = 0.0029326 k( 193) = ( 0.3718220 0.5162731 0.2440534), wk = 0.0029326 k( 194) = ( 0.3650758 0.5272038 0.2568983), wk = 0.0029326 k( 195) = ( 0.3583296 0.5381346 0.2697432), wk = 0.0029326 k( 196) = ( 0.3515834 0.5490653 0.2825881), wk = 0.0029326 k( 197) = ( 0.3448372 0.5599960 0.2954331), wk = 0.0029326 k( 198) = ( 0.3380910 0.5709267 0.3082780), wk = 0.0029326 k( 199) = ( 0.3313448 0.5818574 0.3211229), wk = 0.0029326 k( 200) = ( 0.3245986 0.5927881 0.3339678), wk = 0.0029326 k( 201) = ( 0.3178524 0.6037188 0.3468127), wk = 0.0029326 k( 202) = ( 0.3111062 0.6146495 0.3596576), wk = 0.0029326 k( 203) = ( 0.3043600 0.6255803 0.3725025), wk = 0.0029326 k( 204) = ( 0.2976138 0.6365110 0.3853475), wk = 0.0029326 k( 205) = ( 0.2976138 0.6365110 0.3853475), wk = 0.0029326 k( 206) = ( 0.2810797 0.6322250 0.3903840), wk = 0.0029326 k( 207) = ( 0.2645456 0.6279390 0.3954205), wk = 0.0029326 k( 208) = ( 0.2480115 0.6236531 0.4004571), wk = 0.0029326 k( 209) = ( 0.2314774 0.6193671 0.4054936), wk = 0.0029326 k( 210) = ( 0.2149433 0.6150812 0.4105301), wk = 0.0029326 k( 211) = ( 0.1984092 0.6107952 0.4155666), wk = 0.0029326 k( 212) = ( 0.1818751 0.6065092 0.4206032), wk = 0.0029326 k( 213) = ( 0.1653410 0.6022233 0.4256397), wk = 0.0029326 k( 214) = ( 0.1488069 0.5979373 0.4306762), wk = 0.0029326 k( 215) = ( 0.1322728 0.5936513 0.4357128), wk = 0.0029326 k( 216) = ( 0.1157387 0.5893653 0.4407493), wk = 0.0029326 k( 217) = ( 0.0992046 0.5850794 0.4457858), wk = 0.0029326 k( 218) = ( 0.0826705 0.5807934 0.4508223), wk = 0.0029326 k( 219) = ( 0.0661364 0.5765075 0.4558589), wk = 0.0029326 k( 220) = ( 0.0496023 0.5722215 0.4608954), wk = 0.0029326 k( 221) = ( 0.0330682 0.5679355 0.4659319), wk = 0.0029326 k( 222) = ( 0.0165341 0.5636496 0.4709685), wk = 0.0029326 k( 223) = ( 0.0000000 0.5593636 0.4760050), wk = 0.0029326 k( 224) = ( 0.0000000 0.5593636 0.4760050), wk = 0.0029326 k( 225) = ( 0.0067568 0.5484158 0.4888700), wk = 0.0029326 k( 226) = ( 0.0135135 0.5374680 0.5017350), wk = 0.0029326 k( 227) = ( 0.0202703 0.5265202 0.5146000), wk = 0.0029326 k( 228) = ( 0.0270270 0.5155724 0.5274650), wk = 0.0029326 k( 229) = ( 0.0337838 0.5046246 0.5403300), wk = 0.0029326 k( 230) = ( 0.0405405 0.4936768 0.5531950), wk = 0.0029326 k( 231) = ( 0.0472973 0.4827289 0.5660600), wk = 0.0029326 k( 232) = ( 0.0540540 0.4717812 0.5789250), wk = 0.0029326 k( 233) = ( 0.0608108 0.4608333 0.5917900), wk = 0.0029326 k( 234) = ( 0.0675676 0.4498855 0.6046550), wk = 0.0029326 k( 235) = ( 0.0743243 0.4389377 0.6175200), wk = 0.0029326 k( 236) = ( 0.0810811 0.4279899 0.6303850), wk = 0.0029326 k( 237) = ( 0.0878378 0.4170421 0.6432500), wk = 0.0029326 k( 238) = ( 0.0945946 0.4060943 0.6561150), wk = 0.0029326 k( 239) = ( 0.1013514 0.3951465 0.6689800), wk = 0.0029326 k( 240) = ( 0.1081081 0.3841987 0.6818450), wk = 0.0029326 k( 241) = ( 0.1148649 0.3732509 0.6947100), wk = 0.0029326 k( 242) = ( 0.1216216 0.3623031 0.7075750), wk = 0.0029326 k( 243) = ( 0.1283784 0.3513553 0.7204400), wk = 0.0029326 k( 244) = ( 0.1351351 0.3404075 0.7333050), wk = 0.0029326 k( 245) = ( 0.1418919 0.3294597 0.7461700), wk = 0.0029326 k( 246) = ( 0.1486486 0.3185119 0.7590350), wk = 0.0029326 k( 247) = ( 0.1554054 0.3075640 0.7719000), wk = 0.0029326 k( 248) = ( 0.1621622 0.2966162 0.7847650), wk = 0.0029326 k( 249) = ( 0.1689189 0.2856684 0.7976300), wk = 0.0029326 k( 250) = ( 0.1756757 0.2747206 0.8104950), wk = 0.0029326 k( 251) = ( 0.1824324 0.2637728 0.8233600), wk = 0.0029326 k( 252) = ( 0.1891892 0.2528250 0.8362250), wk = 0.0029326 k( 253) = ( 0.1959460 0.2418772 0.8490900), wk = 0.0029326 k( 254) = ( 0.2027027 0.2309294 0.8619550), wk = 0.0029326 k( 255) = ( 0.2094595 0.2199816 0.8748200), wk = 0.0029326 k( 256) = ( 0.2162162 0.2090338 0.8876850), wk = 0.0029326 k( 257) = ( 0.2229730 0.1980860 0.9005500), wk = 0.0029326 k( 258) = ( 0.2297297 0.1871382 0.9134150), wk = 0.0029326 k( 259) = ( 0.2364865 0.1761904 0.9262800), wk = 0.0029326 k( 260) = ( 0.2432432 0.1652426 0.9391450), wk = 0.0029326 k( 261) = ( 0.2500000 0.1542948 0.9520100), wk = 0.0029326 k( 262) = ( 0.2500000 0.1542948 0.9520100), wk = 0.0029326 k( 263) = ( 0.2631579 0.1624155 0.9424671), wk = 0.0029326 k( 264) = ( 0.2763158 0.1705363 0.9329242), wk = 0.0029326 k( 265) = ( 0.2894737 0.1786571 0.9233813), wk = 0.0029326 k( 266) = ( 0.3026316 0.1867779 0.9138384), wk = 0.0029326 k( 267) = ( 0.3157895 0.1948987 0.9042955), wk = 0.0029326 k( 268) = ( 0.3289474 0.2030194 0.8947526), wk = 0.0029326 k( 269) = ( 0.3421053 0.2111402 0.8852097), wk = 0.0029326 k( 270) = ( 0.3552632 0.2192610 0.8756668), wk = 0.0029326 k( 271) = ( 0.3684211 0.2273818 0.8661239), wk = 0.0029326 k( 272) = ( 0.3815789 0.2355025 0.8565810), wk = 0.0029326 k( 273) = ( 0.3947368 0.2436233 0.8470381), wk = 0.0029326 k( 274) = ( 0.4078947 0.2517441 0.8374952), wk = 0.0029326 k( 275) = ( 0.4210526 0.2598649 0.8279523), wk = 0.0029326 k( 276) = ( 0.4342105 0.2679856 0.8184094), wk = 0.0029326 k( 277) = ( 0.4473684 0.2761064 0.8088665), wk = 0.0029326 k( 278) = ( 0.4605263 0.2842272 0.7993236), wk = 0.0029326 k( 279) = ( 0.4736842 0.2923480 0.7897807), wk = 0.0029326 k( 280) = ( 0.4868421 0.3004688 0.7802378), wk = 0.0029326 k( 281) = ( 0.5000000 0.3085895 0.7706949), wk = 0.0029326 k( 282) = ( 0.5000000 0.3085895 0.7706949), wk = 0.0029326 k( 283) = ( 0.5000000 0.3085895 0.7523450), wk = 0.0029326 k( 284) = ( 0.5000000 0.3085895 0.7339952), wk = 0.0029326 k( 285) = ( 0.5000000 0.3085895 0.7156453), wk = 0.0029326 k( 286) = ( 0.5000000 0.3085895 0.6972954), wk = 0.0029326 k( 287) = ( 0.5000000 0.3085895 0.6789455), wk = 0.0029326 k( 288) = ( 0.5000000 0.3085895 0.6605957), wk = 0.0029326 k( 289) = ( 0.5000000 0.3085895 0.6422458), wk = 0.0029326 k( 290) = ( 0.5000000 0.3085895 0.6238959), wk = 0.0029326 k( 291) = ( 0.5000000 0.3085895 0.6055460), wk = 0.0029326 k( 292) = ( 0.5000000 0.3085895 0.5871961), wk = 0.0029326 k( 293) = ( 0.5000000 0.3085895 0.5688462), wk = 0.0029326 k( 294) = ( 0.5000000 0.3085895 0.5504964), wk = 0.0029326 k( 295) = ( 0.5000000 0.3085895 0.5321465), wk = 0.0029326 k( 296) = ( 0.5000000 0.3085895 0.5137966), wk = 0.0029326 k( 297) = ( 0.5000000 0.3085895 0.4954467), wk = 0.0029326 k( 298) = ( 0.5000000 0.3085895 0.4770969), wk = 0.0029326 k( 299) = ( 0.5000000 0.3085895 0.4587470), wk = 0.0029326 k( 300) = ( 0.5000000 0.3085895 0.4403971), wk = 0.0029326 k( 301) = ( 0.5000000 0.3085895 0.4220472), wk = 0.0029326 k( 302) = ( 0.5000000 0.3085895 0.4036973), wk = 0.0029326 k( 303) = ( 0.5000000 0.3085895 0.3853475), wk = 0.0029326 k( 304) = ( 0.5000000 0.3085895 0.3669976), wk = 0.0029326 k( 305) = ( 0.5000000 0.3085895 0.3486477), wk = 0.0029326 k( 306) = ( 0.5000000 0.3085895 0.3302978), wk = 0.0029326 k( 307) = ( 0.5000000 0.3085895 0.3119479), wk = 0.0029326 k( 308) = ( 0.5000000 0.3085895 0.2935981), wk = 0.0029326 k( 309) = ( 0.5000000 0.3085895 0.2752482), wk = 0.0029326 k( 310) = ( 0.5000000 0.3085895 0.2568983), wk = 0.0029326 k( 311) = ( 0.5000000 0.3085895 0.2385484), wk = 0.0029326 k( 312) = ( 0.5000000 0.3085895 0.2201986), wk = 0.0029326 k( 313) = ( 0.5000000 0.3085895 0.2018487), wk = 0.0029326 k( 314) = ( 0.5000000 0.3085895 0.1834988), wk = 0.0029326 k( 315) = ( 0.5000000 0.3085895 0.1651489), wk = 0.0029326 k( 316) = ( 0.5000000 0.3085895 0.1467990), wk = 0.0029326 k( 317) = ( 0.5000000 0.3085895 0.1284491), wk = 0.0029326 k( 318) = ( 0.5000000 0.3085895 0.1100993), wk = 0.0029326 k( 319) = ( 0.5000000 0.3085895 0.0917494), wk = 0.0029326 k( 320) = ( 0.5000000 0.3085895 0.0733995), wk = 0.0029326 k( 321) = ( 0.5000000 0.3085895 0.0550496), wk = 0.0029326 k( 322) = ( 0.5000000 0.3085895 0.0366998), wk = 0.0029326 k( 323) = ( 0.5000000 0.3085895 0.0183499), wk = 0.0029326 k( 324) = ( 0.5000000 0.3085895 -0.0000000), wk = 0.0029326 k( 325) = ( 0.0000000 0.0000000 0.9520100), wk = 0.0029326 k( 326) = ( 0.0156250 0.0096434 0.9520100), wk = 0.0029326 k( 327) = ( 0.0312500 0.0192868 0.9520100), wk = 0.0029326 k( 328) = ( 0.0468750 0.0289303 0.9520100), wk = 0.0029326 k( 329) = ( 0.0625000 0.0385737 0.9520100), wk = 0.0029326 k( 330) = ( 0.0781250 0.0482171 0.9520100), wk = 0.0029326 k( 331) = ( 0.0937500 0.0578605 0.9520100), wk = 0.0029326 k( 332) = ( 0.1093750 0.0675040 0.9520100), wk = 0.0029326 k( 333) = ( 0.1250000 0.0771474 0.9520100), wk = 0.0029326 k( 334) = ( 0.1406250 0.0867908 0.9520100), wk = 0.0029326 k( 335) = ( 0.1562500 0.0964342 0.9520100), wk = 0.0029326 k( 336) = ( 0.1718750 0.1060777 0.9520100), wk = 0.0029326 k( 337) = ( 0.1875000 0.1157211 0.9520100), wk = 0.0029326 k( 338) = ( 0.2031250 0.1253645 0.9520100), wk = 0.0029326 k( 339) = ( 0.2187500 0.1350079 0.9520100), wk = 0.0029326 k( 340) = ( 0.2343750 0.1446513 0.9520100), wk = 0.0029326 k( 341) = ( 0.2500000 0.1542948 0.9520100), wk = 0.0029326 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029326 k( 2) = ( 0.0000000 0.0000000 0.0096154), wk = 0.0029326 k( 3) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0029326 k( 4) = ( 0.0000000 0.0000000 0.0288462), wk = 0.0029326 k( 5) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0029326 k( 6) = ( 0.0000000 0.0000000 0.0480769), wk = 0.0029326 k( 7) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0029326 k( 8) = ( 0.0000000 0.0000000 0.0673077), wk = 0.0029326 k( 9) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0029326 k( 10) = ( 0.0000000 0.0000000 0.0865385), wk = 0.0029326 k( 11) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0029326 k( 12) = ( 0.0000000 0.0000000 0.1057692), wk = 0.0029326 k( 13) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0029326 k( 14) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0029326 k( 15) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0029326 k( 16) = ( 0.0000000 0.0000000 0.1442308), wk = 0.0029326 k( 17) = ( 0.0000000 0.0000000 0.1538462), wk = 0.0029326 k( 18) = ( 0.0000000 0.0000000 0.1634615), wk = 0.0029326 k( 19) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0029326 k( 20) = ( 0.0000000 0.0000000 0.1826923), wk = 0.0029326 k( 21) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0029326 k( 22) = ( 0.0000000 0.0000000 0.2019231), wk = 0.0029326 k( 23) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0029326 k( 24) = ( 0.0000000 0.0000000 0.2211539), wk = 0.0029326 k( 25) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0029326 k( 26) = ( 0.0000000 0.0000000 0.2403846), wk = 0.0029326 k( 27) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0029326 k( 28) = ( 0.0000000 0.0000000 0.2596154), wk = 0.0029326 k( 29) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0029326 k( 30) = ( 0.0000000 0.0000000 0.2788462), wk = 0.0029326 k( 31) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0029326 k( 32) = ( 0.0000000 0.0000000 0.2980769), wk = 0.0029326 k( 33) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0029326 k( 34) = ( 0.0000000 0.0000000 0.3173077), wk = 0.0029326 k( 35) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0029326 k( 36) = ( 0.0000000 0.0000000 0.3365385), wk = 0.0029326 k( 37) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0029326 k( 38) = ( 0.0000000 0.0000000 0.3557692), wk = 0.0029326 k( 39) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0029326 k( 40) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0029326 k( 41) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0029326 k( 42) = ( 0.0000000 0.0000000 0.3942308), wk = 0.0029326 k( 43) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0029326 k( 44) = ( 0.0000000 0.0000000 0.4134615), wk = 0.0029326 k( 45) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0029326 k( 46) = ( 0.0000000 0.0000000 0.4326923), wk = 0.0029326 k( 47) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0029326 k( 48) = ( 0.0000000 0.0000000 0.4519231), wk = 0.0029326 k( 49) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0029326 k( 50) = ( 0.0000000 0.0000000 0.4711538), wk = 0.0029326 k( 51) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0029326 k( 52) = ( 0.0000000 0.0000000 0.4903846), wk = 0.0029326 k( 53) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029326 k( 54) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029326 k( 55) = ( -0.0095227 0.0095228 0.5000000), wk = 0.0029326 k( 56) = ( -0.0190455 0.0190455 0.5000000), wk = 0.0029326 k( 57) = ( -0.0285682 0.0285682 0.5000000), wk = 0.0029326 k( 58) = ( -0.0380910 0.0380910 0.5000000), wk = 0.0029326 k( 59) = ( -0.0476138 0.0476138 0.5000000), wk = 0.0029326 k( 60) = ( -0.0571365 0.0571365 0.5000000), wk = 0.0029326 k( 61) = ( -0.0666593 0.0666593 0.5000000), wk = 0.0029326 k( 62) = ( -0.0761820 0.0761820 0.5000000), wk = 0.0029326 k( 63) = ( -0.0857047 0.0857047 0.5000000), wk = 0.0029326 k( 64) = ( -0.0952275 0.0952275 0.5000000), wk = 0.0029326 k( 65) = ( -0.0952275 0.0952275 0.5000000), wk = 0.0029326 k( 66) = ( -0.1019737 0.1019737 0.4932538), wk = 0.0029326 k( 67) = ( -0.1087199 0.1087199 0.4865076), wk = 0.0029326 k( 68) = ( -0.1154661 0.1154661 0.4797614), wk = 0.0029326 k( 69) = ( -0.1222123 0.1222123 0.4730152), wk = 0.0029326 k( 70) = ( -0.1289585 0.1289585 0.4662690), wk = 0.0029326 k( 71) = ( -0.1357048 0.1357048 0.4595227), wk = 0.0029326 k( 72) = ( -0.1424510 0.1424510 0.4527765), wk = 0.0029326 k( 73) = ( -0.1491972 0.1491972 0.4460303), wk = 0.0029326 k( 74) = ( -0.1559434 0.1559434 0.4392841), wk = 0.0029326 k( 75) = ( -0.1626896 0.1626896 0.4325379), wk = 0.0029326 k( 76) = ( -0.1694358 0.1694358 0.4257917), wk = 0.0029326 k( 77) = ( -0.1761820 0.1761820 0.4190455), wk = 0.0029326 k( 78) = ( -0.1829282 0.1829282 0.4122993), wk = 0.0029326 k( 79) = ( -0.1896744 0.1896744 0.4055531), wk = 0.0029326 k( 80) = ( -0.1964206 0.1964206 0.3988069), wk = 0.0029326 k( 81) = ( -0.2031668 0.2031668 0.3920607), wk = 0.0029326 k( 82) = ( -0.2099130 0.2099130 0.3853145), wk = 0.0029326 k( 83) = ( -0.2166592 0.2166593 0.3785683), wk = 0.0029326 k( 84) = ( -0.2234055 0.2234055 0.3718220), wk = 0.0029326 k( 85) = ( -0.2301517 0.2301517 0.3650758), wk = 0.0029326 k( 86) = ( -0.2368979 0.2368979 0.3583296), wk = 0.0029326 k( 87) = ( -0.2436441 0.2436441 0.3515834), wk = 0.0029326 k( 88) = ( -0.2503903 0.2503903 0.3448372), wk = 0.0029326 k( 89) = ( -0.2571365 0.2571365 0.3380910), wk = 0.0029326 k( 90) = ( -0.2638827 0.2638827 0.3313448), wk = 0.0029326 k( 91) = ( -0.2706289 0.2706289 0.3245986), wk = 0.0029326 k( 92) = ( -0.2773751 0.2773751 0.3178524), wk = 0.0029326 k( 93) = ( -0.2841213 0.2841213 0.3111062), wk = 0.0029326 k( 94) = ( -0.2908675 0.2908675 0.3043600), wk = 0.0029326 k( 95) = ( -0.2976138 0.2976138 0.2976138), wk = 0.0029326 k( 96) = ( -0.2976138 0.2976138 0.2976138), wk = 0.0029326 k( 97) = ( -0.2908498 0.2908498 0.2908498), wk = 0.0029326 k( 98) = ( -0.2840858 0.2840858 0.2840858), wk = 0.0029326 k( 99) = ( -0.2773219 0.2773219 0.2773219), wk = 0.0029326 k( 100) = ( -0.2705579 0.2705580 0.2705580), wk = 0.0029326 k( 101) = ( -0.2637940 0.2637940 0.2637940), wk = 0.0029326 k( 102) = ( -0.2570301 0.2570301 0.2570301), wk = 0.0029326 k( 103) = ( -0.2502661 0.2502661 0.2502661), wk = 0.0029326 k( 104) = ( -0.2435022 0.2435022 0.2435022), wk = 0.0029326 k( 105) = ( -0.2367382 0.2367382 0.2367382), wk = 0.0029326 k( 106) = ( -0.2299743 0.2299743 0.2299743), wk = 0.0029326 k( 107) = ( -0.2232103 0.2232103 0.2232103), wk = 0.0029326 k( 108) = ( -0.2164464 0.2164464 0.2164464), wk = 0.0029326 k( 109) = ( -0.2096824 0.2096824 0.2096824), wk = 0.0029326 k( 110) = ( -0.2029185 0.2029185 0.2029185), wk = 0.0029326 k( 111) = ( -0.1961545 0.1961545 0.1961545), wk = 0.0029326 k( 112) = ( -0.1893906 0.1893906 0.1893906), wk = 0.0029326 k( 113) = ( -0.1826266 0.1826266 0.1826266), wk = 0.0029326 k( 114) = ( -0.1758627 0.1758627 0.1758627), wk = 0.0029326 k( 115) = ( -0.1690987 0.1690987 0.1690987), wk = 0.0029326 k( 116) = ( -0.1623348 0.1623348 0.1623348), wk = 0.0029326 k( 117) = ( -0.1555708 0.1555708 0.1555708), wk = 0.0029326 k( 118) = ( -0.1488069 0.1488069 0.1488069), wk = 0.0029326 k( 119) = ( -0.1420429 0.1420429 0.1420429), wk = 0.0029326 k( 120) = ( -0.1352790 0.1352790 0.1352790), wk = 0.0029326 k( 121) = ( -0.1285150 0.1285150 0.1285150), wk = 0.0029326 k( 122) = ( -0.1217511 0.1217511 0.1217511), wk = 0.0029326 k( 123) = ( -0.1149871 0.1149871 0.1149871), wk = 0.0029326 k( 124) = ( -0.1082232 0.1082232 0.1082232), wk = 0.0029326 k( 125) = ( -0.1014592 0.1014592 0.1014592), wk = 0.0029326 k( 126) = ( -0.0946953 0.0946953 0.0946953), wk = 0.0029326 k( 127) = ( -0.0879313 0.0879313 0.0879313), wk = 0.0029326 k( 128) = ( -0.0811674 0.0811674 0.0811674), wk = 0.0029326 k( 129) = ( -0.0744034 0.0744034 0.0744034), wk = 0.0029326 k( 130) = ( -0.0676395 0.0676395 0.0676395), wk = 0.0029326 k( 131) = ( -0.0608755 0.0608755 0.0608755), wk = 0.0029326 k( 132) = ( -0.0541116 0.0541116 0.0541116), wk = 0.0029326 k( 133) = ( -0.0473476 0.0473476 0.0473476), wk = 0.0029326 k( 134) = ( -0.0405837 0.0405837 0.0405837), wk = 0.0029326 k( 135) = ( -0.0338197 0.0338197 0.0338197), wk = 0.0029326 k( 136) = ( -0.0270558 0.0270558 0.0270558), wk = 0.0029326 k( 137) = ( -0.0202919 0.0202919 0.0202919), wk = 0.0029326 k( 138) = ( -0.0135279 0.0135279 0.0135279), wk = 0.0029326 k( 139) = ( -0.0067640 0.0067640 0.0067640), wk = 0.0029326 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029326 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029326 k( 142) = ( 0.0156250 0.0156250 -0.0156250), wk = 0.0029326 k( 143) = ( 0.0312500 0.0312500 -0.0312500), wk = 0.0029326 k( 144) = ( 0.0468750 0.0468750 -0.0468750), wk = 0.0029326 k( 145) = ( 0.0625000 0.0625000 -0.0625000), wk = 0.0029326 k( 146) = ( 0.0781250 0.0781250 -0.0781250), wk = 0.0029326 k( 147) = ( 0.0937500 0.0937500 -0.0937500), wk = 0.0029326 k( 148) = ( 0.1093750 0.1093750 -0.1093750), wk = 0.0029326 k( 149) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0029326 k( 150) = ( 0.1406250 0.1406250 -0.1406250), wk = 0.0029326 k( 151) = ( 0.1562500 0.1562500 -0.1562500), wk = 0.0029326 k( 152) = ( 0.1718750 0.1718750 -0.1718750), wk = 0.0029326 k( 153) = ( 0.1875000 0.1875000 -0.1875000), wk = 0.0029326 k( 154) = ( 0.2031250 0.2031250 -0.2031250), wk = 0.0029326 k( 155) = ( 0.2187500 0.2187500 -0.2187500), wk = 0.0029326 k( 156) = ( 0.2343750 0.2343750 -0.2343750), wk = 0.0029326 k( 157) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0029326 k( 158) = ( 0.2656250 0.2656250 -0.2656250), wk = 0.0029326 k( 159) = ( 0.2812500 0.2812500 -0.2812500), wk = 0.0029326 k( 160) = ( 0.2968750 0.2968750 -0.2968750), wk = 0.0029326 k( 161) = ( 0.3125000 0.3125000 -0.3125000), wk = 0.0029326 k( 162) = ( 0.3281250 0.3281250 -0.3281250), wk = 0.0029326 k( 163) = ( 0.3437500 0.3437500 -0.3437500), wk = 0.0029326 k( 164) = ( 0.3593750 0.3593750 -0.3593750), wk = 0.0029326 k( 165) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0029326 k( 166) = ( 0.3906250 0.3906250 -0.3906250), wk = 0.0029326 k( 167) = ( 0.4062500 0.4062500 -0.4062500), wk = 0.0029326 k( 168) = ( 0.4218750 0.4218750 -0.4218750), wk = 0.0029326 k( 169) = ( 0.4375000 0.4375000 -0.4375000), wk = 0.0029326 k( 170) = ( 0.4531250 0.4531250 -0.4531250), wk = 0.0029326 k( 171) = ( 0.4687500 0.4687500 -0.4687500), wk = 0.0029326 k( 172) = ( 0.4843750 0.4843750 -0.4843750), wk = 0.0029326 k( 173) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029326 k( 174) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029326 k( 175) = ( 0.4932538 0.5067462 -0.4932538), wk = 0.0029326 k( 176) = ( 0.4865076 0.5134924 -0.4865076), wk = 0.0029326 k( 177) = ( 0.4797614 0.5202386 -0.4797614), wk = 0.0029326 k( 178) = ( 0.4730152 0.5269848 -0.4730152), wk = 0.0029326 k( 179) = ( 0.4662690 0.5337310 -0.4662690), wk = 0.0029326 k( 180) = ( 0.4595227 0.5404773 -0.4595228), wk = 0.0029326 k( 181) = ( 0.4527765 0.5472235 -0.4527765), wk = 0.0029326 k( 182) = ( 0.4460303 0.5539697 -0.4460303), wk = 0.0029326 k( 183) = ( 0.4392841 0.5607159 -0.4392841), wk = 0.0029326 k( 184) = ( 0.4325379 0.5674621 -0.4325379), wk = 0.0029326 k( 185) = ( 0.4257917 0.5742083 -0.4257917), wk = 0.0029326 k( 186) = ( 0.4190455 0.5809545 -0.4190455), wk = 0.0029326 k( 187) = ( 0.4122993 0.5877007 -0.4122993), wk = 0.0029326 k( 188) = ( 0.4055531 0.5944469 -0.4055531), wk = 0.0029326 k( 189) = ( 0.3988069 0.6011931 -0.3988069), wk = 0.0029326 k( 190) = ( 0.3920607 0.6079393 -0.3920607), wk = 0.0029326 k( 191) = ( 0.3853145 0.6146855 -0.3853145), wk = 0.0029326 k( 192) = ( 0.3785682 0.6214318 -0.3785682), wk = 0.0029326 k( 193) = ( 0.3718220 0.6281780 -0.3718220), wk = 0.0029326 k( 194) = ( 0.3650758 0.6349242 -0.3650758), wk = 0.0029326 k( 195) = ( 0.3583296 0.6416704 -0.3583296), wk = 0.0029326 k( 196) = ( 0.3515834 0.6484166 -0.3515834), wk = 0.0029326 k( 197) = ( 0.3448372 0.6551628 -0.3448372), wk = 0.0029326 k( 198) = ( 0.3380910 0.6619090 -0.3380910), wk = 0.0029326 k( 199) = ( 0.3313448 0.6686552 -0.3313448), wk = 0.0029326 k( 200) = ( 0.3245986 0.6754014 -0.3245986), wk = 0.0029326 k( 201) = ( 0.3178524 0.6821476 -0.3178524), wk = 0.0029326 k( 202) = ( 0.3111062 0.6888938 -0.3111062), wk = 0.0029326 k( 203) = ( 0.3043600 0.6956400 -0.3043600), wk = 0.0029326 k( 204) = ( 0.2976138 0.7023863 -0.2976138), wk = 0.0029326 k( 205) = ( 0.2976138 0.7023863 -0.2976138), wk = 0.0029326 k( 206) = ( 0.2810797 0.6911426 -0.2810797), wk = 0.0029326 k( 207) = ( 0.2645456 0.6798989 -0.2645456), wk = 0.0029326 k( 208) = ( 0.2480115 0.6686552 -0.2480115), wk = 0.0029326 k( 209) = ( 0.2314774 0.6574115 -0.2314774), wk = 0.0029326 k( 210) = ( 0.2149433 0.6461679 -0.2149433), wk = 0.0029326 k( 211) = ( 0.1984092 0.6349242 -0.1984092), wk = 0.0029326 k( 212) = ( 0.1818751 0.6236805 -0.1818751), wk = 0.0029326 k( 213) = ( 0.1653410 0.6124368 -0.1653410), wk = 0.0029326 k( 214) = ( 0.1488069 0.6011931 -0.1488069), wk = 0.0029326 k( 215) = ( 0.1322728 0.5899494 -0.1322728), wk = 0.0029326 k( 216) = ( 0.1157387 0.5787058 -0.1157387), wk = 0.0029326 k( 217) = ( 0.0992046 0.5674621 -0.0992046), wk = 0.0029326 k( 218) = ( 0.0826705 0.5562184 -0.0826705), wk = 0.0029326 k( 219) = ( 0.0661364 0.5449747 -0.0661364), wk = 0.0029326 k( 220) = ( 0.0496023 0.5337310 -0.0496023), wk = 0.0029326 k( 221) = ( 0.0330682 0.5224874 -0.0330682), wk = 0.0029326 k( 222) = ( 0.0165341 0.5112437 -0.0165341), wk = 0.0029326 k( 223) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029326 k( 224) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029326 k( 225) = ( 0.0067568 0.4932432 0.0067568), wk = 0.0029326 k( 226) = ( 0.0135135 0.4864865 0.0135135), wk = 0.0029326 k( 227) = ( 0.0202703 0.4797297 0.0202703), wk = 0.0029326 k( 228) = ( 0.0270270 0.4729730 0.0270270), wk = 0.0029326 k( 229) = ( 0.0337838 0.4662162 0.0337838), wk = 0.0029326 k( 230) = ( 0.0405405 0.4594595 0.0405405), wk = 0.0029326 k( 231) = ( 0.0472973 0.4527027 0.0472973), wk = 0.0029326 k( 232) = ( 0.0540540 0.4459459 0.0540540), wk = 0.0029326 k( 233) = ( 0.0608108 0.4391892 0.0608108), wk = 0.0029326 k( 234) = ( 0.0675676 0.4324324 0.0675676), wk = 0.0029326 k( 235) = ( 0.0743243 0.4256757 0.0743243), wk = 0.0029326 k( 236) = ( 0.0810811 0.4189189 0.0810811), wk = 0.0029326 k( 237) = ( 0.0878378 0.4121622 0.0878378), wk = 0.0029326 k( 238) = ( 0.0945946 0.4054054 0.0945946), wk = 0.0029326 k( 239) = ( 0.1013514 0.3986487 0.1013514), wk = 0.0029326 k( 240) = ( 0.1081081 0.3918919 0.1081081), wk = 0.0029326 k( 241) = ( 0.1148649 0.3851351 0.1148649), wk = 0.0029326 k( 242) = ( 0.1216216 0.3783784 0.1216216), wk = 0.0029326 k( 243) = ( 0.1283784 0.3716216 0.1283784), wk = 0.0029326 k( 244) = ( 0.1351351 0.3648649 0.1351351), wk = 0.0029326 k( 245) = ( 0.1418919 0.3581081 0.1418919), wk = 0.0029326 k( 246) = ( 0.1486486 0.3513514 0.1486486), wk = 0.0029326 k( 247) = ( 0.1554054 0.3445946 0.1554054), wk = 0.0029326 k( 248) = ( 0.1621622 0.3378378 0.1621622), wk = 0.0029326 k( 249) = ( 0.1689189 0.3310811 0.1689189), wk = 0.0029326 k( 250) = ( 0.1756757 0.3243243 0.1756757), wk = 0.0029326 k( 251) = ( 0.1824324 0.3175676 0.1824324), wk = 0.0029326 k( 252) = ( 0.1891892 0.3108108 0.1891892), wk = 0.0029326 k( 253) = ( 0.1959460 0.3040541 0.1959460), wk = 0.0029326 k( 254) = ( 0.2027027 0.2972973 0.2027027), wk = 0.0029326 k( 255) = ( 0.2094595 0.2905405 0.2094595), wk = 0.0029326 k( 256) = ( 0.2162162 0.2837838 0.2162162), wk = 0.0029326 k( 257) = ( 0.2229730 0.2770270 0.2229730), wk = 0.0029326 k( 258) = ( 0.2297297 0.2702703 0.2297297), wk = 0.0029326 k( 259) = ( 0.2364865 0.2635135 0.2364865), wk = 0.0029326 k( 260) = ( 0.2432432 0.2567568 0.2432432), wk = 0.0029326 k( 261) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029326 k( 262) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029326 k( 263) = ( 0.2631579 0.2631579 0.2318301), wk = 0.0029326 k( 264) = ( 0.2763158 0.2763158 0.2136603), wk = 0.0029326 k( 265) = ( 0.2894737 0.2894737 0.1954904), wk = 0.0029326 k( 266) = ( 0.3026316 0.3026316 0.1773205), wk = 0.0029326 k( 267) = ( 0.3157895 0.3157895 0.1591507), wk = 0.0029326 k( 268) = ( 0.3289474 0.3289474 0.1409808), wk = 0.0029326 k( 269) = ( 0.3421053 0.3421053 0.1228109), wk = 0.0029326 k( 270) = ( 0.3552632 0.3552632 0.1046411), wk = 0.0029326 k( 271) = ( 0.3684211 0.3684211 0.0864712), wk = 0.0029326 k( 272) = ( 0.3815789 0.3815790 0.0683013), wk = 0.0029326 k( 273) = ( 0.3947368 0.3947368 0.0501314), wk = 0.0029326 k( 274) = ( 0.4078947 0.4078947 0.0319616), wk = 0.0029326 k( 275) = ( 0.4210526 0.4210526 0.0137917), wk = 0.0029326 k( 276) = ( 0.4342105 0.4342105 -0.0043782), wk = 0.0029326 k( 277) = ( 0.4473684 0.4473684 -0.0225480), wk = 0.0029326 k( 278) = ( 0.4605263 0.4605263 -0.0407179), wk = 0.0029326 k( 279) = ( 0.4736842 0.4736842 -0.0588878), wk = 0.0029326 k( 280) = ( 0.4868421 0.4868421 -0.0770576), wk = 0.0029326 k( 281) = ( 0.5000000 0.5000000 -0.0952275), wk = 0.0029326 k( 282) = ( 0.5000000 0.5000000 -0.0952275), wk = 0.0029326 k( 283) = ( 0.5000000 0.5000000 -0.1048649), wk = 0.0029326 k( 284) = ( 0.5000000 0.5000000 -0.1145024), wk = 0.0029326 k( 285) = ( 0.5000000 0.5000000 -0.1241398), wk = 0.0029326 k( 286) = ( 0.5000000 0.5000000 -0.1337773), wk = 0.0029326 k( 287) = ( 0.5000000 0.5000000 -0.1434147), wk = 0.0029326 k( 288) = ( 0.5000000 0.5000000 -0.1530521), wk = 0.0029326 k( 289) = ( 0.5000000 0.5000000 -0.1626896), wk = 0.0029326 k( 290) = ( 0.5000000 0.5000000 -0.1723270), wk = 0.0029326 k( 291) = ( 0.5000000 0.5000000 -0.1819645), wk = 0.0029326 k( 292) = ( 0.5000000 0.5000000 -0.1916019), wk = 0.0029326 k( 293) = ( 0.5000000 0.5000000 -0.2012394), wk = 0.0029326 k( 294) = ( 0.5000000 0.5000000 -0.2108768), wk = 0.0029326 k( 295) = ( 0.5000000 0.5000000 -0.2205142), wk = 0.0029326 k( 296) = ( 0.5000000 0.5000000 -0.2301517), wk = 0.0029326 k( 297) = ( 0.5000000 0.5000000 -0.2397891), wk = 0.0029326 k( 298) = ( 0.5000000 0.5000000 -0.2494266), wk = 0.0029326 k( 299) = ( 0.5000000 0.5000000 -0.2590640), wk = 0.0029326 k( 300) = ( 0.5000000 0.5000000 -0.2687014), wk = 0.0029326 k( 301) = ( 0.5000000 0.5000000 -0.2783389), wk = 0.0029326 k( 302) = ( 0.5000000 0.5000000 -0.2879763), wk = 0.0029326 k( 303) = ( 0.5000000 0.5000000 -0.2976138), wk = 0.0029326 k( 304) = ( 0.5000000 0.5000000 -0.3072512), wk = 0.0029326 k( 305) = ( 0.5000000 0.5000000 -0.3168886), wk = 0.0029326 k( 306) = ( 0.5000000 0.5000000 -0.3265261), wk = 0.0029326 k( 307) = ( 0.5000000 0.5000000 -0.3361635), wk = 0.0029326 k( 308) = ( 0.5000000 0.5000000 -0.3458010), wk = 0.0029326 k( 309) = ( 0.5000000 0.5000000 -0.3554384), wk = 0.0029326 k( 310) = ( 0.5000000 0.5000000 -0.3650758), wk = 0.0029326 k( 311) = ( 0.5000000 0.5000000 -0.3747133), wk = 0.0029326 k( 312) = ( 0.5000000 0.5000000 -0.3843507), wk = 0.0029326 k( 313) = ( 0.5000000 0.5000000 -0.3939882), wk = 0.0029326 k( 314) = ( 0.5000000 0.5000000 -0.4036256), wk = 0.0029326 k( 315) = ( 0.5000000 0.5000000 -0.4132630), wk = 0.0029326 k( 316) = ( 0.5000000 0.5000000 -0.4229005), wk = 0.0029326 k( 317) = ( 0.5000000 0.5000000 -0.4325379), wk = 0.0029326 k( 318) = ( 0.5000000 0.5000000 -0.4421754), wk = 0.0029326 k( 319) = ( 0.5000000 0.5000000 -0.4518128), wk = 0.0029326 k( 320) = ( 0.5000000 0.5000000 -0.4614502), wk = 0.0029326 k( 321) = ( 0.5000000 0.5000000 -0.4710877), wk = 0.0029326 k( 322) = ( 0.5000000 0.5000000 -0.4807251), wk = 0.0029326 k( 323) = ( 0.5000000 0.5000000 -0.4903626), wk = 0.0029326 k( 324) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029326 k( 325) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029326 k( 326) = ( 0.0156250 0.0156250 0.4843750), wk = 0.0029326 k( 327) = ( 0.0312500 0.0312500 0.4687500), wk = 0.0029326 k( 328) = ( 0.0468750 0.0468750 0.4531250), wk = 0.0029326 k( 329) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0029326 k( 330) = ( 0.0781250 0.0781250 0.4218750), wk = 0.0029326 k( 331) = ( 0.0937500 0.0937500 0.4062500), wk = 0.0029326 k( 332) = ( 0.1093750 0.1093750 0.3906250), wk = 0.0029326 k( 333) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0029326 k( 334) = ( 0.1406250 0.1406250 0.3593750), wk = 0.0029326 k( 335) = ( 0.1562500 0.1562500 0.3437500), wk = 0.0029326 k( 336) = ( 0.1718750 0.1718750 0.3281250), wk = 0.0029326 k( 337) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0029326 k( 338) = ( 0.2031250 0.2031250 0.2968750), wk = 0.0029326 k( 339) = ( 0.2187500 0.2187500 0.2812500), wk = 0.0029326 k( 340) = ( 0.2343750 0.2343750 0.2656250), wk = 0.0029326 k( 341) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029326 Dense grid: 132957 G-vectors FFT dimensions: ( 81, 81, 81) Smooth grid: 37801 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.27 Mb ( 278, 64) NL pseudopotentials 0.36 Mb ( 139, 170) Each V/rho on FFT grid 0.30 Mb ( 19683) Each G-vector array 0.03 Mb ( 3694) G-vector shells 0.01 Mb ( 1718) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.09 Mb ( 278, 256) Each subspace H/S matrix 0.06 Mb ( 64, 64) Each matrix 0.33 Mb ( 170, 2, 64) The potential is recalculated from file : ./SrxSiPdx2.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 5.2 secs Computing kpt #: 3 total cpu time spent up to now is 5.9 secs Computing kpt #: 4 total cpu time spent up to now is 6.7 secs Computing kpt #: 5 total cpu time spent up to now is 7.5 secs Computing kpt #: 6 total cpu time spent up to now is 8.3 secs Computing kpt #: 7 total cpu time spent up to now is 9.1 secs Computing kpt #: 8 total cpu time spent up to now is 9.8 secs Computing kpt #: 9 total cpu time spent up to now is 10.6 secs Computing kpt #: 10 total cpu time spent up to now is 11.4 secs Computing kpt #: 11 total cpu time spent up to now is 12.1 secs Computing kpt #: 12 total cpu time spent up to now is 12.9 secs Computing kpt #: 13 total cpu time spent up to now is 13.9 secs Computing kpt #: 14 total cpu time spent up to now is 14.7 secs Computing kpt #: 15 total cpu time spent up to now is 15.4 secs Computing kpt #: 16 total cpu time spent up to now is 16.2 secs Computing kpt #: 17 total cpu time spent up to now is 17.0 secs Computing kpt #: 18 total cpu time spent up to now is 17.8 secs Computing kpt #: 19 total cpu time spent up to now is 18.5 secs Computing kpt #: 20 total cpu time spent up to now is 19.3 secs Computing kpt #: 21 total cpu time spent up to now is 20.1 secs Computing kpt #: 22 total cpu time spent up to now is 20.8 secs Computing kpt #: 23 total cpu time spent up to now is 21.6 secs Computing kpt #: 24 total cpu time spent up to now is 22.4 secs Computing kpt #: 25 total cpu time spent up to now is 23.2 secs Computing kpt #: 26 total cpu time spent up to now is 24.0 secs Computing kpt #: 27 total cpu time spent up to now is 24.8 secs Computing kpt #: 28 total cpu time spent up to now is 25.7 secs Computing kpt #: 29 total cpu time spent up to now is 26.5 secs Computing kpt #: 30 total cpu time spent up to now is 27.2 secs Computing kpt #: 31 total cpu time spent up to now is 28.0 secs Computing kpt #: 32 total cpu time spent up to now is 28.8 secs Computing kpt #: 33 total cpu time spent up to now is 29.5 secs Computing kpt #: 34 total cpu time spent up to now is 30.2 secs Computing kpt #: 35 total cpu time spent up to now is 31.0 secs Computing kpt #: 36 total cpu time spent up to now is 31.7 secs Computing kpt #: 37 total cpu time spent up to now is 32.4 secs Computing kpt #: 38 total cpu time spent up to now is 33.2 secs Computing kpt #: 39 total cpu time spent up to now is 33.9 secs Computing kpt #: 40 total cpu time spent up to now is 34.6 secs Computing kpt #: 41 total cpu time spent up to now is 35.3 secs Computing kpt #: 42 total cpu time spent up to now is 36.0 secs Computing kpt #: 43 total cpu time spent up to now is 36.7 secs Computing kpt #: 44 total cpu time spent up to now is 37.5 secs Computing kpt #: 45 total cpu time spent up to now is 38.2 secs Computing kpt #: 46 total cpu time spent up to now is 38.9 secs Computing kpt #: 47 total cpu time spent up to now is 39.7 secs Computing kpt #: 48 total cpu time spent up to now is 40.4 secs Computing kpt #: 49 total cpu time spent up to now is 41.1 secs Computing kpt #: 50 total cpu time spent up to now is 41.9 secs Computing kpt #: 51 total cpu time spent up to now is 42.6 secs Computing kpt #: 52 total cpu time spent up to now is 43.3 secs Computing kpt #: 53 total cpu time spent up to now is 44.1 secs Computing kpt #: 54 total cpu time spent up to now is 44.8 secs Computing kpt #: 55 total cpu time spent up to now is 45.6 secs Computing kpt #: 56 total cpu time spent up to now is 46.3 secs Computing kpt #: 57 total cpu time spent up to now is 47.0 secs Computing kpt #: 58 total cpu time spent up to now is 47.8 secs Computing kpt #: 59 total cpu time spent up to now is 48.5 secs Computing kpt #: 60 total cpu time spent up to now is 49.3 secs Computing kpt #: 61 total cpu time spent up to now is 50.0 secs Computing kpt #: 62 total cpu time spent up to now is 50.8 secs Computing kpt #: 63 total cpu time spent up to now is 51.6 secs Computing kpt #: 64 total cpu time spent up to now is 52.5 secs Computing kpt #: 65 total cpu time spent up to now is 53.3 secs Computing kpt #: 66 total cpu time spent up to now is 54.2 secs Computing kpt #: 67 total cpu time spent up to now is 55.1 secs Computing kpt #: 68 total cpu time spent up to now is 55.9 secs Computing kpt #: 69 total cpu time spent up to now is 56.7 secs Computing kpt #: 70 total cpu time spent up to now is 57.5 secs Computing kpt #: 71 total cpu time spent up to now is 58.3 secs Computing kpt #: 72 total cpu time spent up to now is 59.1 secs Computing kpt #: 73 total cpu time spent up to now is 59.9 secs Computing kpt #: 74 total cpu time spent up to now is 60.7 secs Computing kpt #: 75 total cpu time spent up to now is 61.5 secs Computing kpt #: 76 total cpu time spent up to now is 62.3 secs Computing kpt #: 77 total cpu time spent up to now is 63.1 secs Computing kpt #: 78 total cpu time spent up to now is 63.8 secs Computing kpt #: 79 total cpu time spent up to now is 64.6 secs Computing kpt #: 80 total cpu time spent up to now is 65.4 secs Computing kpt #: 81 total cpu time spent up to now is 66.2 secs Computing kpt #: 82 total cpu time spent up to now is 67.0 secs Computing kpt #: 83 total cpu time spent up to now is 67.7 secs Computing kpt #: 84 total cpu time spent up to now is 68.5 secs Computing kpt #: 85 total cpu time spent up to now is 69.3 secs Computing kpt #: 86 total cpu time spent up to now is 70.1 secs Computing kpt #: 87 total cpu time spent up to now is 70.9 secs Computing kpt #: 88 total cpu time spent up to now is 71.7 secs Computing kpt #: 89 total cpu time spent up to now is 72.5 secs Computing kpt #: 90 total cpu time spent up to now is 73.3 secs Computing kpt #: 91 total cpu time spent up to now is 74.1 secs Computing kpt #: 92 total cpu time spent up to now is 74.9 secs Computing kpt #: 93 total cpu time spent up to now is 75.7 secs Computing kpt #: 94 total cpu time spent up to now is 76.5 secs Computing kpt #: 95 total cpu time spent up to now is 77.3 secs Computing kpt #: 96 total cpu time spent up to now is 78.0 secs Computing kpt #: 97 total cpu time spent up to now is 78.8 secs Computing kpt #: 98 total cpu time spent up to now is 79.6 secs Computing kpt #: 99 total cpu time spent up to now is 80.4 secs Computing kpt #: 100 total cpu time spent up to now is 81.2 secs Computing kpt #: 101 total cpu time spent up to now is 82.0 secs Computing kpt #: 102 total cpu time spent up to now is 82.8 secs Computing kpt #: 103 total cpu time spent up to now is 83.6 secs Computing kpt #: 104 total cpu time spent up to now is 84.4 secs Computing kpt #: 105 total cpu time spent up to now is 85.2 secs Computing kpt #: 106 total cpu time spent up to now is 86.0 secs Computing kpt #: 107 total cpu time spent up to now is 86.8 secs Computing kpt #: 108 total cpu time spent up to now is 87.5 secs Computing kpt #: 109 total cpu time spent up to now is 88.3 secs Computing kpt #: 110 total cpu time spent up to now is 89.1 secs Computing kpt #: 111 total cpu time spent up to now is 89.9 secs Computing kpt #: 112 total cpu time spent up to now is 90.7 secs Computing kpt #: 113 total cpu time spent up to now is 91.5 secs Computing kpt #: 114 total cpu time spent up to now is 92.3 secs Computing kpt #: 115 total cpu time spent up to now is 93.1 secs Computing kpt #: 116 total cpu time spent up to now is 93.9 secs Computing kpt #: 117 total cpu time spent up to now is 94.8 secs Computing kpt #: 118 total cpu time spent up to now is 95.6 secs Computing kpt #: 119 total cpu time spent up to now is 96.4 secs Computing kpt #: 120 total cpu time spent up to now is 97.2 secs Computing kpt #: 121 total cpu time spent up to now is 98.0 secs Computing kpt #: 122 total cpu time spent up to now is 98.9 secs Computing kpt #: 123 total cpu time spent up to now is 99.7 secs Computing kpt #: 124 total cpu time spent up to now is 100.5 secs Computing kpt #: 125 total cpu time spent up to now is 101.3 secs Computing kpt #: 126 total cpu time spent up to now is 102.1 secs Computing kpt #: 127 total cpu time spent up to now is 102.9 secs Computing kpt #: 128 total cpu time spent up to now is 103.7 secs Computing kpt #: 129 total cpu time spent up to now is 104.5 secs Computing kpt #: 130 total cpu time spent up to now is 105.2 secs Computing kpt #: 131 total cpu time spent up to now is 106.0 secs Computing kpt #: 132 total cpu time spent up to now is 106.7 secs Computing kpt #: 133 total cpu time spent up to now is 107.5 secs Computing kpt #: 134 total cpu time spent up to now is 108.3 secs Computing kpt #: 135 total cpu time spent up to now is 109.0 secs Computing kpt #: 136 total cpu time spent up to now is 109.7 secs Computing kpt #: 137 total cpu time spent up to now is 110.5 secs Computing kpt #: 138 total cpu time spent up to now is 111.2 secs Computing kpt #: 139 total cpu time spent up to now is 111.9 secs Computing kpt #: 140 total cpu time spent up to now is 112.6 secs Computing kpt #: 141 total cpu time spent up to now is 113.4 secs Computing kpt #: 142 total cpu time spent up to now is 114.1 secs Computing kpt #: 143 total cpu time spent up to now is 114.9 secs Computing kpt #: 144 total cpu time spent up to now is 115.6 secs Computing kpt #: 145 total cpu time spent up to now is 116.3 secs Computing kpt #: 146 total cpu time spent up to now is 117.1 secs Computing kpt #: 147 total cpu time spent up to now is 117.8 secs Computing kpt #: 148 total cpu time spent up to now is 118.6 secs Computing kpt #: 149 total cpu time spent up to now is 119.3 secs Computing kpt #: 150 total cpu time spent up to now is 120.1 secs Computing kpt #: 151 total cpu time spent up to now is 120.8 secs Computing kpt #: 152 total cpu time spent up to now is 121.6 secs Computing kpt #: 153 total cpu time spent up to now is 122.4 secs Computing kpt #: 154 total cpu time spent up to now is 123.3 secs Computing kpt #: 155 total cpu time spent up to now is 124.2 secs Computing kpt #: 156 total cpu time spent up to now is 125.1 secs Computing kpt #: 157 total cpu time spent up to now is 125.9 secs Computing kpt #: 158 total cpu time spent up to now is 126.8 secs Computing kpt #: 159 total cpu time spent up to now is 127.7 secs Computing kpt #: 160 total cpu time spent up to now is 128.6 secs Computing kpt #: 161 total cpu time spent up to now is 129.4 secs Computing kpt #: 162 total cpu time spent up to now is 130.3 secs Computing kpt #: 163 total cpu time spent up to now is 131.1 secs Computing kpt #: 164 total cpu time spent up to now is 132.0 secs Computing kpt #: 165 total cpu time spent up to now is 132.8 secs Computing kpt #: 166 total cpu time spent up to now is 133.7 secs Computing kpt #: 167 total cpu time spent up to now is 134.5 secs Computing kpt #: 168 total cpu time spent up to now is 135.3 secs Computing kpt #: 169 total cpu time spent up to now is 136.1 secs Computing kpt #: 170 total cpu time spent up to now is 136.9 secs Computing kpt #: 171 total cpu time spent up to now is 137.7 secs Computing kpt #: 172 total cpu time spent up to now is 138.5 secs Computing kpt #: 173 total cpu time spent up to now is 139.3 secs Computing kpt #: 174 total cpu time spent up to now is 140.2 secs Computing kpt #: 175 total cpu time spent up to now is 141.0 secs Computing kpt #: 176 total cpu time spent up to now is 142.0 secs Computing kpt #: 177 total cpu time spent up to now is 142.8 secs Computing kpt #: 178 total cpu time spent up to now is 143.6 secs Computing kpt #: 179 total cpu time spent up to now is 144.5 secs Computing kpt #: 180 total cpu time spent up to now is 145.3 secs Computing kpt #: 181 total cpu time spent up to now is 146.2 secs Computing kpt #: 182 total cpu time spent up to now is 147.0 secs Computing kpt #: 183 total cpu time spent up to now is 147.9 secs Computing kpt #: 184 total cpu time spent up to now is 148.7 secs Computing kpt #: 185 total cpu time spent up to now is 149.5 secs Computing kpt #: 186 total cpu time spent up to now is 150.4 secs Computing kpt #: 187 total cpu time spent up to now is 151.2 secs Computing kpt #: 188 total cpu time spent up to now is 152.0 secs Computing kpt #: 189 total cpu time spent up to now is 152.9 secs Computing kpt #: 190 total cpu time spent up to now is 153.7 secs Computing kpt #: 191 total cpu time spent up to now is 154.5 secs Computing kpt #: 192 total cpu time spent up to now is 155.3 secs Computing kpt #: 193 total cpu time spent up to now is 156.1 secs Computing kpt #: 194 total cpu time spent up to now is 156.9 secs Computing kpt #: 195 total cpu time spent up to now is 157.7 secs Computing kpt #: 196 total cpu time spent up to now is 158.5 secs Computing kpt #: 197 total cpu time spent up to now is 159.4 secs Computing kpt #: 198 total cpu time spent up to now is 160.2 secs Computing kpt #: 199 total cpu time spent up to now is 161.0 secs Computing kpt #: 200 total cpu time spent up to now is 161.8 secs Computing kpt #: 201 total cpu time spent up to now is 162.6 secs Computing kpt #: 202 total cpu time spent up to now is 163.4 secs Computing kpt #: 203 total cpu time spent up to now is 164.2 secs Computing kpt #: 204 total cpu time spent up to now is 165.0 secs Computing kpt #: 205 total cpu time spent up to now is 165.8 secs Computing kpt #: 206 total cpu time spent up to now is 166.6 secs Computing kpt #: 207 total cpu time spent up to now is 167.4 secs Computing kpt #: 208 total cpu time spent up to now is 168.2 secs Computing kpt #: 209 total cpu time spent up to now is 168.9 secs Computing kpt #: 210 total cpu time spent up to now is 169.7 secs Computing kpt #: 211 total cpu time spent up to now is 170.5 secs Computing kpt #: 212 total cpu time spent up to now is 171.2 secs Computing kpt #: 213 total cpu time spent up to now is 172.0 secs Computing kpt #: 214 total cpu time spent up to now is 172.7 secs Computing kpt #: 215 total cpu time spent up to now is 173.5 secs Computing kpt #: 216 total cpu time spent up to now is 174.3 secs Computing kpt #: 217 total cpu time spent up to now is 175.0 secs Computing kpt #: 218 total cpu time spent up to now is 175.8 secs Computing kpt #: 219 total cpu time spent up to now is 176.6 secs Computing kpt #: 220 total cpu time spent up to now is 177.3 secs Computing kpt #: 221 total cpu time spent up to now is 178.1 secs Computing kpt #: 222 total cpu time spent up to now is 178.9 secs Computing kpt #: 223 total cpu time spent up to now is 179.6 secs Computing kpt #: 224 total cpu time spent up to now is 180.4 secs Computing kpt #: 225 total cpu time spent up to now is 181.1 secs Computing kpt #: 226 total cpu time spent up to now is 181.9 secs Computing kpt #: 227 total cpu time spent up to now is 182.7 secs Computing kpt #: 228 total cpu time spent up to now is 183.5 secs Computing kpt #: 229 total cpu time spent up to now is 184.3 secs Computing kpt #: 230 total cpu time spent up to now is 185.1 secs Computing kpt #: 231 total cpu time spent up to now is 185.9 secs Computing kpt #: 232 total cpu time spent up to now is 186.7 secs Computing kpt #: 233 total cpu time spent up to now is 187.5 secs Computing kpt #: 234 total cpu time spent up to now is 188.3 secs Computing kpt #: 235 total cpu time spent up to now is 189.0 secs Computing kpt #: 236 total cpu time spent up to now is 189.8 secs Computing kpt #: 237 total cpu time spent up to now is 190.6 secs Computing kpt #: 238 total cpu time spent up to now is 191.4 secs Computing kpt #: 239 total cpu time spent up to now is 192.2 secs Computing kpt #: 240 total cpu time spent up to now is 193.1 secs Computing kpt #: 241 total cpu time spent up to now is 193.9 secs Computing kpt #: 242 total cpu time spent up to now is 194.7 secs Computing kpt #: 243 total cpu time spent up to now is 195.4 secs Computing kpt #: 244 total cpu time spent up to now is 196.2 secs Computing kpt #: 245 total cpu time spent up to now is 196.9 secs Computing kpt #: 246 total cpu time spent up to now is 197.7 secs Computing kpt #: 247 total cpu time spent up to now is 198.5 secs Computing kpt #: 248 total cpu time spent up to now is 199.3 secs Computing kpt #: 249 total cpu time spent up to now is 200.1 secs Computing kpt #: 250 total cpu time spent up to now is 200.9 secs Computing kpt #: 251 total cpu time spent up to now is 201.7 secs Computing kpt #: 252 total cpu time spent up to now is 202.5 secs Computing kpt #: 253 total cpu time spent up to now is 203.3 secs Computing kpt #: 254 total cpu time spent up to now is 204.3 secs Computing kpt #: 255 total cpu time spent up to now is 205.1 secs Computing kpt #: 256 total cpu time spent up to now is 206.0 secs Computing kpt #: 257 total cpu time spent up to now is 207.0 secs Computing kpt #: 258 total cpu time spent up to now is 207.9 secs Computing kpt #: 259 total cpu time spent up to now is 208.8 secs Computing kpt #: 260 total cpu time spent up to now is 209.8 secs Computing kpt #: 261 total cpu time spent up to now is 210.9 secs Computing kpt #: 262 total cpu time spent up to now is 212.0 secs Computing kpt #: 263 total cpu time spent up to now is 212.8 secs Computing kpt #: 264 total cpu time spent up to now is 213.6 secs Computing kpt #: 265 total cpu time spent up to now is 214.4 secs Computing kpt #: 266 total cpu time spent up to now is 215.1 secs Computing kpt #: 267 total cpu time spent up to now is 215.9 secs Computing kpt #: 268 total cpu time spent up to now is 216.6 secs Computing kpt #: 269 total cpu time spent up to now is 217.4 secs Computing kpt #: 270 total cpu time spent up to now is 218.1 secs Computing kpt #: 271 total cpu time spent up to now is 218.9 secs Computing kpt #: 272 total cpu time spent up to now is 219.7 secs Computing kpt #: 273 total cpu time spent up to now is 220.5 secs Computing kpt #: 274 total cpu time spent up to now is 221.2 secs Computing kpt #: 275 total cpu time spent up to now is 222.0 secs Computing kpt #: 276 total cpu time spent up to now is 222.8 secs Computing kpt #: 277 total cpu time spent up to now is 223.5 secs Computing kpt #: 278 total cpu time spent up to now is 224.3 secs Computing kpt #: 279 total cpu time spent up to now is 225.1 secs Computing kpt #: 280 total cpu time spent up to now is 225.9 secs Computing kpt #: 281 total cpu time spent up to now is 226.7 secs Computing kpt #: 282 total cpu time spent up to now is 227.5 secs Computing kpt #: 283 total cpu time spent up to now is 228.4 secs Computing kpt #: 284 total cpu time spent up to now is 229.2 secs Computing kpt #: 285 total cpu time spent up to now is 230.0 secs Computing kpt #: 286 total cpu time spent up to now is 230.8 secs Computing kpt #: 287 total cpu time spent up to now is 231.7 secs Computing kpt #: 288 total cpu time spent up to now is 232.5 secs Computing kpt #: 289 total cpu time spent up to now is 233.3 secs Computing kpt #: 290 total cpu time spent up to now is 234.1 secs Computing kpt #: 291 total cpu time spent up to now is 234.9 secs Computing kpt #: 292 total cpu time spent up to now is 235.7 secs Computing kpt #: 293 total cpu time spent up to now is 236.6 secs Computing kpt #: 294 total cpu time spent up to now is 237.4 secs Computing kpt #: 295 total cpu time spent up to now is 238.2 secs Computing kpt #: 296 total cpu time spent up to now is 239.1 secs Computing kpt #: 297 total cpu time spent up to now is 239.9 secs Computing kpt #: 298 total cpu time spent up to now is 240.6 secs Computing kpt #: 299 total cpu time spent up to now is 241.4 secs Computing kpt #: 300 total cpu time spent up to now is 242.2 secs Computing kpt #: 301 total cpu time spent up to now is 243.0 secs Computing kpt #: 302 total cpu time spent up to now is 243.8 secs Computing kpt #: 303 total cpu time spent up to now is 244.5 secs Computing kpt #: 304 total cpu time spent up to now is 245.3 secs Computing kpt #: 305 total cpu time spent up to now is 246.1 secs Computing kpt #: 306 total cpu time spent up to now is 246.9 secs Computing kpt #: 307 total cpu time spent up to now is 247.6 secs Computing kpt #: 308 total cpu time spent up to now is 248.4 secs Computing kpt #: 309 total cpu time spent up to now is 249.2 secs Computing kpt #: 310 total cpu time spent up to now is 250.0 secs Computing kpt #: 311 total cpu time spent up to now is 250.8 secs Computing kpt #: 312 total cpu time spent up to now is 251.6 secs Computing kpt #: 313 total cpu time spent up to now is 252.4 secs Computing kpt #: 314 total cpu time spent up to now is 253.2 secs Computing kpt #: 315 total cpu time spent up to now is 254.0 secs Computing kpt #: 316 total cpu time spent up to now is 254.9 secs Computing kpt #: 317 total cpu time spent up to now is 255.8 secs Computing kpt #: 318 total cpu time spent up to now is 256.6 secs Computing kpt #: 319 total cpu time spent up to now is 257.5 secs Computing kpt #: 320 total cpu time spent up to now is 258.3 secs Computing kpt #: 321 total cpu time spent up to now is 259.2 secs Computing kpt #: 322 total cpu time spent up to now is 260.0 secs Computing kpt #: 323 total cpu time spent up to now is 261.0 secs Computing kpt #: 324 total cpu time spent up to now is 261.8 secs Computing kpt #: 325 total cpu time spent up to now is 262.5 secs Computing kpt #: 326 total cpu time spent up to now is 263.2 secs Computing kpt #: 327 total cpu time spent up to now is 263.9 secs Computing kpt #: 328 total cpu time spent up to now is 264.7 secs Computing kpt #: 329 total cpu time spent up to now is 265.4 secs Computing kpt #: 330 total cpu time spent up to now is 266.1 secs Computing kpt #: 331 total cpu time spent up to now is 266.9 secs Computing kpt #: 332 total cpu time spent up to now is 267.6 secs Computing kpt #: 333 total cpu time spent up to now is 268.4 secs Computing kpt #: 334 total cpu time spent up to now is 269.1 secs Computing kpt #: 335 total cpu time spent up to now is 269.9 secs Computing kpt #: 336 total cpu time spent up to now is 270.6 secs Computing kpt #: 337 total cpu time spent up to now is 271.4 secs Computing kpt #: 338 total cpu time spent up to now is 272.1 secs Computing kpt #: 339 total cpu time spent up to now is 272.9 secs Computing kpt #: 340 total cpu time spent up to now is 273.7 secs Computing kpt #: 341 total cpu time spent up to now is 275.6 secs ethr = 1.85E-08, avg # of iterations = 17.5 total cpu time spent up to now is 275.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4739 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5370 -4.5370 -3.4318 -3.4318 -3.3935 -3.3935 2.6622 2.6622 5.3868 5.3868 7.1600 7.1600 8.1569 8.1569 8.2036 8.2036 8.2687 8.2687 9.5507 9.5507 9.7042 9.7042 10.0941 10.0941 10.2958 10.2958 10.3755 10.3755 10.8564 10.8564 11.3009 11.3009 11.9183 11.9183 12.0477 12.0477 13.7086 13.7086 14.5258 14.5258 14.5384 14.5384 16.8167 16.8167 17.2069 17.2069 k = 0.0000 0.0000 0.0183 ( 4735 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5370 -4.5370 -3.4319 -3.4319 -3.3937 -3.3937 2.6636 2.6636 5.3872 5.3872 7.1613 7.1613 8.1541 8.1541 8.2055 8.2055 8.2701 8.2701 9.5485 9.5485 9.7012 9.7012 10.0935 10.0935 10.2997 10.2997 10.3755 10.3755 10.8559 10.8559 11.2921 11.2921 11.9210 11.9210 12.0493 12.0493 13.6995 13.6995 14.5222 14.5222 14.5461 14.5461 16.8236 16.8236 17.2134 17.2134 k = 0.0000 0.0000 0.0366 ( 4725 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5096 -36.5096 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6506 -21.6506 -4.5372 -4.5372 -3.4320 -3.4320 -3.3942 -3.3942 2.6681 2.6681 5.3885 5.3885 7.1651 7.1651 8.1467 8.1467 8.2102 8.2102 8.2743 8.2743 9.5418 9.5418 9.6929 9.6929 10.0919 10.0919 10.3100 10.3100 10.3763 10.3763 10.8541 10.8541 11.2667 11.2667 11.9283 11.9283 12.0543 12.0543 13.6734 13.6734 14.5008 14.5008 14.5789 14.5789 16.8440 16.8440 17.2306 17.2306 k = 0.0000 0.0000 0.0549 ( 4721 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9451 -40.9451 -40.9140 -40.9140 -36.5094 -36.5094 -36.4560 -36.4560 -36.4427 -36.4427 -36.4359 -36.4359 -21.6505 -21.6505 -4.5376 -4.5376 -3.4322 -3.4322 -3.3950 -3.3950 2.6754 2.6754 5.3906 5.3906 7.1714 7.1714 8.1360 8.1360 8.2167 8.2167 8.2808 8.2808 9.5300 9.5300 9.6810 9.6810 10.0891 10.0891 10.3217 10.3217 10.3817 10.3817 10.8510 10.8510 11.2268 11.2268 11.9378 11.9378 12.0630 12.0630 13.6340 13.6340 14.4647 14.4647 14.6313 14.6313 16.8777 16.8777 17.2524 17.2524 k = 0.0000 0.0000 0.0732 ( 4715 PWs) bands (ev): -72.1112 -72.1112 -72.1026 -72.1026 -40.9450 -40.9450 -40.9141 -40.9141 -36.5092 -36.5092 -36.4559 -36.4559 -36.4429 -36.4429 -36.4361 -36.4361 -21.6504 -21.6504 -4.5381 -4.5381 -3.4325 -3.4325 -3.3961 -3.3961 2.6857 2.6857 5.3936 5.3936 7.1802 7.1802 8.1230 8.1230 8.2244 8.2244 8.2893 8.2893 9.5123 9.5123 9.6679 9.6679 10.0852 10.0852 10.3270 10.3270 10.3977 10.3977 10.8465 10.8465 11.1753 11.1753 11.9476 11.9476 12.0753 12.0753 13.5852 13.5852 14.4167 14.4167 14.6988 14.6988 16.9245 16.9245 17.2728 17.2728 k = 0.0000 0.0000 0.0915 ( 4712 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9449 -40.9449 -40.9142 -40.9142 -36.5089 -36.5089 -36.4559 -36.4559 -36.4431 -36.4431 -36.4362 -36.4362 -21.6503 -21.6503 -4.5388 -4.5388 -3.4329 -3.4329 -3.3976 -3.3976 2.6988 2.6988 5.3974 5.3974 7.1914 7.1914 8.1083 8.1083 8.2334 8.2334 8.2995 8.2995 9.4886 9.4886 9.6551 9.6551 10.0803 10.0803 10.3234 10.3234 10.4248 10.4248 10.8403 10.8403 11.1150 11.1150 11.9559 11.9559 12.0908 12.0908 13.5301 13.5301 14.3590 14.3590 14.7777 14.7777 16.9839 16.9839 17.2896 17.2896 k = 0.0000 0.0000 0.1098 ( 4720 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9447 -40.9447 -40.9144 -40.9144 -36.5085 -36.5085 -36.4558 -36.4558 -36.4434 -36.4434 -36.4363 -36.4363 -21.6502 -21.6502 -4.5395 -4.5395 -3.4334 -3.4334 -3.3993 -3.3993 2.7147 2.7147 5.4019 5.4019 7.2048 7.2048 8.0922 8.0922 8.2436 8.2436 8.3110 8.3110 9.4595 9.4595 9.6434 9.6434 10.0743 10.0743 10.3143 10.3143 10.4587 10.4587 10.8316 10.8316 11.0487 11.0487 11.9625 11.9625 12.1084 12.1084 13.4713 13.4713 14.2940 14.2940 14.8655 14.8655 17.0553 17.0553 17.3036 17.3036 k = 0.0000 0.0000 0.1282 ( 4728 PWs) bands (ev): -72.1111 -72.1111 -72.1027 -72.1027 -40.9445 -40.9445 -40.9145 -40.9145 -36.5081 -36.5081 -36.4558 -36.4558 -36.4438 -36.4438 -36.4365 -36.4365 -21.6501 -21.6501 -4.5405 -4.5405 -3.4340 -3.4340 -3.4013 -3.4013 2.7333 2.7333 5.4072 5.4072 7.2203 7.2203 8.0749 8.0749 8.2551 8.2551 8.3237 8.3237 9.4261 9.4261 9.6327 9.6327 10.0673 10.0673 10.3014 10.3014 10.4957 10.4957 10.8188 10.8188 10.9803 10.9803 11.9674 11.9674 12.1270 12.1270 13.4105 13.4105 14.2237 14.2237 14.9605 14.9605 17.1380 17.1380 17.3161 17.3161 k = 0.0000 0.0000 0.1465 ( 4726 PWs) bands (ev): -72.1110 -72.1110 -72.1028 -72.1028 -40.9443 -40.9443 -40.9148 -40.9148 -36.5076 -36.5076 -36.4557 -36.4557 -36.4443 -36.4443 -36.4366 -36.4366 -21.6500 -21.6500 -4.5415 -4.5415 -3.4347 -3.4347 -3.4036 -3.4036 2.7546 2.7546 5.4134 5.4134 7.2378 7.2378 8.0568 8.0568 8.2680 8.2680 8.3376 8.3376 9.3896 9.3896 9.6223 9.6223 10.0593 10.0593 10.2856 10.2856 10.5339 10.5339 10.7973 10.7973 10.9163 10.9163 11.9713 11.9713 12.1455 12.1455 13.3487 13.3487 14.1501 14.1501 15.0615 15.0615 17.2315 17.2315 17.3281 17.3281 k = 0.0000 0.0000 0.1648 ( 4734 PWs) bands (ev): -72.1109 -72.1109 -72.1028 -72.1028 -40.9441 -40.9441 -40.9150 -40.9150 -36.5071 -36.5071 -36.4556 -36.4556 -36.4448 -36.4448 -36.4367 -36.4367 -21.6498 -21.6498 -4.5427 -4.5427 -3.4354 -3.4354 -3.4061 -3.4061 2.7785 2.7785 5.4202 5.4202 7.2569 7.2569 8.0380 8.0380 8.2823 8.2823 8.3526 8.3526 9.3512 9.3512 9.6114 9.6114 10.0504 10.0504 10.2673 10.2673 10.5713 10.5713 10.7575 10.7575 10.8683 10.8683 11.9743 11.9743 12.1632 12.1632 13.2868 13.2868 14.0748 14.0748 15.1676 15.1676 17.3341 17.3341 17.3408 17.3408 k = 0.0000 0.0000 0.1831 ( 4738 PWs) bands (ev): -72.1109 -72.1109 -72.1029 -72.1029 -40.9439 -40.9439 -40.9153 -40.9153 -36.5065 -36.5065 -36.4555 -36.4555 -36.4455 -36.4455 -36.4368 -36.4368 -21.6496 -21.6496 -4.5439 -4.5439 -3.4363 -3.4363 -3.4088 -3.4088 2.8048 2.8048 5.4278 5.4278 7.2775 7.2775 8.0188 8.0188 8.2980 8.2980 8.3686 8.3686 9.3118 9.3118 9.5993 9.5993 10.0406 10.0406 10.2467 10.2467 10.6039 10.6039 10.6998 10.6998 10.8404 10.8404 11.9770 11.9770 12.1797 12.1797 13.2253 13.2253 13.9991 13.9991 15.2782 15.2782 17.3523 17.3523 17.4475 17.4475 k = 0.0000 0.0000 0.2014 ( 4742 PWs) bands (ev): -72.1108 -72.1108 -72.1030 -72.1030 -40.9436 -40.9436 -40.9155 -40.9155 -36.5059 -36.5059 -36.4554 -36.4554 -36.4462 -36.4462 -36.4369 -36.4369 -21.6494 -21.6494 -4.5453 -4.5453 -3.4372 -3.4372 -3.4116 -3.4116 2.8334 2.8334 5.4360 5.4360 7.2990 7.2990 7.9998 7.9998 8.3151 8.3151 8.3857 8.3857 9.2721 9.2721 9.5851 9.5851 10.0300 10.0300 10.2235 10.2235 10.6005 10.6005 10.6655 10.6655 10.8233 10.8233 11.9795 11.9795 12.1945 12.1945 13.1645 13.1645 13.9241 13.9241 15.3929 15.3929 17.3652 17.3652 17.5685 17.5685 k = 0.0000 0.0000 0.2197 ( 4738 PWs) bands (ev): -72.1107 -72.1107 -72.1031 -72.1031 -40.9433 -40.9433 -40.9159 -40.9159 -36.5052 -36.5052 -36.4552 -36.4552 -36.4471 -36.4471 -36.4369 -36.4369 -21.6492 -21.6492 -4.5468 -4.5468 -3.4383 -3.4383 -3.4146 -3.4146 2.8643 2.8643 5.4449 5.4449 7.3211 7.3211 7.9814 7.9814 8.3335 8.3335 8.4040 8.4040 9.2326 9.2326 9.5681 9.5681 10.0187 10.0187 10.1980 10.1980 10.5373 10.5373 10.6847 10.6847 10.8120 10.8120 11.9821 11.9821 12.2078 12.2078 13.1045 13.1045 13.8508 13.8508 15.5113 15.5113 17.3786 17.3786 17.6960 17.6960 k = 0.0000 0.0000 0.2380 ( 4742 PWs) bands (ev): -72.1106 -72.1106 -72.1032 -72.1032 -40.9430 -40.9430 -40.9162 -40.9162 -36.5045 -36.5045 -36.4550 -36.4550 -36.4481 -36.4481 -36.4369 -36.4369 -21.6489 -21.6489 -4.5484 -4.5484 -3.4395 -3.4395 -3.4178 -3.4178 2.8972 2.8972 5.4544 5.4544 7.3431 7.3431 7.9643 7.9643 8.3532 8.3532 8.4233 8.4233 9.1938 9.1938 9.5471 9.5471 10.0067 10.0067 10.1698 10.1698 10.4674 10.4674 10.7040 10.7040 10.8074 10.8074 11.9849 11.9849 12.2194 12.2194 13.0456 13.0456 13.7799 13.7799 15.6330 15.6330 17.3926 17.3926 17.6638 17.6638 k = 0.0000 0.0000 0.2563 ( 4742 PWs) bands (ev): -72.1105 -72.1105 -72.1032 -72.1032 -40.9426 -40.9426 -40.9165 -40.9165 -36.5038 -36.5038 -36.4548 -36.4548 -36.4491 -36.4491 -36.4368 -36.4368 -21.6487 -21.6487 -4.5500 -4.5500 -3.4408 -3.4408 -3.4209 -3.4209 2.9320 2.9320 5.4645 5.4645 7.3643 7.3643 7.9493 7.9493 8.3740 8.3740 8.4437 8.4437 9.1560 9.1560 9.5211 9.5211 9.9941 9.9941 10.1390 10.1390 10.4010 10.4010 10.7111 10.7111 10.8131 10.8131 11.9880 11.9880 12.2295 12.2295 12.9878 12.9878 13.7118 13.7118 15.7580 15.7580 17.4071 17.4071 17.6329 17.6329 k = 0.0000 0.0000 0.2746 ( 4744 PWs) bands (ev): -72.1104 -72.1104 -72.1033 -72.1033 -40.9423 -40.9423 -40.9169 -40.9169 -36.5031 -36.5031 -36.4546 -36.4546 -36.4502 -36.4502 -36.4367 -36.4367 -21.6484 -21.6484 -4.5518 -4.5518 -3.4423 -3.4423 -3.4241 -3.4241 2.9686 2.9686 5.4751 5.4751 7.3837 7.3837 7.9374 7.9374 8.3959 8.3959 8.4652 8.4652 9.1195 9.1195 9.4891 9.4891 9.9810 9.9810 10.1059 10.1059 10.3409 10.3409 10.7051 10.7051 10.8282 10.8282 11.9916 11.9916 12.2380 12.2380 12.9312 12.9312 13.6470 13.6470 15.8859 15.8859 17.4220 17.4220 17.6063 17.6063 k = 0.0000 0.0000 0.2929 ( 4740 PWs) bands (ev): -72.1103 -72.1103 -72.1034 -72.1034 -40.9419 -40.9419 -40.9173 -40.9173 -36.5023 -36.5023 -36.4543 -36.4543 -36.4514 -36.4514 -36.4367 -36.4367 -21.6481 -21.6481 -4.5536 -4.5536 -3.4441 -3.4441 -3.4271 -3.4271 3.0068 3.0068 5.4862 5.4862 7.4003 7.4003 7.9297 7.9297 8.4188 8.4188 8.4879 8.4879 9.0845 9.0845 9.4501 9.4501 9.9674 9.9674 10.0712 10.0712 10.2883 10.2883 10.6908 10.6908 10.8471 10.8471 11.9958 11.9958 12.2452 12.2452 12.8757 12.8757 13.5858 13.5858 16.0167 16.0167 17.4371 17.4371 17.5846 17.5846 k = 0.0000 0.0000 0.3112 ( 4744 PWs) bands (ev): -72.1102 -72.1102 -72.1035 -72.1035 -40.9415 -40.9415 -40.9177 -40.9177 -36.5015 -36.5015 -36.4541 -36.4541 -36.4526 -36.4526 -36.4365 -36.4365 -21.6478 -21.6478 -4.5554 -4.5554 -3.4461 -3.4461 -3.4300 -3.4300 3.0464 3.0464 5.4978 5.4978 7.4132 7.4132 7.9273 7.9273 8.4424 8.4424 8.5117 8.5117 9.0512 9.0512 9.4036 9.4036 9.9530 9.9530 10.0364 10.0364 10.2431 10.2431 10.6718 10.6718 10.8657 10.8657 12.0006 12.0006 12.2510 12.2510 12.8213 12.8213 13.5282 13.5282 16.1502 16.1502 17.4524 17.4524 17.5684 17.5684 k = 0.0000 0.0000 0.3295 ( 4748 PWs) bands (ev): -72.1101 -72.1101 -72.1037 -72.1037 -40.9411 -40.9411 -40.9181 -40.9181 -36.5007 -36.5007 -36.4540 -36.4540 -36.4537 -36.4537 -36.4364 -36.4364 -21.6475 -21.6475 -4.5574 -4.5574 -3.4484 -3.4484 -3.4327 -3.4327 3.0871 3.0871 5.5097 5.5097 7.4214 7.4214 7.9311 7.9311 8.4667 8.4667 8.5368 8.5368 9.0197 9.0197 9.3496 9.3496 9.9375 9.9375 10.0037 10.0037 10.2045 10.2045 10.6497 10.6497 10.8821 10.8821 12.0060 12.0060 12.2557 12.2557 12.7680 12.7680 13.4742 13.4742 16.2861 16.2861 17.4674 17.4674 17.5583 17.5583 k = 0.0000 0.0000 0.3478 ( 4736 PWs) bands (ev): -72.1100 -72.1100 -72.1038 -72.1038 -40.9407 -40.9407 -40.9186 -40.9186 -36.4999 -36.4999 -36.4553 -36.4553 -36.4534 -36.4534 -36.4363 -36.4363 -21.6472 -21.6472 -4.5593 -4.5593 -3.4511 -3.4511 -3.4351 -3.4351 3.1289 3.1289 5.5219 5.5219 7.4245 7.4245 7.9418 7.9418 8.4913 8.4913 8.5630 8.5630 8.9906 8.9906 9.2885 9.2885 9.9201 9.9201 9.9749 9.9749 10.1716 10.1716 10.6253 10.6253 10.8953 10.8953 12.0123 12.0123 12.2593 12.2593 12.7157 12.7157 13.4239 13.4239 16.4243 16.4243 17.4818 17.4818 17.5545 17.5545 k = 0.0000 0.0000 0.3662 ( 4724 PWs) bands (ev): -72.1098 -72.1098 -72.1039 -72.1039 -40.9402 -40.9402 -40.9190 -40.9190 -36.4991 -36.4991 -36.4567 -36.4567 -36.4530 -36.4530 -36.4361 -36.4361 -21.6469 -21.6469 -4.5613 -4.5613 -3.4540 -3.4540 -3.4373 -3.4373 3.1714 3.1714 5.5345 5.5345 7.4226 7.4226 7.9593 7.9593 8.5160 8.5160 8.5903 8.5903 8.9638 8.9638 9.2216 9.2216 9.9001 9.9001 9.9515 9.9515 10.1431 10.1431 10.5991 10.5991 10.9048 10.9048 12.0194 12.0194 12.2621 12.2621 12.6644 12.6644 13.3770 13.3770 16.5646 16.5646 17.4955 17.4955 17.5574 17.5574 k = 0.0000 0.0000 0.3845 ( 4732 PWs) bands (ev): -72.1097 -72.1097 -72.1040 -72.1040 -40.9398 -40.9398 -40.9195 -40.9195 -36.4983 -36.4983 -36.4582 -36.4582 -36.4526 -36.4526 -36.4359 -36.4359 -21.6466 -21.6466 -4.5633 -4.5633 -3.4572 -3.4572 -3.4392 -3.4392 3.2144 3.2144 5.5472 5.5472 7.4162 7.4162 7.9831 7.9831 8.5402 8.5402 8.6187 8.6187 8.9395 8.9395 9.1503 9.1503 9.8775 9.8775 9.9330 9.9330 10.1183 10.1183 10.5713 10.5713 10.9101 10.9101 12.0273 12.0273 12.2639 12.2639 12.6140 12.6140 13.3332 13.3332 16.7069 16.7069 17.5082 17.5082 17.5663 17.5663 k = 0.0000 0.0000 0.4028 ( 4732 PWs) bands (ev): -72.1096 -72.1096 -72.1041 -72.1041 -40.9394 -40.9394 -40.9200 -40.9200 -36.4975 -36.4975 -36.4597 -36.4597 -36.4521 -36.4521 -36.4358 -36.4358 -21.6462 -21.6462 -4.5653 -4.5653 -3.4606 -3.4606 -3.4409 -3.4409 3.2577 3.2577 5.5601 5.5601 7.4063 7.4063 8.0125 8.0125 8.5636 8.5636 8.6479 8.6479 8.9178 8.9178 9.0765 9.0765 9.8540 9.8540 9.9179 9.9179 10.0968 10.0968 10.5423 10.5423 10.9112 10.9112 12.0360 12.0360 12.2651 12.2651 12.5645 12.5645 13.2922 13.2922 16.8508 16.8508 17.5196 17.5196 17.5807 17.5807 k = 0.0000 0.0000 0.4211 ( 4728 PWs) bands (ev): -72.1095 -72.1095 -72.1043 -72.1043 -40.9389 -40.9389 -40.9204 -40.9204 -36.4968 -36.4968 -36.4612 -36.4612 -36.4516 -36.4516 -36.4356 -36.4356 -21.6459 -21.6459 -4.5673 -4.5673 -3.4641 -3.4641 -3.4424 -3.4424 3.3011 3.3011 5.5732 5.5732 7.3938 7.3938 8.0465 8.0465 8.5851 8.5851 8.6777 8.6777 8.8983 8.8983 9.0028 9.0028 9.8305 9.8305 9.9048 9.9048 10.0784 10.0784 10.5121 10.5121 10.9079 10.9079 12.0457 12.0457 12.2656 12.2656 12.5157 12.5157 13.2537 13.2537 16.9962 16.9962 17.5282 17.5282 17.6001 17.6001 k = 0.0000 0.0000 0.4394 ( 4728 PWs) bands (ev): -72.1093 -72.1093 -72.1044 -72.1044 -40.9385 -40.9385 -40.9209 -40.9209 -36.4961 -36.4961 -36.4627 -36.4627 -36.4510 -36.4510 -36.4354 -36.4354 -21.6456 -21.6456 -4.5693 -4.5693 -3.4677 -3.4677 -3.4438 -3.4438 3.3443 3.3443 5.5862 5.5862 7.3798 7.3798 8.0842 8.0842 8.6034 8.6034 8.7075 8.7075 8.8770 8.8770 8.9365 8.9365 9.8073 9.8073 9.8928 9.8928 10.0626 10.0626 10.4811 10.4811 10.9003 10.9003 12.0562 12.0562 12.2655 12.2655 12.4677 12.4677 13.2171 13.2171 17.1426 17.1426 17.5298 17.5298 17.6243 17.6243 k = 0.0000 0.0000 0.4577 ( 4728 PWs) bands (ev): -72.1092 -72.1092 -72.1045 -72.1045 -40.9380 -40.9380 -40.9214 -40.9214 -36.4954 -36.4954 -36.4642 -36.4642 -36.4505 -36.4505 -36.4352 -36.4352 -21.6452 -21.6452 -4.5713 -4.5713 -3.4713 -3.4713 -3.4451 -3.4451 3.3871 3.3871 5.5993 5.5993 7.3651 7.3651 8.1248 8.1248 8.6150 8.6150 8.7359 8.7359 8.8362 8.8362 8.9006 8.9006 9.7848 9.7848 9.8814 9.8814 10.0494 10.0494 10.4495 10.4495 10.8884 10.8884 12.0675 12.0675 12.2651 12.2651 12.4202 12.4202 13.1819 13.1819 17.2897 17.2897 17.5176 17.5176 17.6524 17.6524 k = 0.0000 0.0000 0.4760 ( 4720 PWs) bands (ev): -72.1090 -72.1090 -72.1047 -72.1047 -40.9375 -40.9375 -40.9219 -40.9219 -36.4947 -36.4947 -36.4658 -36.4658 -36.4498 -36.4498 -36.4350 -36.4350 -21.6449 -21.6449 -4.5733 -4.5733 -3.4749 -3.4749 -3.4463 -3.4463 3.4292 3.4292 5.6124 5.6124 7.3506 7.3506 8.1674 8.1674 8.6124 8.6124 8.7566 8.7566 8.7909 8.7909 8.8946 8.8946 9.7631 9.7631 9.8706 9.8706 10.0384 10.0384 10.4175 10.4175 10.8722 10.8722 12.0797 12.0797 12.2642 12.2642 12.3734 12.3734 13.1476 13.1476 17.4359 17.4359 17.4833 17.4833 17.6816 17.6816 k = 0.0000 0.0000 0.4943 ( 4720 PWs) bands (ev): -72.1089 -72.1089 -72.1048 -72.1048 -40.9371 -40.9371 -40.9224 -40.9224 -36.4941 -36.4941 -36.4673 -36.4673 -36.4492 -36.4492 -36.4348 -36.4348 -21.6445 -21.6445 -4.5752 -4.5752 -3.4785 -3.4785 -3.4474 -3.4474 3.4703 3.4703 5.6252 5.6252 7.3370 7.3370 8.2115 8.2115 8.5838 8.5838 8.7430 8.7430 8.7956 8.7956 8.9027 8.9027 9.7422 9.7422 9.8604 9.8604 10.0293 10.0293 10.3854 10.3854 10.8520 10.8520 12.0927 12.0927 12.2631 12.2631 12.3271 12.3271 13.1135 13.1135 17.4198 17.4198 17.5845 17.5845 17.7046 17.7046 k = 0.0000 0.0000 0.5126 ( 4724 PWs) bands (ev): -72.1088 -72.1088 -72.1049 -72.1049 -40.9366 -40.9366 -40.9229 -40.9229 -36.4935 -36.4935 -36.4689 -36.4689 -36.4485 -36.4485 -36.4346 -36.4346 -21.6442 -21.6442 -4.5771 -4.5771 -3.4819 -3.4819 -3.4485 -3.4485 3.5103 3.5103 5.6379 5.6379 7.3246 7.3246 8.2562 8.2562 8.5301 8.5301 8.7332 8.7332 8.8149 8.8149 8.9218 8.9218 9.7223 9.7223 9.8509 9.8509 10.0216 10.0216 10.3536 10.3536 10.8278 10.8278 12.1064 12.1064 12.2617 12.2617 12.2814 12.2814 13.0790 13.0790 17.3410 17.3410 17.6988 17.6988 17.7335 17.7335 k = 0.0000 0.0000 0.5309 ( 4732 PWs) bands (ev): -72.1087 -72.1087 -72.1051 -72.1051 -40.9362 -40.9362 -40.9234 -40.9234 -36.4929 -36.4929 -36.4704 -36.4704 -36.4478 -36.4478 -36.4344 -36.4344 -21.6439 -21.6439 -4.5790 -4.5790 -3.4853 -3.4853 -3.4495 -3.4495 3.5489 3.5489 5.6504 5.6504 7.3141 7.3141 8.3006 8.3006 8.4649 8.4649 8.7320 8.7320 8.8335 8.8335 8.9492 8.9492 9.7033 9.7033 9.8423 9.8423 10.0150 10.0150 10.3223 10.3223 10.7999 10.7999 12.1207 12.1207 12.2357 12.2357 12.2607 12.2607 13.0436 13.0436 17.2562 17.2562 17.6623 17.6623 17.7828 17.7828 k = 0.0000 0.0000 0.5492 ( 4744 PWs) bands (ev): -72.1085 -72.1085 -72.1052 -72.1052 -40.9357 -40.9357 -40.9238 -40.9238 -36.4924 -36.4924 -36.4720 -36.4720 -36.4470 -36.4470 -36.4342 -36.4342 -21.6435 -21.6435 -4.5808 -4.5808 -3.4886 -3.4886 -3.4505 -3.4505 3.5859 3.5859 5.6626 5.6626 7.3057 7.3057 8.3390 8.3390 8.4021 8.4021 8.7338 8.7338 8.8515 8.8515 8.9821 8.9821 9.6855 9.6855 9.8350 9.8350 10.0090 10.0090 10.2919 10.2919 10.7686 10.7686 12.1354 12.1354 12.1908 12.1908 12.2593 12.2593 13.0067 13.0067 17.1733 17.1733 17.5865 17.5865 17.7919 17.7919 k = 0.0000 0.0000 0.5675 ( 4732 PWs) bands (ev): -72.1084 -72.1084 -72.1053 -72.1053 -40.9353 -40.9353 -40.9243 -40.9243 -36.4919 -36.4919 -36.4735 -36.4735 -36.4462 -36.4462 -36.4340 -36.4340 -21.6432 -21.6432 -4.5826 -4.5826 -3.4918 -3.4918 -3.4514 -3.4514 3.6211 3.6211 5.6745 5.6745 7.2999 7.2999 8.3129 8.3129 8.4034 8.4034 8.7370 8.7370 8.8693 8.8693 9.0182 9.0182 9.6689 9.6689 9.8294 9.8294 10.0032 10.0032 10.2629 10.2629 10.7342 10.7342 12.1447 12.1447 12.1520 12.1520 12.2583 12.2583 12.9678 12.9678 17.0965 17.0965 17.4928 17.4928 17.8038 17.8038 k = 0.0000 0.0000 0.5859 ( 4728 PWs) bands (ev): -72.1083 -72.1083 -72.1054 -72.1054 -40.9348 -40.9348 -40.9248 -40.9248 -36.4915 -36.4915 -36.4749 -36.4749 -36.4455 -36.4455 -36.4338 -36.4338 -21.6429 -21.6429 -4.5843 -4.5843 -3.4949 -3.4949 -3.4523 -3.4523 3.6544 3.6544 5.6860 5.6860 7.2966 7.2966 8.2470 8.2470 8.4449 8.4449 8.7413 8.7413 8.8866 8.8866 9.0562 9.0562 9.6536 9.6536 9.8256 9.8256 9.9970 9.9970 10.2358 10.2358 10.6969 10.6969 12.1017 12.1017 12.1659 12.1659 12.2580 12.2580 12.9264 12.9264 17.0281 17.0281 17.3925 17.3925 17.8173 17.8173 k = 0.0000 0.0000 0.6042 ( 4726 PWs) bands (ev): -72.1081 -72.1081 -72.1056 -72.1056 -40.9344 -40.9344 -40.9252 -40.9252 -36.4911 -36.4911 -36.4764 -36.4764 -36.4447 -36.4447 -36.4336 -36.4336 -21.6426 -21.6426 -4.5859 -4.5859 -3.4978 -3.4978 -3.4531 -3.4531 3.6856 3.6856 5.6971 5.6971 7.2961 7.2961 8.1801 8.1801 8.4887 8.4887 8.7470 8.7470 8.9030 8.9030 9.0951 9.0951 9.6396 9.6396 9.8239 9.8239 9.9901 9.9901 10.2110 10.2110 10.6570 10.6570 12.0578 12.0578 12.1803 12.1803 12.2587 12.2587 12.8821 12.8821 16.9697 16.9697 17.2907 17.2907 17.8317 17.8317 k = 0.0000 0.0000 0.6225 ( 4728 PWs) bands (ev): -72.1080 -72.1080 -72.1057 -72.1057 -40.9340 -40.9340 -40.9257 -40.9257 -36.4907 -36.4907 -36.4778 -36.4778 -36.4439 -36.4439 -36.4334 -36.4334 -21.6423 -21.6423 -4.5875 -4.5875 -3.5006 -3.5006 -3.4538 -3.4538 3.7146 3.7146 5.7077 5.7077 7.2984 7.2984 8.1148 8.1148 8.5322 8.5322 8.7542 8.7542 8.9181 8.9181 9.1340 9.1340 9.6270 9.6270 9.8246 9.8246 9.9822 9.9822 10.1889 10.1889 10.6150 10.6150 12.0144 12.0144 12.1932 12.1932 12.2615 12.2615 12.8349 12.8349 16.9221 16.9221 17.1898 17.1898 17.8462 17.8462 k = 0.0000 0.0000 0.6408 ( 4722 PWs) bands (ev): -72.1079 -72.1079 -72.1058 -72.1058 -40.9336 -40.9336 -40.9261 -40.9261 -36.4904 -36.4904 -36.4791 -36.4791 -36.4431 -36.4431 -36.4332 -36.4332 -21.6420 -21.6420 -4.5890 -4.5890 -3.5033 -3.5033 -3.4545 -3.4545 3.7413 3.7413 5.7179 5.7179 7.3036 7.3036 8.0519 8.0519 8.5749 8.5749 8.7633 8.7633 8.9317 8.9317 9.1724 9.1724 9.6158 9.6158 9.8277 9.8277 9.9732 9.9732 10.1700 10.1700 10.5712 10.5712 11.9713 11.9713 12.2035 12.2035 12.2673 12.2673 12.7845 12.7845 16.8859 16.8859 17.0912 17.0912 17.8605 17.8605 k = 0.0000 0.0000 0.6591 ( 4722 PWs) bands (ev): -72.1078 -72.1078 -72.1059 -72.1059 -40.9332 -40.9332 -40.9265 -40.9265 -36.4901 -36.4901 -36.4804 -36.4804 -36.4423 -36.4423 -36.4330 -36.4330 -21.6417 -21.6417 -4.5904 -4.5904 -3.5058 -3.5058 -3.4552 -3.4552 3.7658 3.7658 5.7275 5.7275 7.3114 7.3114 7.9918 7.9918 8.6165 8.6165 8.7741 8.7741 8.9436 8.9436 9.2093 9.2093 9.6061 9.6061 9.8332 9.8332 9.9634 9.9634 10.1543 10.1543 10.5259 10.5259 11.9288 11.9288 12.2102 12.2102 12.2770 12.2770 12.7311 12.7311 16.8612 16.8612 16.9958 16.9958 17.8742 17.8742 k = 0.0000 0.0000 0.6774 ( 4730 PWs) bands (ev): -72.1077 -72.1077 -72.1060 -72.1060 -40.9329 -40.9329 -40.9269 -40.9269 -36.4899 -36.4899 -36.4817 -36.4817 -36.4415 -36.4415 -36.4328 -36.4328 -21.6414 -21.6414 -4.5917 -4.5917 -3.5081 -3.5081 -3.4558 -3.4558 3.7880 3.7880 5.7366 5.7366 7.3217 7.3217 7.9347 7.9347 8.6569 8.6569 8.7869 8.7869 8.9537 8.9537 9.2438 9.2438 9.5980 9.5980 9.8408 9.8408 9.9537 9.9537 10.1416 10.1416 10.4797 10.4797 11.8868 11.8868 12.2137 12.2137 12.2900 12.2900 12.6748 12.6748 16.8474 16.8474 16.9047 16.9047 17.8871 17.8871 k = 0.0000 0.0000 0.6957 ( 4738 PWs) bands (ev): -72.1076 -72.1076 -72.1061 -72.1061 -40.9325 -40.9325 -40.9273 -40.9273 -36.4896 -36.4896 -36.4829 -36.4829 -36.4407 -36.4407 -36.4327 -36.4327 -21.6412 -21.6412 -4.5930 -4.5930 -3.5104 -3.5104 -3.4563 -3.4563 3.8080 3.8080 5.7452 5.7452 7.3343 7.3343 7.8807 7.8807 8.6957 8.6957 8.8016 8.8016 8.9622 8.9622 9.2748 9.2748 9.5915 9.5915 9.8502 9.8502 9.9454 9.9454 10.1313 10.1313 10.4329 10.4329 11.8455 11.8455 12.2149 12.2149 12.3054 12.3054 12.6161 12.6161 16.8116 16.8116 16.8511 16.8511 17.8988 17.8988 k = 0.0000 0.0000 0.7140 ( 4736 PWs) bands (ev): -72.1075 -72.1075 -72.1062 -72.1062 -40.9322 -40.9322 -40.9276 -40.9276 -36.4894 -36.4894 -36.4840 -36.4840 -36.4400 -36.4400 -36.4325 -36.4325 -21.6409 -21.6409 -4.5942 -4.5942 -3.5124 -3.5124 -3.4568 -3.4568 3.8258 3.8258 5.7532 5.7532 7.3489 7.3489 7.8301 7.8301 8.7328 8.7328 8.8183 8.8183 8.9691 8.9691 9.3014 9.3014 9.5865 9.5865 9.8607 9.8607 9.9402 9.9402 10.1229 10.1229 10.3864 10.3864 11.8051 11.8051 12.2148 12.2148 12.3220 12.3220 12.5556 12.5556 16.7298 16.7298 16.8593 16.8593 17.9091 17.9091 k = 0.0000 0.0000 0.7323 ( 4740 PWs) bands (ev): -72.1074 -72.1074 -72.1063 -72.1063 -40.9319 -40.9319 -40.9280 -40.9280 -36.4892 -36.4892 -36.4851 -36.4851 -36.4393 -36.4393 -36.4324 -36.4324 -21.6407 -21.6407 -4.5953 -4.5953 -3.5143 -3.5143 -3.4573 -3.4573 3.8415 3.8415 5.7605 5.7605 7.3651 7.3651 7.7828 7.7828 8.7678 8.7678 8.8373 8.8373 8.9748 8.9748 9.3224 9.3224 9.5828 9.5828 9.8714 9.8714 9.9400 9.9400 10.1153 10.1153 10.3407 10.3407 11.7657 11.7657 12.2139 12.2139 12.3387 12.3387 12.4941 12.4941 16.6509 16.6509 16.8801 16.8801 17.9177 17.9177 k = 0.0000 0.0000 0.7506 ( 4738 PWs) bands (ev): -72.1073 -72.1073 -72.1064 -72.1064 -40.9316 -40.9316 -40.9283 -40.9283 -36.4891 -36.4891 -36.4861 -36.4861 -36.4386 -36.4386 -36.4322 -36.4322 -21.6405 -21.6405 -4.5963 -4.5963 -3.5161 -3.5161 -3.4577 -3.4577 3.8552 3.8552 5.7674 5.7674 7.3825 7.3825 7.7390 7.7390 8.7998 8.7998 8.8591 8.8591 8.9795 8.9795 9.3373 9.3373 9.5799 9.5799 9.8822 9.8822 9.9457 9.9457 10.1076 10.1076 10.2971 10.2971 11.7274 11.7274 12.2125 12.2125 12.3543 12.3543 12.4334 12.4334 16.5768 16.5768 16.9115 16.9115 17.9244 17.9244 k = 0.0000 0.0000 0.7689 ( 4750 PWs) bands (ev): -72.1073 -72.1073 -72.1065 -72.1065 -40.9313 -40.9313 -40.9286 -40.9286 -36.4890 -36.4890 -36.4870 -36.4870 -36.4380 -36.4380 -36.4321 -36.4321 -21.6403 -21.6403 -4.5972 -4.5972 -3.5177 -3.5177 -3.4581 -3.4581 3.8670 3.8670 5.7736 5.7736 7.4008 7.4008 7.6987 7.6987 8.8281 8.8281 8.8838 8.8838 8.9836 8.9836 9.3458 9.3458 9.5770 9.5770 9.8941 9.8941 9.9565 9.9565 10.0985 10.0985 10.2568 10.2568 11.6906 11.6906 12.2108 12.2108 12.3543 12.3543 12.3885 12.3885 16.5079 16.5079 16.9526 16.9526 17.9288 17.9288 k = 0.0000 0.0000 0.7872 ( 4752 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9311 -40.9311 -40.9289 -40.9289 -36.4888 -36.4888 -36.4878 -36.4878 -36.4374 -36.4374 -36.4320 -36.4320 -21.6401 -21.6401 -4.5980 -4.5980 -3.5191 -3.5191 -3.4584 -3.4584 3.8772 3.8772 5.7792 5.7792 7.4193 7.4193 7.6622 7.6622 8.8525 8.8525 8.9113 8.9113 8.9877 8.9877 9.3484 9.3484 9.5734 9.5734 9.9085 9.9085 9.9703 9.9703 10.0864 10.0864 10.2220 10.2220 11.6556 11.6556 12.2085 12.2085 12.3040 12.3040 12.3948 12.3948 16.4444 16.4444 17.0026 17.0026 17.9304 17.9304 k = 0.0000 0.0000 0.8055 ( 4756 PWs) bands (ev): -72.1071 -72.1071 -72.1066 -72.1066 -40.9308 -40.9308 -40.9291 -40.9291 -36.4888 -36.4888 -36.4885 -36.4885 -36.4368 -36.4368 -36.4319 -36.4319 -21.6399 -21.6399 -4.5988 -4.5988 -3.5204 -3.5204 -3.4587 -3.4587 3.8858 3.8858 5.7842 5.7842 7.4376 7.4376 7.6293 7.6293 8.8734 8.8734 8.9401 8.9401 8.9927 8.9927 9.3456 9.3456 9.5688 9.5688 9.9261 9.9261 9.9844 9.9844 10.0707 10.0707 10.1948 10.1948 11.6226 11.6226 12.2041 12.2041 12.2494 12.2494 12.4089 12.4089 16.3868 16.3868 17.0606 17.0606 17.9287 17.9287 k = 0.0000 0.0000 0.8239 ( 4764 PWs) bands (ev): -72.1071 -72.1071 -72.1067 -72.1067 -40.9306 -40.9306 -40.9293 -40.9293 -36.4893 -36.4893 -36.4886 -36.4886 -36.4364 -36.4364 -36.4318 -36.4318 -21.6398 -21.6398 -4.5994 -4.5994 -3.5215 -3.5215 -3.4590 -3.4590 3.8929 3.8929 5.7886 5.7886 7.4552 7.4552 7.6002 7.6002 8.8910 8.8910 8.9676 8.9676 9.0004 9.0004 9.3383 9.3383 9.5634 9.5634 9.9464 9.9464 9.9940 9.9940 10.0546 10.0546 10.1756 10.1756 11.5920 11.5920 12.1811 12.1811 12.2158 12.2158 12.4228 12.4228 16.3352 16.3352 17.1255 17.1255 17.9229 17.9229 k = 0.0000 0.0000 0.8422 ( 4758 PWs) bands (ev): -72.1070 -72.1070 -72.1067 -72.1067 -40.9305 -40.9305 -40.9295 -40.9295 -36.4899 -36.4899 -36.4886 -36.4886 -36.4359 -36.4359 -36.4317 -36.4317 -21.6397 -21.6397 -4.6000 -4.6000 -3.5225 -3.5225 -3.4592 -3.4592 3.8988 3.8988 5.7924 5.7924 7.4717 7.4717 7.5749 7.5749 8.9055 8.9055 8.9880 8.9880 9.0165 9.0165 9.3274 9.3274 9.5576 9.5576 9.9682 9.9682 9.9892 9.9892 10.0494 10.0494 10.1630 10.1630 11.5642 11.5642 12.1350 12.1350 12.2097 12.2097 12.4356 12.4356 16.2899 16.2899 17.1961 17.1961 17.9122 17.9122 k = 0.0000 0.0000 0.8605 ( 4758 PWs) bands (ev): -72.1070 -72.1070 -72.1068 -72.1068 -40.9303 -40.9303 -40.9297 -40.9297 -36.4904 -36.4904 -36.4885 -36.4885 -36.4356 -36.4356 -36.4316 -36.4316 -21.6395 -21.6395 -4.6005 -4.6005 -3.5233 -3.5233 -3.4593 -3.4593 3.9036 3.9036 5.7956 5.7956 7.4865 7.4865 7.5534 7.5534 8.9167 8.9167 8.9998 8.9998 9.0418 9.0418 9.3134 9.3134 9.5519 9.5519 9.9690 9.9690 9.9909 9.9909 10.0571 10.0571 10.1543 10.1543 11.5396 11.5396 12.0905 12.0905 12.2076 12.2076 12.4468 12.4468 16.2511 16.2511 17.2710 17.2710 17.8955 17.8955 k = 0.0000 0.0000 0.8788 ( 4750 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9302 -40.9302 -40.9298 -40.9298 -36.4908 -36.4908 -36.4885 -36.4885 -36.4353 -36.4353 -36.4316 -36.4316 -21.6394 -21.6394 -4.6009 -4.6009 -3.5240 -3.5240 -3.4595 -3.4595 3.9073 3.9073 5.7982 5.7982 7.4992 7.4992 7.5359 7.5359 8.9249 8.9249 9.0090 9.0090 9.0695 9.0695 9.2972 9.2972 9.5468 9.5468 9.9462 9.9462 10.0117 10.0117 10.0687 10.0687 10.1478 10.1478 11.5187 11.5187 12.0518 12.0518 12.2063 12.2063 12.4563 12.4563 16.2191 16.2191 17.3483 17.3483 17.8718 17.8718 k = 0.0000 0.0000 0.8971 ( 4738 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9301 -40.9301 -40.9299 -40.9299 -36.4911 -36.4911 -36.4884 -36.4884 -36.4350 -36.4350 -36.4315 -36.4315 -21.6394 -21.6394 -4.6012 -4.6012 -3.5245 -3.5245 -3.4596 -3.4596 3.9100 3.9100 5.8003 5.8003 7.5095 7.5095 7.5223 7.5223 8.9305 8.9305 9.0170 9.0170 9.0965 9.0965 9.2797 9.2797 9.5425 9.5425 9.9254 9.9254 10.0301 10.0301 10.0799 10.0799 10.1425 10.1425 11.5019 11.5019 12.0204 12.0204 12.2053 12.2053 12.4639 12.4639 16.1941 16.1941 17.4257 17.4257 17.8405 17.8405 k = 0.0000 0.0000 0.9154 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4913 -36.4913 -36.4884 -36.4884 -36.4348 -36.4348 -36.4315 -36.4315 -21.6393 -21.6393 -4.6014 -4.6014 -3.5249 -3.5249 -3.4597 -3.4597 3.9120 3.9120 5.8017 5.8017 7.5119 7.5119 7.5176 7.5176 8.9339 8.9339 9.0236 9.0236 9.1207 9.1207 9.2623 9.2623 9.5394 9.5394 9.9091 9.9091 10.0445 10.0445 10.0894 10.0894 10.1378 10.1378 11.4895 11.4895 11.9972 11.9972 12.2047 12.2047 12.4694 12.4694 16.1760 16.1760 17.4996 17.4996 17.8021 17.8021 k = 0.0000 0.0000 0.9337 ( 4726 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6015 -4.6015 -3.5251 -3.5251 -3.4597 -3.4597 3.9131 3.9131 5.8026 5.8026 7.5062 7.5062 7.5220 7.5220 8.9358 8.9358 9.0280 9.0280 9.1394 9.1394 9.2477 9.2477 9.5375 9.5375 9.8988 9.8988 10.0538 10.0538 10.0961 10.0961 10.1340 10.1340 11.4820 11.4820 11.9830 11.9830 12.2044 12.2044 12.4728 12.4728 16.1652 16.1652 17.5627 17.5627 17.7615 17.7615 k = 0.0000 0.0000 0.9520 ( 4722 PWs) bands (ev): -72.1068 -72.1068 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5252 -3.5252 -3.4597 -3.4597 3.9135 3.9135 5.8029 5.8029 7.5043 7.5043 7.5236 7.5236 8.9364 8.9364 9.0296 9.0296 9.1469 9.1469 9.2415 9.2415 9.5368 9.5368 9.8953 9.8953 10.0571 10.0571 10.0986 10.0986 10.1325 10.1325 11.4794 11.4794 11.9783 11.9783 12.2042 12.2042 12.4739 12.4739 16.1616 16.1616 17.5925 17.5925 17.7393 17.7393 k = 0.0000 0.0000 0.9520 ( 4722 PWs) bands (ev): -72.1068 -72.1068 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5252 -3.5252 -3.4597 -3.4597 3.9135 3.9135 5.8029 5.8029 7.5043 7.5043 7.5236 7.5236 8.9364 8.9364 9.0296 9.0296 9.1469 9.1469 9.2415 9.2415 9.5368 9.5368 9.8953 9.8953 10.0571 10.0571 10.0986 10.0986 10.1325 10.1325 11.4794 11.4794 11.9783 11.9783 12.2042 12.2042 12.4739 12.4739 16.1616 16.1616 17.5925 17.5925 17.7393 17.7393 k =-0.0095 0.0154 0.9520 ( 4730 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9300 -40.9300 -40.9299 -40.9299 -36.4915 -36.4915 -36.4883 -36.4883 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6015 -4.6015 -3.5251 -3.5251 -3.4597 -3.4597 3.9138 3.9138 5.8002 5.8002 7.5061 7.5061 7.5253 7.5253 8.9311 8.9311 9.0324 9.0324 9.1480 9.1480 9.2415 9.2415 9.5368 9.5368 9.8926 9.8926 10.0563 10.0563 10.0984 10.0984 10.1300 10.1300 11.4814 11.4814 11.9783 11.9783 12.2084 12.2084 12.4781 12.4781 16.1620 16.1620 17.5921 17.5921 17.7446 17.7446 k =-0.0190 0.0309 0.9520 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9301 -40.9301 -40.9299 -40.9299 -36.4916 -36.4916 -36.4882 -36.4882 -36.4347 -36.4347 -36.4316 -36.4316 -21.6393 -21.6393 -4.6014 -4.6014 -3.5248 -3.5248 -3.4598 -3.4598 3.9149 3.9149 5.7920 5.7920 7.5114 7.5114 7.5304 7.5304 8.9168 8.9168 9.0395 9.0395 9.1512 9.1512 9.2418 9.2418 9.5368 9.5368 9.8848 9.8848 10.0538 10.0538 10.0978 10.0978 10.1229 10.1229 11.4875 11.4875 11.9785 11.9785 12.2208 12.2208 12.4905 12.4905 16.1633 16.1633 17.5907 17.5907 17.7603 17.7603 k =-0.0286 0.0463 0.9520 ( 4748 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9302 -40.9302 -40.9298 -40.9298 -36.4916 -36.4916 -36.4880 -36.4880 -36.4348 -36.4348 -36.4318 -36.4318 -21.6394 -21.6394 -4.6012 -4.6012 -3.5244 -3.5244 -3.4599 -3.4599 3.9167 3.9167 5.7785 5.7785 7.5200 7.5200 7.5390 7.5390 8.8963 8.8963 9.0485 9.0485 9.1565 9.1565 9.2424 9.2424 9.5368 9.5368 9.8719 9.8719 10.0495 10.0495 10.0965 10.0965 10.1120 10.1120 11.4977 11.4977 11.9789 11.9789 12.2414 12.2414 12.5110 12.5110 16.1655 16.1655 17.5885 17.5885 17.7862 17.7862 k =-0.0381 0.0617 0.9520 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9303 -40.9303 -40.9297 -40.9297 -36.4916 -36.4916 -36.4877 -36.4877 -36.4348 -36.4348 -36.4320 -36.4320 -21.6394 -21.6394 -4.6010 -4.6010 -3.5238 -3.5238 -3.4600 -3.4600 3.9191 3.9191 5.7599 5.7599 7.5318 7.5318 7.5511 7.5511 8.8713 8.8713 9.0578 9.0578 9.1636 9.1636 9.2433 9.2433 9.5368 9.5368 9.8544 9.8544 10.0430 10.0430 10.0896 10.0896 10.1020 10.1020 11.5125 11.5125 11.9796 11.9796 12.2697 12.2697 12.5393 12.5393 16.1686 16.1686 17.5854 17.5854 17.8217 17.8217 k =-0.0476 0.0771 0.9520 ( 4762 PWs) bands (ev): -72.1070 -72.1070 -72.1068 -72.1068 -40.9304 -40.9304 -40.9296 -40.9296 -36.4916 -36.4916 -36.4872 -36.4872 -36.4349 -36.4349 -36.4323 -36.4323 -21.6395 -21.6395 -4.6006 -4.6006 -3.5230 -3.5230 -3.4602 -3.4602 3.9221 3.9221 5.7367 5.7367 7.5464 7.5464 7.5665 7.5665 8.8431 8.8431 9.0668 9.0668 9.1721 9.1721 9.2444 9.2444 9.5369 9.5369 9.8324 9.8324 10.0339 10.0339 10.0718 10.0718 10.0990 10.0990 11.5321 11.5321 11.9808 11.9808 12.3055 12.3055 12.5750 12.5750 16.1725 16.1725 17.5816 17.5816 17.8662 17.8662 k =-0.0571 0.0926 0.9520 ( 4766 PWs) bands (ev): -72.1070 -72.1070 -72.1068 -72.1068 -40.9305 -40.9305 -40.9295 -40.9295 -36.4917 -36.4917 -36.4868 -36.4868 -36.4349 -36.4349 -36.4327 -36.4327 -21.6396 -21.6396 -4.6002 -4.6002 -3.5220 -3.5220 -3.4604 -3.4604 3.9257 3.9257 5.7092 5.7092 7.5634 7.5634 7.5853 7.5853 8.8121 8.8121 9.0754 9.0754 9.1818 9.1818 9.2458 9.2458 9.5371 9.5371 9.8065 9.8065 10.0220 10.0220 10.0490 10.0490 10.0979 10.0979 11.5566 11.5566 11.9825 11.9825 12.3484 12.3484 12.6177 12.6177 16.1772 16.1772 17.5772 17.5772 17.9186 17.9186 k =-0.0667 0.1080 0.9520 ( 4754 PWs) bands (ev): -72.1070 -72.1070 -72.1067 -72.1067 -40.9307 -40.9307 -40.9293 -40.9293 -36.4917 -36.4917 -36.4862 -36.4862 -36.4350 -36.4350 -36.4331 -36.4331 -21.6397 -21.6397 -4.5997 -4.5997 -3.5208 -3.5208 -3.4606 -3.4606 3.9298 3.9298 5.6778 5.6778 7.5824 7.5824 7.6074 7.6074 8.7789 8.7789 9.0835 9.0835 9.1923 9.1923 9.2477 9.2477 9.5376 9.5376 9.7772 9.7772 10.0070 10.0070 10.0235 10.0235 10.0970 10.0970 11.5864 11.5864 11.9849 11.9849 12.3980 12.3980 12.6668 12.6668 16.1828 16.1828 17.5722 17.5722 17.9776 17.9776 k =-0.0762 0.1234 0.9520 ( 4758 PWs) bands (ev): -72.1071 -72.1071 -72.1066 -72.1066 -40.9309 -40.9309 -40.9291 -40.9291 -36.4918 -36.4918 -36.4855 -36.4855 -36.4351 -36.4351 -36.4336 -36.4336 -21.6399 -21.6399 -4.5991 -4.5991 -3.5195 -3.5195 -3.4609 -3.4609 3.9342 3.9342 5.6429 5.6429 7.6031 7.6031 7.6328 7.6328 8.7440 8.7440 9.0907 9.0907 9.2029 9.2029 9.2499 9.2499 9.5382 9.5382 9.7449 9.7449 9.9883 9.9883 9.9966 9.9966 10.0960 10.0960 11.6215 11.6215 11.9880 11.9880 12.4541 12.4541 12.7220 12.7220 16.1891 16.1891 17.5666 17.5666 18.0411 18.0411 k =-0.0857 0.1389 0.9520 ( 4754 PWs) bands (ev): -72.1072 -72.1072 -72.1066 -72.1066 -40.9311 -40.9311 -40.9288 -40.9288 -36.4919 -36.4919 -36.4847 -36.4847 -36.4352 -36.4352 -36.4342 -36.4342 -21.6400 -21.6400 -4.5984 -4.5984 -3.5180 -3.5180 -3.4612 -3.4612 3.9389 3.9389 5.6050 5.6050 7.6251 7.6251 7.6614 7.6614 8.7078 8.7078 9.0972 9.0972 9.2132 9.2132 9.2529 9.2529 9.5390 9.5390 9.7102 9.7102 9.9634 9.9634 9.9721 9.9721 10.0951 10.0951 11.6617 11.6617 11.9921 11.9921 12.5163 12.5163 12.7828 12.7828 16.1962 16.1962 17.5608 17.5608 18.1055 18.1055 k =-0.0952 0.1543 0.9520 ( 4750 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9313 -40.9313 -40.9286 -40.9286 -36.4920 -36.4920 -36.4839 -36.4839 -36.4354 -36.4354 -36.4348 -36.4348 -21.6402 -21.6402 -4.5977 -4.5977 -3.5163 -3.5163 -3.4615 -3.4615 3.9438 3.9438 5.5644 5.5644 7.6479 7.6479 7.6931 7.6931 8.6704 8.6704 9.1023 9.1023 9.2224 9.2224 9.2567 9.2567 9.5401 9.5401 9.6737 9.6737 9.9343 9.9343 9.9493 9.9493 10.0942 10.0942 11.7066 11.7066 11.9975 11.9975 12.5843 12.5843 12.8486 12.8486 16.2041 16.2041 17.5546 17.5546 18.1587 18.1587 k =-0.0952 0.1543 0.9520 ( 4750 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9313 -40.9313 -40.9286 -40.9286 -36.4920 -36.4920 -36.4839 -36.4839 -36.4354 -36.4354 -36.4348 -36.4348 -21.6402 -21.6402 -4.5977 -4.5977 -3.5163 -3.5163 -3.4615 -3.4615 3.9438 3.9438 5.5644 5.5644 7.6479 7.6479 7.6931 7.6931 8.6704 8.6704 9.1023 9.1023 9.2224 9.2224 9.2567 9.2567 9.5401 9.5401 9.6737 9.6737 9.9343 9.9343 9.9493 9.9493 10.0942 10.0942 11.7066 11.7066 11.9975 11.9975 12.5843 12.5843 12.8486 12.8486 16.2041 16.2041 17.5546 17.5546 18.1587 18.1587 k =-0.1020 0.1652 0.9392 ( 4744 PWs) bands (ev): -72.1073 -72.1073 -72.1064 -72.1064 -40.9315 -40.9315 -40.9284 -40.9284 -36.4920 -36.4920 -36.4833 -36.4833 -36.4355 -36.4355 -36.4352 -36.4352 -21.6403 -21.6403 -4.5971 -4.5971 -3.5150 -3.5150 -3.4617 -3.4617 3.9473 3.9473 5.5344 5.5344 7.6652 7.6652 7.7165 7.7165 8.6439 8.6439 9.1040 9.1040 9.2182 9.2182 9.2690 9.2690 9.5413 9.5413 9.6487 9.6487 9.9131 9.9131 9.9288 9.9288 10.0958 10.0958 11.7391 11.7391 12.0072 12.0072 12.6352 12.6352 12.8984 12.8984 16.2118 16.2118 17.5411 17.5411 18.1459 18.1459 k =-0.1087 0.1762 0.9263 ( 4739 PWs) bands (ev): -72.1073 -72.1073 -72.1064 -72.1064 -40.9317 -40.9317 -40.9282 -40.9282 -36.4920 -36.4920 -36.4826 -36.4826 -36.4358 -36.4358 -36.4355 -36.4355 -21.6404 -21.6404 -4.5965 -4.5965 -3.5137 -3.5137 -3.4617 -3.4617 3.9504 3.9504 5.5035 5.5035 7.6844 7.6844 7.7395 7.7395 8.6182 8.6182 9.1025 9.1025 9.2053 9.2053 9.2881 9.2881 9.5432 9.5432 9.6261 9.6261 9.8909 9.8909 9.9023 9.9023 10.1011 10.1011 11.7678 11.7678 12.0293 12.0293 12.6874 12.6874 12.9515 12.9515 16.2234 16.2234 17.5111 17.5111 18.0829 18.0829 k =-0.1155 0.1871 0.9135 ( 4745 PWs) bands (ev): -72.1074 -72.1074 -72.1063 -72.1063 -40.9318 -40.9318 -40.9280 -40.9280 -36.4920 -36.4920 -36.4819 -36.4819 -36.4363 -36.4363 -36.4358 -36.4358 -21.6406 -21.6406 -4.5958 -4.5958 -3.5124 -3.5124 -3.4616 -3.4616 3.9534 3.9534 5.4720 5.4720 7.7051 7.7051 7.7620 7.7620 8.5934 8.5934 9.0980 9.0980 9.1910 9.1910 9.3065 9.3065 9.5449 9.5449 9.6062 9.6062 9.8617 9.8617 9.8780 9.8780 10.1083 10.1083 11.7903 11.7903 12.0654 12.0654 12.7401 12.7401 13.0085 13.0085 16.2386 16.2386 17.4678 17.4678 18.0095 18.0095 k =-0.1222 0.1980 0.9006 ( 4746 PWs) bands (ev): -72.1074 -72.1074 -72.1063 -72.1063 -40.9320 -40.9320 -40.9278 -40.9278 -36.4919 -36.4919 -36.4812 -36.4812 -36.4368 -36.4368 -36.4360 -36.4360 -21.6407 -21.6407 -4.5951 -4.5951 -3.5111 -3.5111 -3.4613 -3.4613 3.9562 3.9562 5.4401 5.4401 7.7275 7.7275 7.7838 7.7838 8.5698 8.5698 9.0909 9.0909 9.1767 9.1767 9.3223 9.3223 9.5445 9.5445 9.5900 9.5900 9.8251 9.8251 9.8594 9.8594 10.1165 10.1165 11.8072 11.8072 12.1148 12.1148 12.7928 12.7928 13.0699 13.0699 16.2576 16.2576 17.4147 17.4147 17.9324 17.9324 k =-0.1290 0.2089 0.8878 ( 4746 PWs) bands (ev): -72.1075 -72.1075 -72.1062 -72.1062 -40.9322 -40.9322 -40.9276 -40.9276 -36.4918 -36.4918 -36.4804 -36.4804 -36.4374 -36.4374 -36.4363 -36.4363 -21.6409 -21.6409 -4.5943 -4.5943 -3.5100 -3.5100 -3.4608 -3.4608 3.9588 3.9588 5.4081 5.4081 7.7511 7.7511 7.8048 7.8048 8.5476 8.5476 9.0816 9.0816 9.1631 9.1631 9.3350 9.3350 9.5385 9.5385 9.5792 9.5792 9.7863 9.7863 9.8438 9.8438 10.1246 10.1246 11.8204 11.8204 12.1749 12.1749 12.8448 12.8448 13.1362 13.1362 16.2802 16.2802 17.3546 17.3546 17.8529 17.8529 k =-0.1357 0.2199 0.8749 ( 4746 PWs) bands (ev): -72.1076 -72.1076 -72.1062 -72.1062 -40.9323 -40.9323 -40.9274 -40.9274 -36.4917 -36.4917 -36.4797 -36.4797 -36.4380 -36.4380 -36.4366 -36.4366 -21.6411 -21.6411 -4.5935 -4.5935 -3.5091 -3.5091 -3.4600 -3.4600 3.9611 3.9611 5.3760 5.3760 7.7759 7.7759 7.8249 7.8249 8.5268 8.5268 9.0705 9.0705 9.1503 9.1503 9.3440 9.3440 9.5258 9.5258 9.5725 9.5725 9.7485 9.7485 9.8313 9.8313 10.1321 10.1321 11.8323 11.8323 12.2429 12.2429 12.8958 12.8958 13.2077 13.2077 16.3063 16.3063 17.2897 17.2897 17.7718 17.7718 k =-0.1425 0.2308 0.8621 ( 4746 PWs) bands (ev): -72.1076 -72.1076 -72.1061 -72.1061 -40.9325 -40.9325 -40.9273 -40.9273 -36.4915 -36.4915 -36.4788 -36.4788 -36.4386 -36.4386 -36.4369 -36.4369 -21.6413 -21.6413 -4.5927 -4.5927 -3.5083 -3.5083 -3.4588 -3.4588 3.9633 3.9633 5.3441 5.3441 7.8019 7.8019 7.8441 7.8441 8.5077 8.5077 9.0581 9.0581 9.1385 9.1385 9.3490 9.3490 9.5092 9.5092 9.5638 9.5638 9.7154 9.7154 9.8222 9.8222 10.1386 10.1386 11.8448 11.8448 12.3165 12.3165 12.9454 12.9454 13.2845 13.2845 16.3358 16.3358 17.2215 17.2215 17.6898 17.6898 k =-0.1492 0.2417 0.8493 ( 4746 PWs) bands (ev): -72.1076 -72.1076 -72.1061 -72.1061 -40.9326 -40.9326 -40.9271 -40.9271 -36.4913 -36.4913 -36.4780 -36.4780 -36.4392 -36.4392 -36.4373 -36.4373 -21.6415 -21.6415 -4.5919 -4.5919 -3.5078 -3.5078 -3.4573 -3.4573 3.9653 3.9653 5.3126 5.3126 7.8288 7.8288 7.8621 7.8621 8.4904 8.4904 9.0449 9.0449 9.1277 9.1277 9.3496 9.3496 9.4906 9.4906 9.5478 9.5478 9.6906 9.6906 9.8168 9.8168 10.1435 10.1435 11.8591 11.8591 12.3938 12.3938 12.9934 12.9934 13.3667 13.3667 16.3687 16.3687 17.1511 17.1511 17.6077 17.6077 k =-0.1559 0.2527 0.8364 ( 4747 PWs) bands (ev): -72.1077 -72.1077 -72.1061 -72.1061 -40.9328 -40.9328 -40.9269 -40.9269 -36.4911 -36.4911 -36.4772 -36.4772 -36.4399 -36.4399 -36.4377 -36.4377 -21.6417 -21.6417 -4.5910 -4.5910 -3.5076 -3.5076 -3.4555 -3.4555 3.9671 3.9671 5.2816 5.2816 7.8566 7.8566 7.8791 7.8791 8.4747 8.4747 9.0313 9.0313 9.1178 9.1178 9.3449 9.3449 9.4702 9.4702 9.5247 9.5247 9.6749 9.6749 9.8152 9.8152 10.1467 10.1467 11.8762 11.8762 12.4736 12.4736 13.0399 13.0399 13.4541 13.4541 16.4049 16.4049 17.0791 17.0791 17.5263 17.5263 k =-0.1627 0.2636 0.8236 ( 4751 PWs) bands (ev): -72.1077 -72.1077 -72.1060 -72.1060 -40.9329 -40.9329 -40.9268 -40.9268 -36.4908 -36.4908 -36.4763 -36.4763 -36.4405 -36.4405 -36.4381 -36.4381 -21.6420 -21.6420 -4.5902 -4.5902 -3.5076 -3.5076 -3.4534 -3.4534 3.9687 3.9687 5.2512 5.2512 7.8848 7.8848 7.8954 7.8954 8.4608 8.4608 9.0176 9.0176 9.1086 9.1086 9.3338 9.3338 9.4472 9.4472 9.4997 9.4997 9.6653 9.6653 9.8172 9.8172 10.1478 10.1478 11.8967 11.8967 12.5546 12.5546 13.0848 13.0848 13.5465 13.5465 16.4441 16.4441 17.0061 17.0061 17.4467 17.4467 k =-0.1694 0.2745 0.8107 ( 4747 PWs) bands (ev): -72.1078 -72.1078 -72.1060 -72.1060 -40.9330 -40.9330 -40.9266 -40.9266 -36.4906 -36.4906 -36.4754 -36.4754 -36.4412 -36.4412 -36.4386 -36.4386 -21.6422 -21.6422 -4.5894 -4.5894 -3.5078 -3.5078 -3.4509 -3.4509 3.9701 3.9701 5.2215 5.2215 7.9079 7.9079 7.9164 7.9164 8.4485 8.4485 9.0041 9.0041 9.0998 9.0998 9.3149 9.3149 9.4217 9.4217 9.4790 9.4790 9.6587 9.6587 9.8222 9.8222 10.1468 10.1468 11.9212 11.9212 12.6358 12.6358 13.1281 13.1281 13.6436 13.6436 16.4865 16.4865 16.9322 16.9322 17.3698 17.3698 k =-0.1762 0.2855 0.7979 ( 4745 PWs) bands (ev): -72.1078 -72.1078 -72.1059 -72.1059 -40.9332 -40.9332 -40.9265 -40.9265 -36.4903 -36.4903 -36.4745 -36.4745 -36.4419 -36.4419 -36.4391 -36.4391 -21.6424 -21.6424 -4.5886 -4.5886 -3.5082 -3.5082 -3.4482 -3.4482 3.9714 3.9714 5.1928 5.1928 7.9223 7.9223 7.9458 7.9458 8.4378 8.4378 8.9908 8.9908 9.0909 9.0909 9.2877 9.2877 9.3961 9.3961 9.4639 9.4639 9.6530 9.6530 9.8294 9.8294 10.1434 10.1434 11.9498 11.9498 12.7161 12.7161 13.1700 13.1700 13.7453 13.7453 16.5317 16.5317 16.8578 16.8578 17.2969 17.2969 k =-0.1829 0.2964 0.7850 ( 4747 PWs) bands (ev): -72.1078 -72.1078 -72.1059 -72.1059 -40.9333 -40.9333 -40.9263 -40.9263 -36.4899 -36.4899 -36.4736 -36.4736 -36.4426 -36.4426 -36.4396 -36.4396 -21.6426 -21.6426 -4.5878 -4.5878 -3.5088 -3.5088 -3.4454 -3.4454 3.9725 3.9725 5.1651 5.1651 7.9350 7.9350 7.9765 7.9765 8.4286 8.4286 8.9779 8.9779 9.0812 9.0812 9.2538 9.2538 9.3733 9.3733 9.4530 9.4530 9.6475 9.6475 9.8379 9.8379 10.1375 10.1375 11.9829 11.9829 12.7945 12.7945 13.2103 13.2103 13.8511 13.8511 16.5795 16.5795 16.7832 16.7832 17.2290 17.2290 k =-0.1897 0.3073 0.7722 ( 4743 PWs) bands (ev): -72.1079 -72.1079 -72.1059 -72.1059 -40.9334 -40.9334 -40.9262 -40.9262 -36.4896 -36.4896 -36.4727 -36.4727 -36.4433 -36.4433 -36.4402 -36.4402 -21.6428 -21.6428 -4.5870 -4.5870 -3.5096 -3.5096 -3.4423 -3.4423 3.9734 3.9734 5.1384 5.1384 7.9467 7.9467 8.0077 8.0077 8.4208 8.4208 8.9653 8.9653 9.0694 9.0694 9.2162 9.2162 9.3543 9.3543 9.4448 9.4448 9.6420 9.6420 9.8471 9.8471 10.1291 10.1291 12.0204 12.0204 12.8700 12.8700 13.2491 13.2491 13.9609 13.9609 16.6286 16.6286 16.7101 16.7101 17.1669 17.1669 k =-0.1964 0.3183 0.7593 ( 4743 PWs) bands (ev): -72.1079 -72.1079 -72.1058 -72.1058 -40.9335 -40.9335 -40.9260 -40.9260 -36.4892 -36.4892 -36.4717 -36.4717 -36.4440 -36.4440 -36.4408 -36.4408 -21.6430 -21.6430 -4.5863 -4.5863 -3.5104 -3.5104 -3.4392 -3.4392 3.9742 3.9742 5.1130 5.1130 7.9577 7.9577 8.0395 8.0395 8.4142 8.4142 8.9529 8.9529 9.0539 9.0539 9.1784 9.1784 9.3393 9.3393 9.4382 9.4382 9.6365 9.6365 9.8564 9.8564 10.1181 10.1181 12.0625 12.0625 12.9415 12.9415 13.2863 13.2863 14.0744 14.0744 16.6276 16.6276 16.6901 16.6901 17.1113 17.1113 k =-0.2032 0.3292 0.7465 ( 4741 PWs) bands (ev): -72.1079 -72.1079 -72.1058 -72.1058 -40.9336 -40.9336 -40.9259 -40.9259 -36.4888 -36.4888 -36.4708 -36.4708 -36.4446 -36.4446 -36.4414 -36.4414 -21.6432 -21.6432 -4.5856 -4.5856 -3.5113 -3.5113 -3.4360 -3.4360 3.9748 3.9748 5.0888 5.0888 7.9680 7.9680 8.0716 8.0716 8.4088 8.4088 8.9403 8.9403 9.0332 9.0332 9.1434 9.1434 9.3286 9.3286 9.4328 9.4328 9.6310 9.6310 9.8655 9.8655 10.1046 10.1046 12.1088 12.1088 13.0080 13.0080 13.3218 13.3218 14.1913 14.1913 16.5572 16.5572 16.7434 16.7434 17.0629 17.0629 k =-0.2099 0.3401 0.7336 ( 4739 PWs) bands (ev): -72.1080 -72.1080 -72.1058 -72.1058 -40.9337 -40.9337 -40.9258 -40.9258 -36.4885 -36.4885 -36.4699 -36.4699 -36.4453 -36.4453 -36.4420 -36.4420 -21.6434 -21.6434 -4.5849 -4.5849 -3.5123 -3.5123 -3.4329 -3.4329 3.9753 3.9753 5.0660 5.0660 7.9779 7.9779 8.1040 8.1040 8.4045 8.4045 8.9269 8.9269 9.0065 9.0065 9.1130 9.1130 9.3222 9.3222 9.4285 9.4285 9.6258 9.6258 9.8741 9.8741 10.0888 10.0888 12.1593 12.1593 13.0683 13.0683 13.3556 13.3556 14.3113 14.3113 16.4864 16.4864 16.8016 16.8016 17.0219 17.0219 k =-0.2167 0.3510 0.7208 ( 4745 PWs) bands (ev): -72.1080 -72.1080 -72.1057 -72.1057 -40.9338 -40.9338 -40.9257 -40.9257 -36.4881 -36.4881 -36.4690 -36.4690 -36.4460 -36.4460 -36.4426 -36.4426 -21.6436 -21.6436 -4.5843 -4.5843 -3.5133 -3.5133 -3.4297 -3.4297 3.9757 3.9757 5.0446 5.0446 7.9873 7.9873 8.1365 8.1365 8.4012 8.4012 8.9118 8.9118 8.9753 8.9753 9.0873 9.0873 9.3196 9.3196 9.4254 9.4254 9.6207 9.6207 9.8819 9.8819 10.0707 10.0707 12.2138 12.2138 13.1215 13.1215 13.3875 13.3875 14.4340 14.4340 16.4182 16.4182 16.8621 16.8621 16.9888 16.9888 k =-0.2234 0.3620 0.7080 ( 4739 PWs) bands (ev): -72.1080 -72.1080 -72.1057 -72.1057 -40.9339 -40.9339 -40.9256 -40.9256 -36.4877 -36.4877 -36.4681 -36.4681 -36.4466 -36.4466 -36.4432 -36.4432 -21.6438 -21.6438 -4.5837 -4.5837 -3.5142 -3.5142 -3.4267 -3.4267 3.9760 3.9760 5.0247 5.0247 7.9965 7.9965 8.1691 8.1691 8.3990 8.3990 8.8930 8.8930 8.9434 8.9434 9.0655 9.0655 9.3200 9.3200 9.4241 9.4241 9.6159 9.6159 9.8891 9.8891 10.0506 10.0506 12.2717 12.2717 13.1665 13.1665 13.4174 13.4174 14.5593 14.5593 16.3540 16.3540 16.9222 16.9222 16.9660 16.9660 k =-0.2302 0.3729 0.6951 ( 4734 PWs) bands (ev): -72.1080 -72.1080 -72.1057 -72.1057 -40.9339 -40.9339 -40.9255 -40.9255 -36.4873 -36.4873 -36.4672 -36.4672 -36.4472 -36.4472 -36.4439 -36.4439 -21.6440 -21.6440 -4.5832 -4.5832 -3.5152 -3.5152 -3.4238 -3.4238 3.9762 3.9762 5.0064 5.0064 8.0054 8.0054 8.2014 8.2014 8.3979 8.3979 8.8681 8.8681 8.9145 8.9145 9.0468 9.0468 9.3219 9.3219 9.4254 9.4254 9.6116 9.6116 9.8954 9.8954 10.0288 10.0288 12.3328 12.3328 13.2024 13.2024 13.4452 13.4452 14.6867 14.6867 16.2944 16.2944 16.9384 16.9384 16.9967 16.9967 k =-0.2369 0.3838 0.6823 ( 4738 PWs) bands (ev): -72.1081 -72.1081 -72.1057 -72.1057 -40.9340 -40.9340 -40.9254 -40.9254 -36.4869 -36.4869 -36.4664 -36.4664 -36.4478 -36.4478 -36.4445 -36.4445 -21.6441 -21.6441 -4.5827 -4.5827 -3.5161 -3.5161 -3.4211 -3.4211 3.9763 3.9763 4.9896 4.9896 8.0140 8.0140 8.2333 8.2333 8.3981 8.3981 8.8373 8.8373 8.8895 8.8895 9.0309 9.0309 9.3239 9.3239 9.4301 9.4301 9.6076 9.6076 9.9008 9.9008 10.0057 10.0057 12.3966 12.3966 13.2286 13.2286 13.4708 13.4708 14.8156 14.8156 16.2403 16.2403 16.9289 16.9289 17.0619 17.0619 k =-0.2436 0.3948 0.6694 ( 4746 PWs) bands (ev): -72.1081 -72.1081 -72.1057 -72.1057 -40.9341 -40.9341 -40.9253 -40.9253 -36.4865 -36.4865 -36.4656 -36.4656 -36.4484 -36.4484 -36.4451 -36.4451 -21.6443 -21.6443 -4.5823 -4.5823 -3.5169 -3.5169 -3.4185 -3.4185 3.9764 3.9764 4.9745 4.9745 8.0224 8.0224 8.2643 8.2643 8.3998 8.3998 8.8038 8.8038 8.8660 8.8660 9.0180 9.0180 9.3248 9.3248 9.4389 9.4389 9.6041 9.6041 9.9051 9.9051 9.9817 9.9817 12.4625 12.4625 13.2445 13.2445 13.4941 13.4941 14.9455 14.9455 16.1921 16.1921 16.9246 16.9246 17.1292 17.1292 k =-0.2504 0.4057 0.6566 ( 4744 PWs) bands (ev): -72.1081 -72.1081 -72.1056 -72.1056 -40.9341 -40.9341 -40.9253 -40.9253 -36.4862 -36.4862 -36.4649 -36.4649 -36.4489 -36.4489 -36.4456 -36.4456 -21.6444 -21.6444 -4.5819 -4.5819 -3.5177 -3.5177 -3.4162 -3.4162 3.9764 3.9764 4.9611 4.9611 8.0303 8.0303 8.2937 8.2937 8.4037 8.4037 8.7705 8.7705 8.8420 8.8420 9.0079 9.0079 9.3241 9.3241 9.4516 9.4516 9.6010 9.6010 9.9079 9.9079 9.9577 9.9577 12.5299 12.5299 13.2500 13.2500 13.5149 13.5149 15.0756 15.0756 16.1502 16.1502 16.9262 16.9262 17.1925 17.1925 k =-0.2571 0.4166 0.6437 ( 4746 PWs) bands (ev): -72.1081 -72.1081 -72.1056 -72.1056 -40.9342 -40.9342 -40.9252 -40.9252 -36.4858 -36.4858 -36.4642 -36.4642 -36.4494 -36.4494 -36.4461 -36.4461 -21.6445 -21.6445 -4.5815 -4.5815 -3.5184 -3.5184 -3.4142 -3.4142 3.9764 3.9764 4.9494 4.9494 8.0378 8.0378 8.3202 8.3202 8.4106 8.4106 8.7389 8.7389 8.8171 8.8171 9.0004 9.0004 9.3222 9.3222 9.4674 9.4674 9.5984 9.5984 9.9069 9.9069 9.9368 9.9368 12.5982 12.5982 13.2451 13.2451 13.5332 13.5332 15.2047 15.2047 16.1146 16.1146 16.9329 16.9329 17.2066 17.2066 k =-0.2639 0.4276 0.6309 ( 4747 PWs) bands (ev): -72.1081 -72.1081 -72.1056 -72.1056 -40.9342 -40.9342 -40.9252 -40.9252 -36.4855 -36.4855 -36.4637 -36.4637 -36.4498 -36.4498 -36.4465 -36.4465 -21.6446 -21.6446 -4.5813 -4.5813 -3.5190 -3.5190 -3.4124 -3.4124 3.9764 3.9764 4.9395 4.9395 8.0445 8.0445 8.3423 8.3423 8.4217 8.4217 8.7099 8.7099 8.7917 8.7917 8.9950 8.9950 9.3194 9.3194 9.4850 9.4850 9.5963 9.5963 9.8951 9.8951 9.9263 9.9263 12.6664 12.6664 13.2306 13.2306 13.5488 13.5488 15.3312 15.3312 16.0854 16.0854 16.9426 16.9426 17.1043 17.1043 k =-0.2706 0.4385 0.6180 ( 4744 PWs) bands (ev): -72.1081 -72.1081 -72.1056 -72.1056 -40.9342 -40.9342 -40.9251 -40.9251 -36.4852 -36.4852 -36.4632 -36.4632 -36.4502 -36.4502 -36.4469 -36.4469 -21.6447 -21.6447 -4.5810 -4.5810 -3.5195 -3.5195 -3.4109 -3.4109 3.9763 3.9763 4.9313 4.9313 8.0504 8.0504 8.3587 8.3587 8.4374 8.4374 8.6843 8.6843 8.7667 8.7667 8.9912 8.9912 9.3165 9.3165 9.5032 9.5032 9.5947 9.5947 9.8751 9.8751 9.9249 9.9249 12.7334 12.7334 13.2072 13.2072 13.5617 13.5617 15.4522 15.4522 16.0626 16.0626 16.9428 16.9428 16.9936 16.9936 k =-0.2774 0.4494 0.6052 ( 4744 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9342 -40.9342 -40.9251 -40.9251 -36.4850 -36.4850 -36.4629 -36.4629 -36.4505 -36.4505 -36.4471 -36.4471 -21.6448 -21.6448 -4.5808 -4.5808 -3.5199 -3.5199 -3.4097 -3.4097 3.9763 3.9763 4.9250 4.9250 8.0552 8.0552 8.3697 8.3697 8.4563 8.4563 8.6627 8.6627 8.7433 8.7433 8.9887 8.9887 9.3137 9.3137 9.5203 9.5203 9.5936 9.5936 9.8551 9.8551 9.9254 9.9254 12.7979 12.7979 13.1766 13.1766 13.5719 13.5719 15.5633 15.5633 16.0460 16.0460 16.8540 16.8540 16.9798 16.9798 k =-0.2841 0.4604 0.5924 ( 4750 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9343 -40.9343 -40.9251 -40.9251 -36.4847 -36.4847 -36.4628 -36.4628 -36.4508 -36.4508 -36.4472 -36.4472 -21.6448 -21.6448 -4.5807 -4.5807 -3.5202 -3.5202 -3.4089 -3.4089 3.9763 3.9763 4.9204 4.9204 8.0587 8.0587 8.3768 8.3768 8.4747 8.4747 8.6459 8.6459 8.7234 8.7234 8.9870 8.9870 9.3115 9.3115 9.5343 9.5343 9.5931 9.5931 9.8384 9.8384 9.9262 9.9262 12.8569 12.8569 13.1416 13.1416 13.5791 13.5791 15.6569 15.6569 16.0356 16.0356 16.7566 16.7566 16.9904 16.9904 k =-0.2909 0.4713 0.5795 ( 4752 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9343 -40.9343 -40.9250 -40.9250 -36.4846 -36.4846 -36.4628 -36.4628 -36.4510 -36.4510 -36.4472 -36.4472 -21.6449 -21.6449 -4.5806 -4.5806 -3.5204 -3.5204 -3.4084 -3.4084 3.9762 3.9762 4.9177 4.9177 8.0609 8.0609 8.3808 8.3808 8.4887 8.4887 8.6349 8.6349 8.7095 8.7095 8.9861 8.9861 9.3100 9.3100 9.5436 9.5436 9.5929 9.5929 9.8274 9.8274 9.9267 9.9267 12.9042 12.9042 13.1087 13.1087 13.5835 13.5835 15.7216 15.7216 16.0308 16.0308 16.6873 16.6873 16.9987 16.9987 k =-0.2976 0.4822 0.5667 ( 4752 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9343 -40.9343 -40.9250 -40.9250 -36.4844 -36.4844 -36.4629 -36.4629 -36.4512 -36.4512 -36.4470 -36.4470 -21.6449 -21.6449 -4.5806 -4.5806 -3.5205 -3.5205 -3.4082 -3.4082 3.9762 3.9762 4.9167 4.9167 8.0616 8.0616 8.3822 8.3822 8.4943 8.4943 8.6310 8.6310 8.7042 8.7042 8.9858 8.9858 9.3096 9.3096 9.5465 9.5465 9.5929 9.5929 9.8238 9.8238 9.9268 9.9268 12.9243 12.9243 13.0934 13.0934 13.5850 13.5850 15.7449 15.7449 16.0297 16.0297 16.6619 16.6619 17.0018 17.0018 k =-0.2976 0.4822 0.5667 ( 4752 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9343 -40.9343 -40.9250 -40.9250 -36.4844 -36.4844 -36.4629 -36.4629 -36.4512 -36.4512 -36.4470 -36.4470 -21.6449 -21.6449 -4.5806 -4.5806 -3.5205 -3.5205 -3.4082 -3.4082 3.9762 3.9762 4.9167 4.9167 8.0616 8.0616 8.3822 8.3822 8.4943 8.4943 8.6310 8.6310 8.7042 8.7042 8.9858 8.9858 9.3096 9.3096 9.5465 9.5465 9.5929 9.5929 9.8238 9.8238 9.9268 9.9268 12.9243 12.9243 13.0934 13.0934 13.5850 13.5850 15.7449 15.7449 16.0297 16.0297 16.6619 16.6619 17.0018 17.0018 k =-0.2908 0.4713 0.5538 ( 4748 PWs) bands (ev): -72.1080 -72.1080 -72.1058 -72.1058 -40.9336 -40.9336 -40.9257 -40.9257 -36.4830 -36.4830 -36.4644 -36.4644 -36.4509 -36.4509 -36.4473 -36.4473 -21.6448 -21.6448 -4.5814 -4.5814 -3.5224 -3.5224 -3.4075 -3.4075 3.9722 3.9722 4.9573 4.9573 8.0665 8.0665 8.3596 8.3596 8.5113 8.5113 8.6089 8.6089 8.7424 8.7424 9.0154 9.0154 9.2960 9.2960 9.5237 9.5237 9.5864 9.5864 9.7799 9.7799 9.9243 9.9243 12.9397 12.9397 13.0408 13.0408 13.4792 13.4792 15.6533 15.6533 16.0999 16.0999 16.6450 16.6450 17.0765 17.0765 k =-0.2841 0.4603 0.5409 ( 4740 PWs) bands (ev): -72.1078 -72.1078 -72.1060 -72.1060 -40.9330 -40.9330 -40.9263 -40.9263 -36.4815 -36.4815 -36.4659 -36.4659 -36.4506 -36.4506 -36.4476 -36.4476 -21.6447 -21.6447 -4.5821 -4.5821 -3.5240 -3.5240 -3.4069 -3.4069 3.9652 3.9652 4.9974 4.9974 8.0602 8.0602 8.3439 8.3439 8.5246 8.5246 8.5942 8.5942 8.7843 8.7843 9.0420 9.0420 9.2825 9.2825 9.5013 9.5013 9.5854 9.5854 9.7380 9.7380 9.9263 9.9263 12.9439 12.9439 13.0024 13.0024 13.3748 13.3748 15.5584 15.5584 16.1720 16.1720 16.6311 16.6311 17.1508 17.1508 k =-0.2773 0.4493 0.5280 ( 4728 PWs) bands (ev): -72.1076 -72.1076 -72.1061 -72.1061 -40.9323 -40.9323 -40.9270 -40.9270 -36.4799 -36.4799 -36.4674 -36.4674 -36.4503 -36.4503 -36.4479 -36.4479 -21.6446 -21.6446 -4.5827 -4.5827 -3.5253 -3.5253 -3.4063 -3.4063 3.9550 3.9550 5.0369 5.0369 8.0437 8.0437 8.3362 8.3362 8.5204 8.5204 8.5998 8.5998 8.8285 8.8285 9.0628 9.0628 9.2728 9.2728 9.4801 9.4801 9.5878 9.5878 9.6991 9.6991 9.9321 9.9321 12.9154 12.9154 12.9998 12.9998 13.2720 13.2720 15.4621 15.4621 16.2435 16.2435 16.6203 16.6203 17.2240 17.2240 k =-0.2706 0.4384 0.5151 ( 4732 PWs) bands (ev): -72.1074 -72.1074 -72.1063 -72.1063 -40.9317 -40.9317 -40.9276 -40.9276 -36.4784 -36.4784 -36.4690 -36.4690 -36.4500 -36.4500 -36.4482 -36.4482 -21.6446 -21.6446 -4.5831 -4.5831 -3.5262 -3.5262 -3.4057 -3.4057 3.9415 3.9415 5.0756 5.0756 8.0201 8.0201 8.3335 8.3335 8.5022 8.5022 8.6216 8.6216 8.8745 8.8745 9.0743 9.0743 9.2711 9.2711 9.4612 9.4612 9.5907 9.5907 9.6658 9.6658 9.9415 9.9415 12.8725 12.8725 13.0151 13.0151 13.1708 13.1708 15.3647 15.3647 16.3128 16.3128 16.6125 16.6125 17.2958 17.2958 k =-0.2638 0.4274 0.5023 ( 4728 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9310 -40.9310 -40.9283 -40.9283 -36.4769 -36.4769 -36.4705 -36.4705 -36.4497 -36.4497 -36.4485 -36.4485 -21.6445 -21.6445 -4.5833 -4.5833 -3.5269 -3.5269 -3.4052 -3.4052 3.9248 3.9248 5.1134 5.1134 7.9930 7.9930 8.3323 8.3323 8.4803 8.4803 8.6492 8.6492 8.9220 8.9220 9.0744 9.0744 9.2797 9.2797 9.4456 9.4456 9.5874 9.5874 9.6452 9.6452 9.9541 9.9541 12.8292 12.8292 13.0329 13.0329 13.0726 13.0726 15.2668 15.2668 16.3783 16.3783 16.6077 16.6077 17.3658 17.3658 k =-0.2570 0.4165 0.4894 ( 4728 PWs) bands (ev): -72.1070 -72.1070 -72.1067 -72.1067 -40.9304 -40.9304 -40.9290 -40.9290 -36.4753 -36.4753 -36.4721 -36.4721 -36.4494 -36.4494 -36.4488 -36.4488 -21.6445 -21.6445 -4.5834 -4.5834 -3.5272 -3.5272 -3.4047 -3.4047 3.9048 3.9048 5.1500 5.1500 7.9650 7.9650 8.3296 8.3296 8.4583 8.4583 8.6788 8.6788 8.9702 8.9702 9.0650 9.0650 9.2963 9.2963 9.4344 9.4344 9.5722 9.5722 9.6436 9.6436 9.9698 9.9698 12.7878 12.7878 12.9711 12.9711 13.0576 13.0576 15.1685 15.1685 16.4384 16.4384 16.6061 16.6061 17.4335 17.4335 k =-0.2503 0.4055 0.4765 ( 4740 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9296 -40.9296 -36.4738 -36.4738 -36.4736 -36.4736 -36.4491 -36.4491 -36.4491 -36.4491 -21.6445 -21.6445 -4.5834 -4.5834 -3.5272 -3.5272 -3.4044 -3.4044 3.8816 3.8816 5.1852 5.1852 7.9376 7.9376 8.3235 8.3235 8.4372 8.4372 8.7091 8.7091 9.0182 9.0182 9.0499 9.0499 9.3153 9.3153 9.4302 9.4302 9.5545 9.5545 9.6530 9.6530 9.9883 9.9883 12.7485 12.7485 12.8754 12.8754 13.0799 13.0799 15.0699 15.0699 16.4913 16.4913 16.6074 16.6074 17.4989 17.4989 k =-0.2435 0.3945 0.4636 ( 4734 PWs) bands (ev): -72.1071 -72.1071 -72.1067 -72.1067 -40.9303 -40.9303 -40.9290 -40.9290 -36.4752 -36.4752 -36.4722 -36.4722 -36.4494 -36.4494 -36.4488 -36.4488 -21.6446 -21.6446 -4.5831 -4.5831 -3.5268 -3.5268 -3.4041 -3.4041 3.8552 3.8552 5.2190 5.2190 7.9119 7.9119 8.3134 8.3134 8.4171 8.4171 8.7394 8.7394 9.0325 9.0325 9.0639 9.0639 9.3306 9.3306 9.4363 9.4363 9.5431 9.5431 9.6670 9.6670 10.0097 10.0097 12.7100 12.7100 12.7830 12.7830 13.1041 13.1041 14.9712 14.9712 16.5349 16.5349 16.6118 16.6118 17.5617 17.5617 k =-0.2367 0.3836 0.4508 ( 4748 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9310 -40.9310 -40.9284 -40.9284 -36.4767 -36.4767 -36.4707 -36.4707 -36.4497 -36.4497 -36.4485 -36.4485 -21.6446 -21.6446 -4.5827 -4.5827 -3.5261 -3.5261 -3.4038 -3.4038 3.8259 3.8259 5.2510 5.2510 7.8883 7.8883 8.2993 8.2993 8.3973 8.3973 8.7692 8.7692 9.0152 9.0152 9.1035 9.1035 9.3408 9.3408 9.4540 9.4540 9.5421 9.5421 9.6830 9.6830 10.0335 10.0335 12.6611 12.6611 12.7055 12.7055 13.1296 13.1296 14.8724 14.8724 16.5672 16.5672 16.6191 16.6191 17.6220 17.6220 k =-0.2300 0.3726 0.4379 ( 4750 PWs) bands (ev): -72.1074 -72.1074 -72.1063 -72.1063 -40.9316 -40.9316 -40.9277 -40.9277 -36.4783 -36.4783 -36.4691 -36.4691 -36.4500 -36.4500 -36.4482 -36.4482 -21.6447 -21.6447 -4.5822 -4.5822 -3.5250 -3.5250 -3.4037 -3.4037 3.7937 3.7937 5.2812 5.2812 7.8670 7.8670 8.2821 8.2821 8.3772 8.3772 8.7976 8.7976 8.9998 8.9998 9.1313 9.1313 9.3536 9.3536 9.4792 9.4792 9.5537 9.5537 9.7005 9.7005 10.0599 10.0599 12.5814 12.5814 12.6633 12.6633 13.1566 13.1566 14.7738 14.7738 16.5867 16.5867 16.6293 16.6293 17.6803 17.6803 k =-0.2232 0.3617 0.4250 ( 4754 PWs) bands (ev): -72.1076 -72.1076 -72.1062 -72.1062 -40.9323 -40.9323 -40.9270 -40.9270 -36.4798 -36.4798 -36.4676 -36.4676 -36.4503 -36.4503 -36.4479 -36.4479 -21.6448 -21.6448 -4.5814 -4.5814 -3.5236 -3.5236 -3.4036 -3.4036 3.7588 3.7588 5.3093 5.3093 7.8479 7.8479 8.2626 8.2626 8.3562 8.3562 8.8234 8.8234 8.9881 8.9881 9.1420 9.1420 9.3774 9.3774 9.5080 9.5080 9.5780 9.5780 9.7191 9.7191 10.0886 10.0886 12.4926 12.4926 12.6349 12.6349 13.1851 13.1851 14.6753 14.6753 16.5923 16.5923 16.6421 16.6421 17.7371 17.7371 k =-0.2164 0.3507 0.4121 ( 4750 PWs) bands (ev): -72.1078 -72.1078 -72.1060 -72.1060 -40.9329 -40.9329 -40.9264 -40.9264 -36.4813 -36.4813 -36.4660 -36.4660 -36.4506 -36.4506 -36.4476 -36.4476 -21.6449 -21.6449 -4.5805 -4.5805 -3.5218 -3.5218 -3.4035 -3.4035 3.7215 3.7215 5.3354 5.3354 7.8309 7.8309 8.2415 8.2415 8.3344 8.3344 8.8447 8.8447 8.9823 8.9823 9.1368 9.1368 9.4135 9.4135 9.5400 9.5400 9.6126 9.6126 9.7387 9.7387 10.1196 10.1196 12.4034 12.4034 12.6117 12.6117 13.2152 13.2152 14.5769 14.5769 16.5832 16.5832 16.6575 16.6575 17.7927 17.7927 k =-0.2097 0.3397 0.3992 ( 4754 PWs) bands (ev): -72.1080 -72.1080 -72.1058 -72.1058 -40.9336 -40.9336 -40.9257 -40.9257 -36.4828 -36.4828 -36.4645 -36.4645 -36.4509 -36.4509 -36.4473 -36.4473 -21.6450 -21.6450 -4.5795 -4.5795 -3.5197 -3.5197 -3.4036 -3.4036 3.6821 3.6821 5.3592 5.3592 7.8154 7.8154 8.2192 8.2192 8.3122 8.3122 8.8587 8.8587 8.9847 8.9847 9.1216 9.1216 9.4563 9.4563 9.5768 9.5768 9.6544 9.6544 9.7595 9.7595 10.1524 10.1524 12.3151 12.3151 12.5925 12.5925 13.2468 13.2468 14.4789 14.4789 16.5596 16.5596 16.6757 16.6757 17.8474 17.8474 k =-0.2029 0.3288 0.3864 ( 4746 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9342 -40.9342 -40.9251 -40.9251 -36.4843 -36.4843 -36.4630 -36.4630 -36.4512 -36.4512 -36.4470 -36.4470 -21.6452 -21.6452 -4.5783 -4.5783 -3.5173 -3.5173 -3.4037 -3.4037 3.6407 3.6407 5.3808 5.3808 7.8012 7.8012 8.1961 8.1961 8.2901 8.2901 8.8642 8.8642 8.9956 8.9956 9.1026 9.1026 9.5011 9.5011 9.6189 9.6189 9.7021 9.7021 9.7819 9.7819 10.1871 10.1871 12.2280 12.2280 12.5770 12.5770 13.2801 13.2801 14.3812 14.3812 16.5225 16.5225 16.6967 16.6967 17.9014 17.9014 k =-0.1962 0.3178 0.3735 ( 4736 PWs) bands (ev): -72.1083 -72.1083 -72.1054 -72.1054 -40.9349 -40.9349 -40.9244 -40.9244 -36.4858 -36.4858 -36.4616 -36.4616 -36.4515 -36.4515 -36.4466 -36.4466 -21.6453 -21.6453 -4.5770 -4.5770 -3.5146 -3.5146 -3.4038 -3.4038 3.5977 3.5977 5.4000 5.4000 7.7873 7.7873 8.1725 8.1725 8.2689 8.2689 8.8628 8.8628 9.0107 9.0107 9.0859 9.0859 9.5453 9.5453 9.6640 9.6640 9.7558 9.7558 9.8067 9.8067 10.2233 10.2233 12.1424 12.1424 12.5653 12.5653 13.3150 13.3150 14.2838 14.2838 16.4735 16.4735 16.7203 16.7203 17.9543 17.9543 k =-0.1894 0.3069 0.3606 ( 4734 PWs) bands (ev): -72.1085 -72.1085 -72.1052 -72.1052 -40.9355 -40.9355 -40.9238 -40.9238 -36.4872 -36.4872 -36.4601 -36.4601 -36.4517 -36.4517 -36.4463 -36.4463 -21.6455 -21.6455 -4.5756 -4.5756 -3.5115 -3.5115 -3.4041 -3.4041 3.5533 3.5533 5.4168 5.4168 7.7733 7.7733 8.1491 8.1491 8.2490 8.2490 8.8564 8.8564 9.0195 9.0195 9.0813 9.0813 9.5881 9.5881 9.7080 9.7080 9.8159 9.8159 9.8354 9.8354 10.2607 10.2607 12.0581 12.0581 12.5573 12.5573 13.3516 13.3516 14.1868 14.1868 16.4145 16.4145 16.7464 16.7464 18.0055 18.0055 k =-0.1826 0.2959 0.3477 ( 4738 PWs) bands (ev): -72.1087 -72.1087 -72.1051 -72.1051 -40.9361 -40.9361 -40.9232 -40.9232 -36.4886 -36.4886 -36.4587 -36.4587 -36.4520 -36.4520 -36.4460 -36.4460 -21.6457 -21.6457 -4.5740 -4.5740 -3.5082 -3.5082 -3.4043 -3.4043 3.5078 3.5078 5.4312 5.4312 7.7583 7.7583 8.1266 8.1266 8.2309 8.2309 8.8461 8.8461 9.0148 9.0148 9.0960 9.0960 9.6302 9.6302 9.7471 9.7471 9.8678 9.8678 9.8845 9.8845 10.2990 10.2990 11.9753 11.9753 12.5533 12.5533 13.3898 13.3898 14.0903 14.0903 16.3474 16.3474 16.7749 16.7749 18.0544 18.0544 k =-0.1759 0.2849 0.3348 ( 4740 PWs) bands (ev): -72.1089 -72.1089 -72.1049 -72.1049 -40.9367 -40.9367 -40.9226 -40.9226 -36.4900 -36.4900 -36.4573 -36.4573 -36.4523 -36.4523 -36.4458 -36.4458 -21.6459 -21.6459 -4.5724 -4.5724 -3.5046 -3.5046 -3.4046 -3.4046 3.4615 3.4615 5.4433 5.4433 7.7414 7.7414 8.1059 8.1059 8.2147 8.2147 8.8319 8.8319 9.0061 9.0061 9.1212 9.1212 9.6719 9.6719 9.7799 9.7799 9.9072 9.9072 9.9578 9.9578 10.3379 10.3379 11.8941 11.8941 12.5533 12.5533 13.4297 13.4297 13.9944 13.9944 16.2739 16.2739 16.8058 16.8058 18.1002 18.1002 k =-0.1691 0.2740 0.3220 ( 4740 PWs) bands (ev): -72.1090 -72.1090 -72.1047 -72.1047 -40.9373 -40.9373 -40.9220 -40.9220 -36.4914 -36.4914 -36.4559 -36.4559 -36.4525 -36.4525 -36.4455 -36.4455 -21.6461 -21.6461 -4.5707 -4.5707 -3.5008 -3.5008 -3.4050 -3.4050 3.4146 3.4146 5.4532 5.4532 7.7222 7.7222 8.0880 8.0880 8.2004 8.2004 8.8136 8.8136 9.0008 9.0008 9.1499 9.1499 9.7136 9.7136 9.8073 9.8073 9.9513 9.9513 10.0365 10.0365 10.3771 10.3771 11.8146 11.8146 12.5575 12.5575 13.4711 13.4711 13.8990 13.8990 16.1957 16.1957 16.8390 16.8390 18.1423 18.1423 k =-0.1623 0.2630 0.3091 ( 4744 PWs) bands (ev): -72.1092 -72.1092 -72.1046 -72.1046 -40.9378 -40.9378 -40.9214 -40.9214 -36.4927 -36.4927 -36.4546 -36.4546 -36.4528 -36.4528 -36.4452 -36.4452 -21.6463 -21.6463 -4.5689 -4.5689 -3.4968 -3.4968 -3.4054 -3.4054 3.3675 3.3675 5.4608 5.4608 7.7001 7.7001 8.0733 8.0733 8.1880 8.1880 8.7916 8.7916 9.0006 9.0006 9.1800 9.1800 9.7551 9.7551 9.8309 9.8309 9.9986 9.9986 10.1187 10.1187 10.4164 10.4164 11.7369 11.7369 12.5661 12.5661 13.5139 13.5139 13.8045 13.8045 16.1140 16.1140 16.8743 16.8743 18.1799 18.1799 k =-0.1556 0.2521 0.2962 ( 4744 PWs) bands (ev): -72.1094 -72.1094 -72.1044 -72.1044 -40.9384 -40.9384 -40.9209 -40.9209 -36.4940 -36.4940 -36.4534 -36.4534 -36.4529 -36.4529 -36.4448 -36.4448 -21.6466 -21.6466 -4.5670 -4.5670 -3.4926 -3.4926 -3.4057 -3.4057 3.3204 3.3204 5.4664 5.4664 7.6751 7.6751 8.0622 8.0622 8.1774 8.1774 8.7666 8.7666 9.0059 9.0059 9.2106 9.2106 9.7964 9.7964 9.8521 9.8521 10.0485 10.0485 10.2037 10.2037 10.4553 10.4553 11.6612 11.6612 12.5793 12.5793 13.5573 13.5573 13.7114 13.7114 16.0301 16.0301 16.9116 16.9116 18.2126 18.2126 k =-0.1488 0.2411 0.2833 ( 4748 PWs) bands (ev): -72.1095 -72.1095 -72.1043 -72.1043 -40.9389 -40.9389 -40.9203 -40.9203 -36.4952 -36.4952 -36.4533 -36.4533 -36.4520 -36.4520 -36.4445 -36.4445 -21.6468 -21.6468 -4.5651 -4.5651 -3.4882 -3.4882 -3.4061 -3.4061 3.2735 3.2735 5.4700 5.4700 7.6473 7.6473 8.0545 8.0545 8.1687 8.1687 8.7396 8.7396 9.0160 9.0160 9.2411 9.2411 9.8370 9.8370 9.8720 9.8720 10.1001 10.1001 10.2901 10.2901 10.4938 10.4938 11.5876 11.5876 12.5971 12.5971 13.5886 13.5886 13.6327 13.6327 15.9449 15.9449 16.9508 16.9508 18.2398 18.2398 k =-0.1420 0.2301 0.2705 ( 4744 PWs) bands (ev): -72.1097 -72.1097 -72.1041 -72.1041 -40.9395 -40.9395 -40.9198 -40.9198 -36.4964 -36.4964 -36.4535 -36.4535 -36.4508 -36.4508 -36.4442 -36.4442 -21.6471 -21.6471 -4.5632 -4.5632 -3.4837 -3.4837 -3.4065 -3.4065 3.2270 3.2270 5.4718 5.4718 7.6174 7.6174 8.0498 8.0498 8.1618 8.1618 8.7113 8.7113 9.0303 9.0303 9.2714 9.2714 9.8752 9.8752 9.8929 9.8929 10.1531 10.1531 10.3769 10.3769 10.5319 10.5319 11.5167 11.5167 12.6197 12.6197 13.5177 13.5177 13.6582 13.6582 15.8593 15.8593 16.9916 16.9916 18.2607 18.2607 k =-0.1353 0.2192 0.2576 ( 4742 PWs) bands (ev): -72.1098 -72.1098 -72.1040 -72.1040 -40.9400 -40.9400 -40.9193 -40.9193 -36.4976 -36.4976 -36.4537 -36.4537 -36.4497 -36.4497 -36.4439 -36.4439 -21.6473 -21.6473 -4.5612 -4.5612 -3.4791 -3.4791 -3.4069 -3.4069 3.1813 3.1813 5.4720 5.4720 7.5858 7.5858 8.0477 8.0477 8.1568 8.1568 8.6824 8.6824 9.0483 9.0483 9.3012 9.3012 9.9021 9.9021 9.9233 9.9233 10.2072 10.2072 10.4619 10.4619 10.5702 10.5702 11.4489 11.4489 12.6473 12.6473 13.4268 13.4268 13.7058 13.7058 15.7738 15.7738 17.0338 17.0338 18.2749 18.2749 k =-0.1285 0.2082 0.2447 ( 4750 PWs) bands (ev): -72.1099 -72.1099 -72.1038 -72.1038 -40.9404 -40.9404 -40.9188 -40.9188 -36.4987 -36.4987 -36.4540 -36.4540 -36.4486 -36.4486 -36.4436 -36.4436 -21.6476 -21.6476 -4.5593 -4.5593 -3.4745 -3.4745 -3.4072 -3.4072 3.1365 3.1365 5.4707 5.4707 7.5531 7.5531 8.0474 8.0474 8.1537 8.1537 8.6532 8.6532 9.0695 9.0695 9.3303 9.3303 9.9204 9.9204 9.9606 9.9606 10.2622 10.2622 10.5402 10.5402 10.6121 10.6121 11.3855 11.3855 12.6799 12.6799 13.3355 13.3355 13.7557 13.7557 15.6890 15.6890 17.0769 17.0769 18.2811 18.2811 k =-0.1218 0.1973 0.2318 ( 4744 PWs) bands (ev): -72.1101 -72.1101 -72.1037 -72.1037 -40.9409 -40.9409 -40.9183 -40.9183 -36.4998 -36.4998 -36.4542 -36.4542 -36.4477 -36.4477 -36.4432 -36.4432 -21.6478 -21.6478 -4.5574 -4.5574 -3.4699 -3.4699 -3.4075 -3.4075 3.0929 3.0929 5.4682 5.4682 7.5199 7.5199 8.0486 8.0486 8.1524 8.1524 8.6241 8.6241 9.0935 9.0935 9.3588 9.3588 9.9367 9.9367 9.9983 9.9983 10.3181 10.3181 10.6004 10.6004 10.6666 10.6666 11.3281 11.3281 12.7174 12.7174 13.2446 13.2446 13.8070 13.8070 15.6052 15.6052 17.1207 17.1207 18.2780 18.2780 k =-0.1150 0.1863 0.2189 ( 4748 PWs) bands (ev): -72.1102 -72.1102 -72.1036 -72.1036 -40.9414 -40.9414 -40.9178 -40.9178 -36.5008 -36.5008 -36.4543 -36.4543 -36.4468 -36.4468 -36.4428 -36.4428 -21.6481 -21.6481 -4.5555 -4.5555 -3.4653 -3.4653 -3.4077 -3.4077 3.0505 3.0505 5.4645 5.4645 7.4867 7.4867 8.0507 8.0507 8.1528 8.1528 8.5952 8.5952 9.1199 9.1199 9.3864 9.3864 9.9522 9.9522 10.0349 10.0349 10.3747 10.3747 10.6400 10.6400 10.7323 10.7323 11.2802 11.2802 12.7598 12.7598 13.1545 13.1545 13.8594 13.8594 15.5229 15.5229 17.1644 17.1644 18.2635 18.2635 k =-0.1082 0.1754 0.2061 ( 4748 PWs) bands (ev): -72.1103 -72.1103 -72.1035 -72.1035 -40.9418 -40.9418 -40.9174 -40.9174 -36.5018 -36.5018 -36.4545 -36.4545 -36.4460 -36.4460 -36.4423 -36.4423 -21.6483 -21.6483 -4.5536 -4.5536 -3.4609 -3.4609 -3.4078 -3.4078 3.0096 3.0096 5.4600 5.4600 7.4539 7.4539 8.0535 8.0535 8.1549 8.1549 8.5667 8.5667 9.1485 9.1485 9.4130 9.4130 9.9670 9.9670 10.0701 10.0701 10.4318 10.4318 10.6696 10.6696 10.7923 10.7923 11.2477 11.2477 12.8071 12.8071 13.0652 13.0652 13.9125 13.9125 15.4422 15.4422 17.2070 17.2070 18.2347 18.2347 k =-0.1015 0.1644 0.1932 ( 4744 PWs) bands (ev): -72.1104 -72.1104 -72.1034 -72.1034 -40.9422 -40.9422 -40.9170 -40.9170 -36.5027 -36.5027 -36.4547 -36.4547 -36.4454 -36.4454 -36.4418 -36.4418 -21.6486 -21.6486 -4.5518 -4.5518 -3.4566 -3.4566 -3.4078 -3.4078 2.9704 2.9704 5.4547 5.4547 7.4218 7.4218 8.0569 8.0569 8.1584 8.1584 8.5387 8.5387 9.1789 9.1789 9.4387 9.4387 9.9811 9.9811 10.1037 10.1037 10.4893 10.4893 10.6932 10.6932 10.8333 10.8333 11.2396 11.2396 12.8590 12.8590 12.9768 12.9768 13.9662 13.9662 15.3634 15.3634 17.2473 17.2473 18.1890 18.1890 k =-0.0947 0.1534 0.1803 ( 4746 PWs) bands (ev): -72.1105 -72.1105 -72.1033 -72.1033 -40.9426 -40.9426 -40.9166 -40.9166 -36.5036 -36.5036 -36.4549 -36.4549 -36.4448 -36.4448 -36.4412 -36.4412 -21.6488 -21.6488 -4.5500 -4.5500 -3.4525 -3.4525 -3.4076 -3.4076 2.9330 2.9330 5.4489 5.4489 7.3908 7.3908 8.0606 8.0606 8.1630 8.1630 8.5114 8.5114 9.2108 9.2108 9.4633 9.4633 9.9945 9.9945 10.1356 10.1356 10.5465 10.5465 10.7105 10.7105 10.8495 10.8495 11.2620 11.2620 12.8893 12.8893 12.9153 12.9153 14.0201 14.0201 15.2864 15.2864 17.2828 17.2828 18.1258 18.1258 k =-0.0879 0.1425 0.1674 ( 4742 PWs) bands (ev): -72.1106 -72.1106 -72.1032 -72.1032 -40.9429 -40.9429 -40.9162 -40.9162 -36.5044 -36.5044 -36.4550 -36.4550 -36.4444 -36.4444 -36.4406 -36.4406 -21.6490 -21.6490 -4.5484 -4.5484 -3.4488 -3.4488 -3.4072 -3.4072 2.8976 2.8976 5.4428 5.4428 7.3612 7.3612 8.0649 8.0649 8.1686 8.1686 8.4848 8.4848 9.2439 9.2439 9.4869 9.4869 10.0073 10.0073 10.1657 10.1657 10.6025 10.6025 10.7182 10.7182 10.8486 10.8486 11.3109 11.3109 12.8031 12.8031 12.9754 12.9754 14.0739 14.0739 15.2114 15.2114 17.3102 17.3102 18.0476 18.0476 k =-0.0812 0.1315 0.1545 ( 4738 PWs) bands (ev): -72.1107 -72.1107 -72.1031 -72.1031 -40.9433 -40.9433 -40.9159 -40.9159 -36.5052 -36.5052 -36.4552 -36.4552 -36.4440 -36.4440 -36.4400 -36.4400 -21.6492 -21.6492 -4.5468 -4.5468 -3.4454 -3.4454 -3.4065 -3.4065 2.8642 2.8642 5.4364 5.4364 7.3331 7.3331 8.0696 8.0696 8.1748 8.1748 8.4591 8.4591 9.2779 9.2779 9.5093 9.5093 10.0194 10.0194 10.1937 10.1937 10.6534 10.6534 10.7133 10.7133 10.8475 10.8475 11.3759 11.3759 12.7181 12.7181 13.0391 13.0391 14.1272 14.1272 15.1385 15.1385 17.3245 17.3245 17.9594 17.9594 k =-0.0744 0.1206 0.1417 ( 4736 PWs) bands (ev): -72.1108 -72.1108 -72.1030 -72.1030 -40.9436 -40.9436 -40.9156 -40.9156 -36.5059 -36.5059 -36.4553 -36.4553 -36.4437 -36.4437 -36.4394 -36.4394 -21.6494 -21.6494 -4.5453 -4.5453 -3.4424 -3.4424 -3.4057 -3.4057 2.8331 2.8331 5.4299 5.4299 7.3066 7.3066 8.0749 8.0749 8.1813 8.1813 8.4342 8.4342 9.3123 9.3123 9.5308 9.5308 10.0307 10.0307 10.2196 10.2196 10.6690 10.6690 10.7219 10.7219 10.8579 10.8579 11.4485 11.4485 12.6345 12.6345 13.1057 13.1057 14.1797 14.1797 15.0676 15.0676 17.3192 17.3192 17.8659 17.8659 k =-0.0676 0.1096 0.1288 ( 4726 PWs) bands (ev): -72.1109 -72.1109 -72.1029 -72.1029 -40.9438 -40.9438 -40.9153 -40.9153 -36.5066 -36.5066 -36.4554 -36.4554 -36.4435 -36.4435 -36.4388 -36.4388 -21.6496 -21.6496 -4.5439 -4.5439 -3.4399 -3.4399 -3.4046 -3.4046 2.8043 2.8043 5.4235 5.4235 7.2821 7.2821 8.0808 8.0808 8.1877 8.1877 8.4103 8.4103 9.3468 9.3468 9.5514 9.5514 10.0412 10.0412 10.2433 10.2433 10.6372 10.6372 10.7582 10.7582 10.8827 10.8827 11.5233 11.5233 12.5527 12.5527 13.1746 13.1746 14.2308 14.2308 14.9988 14.9988 17.2905 17.2905 17.7710 17.7710 k =-0.0609 0.0986 0.1159 ( 4730 PWs) bands (ev): -72.1109 -72.1109 -72.1028 -72.1028 -40.9441 -40.9441 -40.9150 -40.9150 -36.5072 -36.5072 -36.4555 -36.4555 -36.4433 -36.4433 -36.4383 -36.4383 -21.6498 -21.6498 -4.5426 -4.5426 -3.4378 -3.4378 -3.4033 -3.4033 2.7779 2.7779 5.4174 5.4174 7.2596 7.2596 8.0873 8.0873 8.1940 8.1940 8.3873 8.3873 9.3806 9.3806 9.5711 9.5711 10.0509 10.0509 10.2646 10.2646 10.5953 10.5953 10.7877 10.7877 10.9212 10.9212 11.5972 11.5972 12.4729 12.4729 13.2450 13.2450 14.2800 14.2800 14.9320 14.9320 17.2404 17.2404 17.6777 17.6777 k =-0.0541 0.0877 0.1030 ( 4732 PWs) bands (ev): -72.1110 -72.1110 -72.1028 -72.1028 -40.9443 -40.9443 -40.9148 -40.9148 -36.5077 -36.5077 -36.4556 -36.4556 -36.4431 -36.4431 -36.4378 -36.4378 -21.6500 -21.6500 -4.5415 -4.5415 -3.4361 -3.4361 -3.4018 -3.4018 2.7541 2.7541 5.4115 5.4115 7.2391 7.2391 8.0945 8.0945 8.1998 8.1998 8.3655 8.3655 9.4132 9.4132 9.5902 9.5902 10.0597 10.0597 10.2836 10.2836 10.5509 10.5509 10.8081 10.8081 10.9700 10.9700 11.6678 11.6678 12.3955 12.3955 13.3161 13.3161 14.3268 14.3268 14.8674 14.8674 17.1765 17.1765 17.5887 17.5887 k =-0.0473 0.0767 0.0902 ( 4724 PWs) bands (ev): -72.1111 -72.1111 -72.1027 -72.1027 -40.9445 -40.9445 -40.9145 -40.9145 -36.5082 -36.5082 -36.4557 -36.4557 -36.4430 -36.4430 -36.4373 -36.4373 -21.6501 -21.6501 -4.5404 -4.5404 -3.4348 -3.4348 -3.4003 -3.4003 2.7328 2.7328 5.4061 5.4061 7.2209 7.2209 8.1023 8.1023 8.2050 8.2050 8.3451 8.3451 9.4440 9.4440 9.6089 9.6089 10.0676 10.0676 10.3000 10.3000 10.5070 10.5070 10.8224 10.8224 11.0238 11.0238 11.7336 11.7336 12.3212 12.3212 13.3867 13.3867 14.3704 14.3704 14.8054 14.8054 17.1072 17.1072 17.5058 17.5058 k =-0.0406 0.0658 0.0773 ( 4718 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9447 -40.9447 -40.9143 -40.9143 -36.5086 -36.5086 -36.4558 -36.4558 -36.4428 -36.4428 -36.4369 -36.4369 -21.6502 -21.6502 -4.5395 -4.5395 -3.4338 -3.4338 -3.3987 -3.3987 2.7143 2.7143 5.4013 5.4013 7.2049 7.2049 8.1108 8.1108 8.2092 8.2092 8.3261 8.3261 9.4719 9.4719 9.6274 9.6274 10.0746 10.0746 10.3135 10.3135 10.4654 10.4654 10.8328 10.8328 11.0793 11.0793 11.7927 11.7927 12.2511 12.2511 13.4555 13.4555 14.4102 14.4102 14.7462 14.7462 17.0388 17.0388 17.4308 17.4308 k =-0.0338 0.0548 0.0644 ( 4714 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9449 -40.9449 -40.9142 -40.9142 -36.5089 -36.5089 -36.4559 -36.4559 -36.4427 -36.4427 -36.4366 -36.4366 -21.6504 -21.6504 -4.5387 -4.5387 -3.4331 -3.4331 -3.3973 -3.3973 2.6985 2.6985 5.3970 5.3970 7.1913 7.1913 8.1198 8.1198 8.2120 8.2120 8.3090 8.3090 9.4962 9.4962 9.6457 9.6457 10.0805 10.0805 10.3230 10.3230 10.4284 10.4284 10.8407 10.8407 11.1338 11.1338 11.8435 11.8435 12.1866 12.1866 13.5209 13.5209 14.4454 14.4454 14.6908 14.6908 16.9757 16.9757 17.3650 17.3650 k =-0.0271 0.0438 0.0515 ( 4714 PWs) bands (ev): -72.1112 -72.1112 -72.1026 -72.1026 -40.9450 -40.9450 -40.9141 -40.9141 -36.5092 -36.5092 -36.4559 -36.4559 -36.4427 -36.4427 -36.4363 -36.4363 -21.6504 -21.6504 -4.5381 -4.5381 -3.4326 -3.4326 -3.3960 -3.3960 2.6855 2.6855 5.3934 5.3934 7.1801 7.1801 8.1292 8.1292 8.2131 8.2131 8.2944 8.2944 9.5162 9.5162 9.6633 9.6633 10.0854 10.0854 10.3268 10.3268 10.3991 10.3991 10.8467 10.8467 11.1852 11.1852 11.8838 11.8838 12.1303 12.1303 13.5808 13.5808 14.4754 14.4754 14.6404 14.6404 16.9208 16.9208 17.3094 17.3094 k =-0.0203 0.0329 0.0386 ( 4719 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9451 -40.9451 -40.9140 -40.9140 -36.5094 -36.5094 -36.4560 -36.4560 -36.4426 -36.4426 -36.4360 -36.4360 -21.6505 -21.6505 -4.5376 -4.5376 -3.4322 -3.4322 -3.3950 -3.3950 2.6753 2.6753 5.3906 5.3906 7.1713 7.1713 8.1386 8.1386 8.2121 8.2121 8.2827 8.2827 9.5315 9.5315 9.6794 9.6794 10.0891 10.0891 10.3217 10.3217 10.3821 10.3821 10.8511 10.8511 11.2309 11.2309 11.9107 11.9107 12.0865 12.0865 13.6326 13.6326 14.4995 14.4995 14.5969 14.5969 16.8763 16.8763 17.2652 17.2652 k =-0.0135 0.0219 0.0258 ( 4727 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5096 -36.5096 -36.4560 -36.4560 -36.4426 -36.4426 -36.4359 -36.4359 -21.6506 -21.6506 -4.5372 -4.5372 -3.4320 -3.4320 -3.3942 -3.3942 2.6680 2.6680 5.3885 5.3885 7.1650 7.1650 8.1473 8.1473 8.2092 8.2092 8.2746 8.2746 9.5422 9.5422 9.6925 9.6925 10.0919 10.0919 10.3099 10.3099 10.3764 10.3764 10.8541 10.8541 11.2679 11.2679 11.9216 11.9216 12.0599 12.0599 13.6733 13.6733 14.5168 14.5168 14.5629 14.5629 16.8435 16.8435 17.2330 17.2330 k =-0.0068 0.0110 0.0129 ( 4731 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5370 -4.5370 -3.4319 -3.4319 -3.3937 -3.3937 2.6636 2.6636 5.3872 5.3872 7.1613 7.1613 8.1542 8.1542 8.2055 8.2055 8.2701 8.2701 9.5486 9.5486 9.7012 9.7012 10.0935 10.0935 10.2997 10.2997 10.3756 10.3756 10.8559 10.8559 11.2923 11.2923 11.9206 11.9206 12.0497 12.0497 13.6995 13.6995 14.5257 14.5257 14.5426 14.5426 16.8235 16.8235 17.2135 17.2135 k = 0.0000 0.0000 0.0000 ( 4739 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5370 -4.5370 -3.4318 -3.4318 -3.3935 -3.3935 2.6622 2.6622 5.3868 5.3868 7.1600 7.1600 8.1569 8.1569 8.2036 8.2036 8.2687 8.2687 9.5507 9.5507 9.7042 9.7042 10.0941 10.0941 10.2958 10.2958 10.3755 10.3755 10.8564 10.8564 11.3009 11.3009 11.9183 11.9183 12.0477 12.0477 13.7086 13.7086 14.5258 14.5258 14.5384 14.5384 16.8167 16.8167 17.2069 17.2069 k = 0.0000 0.0000 0.0000 ( 4739 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5370 -4.5370 -3.4318 -3.4318 -3.3935 -3.3935 2.6622 2.6622 5.3868 5.3868 7.1600 7.1600 8.1569 8.1569 8.2036 8.2036 8.2687 8.2687 9.5507 9.5507 9.7042 9.7042 10.0941 10.0941 10.2958 10.2958 10.3755 10.3755 10.8564 10.8564 11.3009 11.3009 11.9183 11.9183 12.0477 12.0477 13.7086 13.7086 14.5258 14.5258 14.5384 14.5384 16.8167 16.8167 17.2069 17.2069 k = 0.0156 0.0096-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5370 -4.5370 -3.4319 -3.4319 -3.3935 -3.3935 2.6637 2.6637 5.3839 5.3839 7.1616 7.1616 8.1568 8.1568 8.2038 8.2038 8.2686 8.2686 9.5502 9.5502 9.7039 9.7039 10.0927 10.0927 10.2847 10.2847 10.3756 10.3756 10.8693 10.8693 11.3011 11.3011 11.9179 11.9179 12.0469 12.0469 13.7104 13.7104 14.5297 14.5297 14.5425 14.5425 16.8192 16.8192 17.2029 17.2029 k = 0.0312 0.0193-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5371 -4.5371 -3.4322 -3.4322 -3.3935 -3.3935 2.6681 2.6681 5.3753 5.3753 7.1665 7.1665 8.1566 8.1566 8.2040 8.2040 8.2686 8.2686 9.5484 9.5484 9.7026 9.7026 10.0887 10.0887 10.2541 10.2541 10.3756 10.3756 10.9051 10.9051 11.3016 11.3016 11.9167 11.9167 12.0445 12.0445 13.7157 13.7157 14.5414 14.5414 14.5546 14.5546 16.8267 16.8267 17.1913 17.1913 k = 0.0469 0.0289-0.0000 ( 4723 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5372 -4.5372 -3.4326 -3.4326 -3.3934 -3.3934 2.6755 2.6755 5.3612 5.3612 7.1744 7.1744 8.1563 8.1563 8.2043 8.2043 8.2686 8.2686 9.5456 9.5456 9.7005 9.7005 10.0821 10.0821 10.2098 10.2098 10.3757 10.3757 10.9583 10.9583 11.3027 11.3027 11.9148 11.9148 12.0407 12.0407 13.7244 13.7244 14.5609 14.5609 14.5748 14.5748 16.8392 16.8392 17.1727 17.1727 k = 0.0625 0.0386-0.0000 ( 4727 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5374 -4.5374 -3.4333 -3.4333 -3.3934 -3.3934 2.6858 2.6858 5.3418 5.3418 7.1850 7.1850 8.1558 8.1558 8.2048 8.2048 8.2685 8.2685 9.5414 9.5414 9.6974 9.6974 10.0730 10.0730 10.1569 10.1569 10.3757 10.3757 11.0230 11.0230 11.3048 11.3048 11.9123 11.9123 12.0356 12.0356 13.7363 13.7363 14.5878 14.5878 14.6027 14.6027 16.8567 16.8567 17.1484 17.1484 k = 0.0781 0.0482-0.0000 ( 4735 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6506 -21.6506 -4.5377 -4.5377 -3.4341 -3.4341 -3.3933 -3.3933 2.6991 2.6991 5.3175 5.3175 7.1980 7.1980 8.1552 8.1552 8.2054 8.2054 8.2683 8.2683 9.5358 9.5358 9.6935 9.6935 10.0616 10.0616 10.0994 10.0994 10.3757 10.3757 11.0949 11.0949 11.3088 11.3088 11.9093 11.9093 12.0293 12.0293 13.7514 13.7514 14.6220 14.6220 14.6382 14.6382 16.8794 16.8794 17.1197 17.1197 k = 0.0938 0.0579-0.0000 ( 4735 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6505 -21.6505 -4.5380 -4.5380 -3.4350 -3.4350 -3.3932 -3.3932 2.7151 2.7151 5.2887 5.2887 7.2128 7.2128 8.1545 8.1545 8.2061 8.2061 8.2683 8.2683 9.5287 9.5287 9.6887 9.6887 10.0399 10.0399 10.0481 10.0481 10.3757 10.3757 11.1685 11.1685 11.3180 11.3180 11.9059 11.9059 12.0222 12.0222 13.7693 13.7693 14.6634 14.6634 14.6810 14.6810 16.9072 16.9072 17.0879 17.0879 k = 0.1094 0.0675-0.0000 ( 4723 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6505 -21.6505 -4.5384 -4.5384 -3.4361 -3.4361 -3.3931 -3.3931 2.7340 2.7340 5.2559 5.2559 7.2290 7.2290 8.1539 8.1539 8.2070 8.2070 8.2683 8.2683 9.5198 9.5198 9.6832 9.6832 9.9802 9.9802 10.0327 10.0327 10.3757 10.3757 11.2310 11.2310 11.3437 11.3437 11.9023 11.9023 12.0144 12.0144 13.7898 13.7898 14.7115 14.7115 14.7308 14.7308 16.9403 16.9403 17.0540 17.0540 k = 0.1250 0.0771-0.0000 ( 4731 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6505 -21.6505 -4.5388 -4.5388 -3.4374 -3.4374 -3.3930 -3.3930 2.7556 2.7556 5.2194 5.2194 7.2460 7.2460 8.1530 8.1530 8.2079 8.2079 8.2683 8.2683 9.5089 9.5089 9.6768 9.6768 9.9214 9.9214 10.0153 10.0153 10.3756 10.3756 11.2639 11.2639 11.4039 11.4039 11.8988 11.8988 12.0063 12.0063 13.8125 13.8125 14.7661 14.7661 14.7871 14.7871 16.9787 16.9787 17.0191 17.0191 k = 0.1406 0.0868-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6504 -21.6504 -4.5392 -4.5392 -3.4387 -3.4387 -3.3928 -3.3928 2.7799 2.7799 5.1798 5.1798 7.2634 7.2634 8.1522 8.1522 8.2089 8.2089 8.2684 8.2684 9.4953 9.4953 9.6696 9.6696 9.8648 9.8648 9.9969 9.9969 10.3755 10.3755 11.2759 11.2759 11.4891 11.4891 11.8954 11.8954 11.9982 11.9982 13.8371 13.8371 14.8268 14.8268 14.8498 14.8498 16.9838 16.9838 17.0225 17.0225 k = 0.1562 0.0964-0.0000 ( 4727 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6504 -21.6504 -4.5397 -4.5397 -3.4402 -3.4402 -3.3927 -3.3927 2.8068 2.8068 5.1375 5.1375 7.2807 7.2807 8.1513 8.1513 8.2100 8.2100 8.2685 8.2685 9.4790 9.4790 9.6617 9.6617 9.8114 9.8114 9.9769 9.9769 10.3754 10.3754 11.2810 11.2810 11.5850 11.5850 11.8923 11.8923 11.9904 11.9904 13.8632 13.8632 14.8933 14.8933 14.9183 14.9183 16.9488 16.9488 17.0716 17.0716 k = 0.1719 0.1061-0.0000 ( 4727 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4425 -36.4425 -36.4358 -36.4358 -21.6503 -21.6503 -4.5403 -4.5403 -3.4418 -3.4418 -3.3925 -3.3925 2.8361 2.8361 5.0929 5.0929 7.2973 7.2973 8.1504 8.1504 8.2112 8.2112 8.2687 8.2687 9.4592 9.4592 9.6532 9.6532 9.7623 9.7623 9.9561 9.9561 10.3752 10.3752 11.2835 11.2835 11.6868 11.6868 11.8896 11.8896 11.9833 11.9833 13.8906 13.8906 14.9653 14.9653 14.9924 14.9924 16.9146 16.9146 17.1263 17.1263 k = 0.1875 0.1157-0.0000 ( 4723 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6503 -21.6503 -4.5408 -4.5408 -3.4434 -3.4434 -3.3923 -3.3923 2.8679 2.8679 5.0463 5.0463 7.3129 7.3129 8.1496 8.1496 8.2124 8.2124 8.2690 8.2690 9.4355 9.4355 9.6440 9.6440 9.7183 9.7183 9.9346 9.9346 10.3750 10.3750 11.2851 11.2851 11.7917 11.7917 11.8875 11.8875 11.9782 11.9782 13.9187 13.9187 15.0424 15.0424 15.0716 15.0716 16.8814 16.8814 17.1863 17.1863 k = 0.2031 0.1254-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6502 -21.6502 -4.5414 -4.5414 -3.4451 -3.4451 -3.3921 -3.3921 2.9019 2.9019 4.9981 4.9981 7.3272 7.3272 8.1488 8.1488 8.2137 8.2137 8.2695 8.2695 9.4077 9.4077 9.6342 9.6342 9.6798 9.6798 9.9125 9.9125 10.3748 10.3748 11.2859 11.2859 11.8861 11.8861 11.8928 11.8928 11.9817 11.9817 13.9473 13.9473 15.1244 15.1244 15.1557 15.1557 16.8495 16.8495 17.2371 17.2371 k = 0.2188 0.1350-0.0000 ( 4735 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6502 -21.6502 -4.5420 -4.5420 -3.4469 -3.4469 -3.3919 -3.3919 2.9382 2.9382 4.9485 4.9485 7.3399 7.3399 8.1479 8.1479 8.2150 8.2150 8.2701 8.2701 9.3764 9.3764 9.6240 9.6240 9.6470 9.6470 9.8901 9.8901 10.3745 10.3745 11.2864 11.2864 11.8853 11.8853 11.9424 11.9424 12.0412 12.0412 13.9759 13.9759 15.2110 15.2110 15.2443 15.2443 16.8191 16.8191 17.2199 17.2199 k = 0.2344 0.1447-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6501 -21.6501 -4.5426 -4.5426 -3.4486 -3.4486 -3.3918 -3.3918 2.9764 2.9764 4.8978 4.8978 7.3507 7.3507 8.1471 8.1471 8.2164 8.2164 8.2707 8.2707 9.3423 9.3423 9.6134 9.6134 9.6194 9.6194 9.8678 9.8678 10.3742 10.3742 11.2868 11.2868 11.8852 11.8852 11.9455 11.9455 12.1515 12.1515 14.0043 14.0043 15.3018 15.3018 15.3371 15.3371 16.7903 16.7903 17.2008 17.2008 k = 0.2500 0.1543-0.0000 ( 4715 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6500 -21.6500 -4.5432 -4.5432 -3.4504 -3.4504 -3.3916 -3.3916 3.0166 3.0166 4.8463 4.8463 7.3595 7.3595 8.1465 8.1465 8.2177 8.2177 8.2716 8.2716 9.3066 9.3066 9.5957 9.5957 9.6030 9.6030 9.8457 9.8457 10.3740 10.3740 11.2871 11.2871 11.8859 11.8859 11.9431 11.9431 12.2713 12.2713 14.0322 14.0322 15.3966 15.3966 15.4337 15.4337 16.7632 16.7632 17.1816 17.1816 k = 0.2656 0.1639-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6500 -21.6500 -4.5439 -4.5439 -3.4522 -3.4522 -3.3914 -3.3914 3.0585 3.0585 4.7941 4.7941 7.3662 7.3662 8.1458 8.1458 8.2189 8.2189 8.2725 8.2725 9.2704 9.2704 9.5754 9.5754 9.5920 9.5920 9.8239 9.8239 10.3736 10.3736 11.2872 11.2872 11.8872 11.8872 11.9401 11.9401 12.3955 12.3955 14.0593 14.0593 15.4951 15.4951 15.5339 15.5339 16.7378 16.7378 17.1626 17.1626 k = 0.2812 0.1736-0.0000 ( 4731 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6499 -21.6499 -4.5445 -4.5445 -3.4539 -3.4539 -3.3912 -3.3912 3.1019 3.1019 4.7415 4.7415 7.3708 7.3708 8.1452 8.1452 8.2202 8.2202 8.2736 8.2736 9.2349 9.2349 9.5578 9.5578 9.5811 9.5811 9.8026 9.8026 10.3733 10.3733 11.2873 11.2873 11.8892 11.8892 11.9375 11.9375 12.5227 12.5227 14.0853 14.0853 15.5970 15.5970 15.6372 15.6372 16.7142 16.7142 17.1439 17.1439 k = 0.2969 0.1832-0.0000 ( 4719 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6499 -21.6499 -4.5451 -4.5451 -3.4556 -3.4556 -3.3910 -3.3910 3.1468 3.1468 4.6885 4.6885 7.3733 7.3733 8.1448 8.1448 8.2215 8.2215 8.2748 8.2748 9.2009 9.2009 9.5422 9.5422 9.5703 9.5703 9.7821 9.7821 10.3731 10.3731 11.2874 11.2874 11.8917 11.8917 11.9355 11.9355 12.6524 12.6524 14.1101 14.1101 15.7021 15.7021 15.7435 15.7435 16.6925 16.6925 17.1257 17.1257 k = 0.3125 0.1929-0.0000 ( 4719 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6498 -21.6498 -4.5457 -4.5457 -3.4573 -3.4573 -3.3908 -3.3908 3.1929 3.1929 4.6355 4.6355 7.3740 7.3740 8.1443 8.1443 8.2227 8.2227 8.2761 8.2761 9.1688 9.1688 9.5281 9.5281 9.5597 9.5597 9.7625 9.7625 10.3729 10.3729 11.2874 11.2874 11.8947 11.8947 11.9341 11.9341 12.7839 12.7839 14.1335 14.1335 15.8100 15.8100 15.8522 15.8522 16.6725 16.6725 17.1082 17.1082 k = 0.3281 0.2025-0.0000 ( 4715 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6498 -21.6498 -4.5462 -4.5462 -3.4589 -3.4589 -3.3906 -3.3906 3.2399 3.2399 4.5826 4.5826 7.3729 7.3729 8.1440 8.1440 8.2238 8.2238 8.2774 8.2774 9.1390 9.1390 9.5154 9.5154 9.5495 9.5495 9.7439 9.7439 10.3726 10.3726 11.2874 11.2874 11.8981 11.8981 11.9333 11.9333 12.9167 12.9167 14.1553 14.1553 15.9204 15.9204 15.9628 15.9628 16.6545 16.6545 17.0916 17.0916 k = 0.3438 0.2122-0.0000 ( 4715 PWs) bands (ev): -72.1113 -72.1113 -72.1025 -72.1025 -40.9452 -40.9452 -40.9139 -40.9139 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6497 -21.6497 -4.5468 -4.5468 -3.4603 -3.4603 -3.3905 -3.3905 3.2876 3.2876 4.5299 4.5299 7.3703 7.3703 8.1436 8.1436 8.2249 8.2249 8.2788 8.2788 9.1118 9.1118 9.5038 9.5038 9.5397 9.5397 9.7265 9.7265 10.3724 10.3724 11.2874 11.2874 11.9017 11.9017 11.9330 11.9330 13.0498 13.0498 14.1755 14.1755 16.0329 16.0329 16.0748 16.0748 16.6386 16.6386 17.0760 17.0760 k = 0.3594 0.2218-0.0000 ( 4699 PWs) bands (ev): -72.1113 -72.1113 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6497 -21.6497 -4.5473 -4.5473 -3.4617 -3.4617 -3.3903 -3.3903 3.3358 3.3358 4.4776 4.4776 7.3666 7.3666 8.1435 8.1435 8.2260 8.2260 8.2803 8.2803 9.0874 9.0874 9.4934 9.4934 9.5306 9.5306 9.7103 9.7103 10.3723 10.3723 11.2874 11.2874 11.9055 11.9055 11.9331 11.9331 13.1823 13.1823 14.1939 14.1939 16.1471 16.1471 16.1874 16.1874 16.6250 16.6250 17.0614 17.0614 k = 0.3750 0.2314-0.0000 ( 4687 PWs) bands (ev): -72.1113 -72.1113 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6496 -21.6496 -4.5477 -4.5477 -3.4630 -3.4630 -3.3902 -3.3902 3.3839 3.3839 4.4262 4.4262 7.3620 7.3620 8.1434 8.1434 8.2269 8.2269 8.2818 8.2818 9.0657 9.0657 9.4840 9.4840 9.5220 9.5220 9.6958 9.6958 10.3722 10.3722 11.2874 11.2874 11.9092 11.9092 11.9336 11.9336 13.3129 13.3129 14.2105 14.2105 16.2622 16.2622 16.2991 16.2991 16.6144 16.6144 17.0481 17.0481 k = 0.3906 0.2411-0.0000 ( 4687 PWs) bands (ev): -72.1113 -72.1113 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6496 -21.6496 -4.5482 -4.5482 -3.4642 -3.4642 -3.3900 -3.3900 3.4316 3.4316 4.3758 4.3758 7.3569 7.3569 8.1432 8.1432 8.2278 8.2278 8.2831 8.2831 9.0469 9.0469 9.4756 9.4756 9.5143 9.5143 9.6824 9.6824 10.3720 10.3720 11.2873 11.2873 11.9129 11.9129 11.9343 11.9343 13.4399 13.4399 14.2251 14.2251 16.3776 16.3776 16.4062 16.4062 16.6096 16.6096 17.0361 17.0361 k = 0.4062 0.2507-0.0000 ( 4679 PWs) bands (ev): -72.1113 -72.1113 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6496 -21.6496 -4.5485 -4.5485 -3.4652 -3.4652 -3.3899 -3.3899 3.4782 3.4782 4.3272 4.3272 7.3516 7.3516 8.1431 8.1431 8.2285 8.2285 8.2843 8.2843 9.0307 9.0307 9.4683 9.4683 9.5074 9.5074 9.6707 9.6707 10.3720 10.3720 11.2873 11.2873 11.9163 11.9163 11.9352 11.9352 13.5612 13.5612 14.2378 14.2378 16.4919 16.4919 16.4966 16.4966 16.6214 16.6214 17.0255 17.0255 k = 0.4219 0.2604-0.0000 ( 4678 PWs) bands (ev): -72.1113 -72.1113 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6495 -21.6495 -4.5489 -4.5489 -3.4661 -3.4661 -3.3898 -3.3898 3.5229 3.5229 4.2810 4.2810 7.3465 7.3465 8.1430 8.1430 8.2292 8.2292 8.2854 8.2854 9.0172 9.0172 9.4620 9.4620 9.5014 9.5014 9.6607 9.6607 10.3719 10.3719 11.2873 11.2873 11.9194 11.9194 11.9361 11.9361 13.6742 13.6742 14.2487 14.2487 16.5394 16.5394 16.6036 16.6036 16.6786 16.6786 16.9220 16.9220 k = 0.4375 0.2700-0.0000 ( 4686 PWs) bands (ev): -72.1113 -72.1113 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6495 -21.6495 -4.5491 -4.5491 -3.4668 -3.4668 -3.3897 -3.3897 3.5644 3.5644 4.2384 4.2384 7.3419 7.3419 8.1429 8.1429 8.2297 8.2297 8.2863 8.2863 9.0063 9.0063 9.4568 9.4568 9.4964 9.4964 9.6525 9.6525 10.3718 10.3718 11.2871 11.2871 11.9221 11.9221 11.9369 11.9369 13.7755 13.7755 14.2575 14.2575 16.5469 16.5469 16.7099 16.7099 16.7655 16.7655 16.7951 16.7951 k = 0.4531 0.2797-0.0000 ( 4682 PWs) bands (ev): -72.1112 -72.1112 -72.1024 -72.1024 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6495 -21.6495 -4.5493 -4.5493 -3.4674 -3.4674 -3.3897 -3.3897 3.6010 3.6010 4.2009 4.2009 7.3380 7.3380 8.1429 8.1429 8.2301 8.2301 8.2871 8.2871 8.9980 8.9980 9.4528 9.4528 9.4925 9.4925 9.6460 9.6460 10.3717 10.3717 11.2871 11.2871 11.9243 11.9243 11.9377 11.9377 13.8611 13.8611 14.2645 14.2645 16.5461 16.5461 16.6881 16.6881 16.8066 16.8066 16.8529 16.8529 k = 0.4688 0.2893-0.0000 ( 4682 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4357 -36.4357 -21.6495 -21.6495 -4.5495 -4.5495 -3.4678 -3.4678 -3.3896 -3.3896 3.6305 3.6305 4.1710 4.1710 7.3350 7.3350 8.1428 8.1428 8.2305 8.2305 8.2876 8.2876 8.9921 8.9921 9.4499 9.4499 9.4897 9.4897 9.6413 9.6413 10.3718 10.3718 11.2871 11.2871 11.9259 11.9259 11.9383 11.9383 13.9267 13.9267 14.2694 14.2694 16.5432 16.5432 16.6086 16.6086 16.8870 16.8870 16.9255 16.9255 k = 0.4844 0.2989-0.0000 ( 4682 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4357 -36.4357 -21.6495 -21.6495 -4.5496 -4.5496 -3.4680 -3.4680 -3.3896 -3.3896 3.6499 3.6499 4.1513 4.1513 7.3332 7.3332 8.1428 8.1428 8.2307 8.2307 8.2879 8.2879 8.9886 8.9886 9.4481 9.4481 9.4880 9.4880 9.6384 9.6384 10.3718 10.3718 11.2871 11.2871 11.9268 11.9268 11.9386 11.9386 13.9682 13.9682 14.2723 14.2723 16.5366 16.5366 16.5633 16.5633 16.9418 16.9418 16.9746 16.9746 k = 0.5000 0.3086-0.0000 ( 4682 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4357 -36.4357 -21.6495 -21.6495 -4.5496 -4.5496 -3.4681 -3.4681 -3.3896 -3.3896 3.6567 3.6567 4.1443 4.1443 7.3325 7.3325 8.1428 8.1428 8.2307 8.2307 8.2880 8.2880 8.9874 8.9874 9.4476 9.4476 9.4874 9.4874 9.6375 9.6375 10.3718 10.3718 11.2871 11.2871 11.9272 11.9272 11.9387 11.9387 13.9824 13.9824 14.2733 14.2733 16.5288 16.5288 16.5534 16.5534 16.9613 16.9613 16.9922 16.9922 k = 0.5000 0.3086-0.0000 ( 4682 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4357 -36.4357 -21.6495 -21.6495 -4.5496 -4.5496 -3.4681 -3.4681 -3.3896 -3.3896 3.6567 3.6567 4.1443 4.1443 7.3325 7.3325 8.1428 8.1428 8.2307 8.2307 8.2880 8.2880 8.9874 8.9874 9.4476 9.4476 9.4874 9.4874 9.6375 9.6375 10.3718 10.3718 11.2871 11.2871 11.9272 11.9272 11.9387 11.9387 13.9824 13.9824 14.2733 14.2733 16.5288 16.5288 16.5534 16.5534 16.9613 16.9613 16.9922 16.9922 k = 0.4933 0.3195 0.0128 ( 4686 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6495 -21.6495 -4.5497 -4.5497 -3.4681 -3.4681 -3.3897 -3.3897 3.6575 3.6575 4.1454 4.1454 7.3337 7.3337 8.1427 8.1427 8.2313 8.2313 8.2890 8.2890 8.9879 8.9879 9.4464 9.4464 9.4854 9.4854 9.6389 9.6389 10.3705 10.3705 11.2802 11.2802 11.9214 11.9214 11.9412 11.9412 13.9848 13.9848 14.2793 14.2793 16.5218 16.5218 16.5586 16.5586 16.9588 16.9588 16.9901 16.9901 k = 0.4865 0.3305 0.0257 ( 4686 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9451 -40.9451 -40.9139 -40.9139 -36.5096 -36.5096 -36.4559 -36.4559 -36.4426 -36.4426 -36.4359 -36.4359 -21.6494 -21.6494 -4.5498 -4.5498 -3.4681 -3.4681 -3.3902 -3.3902 3.6598 3.6598 4.1484 4.1484 7.3372 7.3372 8.1423 8.1423 8.2329 8.2329 8.2919 8.2919 8.9893 8.9893 9.4428 9.4428 9.4797 9.4797 9.6430 9.6430 10.3669 10.3669 11.2602 11.2602 11.8932 11.8932 11.9591 11.9591 13.9914 13.9914 14.2975 14.2975 16.5026 16.5026 16.5719 16.5719 16.9500 16.9500 16.9756 16.9756 k = 0.4798 0.3414 0.0385 ( 4686 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9451 -40.9451 -40.9140 -40.9140 -36.5094 -36.5094 -36.4559 -36.4559 -36.4427 -36.4427 -36.4360 -36.4360 -21.6494 -21.6494 -4.5501 -4.5501 -3.4682 -3.4682 -3.3910 -3.3910 3.6636 3.6636 4.1535 4.1535 7.3430 7.3430 8.1420 8.1420 8.2354 8.2354 8.2969 8.2969 8.9917 8.9917 9.4370 9.4370 9.4709 9.4709 9.6492 9.6492 10.3609 10.3609 11.2294 11.2294 11.8460 11.8460 11.9884 11.9884 14.0005 14.0005 14.3277 14.3277 16.4710 16.4710 16.5919 16.5919 16.9321 16.9321 16.9557 16.9557 k = 0.4730 0.3523 0.0514 ( 4698 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9450 -40.9450 -40.9141 -40.9141 -36.5092 -36.5092 -36.4559 -36.4559 -36.4427 -36.4427 -36.4363 -36.4363 -21.6493 -21.6493 -4.5505 -4.5505 -3.4682 -3.4682 -3.3921 -3.3921 3.6689 3.6689 4.1606 4.1606 7.3511 7.3511 8.1417 8.1417 8.2385 8.2385 8.3038 8.3038 8.9949 8.9949 9.4289 9.4289 9.4595 9.4595 9.6566 9.6566 10.3525 10.3525 11.1902 11.1902 11.7829 11.7829 12.0256 12.0256 14.0103 14.0103 14.3694 14.3694 16.4255 16.4255 16.6181 16.6181 16.9049 16.9049 16.9370 16.9370 k = 0.4663 0.3632 0.0642 ( 4698 PWs) bands (ev): -72.1112 -72.1112 -72.1026 -72.1026 -40.9449 -40.9449 -40.9142 -40.9142 -36.5089 -36.5089 -36.4558 -36.4558 -36.4428 -36.4428 -36.4366 -36.4366 -21.6492 -21.6492 -4.5509 -4.5509 -3.4683 -3.4683 -3.3934 -3.3934 3.6757 3.6757 4.1698 4.1698 7.3614 7.3614 8.1418 8.1418 8.2423 8.2423 8.3128 8.3128 8.9989 8.9989 9.4185 9.4185 9.4463 9.4463 9.6649 9.6649 10.3418 10.3418 11.1451 11.1451 11.7066 11.7066 12.0683 12.0683 14.0195 14.0195 14.4212 14.4212 16.3656 16.3656 16.6489 16.6489 16.8721 16.8721 16.9222 16.9222 k = 0.4595 0.3742 0.0771 ( 4694 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9447 -40.9447 -40.9143 -40.9143 -36.5086 -36.5086 -36.4558 -36.4558 -36.4429 -36.4429 -36.4369 -36.4369 -21.6491 -21.6491 -4.5515 -4.5515 -3.4685 -3.4685 -3.3949 -3.3949 3.6838 3.6838 4.1809 4.1809 7.3741 7.3741 8.1423 8.1423 8.2465 8.2465 8.3238 8.3238 9.0034 9.0034 9.4058 9.4058 9.4319 9.4319 9.6735 9.6735 10.3287 10.3287 11.0958 11.0958 11.6197 11.6197 12.1146 12.1146 14.0271 14.0271 14.4811 14.4811 16.2920 16.2920 16.6803 16.6803 16.8373 16.8373 16.9119 16.9119 k = 0.4528 0.3851 0.0899 ( 4700 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9445 -40.9445 -40.9145 -40.9145 -36.5082 -36.5082 -36.4557 -36.4557 -36.4430 -36.4430 -36.4373 -36.4373 -21.6490 -21.6490 -4.5521 -4.5521 -3.4688 -3.4688 -3.3967 -3.3967 3.6933 3.6933 4.1940 4.1940 7.3889 7.3889 8.1435 8.1435 8.2512 8.2512 8.3366 8.3366 9.0083 9.0083 9.3907 9.3907 9.4167 9.4167 9.6819 9.6819 10.3133 10.3133 11.0435 11.0435 11.5245 11.5245 12.1629 12.1629 14.0327 14.0327 14.5469 14.5469 16.2065 16.2065 16.7023 16.7023 16.8028 16.8028 16.9063 16.9063 k = 0.4460 0.3960 0.1028 ( 4692 PWs) bands (ev): -72.1110 -72.1110 -72.1027 -72.1027 -40.9443 -40.9443 -40.9147 -40.9147 -36.5077 -36.5077 -36.4556 -36.4556 -36.4432 -36.4432 -36.4378 -36.4378 -21.6489 -21.6489 -4.5529 -4.5529 -3.4691 -3.4691 -3.3985 -3.3985 3.7041 3.7041 4.2090 4.2090 7.4059 7.4059 8.1455 8.1455 8.2565 8.2565 8.3512 8.3512 9.0133 9.0133 9.3730 9.3730 9.4013 9.4013 9.6900 9.6900 10.2958 10.2958 10.9893 10.9893 11.4233 11.4233 12.2121 12.2121 14.0360 14.0360 14.6163 14.6163 16.1112 16.1112 16.6936 16.6936 16.7712 16.7712 16.9045 16.9045 k = 0.4393 0.4070 0.1156 ( 4694 PWs) bands (ev): -72.1109 -72.1109 -72.1028 -72.1028 -40.9441 -40.9441 -40.9150 -40.9150 -36.5072 -36.5072 -36.4555 -36.4555 -36.4433 -36.4433 -36.4383 -36.4383 -21.6488 -21.6488 -4.5537 -4.5537 -3.4696 -3.4696 -3.4005 -3.4005 3.7160 3.7160 4.2260 4.2260 7.4250 7.4250 8.1483 8.1483 8.2625 8.2625 8.3674 8.3674 9.0183 9.0183 9.3527 9.3527 9.3861 9.3861 9.6974 9.6974 10.2758 10.2758 10.9338 10.9338 11.3179 11.3179 12.2615 12.2615 14.0366 14.0366 14.6875 14.6875 16.0084 16.0084 16.6424 16.6424 16.7447 16.7447 16.9067 16.9067 k = 0.4325 0.4179 0.1284 ( 4708 PWs) bands (ev): -72.1109 -72.1109 -72.1028 -72.1028 -40.9438 -40.9438 -40.9153 -40.9153 -36.5066 -36.5066 -36.4554 -36.4554 -36.4435 -36.4435 -36.4388 -36.4388 -21.6486 -21.6486 -4.5547 -4.5547 -3.4703 -3.4703 -3.4025 -3.4025 3.7291 3.7291 4.2448 4.2448 7.4460 7.4460 8.1521 8.1521 8.2692 8.2692 8.3850 8.3850 9.0226 9.0226 9.3299 9.3299 9.3714 9.3714 9.7039 9.7039 10.2535 10.2535 10.8776 10.8776 11.2100 11.2100 12.3104 12.3104 14.0339 14.0339 14.7588 14.7588 15.8999 15.8999 16.5703 16.5703 16.7222 16.7222 16.9128 16.9128 k = 0.4258 0.4288 0.1413 ( 4700 PWs) bands (ev): -72.1108 -72.1108 -72.1029 -72.1029 -40.9435 -40.9435 -40.9155 -40.9155 -36.5059 -36.5059 -36.4553 -36.4553 -36.4438 -36.4438 -36.4394 -36.4394 -21.6484 -21.6484 -4.5557 -4.5557 -3.4712 -3.4712 -3.4044 -3.4044 3.7431 3.7431 4.2655 4.2655 7.4691 7.4691 8.1569 8.1569 8.2768 8.2768 8.4041 8.4041 9.0261 9.0261 9.3047 9.3047 9.3573 9.3573 9.7095 9.7095 10.2291 10.2291 10.8212 10.8212 11.1011 11.1011 12.3583 12.3583 14.0274 14.0274 14.8291 14.8291 15.7872 15.7872 16.4963 16.4963 16.7042 16.7042 16.9219 16.9219 k = 0.4190 0.4398 0.1541 ( 4696 PWs) bands (ev): -72.1107 -72.1107 -72.1030 -72.1030 -40.9432 -40.9432 -40.9159 -40.9159 -36.5052 -36.5052 -36.4551 -36.4551 -36.4441 -36.4441 -36.4400 -36.4400 -21.6482 -21.6482 -4.5568 -4.5568 -3.4723 -3.4723 -3.4063 -3.4063 3.7580 3.7580 4.2880 4.2880 7.4941 7.4941 8.1628 8.1628 8.2853 8.2853 8.4245 8.4245 9.0281 9.0281 9.2773 9.2773 9.3441 9.3441 9.7140 9.7140 10.2025 10.2025 10.7647 10.7647 10.9925 10.9925 12.4048 12.4048 14.0165 14.0165 14.8974 14.8974 15.6715 15.6715 16.4288 16.4288 16.6917 16.6917 16.9158 16.9158 k = 0.4123 0.4507 0.1670 ( 4696 PWs) bands (ev): -72.1106 -72.1106 -72.1031 -72.1031 -40.9429 -40.9429 -40.9162 -40.9162 -36.5045 -36.5045 -36.4550 -36.4550 -36.4444 -36.4444 -36.4406 -36.4406 -21.6481 -21.6481 -4.5580 -4.5580 -3.4737 -3.4737 -3.4080 -3.4080 3.7736 3.7736 4.3122 4.3122 7.5210 7.5210 8.1698 8.1698 8.2949 8.2949 8.4460 8.4460 9.0281 9.0281 9.2477 9.2477 9.3322 9.3322 9.7172 9.7172 10.1738 10.1738 10.7082 10.7082 10.8853 10.8853 12.4496 12.4496 14.0004 14.0004 14.9630 14.9630 15.5536 15.5536 16.3720 16.3720 16.6849 16.6849 16.8975 16.8975 k = 0.4056 0.4616 0.1798 ( 4694 PWs) bands (ev): -72.1105 -72.1105 -72.1032 -72.1032 -40.9425 -40.9425 -40.9166 -40.9166 -36.5036 -36.5036 -36.4548 -36.4548 -36.4448 -36.4448 -36.4412 -36.4412 -21.6479 -21.6479 -4.5592 -4.5592 -3.4754 -3.4754 -3.4096 -3.4096 3.7899 3.7899 4.3382 4.3382 7.5495 7.5495 8.1779 8.1779 8.3056 8.3056 8.4687 8.4687 9.0255 9.0255 9.2158 9.2158 9.3221 9.3221 9.7191 9.7191 10.1431 10.1431 10.6518 10.6518 10.7808 10.7808 12.4925 12.4925 13.9787 13.9787 15.0257 15.0257 15.4344 15.4344 16.3280 16.3280 16.6843 16.6843 16.8741 16.8741 k = 0.3988 0.4726 0.1927 ( 4698 PWs) bands (ev): -72.1104 -72.1104 -72.1033 -72.1033 -40.9422 -40.9422 -40.9170 -40.9170 -36.5028 -36.5028 -36.4547 -36.4547 -36.4454 -36.4454 -36.4418 -36.4418 -21.6476 -21.6476 -4.5605 -4.5605 -3.4774 -3.4774 -3.4109 -3.4109 3.8065 3.8065 4.3658 4.3658 7.5796 7.5796 8.1873 8.1873 8.3176 8.3176 8.4924 8.4924 9.0196 9.0196 9.1817 9.1817 9.3141 9.3141 9.7196 9.7196 10.1103 10.1103 10.5956 10.5956 10.6800 10.6800 12.5333 12.5333 13.9508 13.9508 15.0853 15.0853 15.3144 15.3144 16.2980 16.2980 16.6900 16.6900 16.8452 16.8452 k = 0.3921 0.4835 0.2055 ( 4700 PWs) bands (ev): -72.1103 -72.1103 -72.1034 -72.1034 -40.9418 -40.9418 -40.9174 -40.9174 -36.5018 -36.5018 -36.4545 -36.4545 -36.4460 -36.4460 -36.4423 -36.4423 -21.6474 -21.6474 -4.5619 -4.5619 -3.4797 -3.4797 -3.4119 -3.4119 3.8235 3.8235 4.3949 4.3949 7.6111 7.6111 8.1978 8.1978 8.3309 8.3309 8.5170 8.5170 9.0101 9.0101 9.1453 9.1453 9.3085 9.3085 9.7185 9.7185 10.0756 10.0756 10.5394 10.5394 10.5843 10.5843 12.5720 12.5720 13.9166 13.9166 15.1413 15.1413 15.1951 15.1951 16.2825 16.2825 16.7017 16.7017 16.8103 16.8103 k = 0.3853 0.4944 0.2184 ( 4704 PWs) bands (ev): -72.1102 -72.1102 -72.1035 -72.1035 -40.9414 -40.9414 -40.9178 -40.9178 -36.5009 -36.5009 -36.4543 -36.4543 -36.4467 -36.4467 -36.4428 -36.4428 -21.6472 -21.6472 -4.5633 -4.5633 -3.4822 -3.4822 -3.4127 -3.4127 3.8405 3.8405 4.4256 4.4256 7.6440 7.6440 8.2095 8.2095 8.3457 8.3457 8.5422 8.5422 8.9967 8.9967 9.1067 9.1067 9.3055 9.3055 9.7161 9.7161 10.0391 10.0391 10.4798 10.4798 10.4979 10.4979 12.6084 12.6084 13.8761 13.8761 15.0725 15.0725 15.1985 15.1985 16.2812 16.2812 16.7179 16.7179 16.7708 16.7708 k = 0.3786 0.5053 0.2312 ( 4704 PWs) bands (ev): -72.1100 -72.1100 -72.1037 -72.1037 -40.9409 -40.9409 -40.9182 -40.9182 -36.4998 -36.4998 -36.4541 -36.4541 -36.4476 -36.4476 -36.4432 -36.4432 -21.6470 -21.6470 -4.5647 -4.5647 -3.4850 -3.4850 -3.4132 -3.4132 3.8575 3.8575 4.4577 4.4577 7.6782 7.6782 8.2224 8.2224 8.3620 8.3620 8.5682 8.5682 8.9792 8.9792 9.0661 9.0661 9.3048 9.3048 9.7120 9.7120 10.0010 10.0010 10.4040 10.4040 10.4344 10.4344 12.6426 12.6426 13.8296 13.8296 14.9527 14.9527 15.2519 15.2519 16.2933 16.2933 16.7105 16.7105 16.7547 16.7547 k = 0.3718 0.5163 0.2441 ( 4716 PWs) bands (ev): -72.1099 -72.1099 -72.1038 -72.1038 -40.9405 -40.9405 -40.9187 -40.9187 -36.4988 -36.4988 -36.4539 -36.4539 -36.4486 -36.4486 -36.4436 -36.4436 -21.6468 -21.6468 -4.5662 -4.5662 -3.4880 -3.4880 -3.4135 -3.4135 3.8742 3.8742 4.4911 4.4911 7.7132 7.7132 8.2366 8.2366 8.3798 8.3798 8.5943 8.5943 8.9573 8.9573 9.0241 9.0241 9.3062 9.3062 9.7064 9.7064 9.9612 9.9612 10.3272 10.3272 10.3792 10.3792 12.6746 12.6746 13.7778 13.7778 14.8330 14.8330 15.3053 15.3053 16.3174 16.3174 16.6595 16.6595 16.7816 16.7816 k = 0.3651 0.5272 0.2569 ( 4726 PWs) bands (ev): -72.1098 -72.1098 -72.1040 -72.1040 -40.9400 -40.9400 -40.9192 -40.9192 -36.4977 -36.4977 -36.4537 -36.4537 -36.4496 -36.4496 -36.4439 -36.4439 -21.6466 -21.6466 -4.5677 -4.5677 -3.4912 -3.4912 -3.4136 -3.4136 3.8904 3.8904 4.5258 4.5258 7.7492 7.7492 8.2520 8.2520 8.3993 8.3993 8.6203 8.6203 8.9301 8.9301 8.9826 8.9826 9.3092 9.3092 9.6993 9.6993 9.9204 9.9204 10.2568 10.2568 10.3254 10.3254 12.7046 12.7046 13.7214 13.7214 14.7140 14.7140 15.3593 15.3593 16.3519 16.3519 16.5990 16.5990 16.8173 16.8173 k = 0.3583 0.5381 0.2697 ( 4734 PWs) bands (ev): -72.1096 -72.1096 -72.1041 -72.1041 -40.9395 -40.9395 -40.9197 -40.9197 -36.4965 -36.4965 -36.4535 -36.4535 -36.4507 -36.4507 -36.4443 -36.4443 -21.6464 -21.6464 -4.5692 -4.5692 -3.4944 -3.4944 -3.4135 -3.4135 3.9060 3.9060 4.5617 4.5617 7.7856 7.7856 8.2685 8.2685 8.4205 8.4205 8.6451 8.6451 8.8961 8.8961 8.9447 8.9447 9.3134 9.3134 9.6907 9.6907 9.8790 9.8790 10.1936 10.1936 10.2724 10.2724 12.7325 12.7325 13.6613 13.6613 14.5959 14.5959 15.4146 15.4146 16.3947 16.3947 16.5331 16.5331 16.8556 16.8556 k = 0.3516 0.5491 0.2826 ( 4736 PWs) bands (ev): -72.1095 -72.1095 -72.1043 -72.1043 -40.9390 -40.9390 -40.9203 -40.9203 -36.4953 -36.4953 -36.4533 -36.4533 -36.4519 -36.4519 -36.4446 -36.4446 -21.6462 -21.6462 -4.5706 -4.5706 -3.4977 -3.4977 -3.4132 -3.4132 3.9206 3.9206 4.5986 4.5986 7.8225 7.8225 8.2863 8.2863 8.4434 8.4434 8.6666 8.6666 8.8560 8.8560 8.9126 8.9126 9.3183 9.3183 9.6806 9.6806 9.8375 9.8375 10.1375 10.1375 10.2202 10.2202 12.7587 12.7587 13.5985 13.5985 14.4787 14.4787 15.4718 15.4718 16.4347 16.4347 16.4723 16.4723 16.8751 16.8751 k = 0.3448 0.5600 0.2954 ( 4740 PWs) bands (ev): -72.1093 -72.1093 -72.1044 -72.1044 -40.9384 -40.9384 -40.9208 -40.9208 -36.4941 -36.4941 -36.4533 -36.4533 -36.4528 -36.4528 -36.4449 -36.4449 -21.6460 -21.6460 -4.5721 -4.5721 -3.5010 -3.5010 -3.4128 -3.4128 3.9340 3.9340 4.6365 4.6365 7.8593 7.8593 8.3051 8.3051 8.4682 8.4682 8.6794 8.6794 8.8163 8.8163 8.8862 8.8862 9.3232 9.3232 9.6689 9.6689 9.7966 9.7966 10.0885 10.0885 10.1686 10.1686 12.7832 12.7832 13.5339 13.5339 14.3626 14.3626 15.5311 15.5311 16.3793 16.3793 16.5085 16.5085 16.8548 16.8548 k = 0.3381 0.5709 0.3083 ( 4736 PWs) bands (ev): -72.1092 -72.1092 -72.1046 -72.1046 -40.9379 -40.9379 -40.9214 -40.9214 -36.4928 -36.4928 -36.4545 -36.4545 -36.4527 -36.4527 -36.4452 -36.4452 -21.6458 -21.6458 -4.5735 -4.5735 -3.5042 -3.5042 -3.4123 -3.4123 3.9461 3.9461 4.6751 4.6751 7.8957 7.8957 8.3249 8.3249 8.4948 8.4948 8.6724 8.6724 8.7872 8.7872 8.8676 8.8676 9.3278 9.3278 9.6557 9.6557 9.7571 9.7571 10.0461 10.0461 10.1178 10.1178 12.8063 12.8063 13.4683 13.4683 14.2476 14.2476 15.5928 15.5928 16.3003 16.3003 16.5694 16.5694 16.8243 16.8243 k = 0.3313 0.5819 0.3211 ( 4734 PWs) bands (ev): -72.1090 -72.1090 -72.1047 -72.1047 -40.9373 -40.9373 -40.9220 -40.9220 -36.4915 -36.4915 -36.4558 -36.4558 -36.4525 -36.4525 -36.4455 -36.4455 -21.6456 -21.6456 -4.5749 -4.5749 -3.5074 -3.5074 -3.4117 -3.4117 3.9565 3.9565 4.7145 4.7145 7.9312 7.9312 8.3454 8.3454 8.5233 8.5233 8.6406 8.6406 8.7685 8.7685 8.8632 8.8632 9.3314 9.3314 9.6409 9.6409 9.7196 9.7196 10.0100 10.0100 10.0681 10.0681 12.8282 12.8282 13.4026 13.4026 14.1339 14.1339 15.6567 15.6567 16.2175 16.2175 16.6345 16.6345 16.7934 16.7934 k = 0.3246 0.5928 0.3340 ( 4730 PWs) bands (ev): -72.1089 -72.1089 -72.1049 -72.1049 -40.9367 -40.9367 -40.9226 -40.9226 -36.4901 -36.4901 -36.4572 -36.4572 -36.4522 -36.4522 -36.4458 -36.4458 -21.6454 -21.6454 -4.5762 -4.5762 -3.5104 -3.5104 -3.4110 -3.4110 3.9651 3.9651 4.7544 4.7544 7.9651 7.9651 8.3662 8.3662 8.5534 8.5534 8.5960 8.5960 8.7479 8.7479 8.8753 8.8753 9.3332 9.3332 9.6246 9.6246 9.6848 9.6848 9.9793 9.9793 10.0200 10.0200 12.8490 12.8490 13.3374 13.3374 14.0214 14.0214 15.7221 15.7221 16.1326 16.1326 16.6999 16.6999 16.7669 16.7669 k = 0.3179 0.6037 0.3468 ( 4748 PWs) bands (ev): -72.1087 -72.1087 -72.1051 -72.1051 -40.9361 -40.9361 -40.9232 -40.9232 -36.4887 -36.4887 -36.4586 -36.4586 -36.4520 -36.4520 -36.4461 -36.4461 -21.6453 -21.6453 -4.5774 -4.5774 -3.5133 -3.5133 -3.4103 -3.4103 3.9716 3.9716 4.7948 4.7948 7.9965 7.9965 8.3861 8.3861 8.5487 8.5487 8.5857 8.5857 8.7232 8.7232 8.8978 8.8978 9.3325 9.3325 9.6070 9.6070 9.6535 9.6535 9.9503 9.9503 9.9768 9.9768 12.8689 12.8689 13.2733 13.2733 13.9102 13.9102 15.7870 15.7870 16.0479 16.0479 16.7248 16.7248 16.7854 16.7854 k = 0.3111 0.6146 0.3597 ( 4756 PWs) bands (ev): -72.1085 -72.1085 -72.1053 -72.1053 -40.9355 -40.9355 -40.9238 -40.9238 -36.4873 -36.4873 -36.4600 -36.4600 -36.4517 -36.4517 -36.4464 -36.4464 -21.6451 -21.6451 -4.5786 -4.5786 -3.5159 -3.5159 -3.4096 -3.4096 3.9757 3.9757 4.8354 4.8354 8.0243 8.0243 8.4015 8.4015 8.5085 8.5085 8.6180 8.6180 8.6976 8.6976 8.9254 8.9254 9.3285 9.3285 9.5883 9.5883 9.6268 9.6268 9.9128 9.9128 9.9490 9.9490 12.8881 12.8881 13.2108 13.2108 13.8004 13.8004 15.8410 15.8410 15.9740 15.9740 16.7036 16.7036 16.8541 16.8541 k = 0.3044 0.6256 0.3725 ( 4756 PWs) bands (ev): -72.1084 -72.1084 -72.1054 -72.1054 -40.9349 -40.9349 -40.9244 -40.9244 -36.4859 -36.4859 -36.4614 -36.4614 -36.4514 -36.4514 -36.4467 -36.4467 -21.6450 -21.6450 -4.5797 -4.5797 -3.5183 -3.5183 -3.4089 -3.4089 3.9773 3.9773 4.8761 4.8761 8.0467 8.0467 8.4017 8.4017 8.4881 8.4881 8.6424 8.6424 8.6816 8.6816 8.9554 8.9554 9.3208 9.3208 9.5683 9.5683 9.6062 9.6062 9.8686 9.8686 9.9345 9.9345 12.9066 12.9066 13.1506 13.1506 13.6920 13.6920 15.8248 15.8248 15.9702 15.9702 16.6816 16.6816 16.9274 16.9274 k = 0.2976 0.6365 0.3853 ( 4752 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9343 -40.9343 -40.9250 -40.9250 -36.4844 -36.4844 -36.4629 -36.4629 -36.4512 -36.4512 -36.4470 -36.4470 -21.6449 -21.6449 -4.5806 -4.5806 -3.5205 -3.5205 -3.4082 -3.4082 3.9762 3.9762 4.9167 4.9167 8.0616 8.0616 8.3822 8.3822 8.4943 8.4943 8.6310 8.6310 8.7042 8.7042 8.9858 8.9858 9.3096 9.3096 9.5465 9.5465 9.5929 9.5929 9.8238 9.8238 9.9268 9.9268 12.9243 12.9243 13.0934 13.0934 13.5850 13.5850 15.7449 15.7449 16.0297 16.0297 16.6619 16.6619 17.0018 17.0018 k = 0.2976 0.6365 0.3853 ( 4752 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9343 -40.9343 -40.9250 -40.9250 -36.4844 -36.4844 -36.4629 -36.4629 -36.4512 -36.4512 -36.4470 -36.4470 -21.6449 -21.6449 -4.5806 -4.5806 -3.5205 -3.5205 -3.4082 -3.4082 3.9762 3.9762 4.9167 4.9167 8.0616 8.0616 8.3822 8.3822 8.4943 8.4943 8.6310 8.6310 8.7042 8.7042 8.9858 8.9858 9.3096 9.3096 9.5465 9.5465 9.5929 9.5929 9.8238 9.8238 9.9268 9.9268 12.9243 12.9243 13.0934 13.0934 13.5850 13.5850 15.7449 15.7449 16.0297 16.0297 16.6619 16.6619 17.0018 17.0018 k = 0.2811 0.6322 0.3904 ( 4748 PWs) bands (ev): -72.1081 -72.1081 -72.1057 -72.1057 -40.9340 -40.9340 -40.9253 -40.9253 -36.4839 -36.4839 -36.4635 -36.4635 -36.4511 -36.4511 -36.4471 -36.4471 -21.6448 -21.6448 -4.5809 -4.5809 -3.5212 -3.5212 -3.4079 -3.4079 3.9744 3.9744 4.9332 4.9332 8.0657 8.0657 8.3712 8.3712 8.5005 8.5005 8.6221 8.6221 8.7199 8.7199 8.9978 8.9978 9.3042 9.3042 9.5374 9.5374 9.5905 9.5905 9.8062 9.8062 9.9266 9.9266 12.9293 12.9293 13.0473 13.0473 13.5705 13.5705 15.7102 15.7102 16.0545 16.0545 16.6538 16.6538 17.0093 17.0093 k = 0.2645 0.6279 0.3954 ( 4743 PWs) bands (ev): -72.1080 -72.1080 -72.1057 -72.1057 -40.9338 -40.9338 -40.9255 -40.9255 -36.4833 -36.4833 -36.4641 -36.4641 -36.4509 -36.4509 -36.4472 -36.4472 -21.6448 -21.6448 -4.5812 -4.5812 -3.5220 -3.5220 -3.4076 -3.4076 3.9712 3.9712 4.9503 4.9503 8.0700 8.0700 8.3585 8.3585 8.5065 8.5065 8.6142 8.6142 8.7382 8.7382 9.0100 9.0100 9.2979 9.2979 9.5276 9.5276 9.5905 9.5905 9.7885 9.7885 9.9300 9.9300 12.9179 12.9179 12.9758 12.9758 13.6003 13.6003 15.6765 15.6765 16.0748 16.0748 16.6443 16.6443 16.9820 16.9820 k = 0.2480 0.6237 0.4005 ( 4739 PWs) bands (ev): -72.1080 -72.1080 -72.1058 -72.1058 -40.9335 -40.9335 -40.9258 -40.9258 -36.4827 -36.4827 -36.4647 -36.4647 -36.4508 -36.4508 -36.4473 -36.4473 -21.6447 -21.6447 -4.5815 -4.5815 -3.5226 -3.5226 -3.4073 -3.4073 3.9669 3.9669 4.9677 4.9677 8.0742 8.0742 8.3458 8.3458 8.5101 8.5101 8.6095 8.6095 8.7575 8.7575 9.0222 9.0222 9.2909 9.2909 9.5176 9.5176 9.5917 9.5917 9.7708 9.7708 9.9374 9.9374 12.8301 12.8301 12.9582 12.9582 13.6553 13.6553 15.6446 15.6446 16.0887 16.0887 16.6341 16.6341 16.9371 16.9371 k = 0.2315 0.6194 0.4055 ( 4736 PWs) bands (ev): -72.1079 -72.1079 -72.1059 -72.1059 -40.9333 -40.9333 -40.9260 -40.9260 -36.4821 -36.4821 -36.4653 -36.4653 -36.4507 -36.4507 -36.4475 -36.4475 -21.6447 -21.6447 -4.5818 -4.5818 -3.5233 -3.5233 -3.4070 -3.4070 3.9618 3.9618 4.9850 4.9850 8.0781 8.0781 8.3343 8.3343 8.5101 8.5101 8.6092 8.6092 8.7770 8.7770 9.0341 9.0341 9.2834 9.2834 9.5077 9.5077 9.5934 9.5934 9.7532 9.7532 9.9491 9.9491 12.7116 12.7116 12.9614 12.9614 13.7232 13.7232 15.6150 15.6150 16.0936 16.0936 16.6243 16.6243 16.8880 16.8880 k = 0.2149 0.6151 0.4105 ( 4734 PWs) bands (ev): -72.1078 -72.1078 -72.1059 -72.1059 -40.9330 -40.9330 -40.9263 -40.9263 -36.4815 -36.4815 -36.4659 -36.4659 -36.4506 -36.4506 -36.4476 -36.4476 -21.6447 -21.6447 -4.5820 -4.5820 -3.5239 -3.5239 -3.4067 -3.4067 3.9561 3.9561 5.0019 5.0019 8.0816 8.0816 8.3246 8.3246 8.5064 8.5064 8.6130 8.6130 8.7963 8.7963 9.0453 9.0453 9.2760 9.2760 9.4978 9.4978 9.5947 9.5947 9.7360 9.7360 9.9654 9.9654 12.5876 12.5876 12.9664 12.9664 13.7979 13.7979 15.5882 15.5882 16.0867 16.0867 16.6167 16.6167 16.8427 16.8427 k = 0.1984 0.6108 0.4156 ( 4735 PWs) bands (ev): -72.1077 -72.1077 -72.1060 -72.1060 -40.9328 -40.9328 -40.9266 -40.9266 -36.4809 -36.4809 -36.4665 -36.4665 -36.4505 -36.4505 -36.4477 -36.4477 -21.6447 -21.6447 -4.5822 -4.5822 -3.5244 -3.5244 -3.4063 -3.4063 3.9502 3.9502 5.0183 5.0183 8.0842 8.0842 8.3175 8.3175 8.4998 8.4998 8.6200 8.6200 8.8149 8.8149 9.0554 9.0554 9.2693 9.2693 9.4882 9.4882 9.5950 9.5950 9.7192 9.7192 9.9863 9.9863 12.4630 12.4630 12.9715 12.9715 13.8765 13.8765 15.5642 15.5642 16.0654 16.0654 16.6138 16.6138 16.8048 16.8048 k = 0.1819 0.6065 0.4206 ( 4735 PWs) bands (ev): -72.1077 -72.1077 -72.1061 -72.1061 -40.9325 -40.9325 -40.9268 -40.9268 -36.4803 -36.4803 -36.4670 -36.4670 -36.4504 -36.4504 -36.4478 -36.4478 -21.6446 -21.6446 -4.5824 -4.5824 -3.5249 -3.5249 -3.4060 -3.4060 3.9442 3.9442 5.0337 5.0337 8.0860 8.0860 8.3131 8.3131 8.4916 8.4916 8.6288 8.6288 8.8326 8.8326 9.0639 9.0639 9.2641 9.2641 9.4789 9.4789 9.5941 9.5941 9.7031 9.7031 10.0116 10.0116 12.3401 12.3401 12.9762 12.9762 13.9573 13.9573 15.5432 15.5432 16.0291 16.0291 16.6174 16.6174 16.7750 16.7750 k = 0.1653 0.6022 0.4256 ( 4736 PWs) bands (ev): -72.1076 -72.1076 -72.1061 -72.1061 -40.9322 -40.9322 -40.9271 -40.9271 -36.4797 -36.4797 -36.4676 -36.4676 -36.4503 -36.4503 -36.4479 -36.4479 -21.6446 -21.6446 -4.5826 -4.5826 -3.5254 -3.5254 -3.4057 -3.4057 3.9382 3.9382 5.0481 5.0481 8.0867 8.0867 8.3116 8.3116 8.4826 8.4826 8.6385 8.6385 8.8491 8.8491 9.0703 9.0703 9.2611 9.2611 9.4697 9.4697 9.5917 9.5917 9.6881 9.6881 10.0412 10.0412 12.2203 12.2203 12.9804 12.9804 14.0393 14.0393 15.5251 15.5251 15.9792 15.9792 16.6282 16.6282 16.7522 16.7522 k = 0.1488 0.5979 0.4307 ( 4744 PWs) bands (ev): -72.1075 -72.1075 -72.1062 -72.1062 -40.9320 -40.9320 -40.9273 -40.9273 -36.4791 -36.4791 -36.4683 -36.4683 -36.4501 -36.4501 -36.4481 -36.4481 -21.6446 -21.6446 -4.5828 -4.5828 -3.5258 -3.5258 -3.4054 -3.4054 3.9325 3.9325 5.0614 5.0614 8.0864 8.0864 8.3128 8.3128 8.4734 8.4734 8.6484 8.6484 8.8643 8.8643 9.0742 9.0742 9.2609 9.2609 9.4607 9.4607 9.5878 9.5878 9.6742 9.6742 10.0742 10.0742 12.1048 12.1048 12.9842 12.9842 14.1218 14.1218 15.5098 15.5098 15.9187 15.9187 16.6451 16.6451 16.7350 16.7350 k = 0.1323 0.5937 0.4357 ( 4736 PWs) bands (ev): -72.1075 -72.1075 -72.1063 -72.1063 -40.9317 -40.9317 -40.9276 -40.9276 -36.4785 -36.4785 -36.4689 -36.4689 -36.4500 -36.4500 -36.4482 -36.4482 -21.6446 -21.6446 -4.5829 -4.5829 -3.5261 -3.5261 -3.4051 -3.4051 3.9271 3.9271 5.0734 5.0734 8.0853 8.0853 8.3164 8.3164 8.4644 8.4644 8.6582 8.6582 8.8778 8.8778 9.0756 9.0756 9.2640 9.2640 9.4517 9.4517 9.5826 9.5826 9.6619 9.6619 10.1103 10.1103 11.9946 11.9946 12.9874 12.9874 14.2039 14.2039 15.4972 15.4972 15.8508 15.8508 16.6662 16.6662 16.7224 16.7224 k = 0.1157 0.5894 0.4407 ( 4739 PWs) bands (ev): -72.1074 -72.1074 -72.1064 -72.1064 -40.9315 -40.9315 -40.9278 -40.9278 -36.4779 -36.4779 -36.4695 -36.4695 -36.4499 -36.4499 -36.4483 -36.4483 -21.6446 -21.6446 -4.5830 -4.5830 -3.5265 -3.5265 -3.4048 -3.4048 3.9221 3.9221 5.0840 5.0840 8.0835 8.0835 8.3218 8.3218 8.4558 8.4558 8.6674 8.6674 8.8895 8.8895 9.0749 9.0749 9.2701 9.2701 9.4425 9.4425 9.5763 9.5763 9.6512 9.6512 10.1482 10.1482 11.8907 11.8907 12.9900 12.9900 14.2849 14.2849 15.4869 15.4869 15.7788 15.7788 16.6874 16.6874 16.7153 16.7153 k = 0.0992 0.5851 0.4458 ( 4739 PWs) bands (ev): -72.1073 -72.1073 -72.1064 -72.1064 -40.9312 -40.9312 -40.9281 -40.9281 -36.4773 -36.4773 -36.4701 -36.4701 -36.4498 -36.4498 -36.4484 -36.4484 -21.6446 -21.6446 -4.5831 -4.5831 -3.5267 -3.5267 -3.4046 -3.4046 3.9177 3.9177 5.0933 5.0933 8.0814 8.0814 8.3286 8.3286 8.4476 8.4476 8.6759 8.6759 8.8993 8.8993 9.0728 9.0728 9.2790 9.2790 9.4330 9.4330 9.5694 9.5694 9.6421 9.6421 10.1871 10.1871 11.7946 11.7946 12.9922 12.9922 14.3639 14.3639 15.4788 15.4788 15.7055 15.7055 16.6958 16.6958 16.7241 16.7241 k = 0.0827 0.5808 0.4508 ( 4738 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9310 -40.9310 -40.9284 -40.9284 -36.4767 -36.4767 -36.4707 -36.4707 -36.4497 -36.4497 -36.4485 -36.4485 -21.6446 -21.6446 -4.5832 -4.5832 -3.5270 -3.5270 -3.4044 -3.4044 3.9138 3.9138 5.1012 5.1012 8.0793 8.0793 8.3361 8.3361 8.4399 8.4399 8.6835 8.6835 8.9070 8.9070 9.0700 9.0700 9.2901 9.2901 9.4229 9.4229 9.5625 9.5625 9.6346 9.6346 10.2254 10.2254 11.7076 11.7076 12.9940 12.9940 14.4395 14.4395 15.4724 15.4724 15.6333 15.6333 16.6924 16.6924 16.7458 16.7458 k = 0.0661 0.5765 0.4559 ( 4735 PWs) bands (ev): -72.1072 -72.1072 -72.1066 -72.1066 -40.9307 -40.9307 -40.9286 -40.9286 -36.4761 -36.4761 -36.4713 -36.4713 -36.4496 -36.4496 -36.4486 -36.4486 -21.6445 -21.6445 -4.5833 -4.5833 -3.5272 -3.5272 -3.4042 -3.4042 3.9105 3.9105 5.1076 5.1076 8.0772 8.0772 8.3439 8.3439 8.4329 8.4329 8.6900 8.6900 8.9128 8.9128 9.0671 9.0671 9.3027 9.3027 9.4121 9.4121 9.5561 9.5561 9.6286 9.6286 10.2615 10.2615 11.6315 11.6315 12.9954 12.9954 14.5099 14.5099 15.4673 15.4673 15.5653 15.5653 16.6883 16.6883 16.7675 16.7675 k = 0.0496 0.5722 0.4609 ( 4739 PWs) bands (ev): -72.1071 -72.1071 -72.1067 -72.1067 -40.9304 -40.9304 -40.9289 -40.9289 -36.4755 -36.4755 -36.4719 -36.4719 -36.4495 -36.4495 -36.4488 -36.4488 -21.6445 -21.6445 -4.5833 -4.5833 -3.5273 -3.5273 -3.4041 -3.4041 3.9080 3.9080 5.1126 5.1126 8.0754 8.0754 8.3512 8.3512 8.4266 8.4266 8.6953 8.6953 8.9167 8.9167 9.0646 9.0646 9.3162 9.3162 9.4005 9.4005 9.5506 9.5506 9.6241 9.6241 10.2932 10.2932 11.5686 11.5686 12.9963 12.9963 14.5724 14.5724 15.4618 15.4618 15.5061 15.5061 16.6850 16.6850 16.7863 16.7863 k = 0.0331 0.5679 0.4659 ( 4733 PWs) bands (ev): -72.1070 -72.1070 -72.1067 -72.1067 -40.9302 -40.9302 -40.9291 -40.9291 -36.4749 -36.4749 -36.4725 -36.4725 -36.4493 -36.4493 -36.4489 -36.4489 -21.6445 -21.6445 -4.5834 -4.5834 -3.5274 -3.5274 -3.4040 -3.4040 3.9061 3.9061 5.1162 5.1162 8.0741 8.0741 8.3575 8.3575 8.4214 8.4214 8.6992 8.6992 8.9192 8.9192 9.0628 9.0628 9.3303 9.3303 9.3883 9.3883 9.5465 9.5465 9.6208 9.6208 10.3184 10.3184 11.5211 11.5211 12.9970 12.9970 14.6229 14.6229 15.4439 15.4439 15.4719 15.4719 16.6826 16.6826 16.8009 16.8009 k = 0.0165 0.5636 0.4710 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9299 -40.9299 -40.9294 -40.9294 -36.4743 -36.4743 -36.4731 -36.4731 -36.4492 -36.4492 -36.4490 -36.4490 -21.6445 -21.6445 -4.5834 -4.5834 -3.5275 -3.5275 -3.4039 -3.4039 3.9050 3.9050 5.1184 5.1184 8.0732 8.0732 8.3618 8.3618 8.4179 8.4179 8.7016 8.7016 8.9205 8.9205 9.0617 9.0617 9.3441 9.3441 9.3756 9.3756 9.5440 9.5440 9.6189 9.6189 10.3346 10.3346 11.4915 11.4915 12.9974 12.9974 14.6565 14.6565 15.4151 15.4151 15.4660 15.4660 16.6812 16.6812 16.8103 16.8103 k = 0.0000 0.5594 0.4760 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4737 -36.4737 -36.4737 -36.4737 -36.4491 -36.4491 -36.4491 -36.4491 -21.6445 -21.6445 -4.5834 -4.5834 -3.5275 -3.5275 -3.4039 -3.4039 3.9047 3.9047 5.1191 5.1191 8.0729 8.0729 8.3634 8.3634 8.4165 8.4165 8.7024 8.7024 8.9209 8.9209 9.0614 9.0614 9.3532 9.3532 9.3669 9.3669 9.5431 9.5431 9.6183 9.6183 10.3402 10.3402 11.4814 11.4814 12.9976 12.9976 14.6684 14.6684 15.4039 15.4039 15.4650 15.4650 16.6807 16.6807 16.8136 16.8136 k = 0.0000 0.5594 0.4760 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4737 -36.4737 -36.4737 -36.4737 -36.4491 -36.4491 -36.4491 -36.4491 -21.6445 -21.6445 -4.5834 -4.5834 -3.5275 -3.5275 -3.4039 -3.4039 3.9047 3.9047 5.1191 5.1191 8.0729 8.0729 8.3634 8.3634 8.4165 8.4165 8.7024 8.7024 8.9209 8.9209 9.0614 9.0614 9.3532 9.3532 9.3669 9.3669 9.5431 9.5431 9.6183 9.6183 10.3402 10.3402 11.4814 11.4814 12.9976 12.9976 14.6684 14.6684 15.4039 15.4039 15.4650 15.4650 16.6807 16.6807 16.8136 16.8136 k = 0.0068 0.5484 0.4889 ( 4732 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4739 -36.4739 -36.4736 -36.4736 -36.4492 -36.4492 -36.4489 -36.4489 -21.6445 -21.6445 -4.5834 -4.5834 -3.5275 -3.5275 -3.4040 -3.4040 3.9047 3.9047 5.1201 5.1201 8.0713 8.0713 8.3524 8.3524 8.4268 8.4268 8.7030 8.7030 8.9219 8.9219 9.0599 9.0599 9.3538 9.3538 9.3666 9.3666 9.5453 9.5453 9.6210 9.6210 10.3395 10.3395 11.4818 11.4818 12.9950 12.9950 14.6624 14.6624 15.3723 15.3723 15.4753 15.4753 16.7035 16.7035 16.7883 16.7883 k = 0.0135 0.5375 0.5017 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4742 -36.4742 -36.4736 -36.4736 -36.4492 -36.4492 -36.4486 -36.4486 -21.6445 -21.6445 -4.5835 -4.5835 -3.5273 -3.5273 -3.4045 -3.4045 3.9048 3.9048 5.1232 5.1232 8.0667 8.0667 8.3300 8.3300 8.4469 8.4469 8.7048 8.7048 8.9251 8.9251 9.0557 9.0557 9.3534 9.3534 9.3681 9.3681 9.5516 9.5516 9.6289 9.6289 10.3372 10.3372 11.4829 11.4829 12.9871 12.9871 14.6445 14.6445 15.2994 15.2994 15.4885 15.4885 16.7526 16.7526 16.7757 16.7757 k = 0.0203 0.5265 0.5146 ( 4732 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4746 -36.4746 -36.4737 -36.4737 -36.4491 -36.4491 -36.4482 -36.4482 -21.6445 -21.6445 -4.5836 -4.5836 -3.5271 -3.5271 -3.4054 -3.4054 3.9050 3.9050 5.1283 5.1283 8.0590 8.0590 8.3040 8.3040 8.4691 8.4691 8.7077 8.7077 8.9299 8.9299 9.0495 9.0495 9.3494 9.3494 9.3745 9.3745 9.5618 9.5618 9.6412 9.6412 10.3336 10.3336 11.4848 11.4848 12.9743 12.9743 14.6151 14.6151 15.2004 15.2004 15.4990 15.4990 16.7389 16.7389 16.8680 16.8680 k = 0.0270 0.5156 0.5275 ( 4736 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4750 -36.4750 -36.4738 -36.4738 -36.4490 -36.4490 -36.4478 -36.4478 -21.6444 -21.6444 -4.5838 -4.5838 -3.5267 -3.5267 -3.4065 -3.4065 3.9053 3.9053 5.1355 5.1355 8.0486 8.0486 8.2763 8.2763 8.4915 8.4915 8.7118 8.7118 8.9358 8.9358 9.0424 9.0424 9.3437 9.3437 9.3842 9.3842 9.5757 9.5757 9.6570 9.6570 10.3287 10.3287 11.4874 11.4874 12.9565 12.9565 14.5749 14.5749 15.0835 15.0835 15.5087 15.5087 16.7314 16.7314 16.9869 16.9869 k = 0.0338 0.5046 0.5403 ( 4738 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4755 -36.4755 -36.4741 -36.4741 -36.4487 -36.4487 -36.4473 -36.4473 -21.6443 -21.6443 -4.5840 -4.5840 -3.5262 -3.5262 -3.4079 -3.4079 3.9056 3.9056 5.1446 5.1446 8.0358 8.0358 8.2474 8.2474 8.5136 8.5136 8.7169 8.7169 8.9420 8.9420 9.0353 9.0353 9.3385 9.3385 9.3958 9.3958 9.5927 9.5927 9.6754 9.6754 10.3226 10.3226 11.4907 11.4907 12.9340 12.9340 14.5245 14.5245 14.9548 14.9548 15.5187 15.5187 16.7346 16.7346 17.1196 17.1196 k = 0.0405 0.4937 0.5532 ( 4742 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4761 -36.4761 -36.4745 -36.4745 -36.4484 -36.4484 -36.4467 -36.4467 -21.6442 -21.6442 -4.5843 -4.5843 -3.5257 -3.5257 -3.4097 -3.4097 3.9060 3.9060 5.1557 5.1557 8.0207 8.0207 8.2175 8.2175 8.5351 8.5351 8.7229 8.7229 8.9477 8.9477 9.0293 9.0293 9.3352 9.3352 9.4086 9.4086 9.6123 9.6123 9.6957 9.6957 10.3156 10.3156 11.4947 11.4947 12.9073 12.9073 14.4650 14.4650 14.8192 14.8192 15.5297 15.5297 16.7483 16.7483 17.2516 17.2516 k = 0.0473 0.4827 0.5661 ( 4744 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4767 -36.4767 -36.4749 -36.4749 -36.4480 -36.4480 -36.4461 -36.4461 -21.6441 -21.6441 -4.5846 -4.5846 -3.5251 -3.5251 -3.4116 -3.4116 3.9064 3.9064 5.1687 5.1687 8.0038 8.0038 8.1868 8.1868 8.5560 8.5560 8.7299 8.7299 8.9520 8.9520 9.0251 9.0251 9.3347 9.3347 9.4221 9.4221 9.6339 9.6339 9.7169 9.7169 10.3081 10.3081 11.4995 11.4995 12.8765 12.8765 14.3974 14.3974 14.6796 14.6796 15.5418 15.5418 16.7719 16.7719 17.3539 17.3539 k = 0.0541 0.4718 0.5789 ( 4744 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4774 -36.4774 -36.4754 -36.4754 -36.4475 -36.4475 -36.4454 -36.4454 -21.6440 -21.6440 -4.5850 -4.5850 -3.5244 -3.5244 -3.4139 -3.4139 3.9069 3.9069 5.1835 5.1835 7.9854 7.9854 8.1555 8.1555 8.5761 8.5761 8.7377 8.7377 8.9545 8.9545 9.0233 9.0233 9.3379 9.3379 9.4364 9.4364 9.6568 9.6568 9.7388 9.7388 10.3002 10.3002 11.5050 11.5050 12.8421 12.8421 14.3225 14.3225 14.5386 14.5386 15.5551 15.5551 16.8046 16.8046 17.4528 17.4528 k = 0.0608 0.4608 0.5918 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4781 -36.4781 -36.4759 -36.4759 -36.4470 -36.4470 -36.4448 -36.4448 -21.6438 -21.6438 -4.5854 -4.5854 -3.5236 -3.5236 -3.4163 -3.4163 3.9074 3.9074 5.2001 5.2001 7.9656 7.9656 8.1237 8.1237 8.5953 8.5953 8.7462 8.7462 8.9551 8.9551 9.0238 9.0238 9.3451 9.3451 9.4514 9.4514 9.6802 9.6802 9.7608 9.7608 10.2925 10.2925 11.5111 11.5111 12.8044 12.8044 14.2412 14.2412 14.3978 14.3978 15.5696 15.5696 16.8456 16.8456 17.5543 17.5543 k = 0.0676 0.4499 0.6047 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9297 -40.9297 -40.9297 -40.9297 -36.4788 -36.4788 -36.4765 -36.4765 -36.4464 -36.4464 -36.4441 -36.4441 -21.6437 -21.6437 -4.5858 -4.5858 -3.5228 -3.5228 -3.4190 -3.4190 3.9080 3.9080 5.2184 5.2184 7.9448 7.9448 8.0915 8.0915 8.6136 8.6136 8.7555 8.7555 8.9544 8.9544 9.0263 9.0263 9.3564 9.3564 9.4670 9.4670 9.7033 9.7033 9.7827 9.7827 10.2853 10.2853 11.5179 11.5179 12.7638 12.7638 14.1534 14.1534 14.2594 14.2594 15.5852 15.5852 16.8938 16.8938 17.6585 17.6585 k = 0.0743 0.4389 0.6175 ( 4752 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9297 -40.9297 -36.4795 -36.4795 -36.4771 -36.4771 -36.4458 -36.4458 -36.4434 -36.4434 -21.6435 -21.6435 -4.5863 -4.5863 -3.5220 -3.5220 -3.4218 -3.4218 3.9085 3.9085 5.2384 5.2384 7.9231 7.9231 8.0591 8.0591 8.6309 8.6309 8.7655 8.7655 8.9530 8.9530 9.0305 9.0305 9.3716 9.3716 9.4832 9.4832 9.7254 9.7254 9.8041 9.8041 10.2791 10.2791 11.5253 11.5253 12.7208 12.7208 14.0575 14.0575 14.1268 14.1268 15.6018 15.6018 16.9485 16.9485 17.7650 17.7650 k = 0.0811 0.4280 0.6304 ( 4752 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9297 -40.9297 -36.4802 -36.4802 -36.4777 -36.4777 -36.4452 -36.4452 -36.4426 -36.4426 -21.6433 -21.6433 -4.5869 -4.5869 -3.5211 -3.5211 -3.4247 -3.4247 3.9091 3.9091 5.2598 5.2598 7.9008 7.9008 8.0265 8.0265 8.6471 8.6471 8.7762 8.7762 8.9513 8.9513 9.0363 9.0363 9.3901 9.3901 9.5001 9.5001 9.7457 9.7457 9.8248 9.8248 10.2745 10.2745 11.5333 11.5333 12.6756 12.6756 13.9480 13.9480 14.0072 14.0072 15.6191 15.6191 17.0087 17.0087 17.8734 17.8734 k = 0.0878 0.4170 0.6432 ( 4756 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9297 -40.9297 -36.4809 -36.4809 -36.4783 -36.4783 -36.4446 -36.4446 -36.4419 -36.4419 -21.6431 -21.6431 -4.5875 -4.5875 -3.5203 -3.5203 -3.4277 -3.4277 3.9097 3.9097 5.2826 5.2826 7.8782 7.8782 7.9940 7.9940 8.6622 8.6622 8.7876 8.7876 8.9499 8.9499 9.0437 9.0437 9.4113 9.4113 9.5176 9.5176 9.7636 9.7636 9.8448 9.8448 10.2717 10.2717 11.5419 11.5419 12.6286 12.6286 13.8251 13.8251 13.9016 13.9016 15.6370 15.6370 17.0735 17.0735 17.9834 17.9834 k = 0.0946 0.4061 0.6561 ( 4758 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9298 -40.9298 -36.4817 -36.4817 -36.4790 -36.4790 -36.4439 -36.4439 -36.4412 -36.4412 -21.6429 -21.6429 -4.5881 -4.5881 -3.5195 -3.5195 -3.4307 -3.4307 3.9103 3.9103 5.3068 5.3068 7.8552 7.8552 7.9617 7.9617 8.6762 8.6762 8.7995 8.7995 8.9491 8.9491 9.0527 9.0527 9.4345 9.4345 9.5355 9.5355 9.7787 9.7787 9.8639 9.8639 10.2714 10.2714 11.5510 11.5510 12.5803 12.5803 13.6987 13.6987 13.8014 13.8014 15.6552 15.6552 17.1421 17.1421 18.0948 18.0948 k = 0.1014 0.3951 0.6690 ( 4758 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9298 -40.9298 -36.4824 -36.4824 -36.4796 -36.4796 -36.4433 -36.4433 -36.4405 -36.4405 -21.6427 -21.6427 -4.5887 -4.5887 -3.5187 -3.5187 -3.4338 -3.4338 3.9108 3.9108 5.3321 5.3321 7.8321 7.8321 7.9296 7.9296 8.6894 8.6894 8.8118 8.8118 8.9496 8.9496 9.0631 9.0631 9.4588 9.4588 9.5538 9.5538 9.7910 9.7910 9.8819 9.8819 10.2737 10.2737 11.5606 11.5606 12.5309 12.5309 13.5739 13.5739 13.7026 13.7026 15.6734 15.6734 17.2139 17.2139 18.2071 18.2071 k = 0.1081 0.3842 0.6818 ( 4752 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9298 -40.9298 -36.4831 -36.4831 -36.4803 -36.4803 -36.4426 -36.4426 -36.4398 -36.4398 -21.6425 -21.6425 -4.5894 -4.5894 -3.5179 -3.5179 -3.4368 -3.4368 3.9114 3.9114 5.3584 5.3584 7.8090 7.8090 7.8981 7.8981 8.7018 8.7018 8.8242 8.8242 8.9518 8.9518 9.0749 9.0749 9.4834 9.4834 9.5722 9.5722 9.8005 9.8005 9.8988 9.8988 10.2787 10.2787 11.5707 11.5707 12.4808 12.4808 13.4527 13.4527 13.6043 13.6043 15.6915 15.6915 17.2880 17.2880 18.3194 18.3194 k = 0.1149 0.3733 0.6947 ( 4748 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9298 -40.9298 -40.9298 -40.9298 -36.4838 -36.4838 -36.4809 -36.4809 -36.4420 -36.4420 -36.4391 -36.4391 -21.6423 -21.6423 -4.5902 -4.5902 -3.5173 -3.5173 -3.4398 -3.4398 3.9119 3.9119 5.3856 5.3856 7.7860 7.7860 7.8672 7.8672 8.7135 8.7135 8.8364 8.8364 8.9562 8.9562 9.0878 9.0878 9.5075 9.5075 9.5903 9.5903 9.8081 9.8081 9.9143 9.9143 10.2862 10.2862 11.5811 11.5811 12.4304 12.4304 13.3357 13.3357 13.5066 13.5066 15.7089 15.7089 17.3640 17.3640 18.2774 18.2774 k = 0.1216 0.3623 0.7076 ( 4748 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9298 -40.9298 -36.4845 -36.4845 -36.4816 -36.4816 -36.4414 -36.4414 -36.4384 -36.4384 -21.6420 -21.6420 -4.5909 -4.5909 -3.5167 -3.5167 -3.4426 -3.4426 3.9124 3.9124 5.4135 5.4135 7.7633 7.7633 7.8370 7.8370 8.7248 8.7248 8.8480 8.8480 8.9631 8.9631 9.1016 9.1016 9.5299 9.5299 9.6077 9.6077 9.8145 9.8145 9.9284 9.9284 10.2960 10.2960 11.5919 11.5919 12.3799 12.3799 13.2238 13.2238 13.4097 13.4097 15.7254 15.7254 17.4412 17.4412 18.2096 18.2096 k = 0.1284 0.3514 0.7204 ( 4744 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9298 -40.9298 -36.4851 -36.4851 -36.4822 -36.4822 -36.4407 -36.4407 -36.4378 -36.4378 -21.6418 -21.6418 -4.5917 -4.5917 -3.5163 -3.5163 -3.4453 -3.4453 3.9128 3.9128 5.4420 5.4420 7.7409 7.7409 7.8078 7.8078 8.7359 8.7359 8.8591 8.8591 8.9728 8.9728 9.1162 9.1162 9.5496 9.5496 9.6240 9.6240 9.8212 9.8212 9.9413 9.9413 10.3075 10.3075 11.6028 11.6028 12.3297 12.3297 13.1172 13.1172 13.3141 13.3141 15.7406 15.7406 17.5191 17.5191 18.1411 18.1411 k = 0.1351 0.3404 0.7333 ( 4736 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9298 -40.9298 -36.4858 -36.4858 -36.4828 -36.4828 -36.4401 -36.4401 -36.4371 -36.4371 -21.6416 -21.6416 -4.5925 -4.5925 -3.5160 -3.5160 -3.4478 -3.4478 3.9132 3.9132 5.4707 5.4707 7.7188 7.7188 7.7795 7.7795 8.7469 8.7469 8.8697 8.8697 8.9851 8.9851 9.1313 9.1313 9.5653 9.5653 9.6387 9.6387 9.8294 9.8294 9.9532 9.9532 10.3203 10.3203 11.6139 11.6139 12.2801 12.2801 13.0164 13.0164 13.2202 13.2202 15.7541 15.7541 17.5975 17.5975 18.0759 18.0759 k = 0.1419 0.3295 0.7462 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9298 -40.9298 -36.4864 -36.4864 -36.4834 -36.4834 -36.4396 -36.4396 -36.4365 -36.4365 -21.6414 -21.6414 -4.5932 -4.5932 -3.5159 -3.5159 -3.4501 -3.4501 3.9136 3.9136 5.4997 5.4997 7.6973 7.6973 7.7523 7.7523 8.7581 8.7581 8.8799 8.8799 8.9996 8.9996 9.1468 9.1468 9.5762 9.5762 9.6511 9.6511 9.8402 9.8402 9.9642 9.9642 10.3338 10.3338 11.6250 11.6250 12.2315 12.2315 12.9216 12.9216 13.1285 13.1285 15.7656 15.7656 17.6760 17.6760 18.0160 18.0160 k = 0.1486 0.3185 0.7590 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9298 -40.9298 -36.4870 -36.4870 -36.4840 -36.4840 -36.4390 -36.4390 -36.4360 -36.4360 -21.6411 -21.6411 -4.5940 -4.5940 -3.5160 -3.5160 -3.4521 -3.4521 3.9139 3.9139 5.5285 5.5285 7.6764 7.6764 7.7263 7.7263 8.7695 8.7695 8.8900 8.8900 9.0159 9.0159 9.1625 9.1625 9.5816 9.5816 9.6606 9.6606 9.8545 9.8545 9.9748 9.9748 10.3474 10.3474 11.6360 11.6360 12.1841 12.1841 12.8331 12.8331 13.0392 13.0392 15.7747 15.7747 17.7541 17.7541 17.9627 17.9627 k = 0.1554 0.3076 0.7719 ( 4732 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9299 -40.9299 -36.4875 -36.4875 -36.4845 -36.4845 -36.4385 -36.4385 -36.4354 -36.4354 -21.6409 -21.6409 -4.5948 -4.5948 -3.5162 -3.5162 -3.4539 -3.4539 3.9141 3.9141 5.5571 5.5571 7.6562 7.6562 7.7017 7.7017 8.7813 8.7813 8.9003 8.9003 9.0336 9.0336 9.1784 9.1784 9.5817 9.5817 9.6669 9.6669 9.8720 9.8720 9.9854 9.9854 10.3608 10.3608 11.6467 11.6467 12.1383 12.1383 12.7510 12.7510 12.9530 12.9530 15.7814 15.7814 17.8315 17.8315 17.9172 17.9172 k = 0.1622 0.2966 0.7848 ( 4734 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9299 -40.9299 -36.4881 -36.4881 -36.4850 -36.4850 -36.4380 -36.4380 -36.4349 -36.4349 -21.6407 -21.6407 -4.5956 -4.5956 -3.5167 -3.5167 -3.4554 -3.4554 3.9144 3.9144 5.5852 5.5852 7.6368 7.6368 7.6784 7.6784 8.7938 8.7938 8.9107 8.9107 9.0521 9.0521 9.1943 9.1943 9.5773 9.5773 9.6694 9.6694 9.8922 9.8922 9.9963 9.9963 10.3736 10.3736 11.6570 11.6570 12.0944 12.0944 12.6756 12.6756 12.8703 12.8703 15.7853 15.7853 17.8748 17.8748 17.9131 17.9131 k = 0.1689 0.2857 0.7976 ( 4732 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9299 -40.9299 -40.9299 -40.9299 -36.4886 -36.4886 -36.4855 -36.4855 -36.4375 -36.4375 -36.4344 -36.4344 -21.6405 -21.6405 -4.5964 -4.5964 -3.5172 -3.5172 -3.4567 -3.4567 3.9145 3.9145 5.6125 5.6125 7.6182 7.6182 7.6566 7.6566 8.8070 8.8070 8.9213 8.9213 9.0711 9.0711 9.2103 9.2103 9.5691 9.5691 9.6679 9.6679 9.9142 9.9142 10.0078 10.0078 10.3854 10.3854 11.6667 11.6667 12.0528 12.0528 12.6067 12.6067 12.7914 12.7914 15.7864 15.7864 17.8466 17.8466 17.9882 17.9882 k = 0.1757 0.2747 0.8105 ( 4730 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4890 -36.4890 -36.4859 -36.4859 -36.4371 -36.4371 -36.4339 -36.4339 -21.6403 -21.6403 -4.5971 -4.5971 -3.5179 -3.5179 -3.4577 -3.4577 3.9147 3.9147 5.6389 5.6389 7.6006 7.6006 7.6363 7.6363 8.8210 8.8210 8.9320 8.9320 9.0901 9.0901 9.2262 9.2262 9.5581 9.5581 9.6623 9.6623 9.9372 9.9372 10.0200 10.0200 10.3961 10.3961 11.6756 11.6756 12.0138 12.0138 12.5444 12.5444 12.7170 12.7170 15.7850 15.7850 17.8246 17.8246 18.0646 18.0646 k = 0.1824 0.2638 0.8234 ( 4736 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4894 -36.4894 -36.4864 -36.4864 -36.4367 -36.4367 -36.4335 -36.4335 -21.6402 -21.6402 -4.5978 -4.5978 -3.5187 -3.5187 -3.4585 -3.4585 3.9148 3.9148 5.6640 5.6640 7.5841 7.5841 7.6176 7.6176 8.8358 8.8358 8.9427 8.9427 9.1088 9.1088 9.2420 9.2420 9.5452 9.5452 9.6530 9.6530 9.9604 9.9604 10.0326 10.0326 10.4055 10.4055 11.6833 11.6833 11.9777 11.9777 12.4885 12.4885 12.6475 12.6475 15.7812 15.7812 17.8102 17.8102 18.1407 18.1407 k = 0.1892 0.2528 0.8362 ( 4742 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4898 -36.4898 -36.4867 -36.4867 -36.4363 -36.4363 -36.4331 -36.4331 -21.6400 -21.6400 -4.5984 -4.5984 -3.5196 -3.5196 -3.4591 -3.4591 3.9149 3.9149 5.6877 5.6877 7.5688 7.5688 7.6005 7.6005 8.8514 8.8514 8.9533 8.9533 9.1269 9.1269 9.2574 9.2574 9.5308 9.5308 9.6405 9.6405 9.9830 9.9830 10.0455 10.0455 10.4136 10.4136 11.6898 11.6898 11.9450 11.9450 12.4388 12.4388 12.5834 12.5834 15.7753 15.7753 17.8030 17.8030 18.2166 18.2166 k = 0.1959 0.2419 0.8491 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4902 -36.4902 -36.4871 -36.4871 -36.4360 -36.4360 -36.4328 -36.4328 -21.6399 -21.6399 -4.5991 -4.5991 -3.5204 -3.5204 -3.4595 -3.4595 3.9149 3.9149 5.7097 5.7097 7.5547 7.5547 7.5851 7.5851 8.8676 8.8676 8.9635 8.9635 9.1442 9.1442 9.2723 9.2723 9.5156 9.5156 9.6255 9.6255 10.0045 10.0045 10.0583 10.0583 10.4204 10.4204 11.6946 11.6946 11.9159 11.9159 12.3950 12.3950 12.5253 12.5253 15.7679 15.7679 17.8023 17.8023 18.2921 18.2921 k = 0.2027 0.2309 0.8620 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4905 -36.4905 -36.4874 -36.4874 -36.4357 -36.4357 -36.4325 -36.4325 -21.6397 -21.6397 -4.5996 -4.5996 -3.5213 -3.5213 -3.4598 -3.4598 3.9150 3.9150 5.7297 5.7297 7.5421 7.5421 7.5714 7.5714 8.8841 8.8841 8.9734 8.9734 9.1606 9.1606 9.2860 9.2860 9.5004 9.5004 9.6089 9.6089 10.0246 10.0246 10.0705 10.0705 10.4260 10.4260 11.6976 11.6976 11.8910 11.8910 12.3566 12.3566 12.4738 12.4738 15.7595 15.7595 17.8072 17.8072 18.3675 18.3675 k = 0.2095 0.2200 0.8748 ( 4744 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4908 -36.4908 -36.4876 -36.4876 -36.4354 -36.4354 -36.4322 -36.4322 -21.6396 -21.6396 -4.6001 -4.6001 -3.5221 -3.5221 -3.4600 -3.4600 3.9150 3.9150 5.7476 5.7476 7.5310 7.5310 7.5595 7.5595 8.9004 8.9004 8.9826 8.9826 9.1760 9.1760 9.2978 9.2978 9.4860 9.4860 9.5914 9.5914 10.0428 10.0428 10.0817 10.0817 10.4306 10.4306 11.6986 11.6986 11.8704 11.8704 12.3233 12.3233 12.4294 12.4294 15.7507 15.7507 17.8166 17.8166 18.4428 18.4428 k = 0.2162 0.2090 0.8877 ( 4742 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9299 -40.9299 -36.4910 -36.4910 -36.4879 -36.4879 -36.4352 -36.4352 -36.4320 -36.4320 -21.6395 -21.6395 -4.6005 -4.6005 -3.5229 -3.5229 -3.4601 -3.4601 3.9150 3.9150 5.7631 5.7631 7.5215 7.5215 7.5493 7.5493 8.9162 8.9162 8.9910 8.9910 9.1906 9.1906 9.3062 9.3062 9.4736 9.4736 9.5739 9.5739 10.0589 10.0589 10.0915 10.0915 10.4342 10.4342 11.6978 11.6978 11.8543 11.8543 12.2947 12.2947 12.3924 12.3924 15.7421 15.7421 17.8289 17.8289 18.5179 18.5179 k = 0.2230 0.1981 0.9005 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4912 -36.4912 -36.4881 -36.4881 -36.4350 -36.4350 -36.4318 -36.4318 -21.6394 -21.6394 -4.6009 -4.6009 -3.5235 -3.5235 -3.4602 -3.4602 3.9150 3.9150 5.7760 5.7760 7.5136 7.5136 7.5409 7.5409 8.9305 8.9305 8.9985 8.9985 9.2048 9.2048 9.3099 9.3099 9.4650 9.4650 9.5570 9.5570 10.0728 10.0728 10.0993 10.0993 10.4370 10.4370 11.6956 11.6956 11.8423 11.8423 12.2706 12.2706 12.3629 12.3629 15.7341 15.7341 17.8426 17.8426 18.5929 18.5929 k = 0.2297 0.1871 0.9134 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4913 -36.4913 -36.4882 -36.4882 -36.4349 -36.4349 -36.4317 -36.4317 -21.6394 -21.6394 -4.6012 -4.6012 -3.5241 -3.5241 -3.4602 -3.4602 3.9150 3.9150 5.7863 5.7863 7.5074 7.5074 7.5343 7.5343 8.9427 8.9427 9.0048 9.0048 9.2186 9.2186 9.3078 9.3078 9.4613 9.4613 9.5413 9.5413 10.0844 10.0844 10.1050 10.1050 10.4392 10.4392 11.6926 11.6926 11.8339 11.8339 12.2512 12.2512 12.3407 12.3407 15.7274 15.7274 17.8559 17.8559 18.6676 18.6676 k = 0.2365 0.1762 0.9263 ( 4758 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4914 -36.4914 -36.4883 -36.4883 -36.4348 -36.4348 -36.4316 -36.4316 -21.6393 -21.6393 -4.6014 -4.6014 -3.5245 -3.5245 -3.4602 -3.4602 3.9150 3.9150 5.7937 5.7937 7.5029 7.5029 7.5295 7.5295 8.9519 8.9519 9.0096 9.0096 9.2322 9.2322 9.3006 9.3006 9.4623 9.4623 9.5276 9.5276 10.0936 10.0936 10.1083 10.1083 10.4407 10.4407 11.6897 11.6897 11.8286 11.8286 12.2368 12.2368 12.3254 12.3254 15.7223 15.7223 17.8671 17.8671 18.7408 18.7408 k = 0.2432 0.1652 0.9391 ( 4764 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6015 -4.6015 -3.5247 -3.5247 -3.4602 -3.4602 3.9150 3.9150 5.7982 5.7982 7.5002 7.5002 7.5267 7.5267 8.9577 8.9577 9.0127 9.0127 9.2443 9.2443 9.2911 9.2911 9.4655 9.4655 9.5174 9.5174 10.1000 10.1000 10.1095 10.1095 10.4416 10.4416 11.6876 11.6876 11.8256 11.8256 12.2280 12.2280 12.3165 12.3165 15.7191 15.7191 17.8746 17.8746 18.8083 18.8083 k = 0.2500 0.1543 0.9520 ( 4764 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5248 -3.5248 -3.4602 -3.4602 3.9150 3.9150 5.7997 5.7997 7.4993 7.4993 7.5257 7.5257 8.9597 8.9597 9.0138 9.0138 9.2503 9.2503 9.2858 9.2858 9.4674 9.4674 9.5133 9.5133 10.1026 10.1026 10.1094 10.1094 10.4419 10.4419 11.6868 11.6868 11.8247 11.8247 12.2250 12.2250 12.3136 12.3136 15.7180 15.7180 17.8772 17.8772 18.8412 18.8412 k = 0.2500 0.1543 0.9520 ( 4764 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5248 -3.5248 -3.4602 -3.4602 3.9150 3.9150 5.7997 5.7997 7.4993 7.4993 7.5257 7.5257 8.9597 8.9597 9.0138 9.0138 9.2503 9.2503 9.2858 9.2858 9.4674 9.4674 9.5133 9.5133 10.1026 10.1026 10.1094 10.1094 10.4419 10.4419 11.6868 11.6868 11.8247 11.8247 12.2250 12.2250 12.3136 12.3136 15.7180 15.7180 17.8772 17.8772 18.8412 18.8413 k = 0.2632 0.1624 0.9425 ( 4762 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6015 -4.6015 -3.5248 -3.5248 -3.4602 -3.4602 3.9150 3.9150 5.7993 5.7993 7.4997 7.4997 7.5259 7.5259 8.9588 8.9588 9.0138 9.0138 9.2460 9.2460 9.2883 9.2883 9.4683 9.4683 9.5158 9.5158 10.1019 10.1019 10.1094 10.1094 10.4402 10.4402 11.6832 11.6832 11.8286 11.8286 12.2253 12.2253 12.3158 12.3158 15.7208 15.7208 17.8760 17.8760 18.7362 18.7362 k = 0.2763 0.1705 0.9329 ( 4750 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6015 -4.6015 -3.5247 -3.5247 -3.4602 -3.4602 3.9150 3.9150 5.7979 5.7979 7.5007 7.5007 7.5268 7.5268 8.9558 8.9558 9.0144 9.0144 9.2377 9.2377 9.2919 9.2919 9.4695 9.4695 9.5237 9.5237 10.0999 10.0999 10.1094 10.1094 10.4352 10.4352 11.6734 11.6734 11.8388 11.8388 12.2273 12.2273 12.3218 12.3218 15.7290 15.7290 17.8733 17.8733 18.6277 18.6277 k = 0.2895 0.1787 0.9234 ( 4750 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4914 -36.4914 -36.4884 -36.4884 -36.4348 -36.4348 -36.4315 -36.4315 -21.6393 -21.6393 -4.6014 -4.6014 -3.5246 -3.5246 -3.4602 -3.4602 3.9151 3.9151 5.7954 5.7954 7.5024 7.5024 7.5284 7.5284 8.9501 8.9501 9.0158 9.0158 9.2291 9.2291 9.2940 9.2940 9.4700 9.4700 9.5367 9.5367 10.0967 10.0967 10.1092 10.1092 10.4268 10.4268 11.6591 11.6591 11.8532 11.8532 12.2316 12.2316 12.3313 12.3313 15.7424 15.7424 17.8703 17.8703 18.5219 18.5219 k = 0.3026 0.1868 0.9138 ( 4746 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4913 -36.4913 -36.4884 -36.4884 -36.4348 -36.4348 -36.4315 -36.4315 -21.6393 -21.6393 -4.6014 -4.6014 -3.5244 -3.5244 -3.4602 -3.4602 3.9153 3.9153 5.7917 5.7917 7.5047 7.5047 7.5311 7.5311 8.9416 8.9416 9.0184 9.0184 9.2214 9.2214 9.2941 9.2941 9.4702 9.4702 9.5534 9.5534 10.0924 10.0924 10.1086 10.1086 10.4149 10.4149 11.6424 11.6424 11.8700 11.8700 12.2385 12.2385 12.3444 12.3444 15.7607 15.7607 17.8680 17.8680 18.4194 18.4194 k = 0.3158 0.1949 0.9043 ( 4743 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9301 -40.9301 -40.9299 -40.9299 -36.4912 -36.4912 -36.4884 -36.4884 -36.4349 -36.4349 -36.4315 -36.4315 -21.6393 -21.6393 -4.6013 -4.6013 -3.5242 -3.5242 -3.4602 -3.4602 3.9157 3.9157 5.7866 5.7866 7.5079 7.5079 7.5348 7.5348 8.9307 8.9307 9.0220 9.0220 9.2149 9.2149 9.2927 9.2927 9.4705 9.4705 9.5724 9.5724 10.0871 10.0871 10.1078 10.1078 10.3996 10.3996 11.6250 11.6250 11.8875 11.8875 12.2482 12.2482 12.3610 12.3610 15.7834 15.7834 17.8670 17.8670 18.3208 18.3208 k = 0.3289 0.2030 0.8948 ( 4748 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9301 -40.9301 -40.9299 -40.9299 -36.4911 -36.4911 -36.4884 -36.4884 -36.4350 -36.4350 -36.4316 -36.4316 -21.6394 -21.6394 -4.6011 -4.6011 -3.5240 -3.5240 -3.4603 -3.4603 3.9163 3.9163 5.7799 5.7799 7.5119 7.5119 7.5397 7.5397 8.9175 8.9175 9.0265 9.0265 9.2097 9.2097 9.2901 9.2901 9.4713 9.4713 9.5921 9.5921 10.0806 10.0806 10.1067 10.1067 10.3809 10.3809 11.6082 11.6082 11.9046 11.9046 12.2606 12.2606 12.3812 12.3812 15.8101 15.8101 17.8682 17.8682 18.2265 18.2265 k = 0.3421 0.2111 0.8852 ( 4748 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9301 -40.9301 -40.9298 -40.9298 -36.4909 -36.4909 -36.4885 -36.4885 -36.4351 -36.4351 -36.4316 -36.4316 -21.6394 -21.6394 -4.6010 -4.6010 -3.5237 -3.5237 -3.4603 -3.4603 3.9171 3.9171 5.7717 5.7717 7.5170 7.5170 7.5456 7.5456 8.9027 8.9027 9.0317 9.0317 9.2056 9.2056 9.2867 9.2867 9.4731 9.4731 9.6118 9.6118 10.0731 10.0731 10.1054 10.1054 10.3587 10.3587 11.5933 11.5933 11.9206 11.9206 12.2754 12.2754 12.4049 12.4049 15.8403 15.8403 17.8720 17.8720 18.1371 18.1371 k = 0.3553 0.2193 0.8757 ( 4750 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9302 -40.9302 -40.9298 -40.9298 -36.4907 -36.4907 -36.4885 -36.4885 -36.4353 -36.4353 -36.4316 -36.4316 -21.6394 -21.6394 -4.6008 -4.6008 -3.5234 -3.5234 -3.4603 -3.4603 3.9181 3.9181 5.7619 5.7619 7.5231 7.5231 7.5526 7.5526 8.8865 8.8865 9.0374 9.0374 9.2027 9.2027 9.2826 9.2826 9.4759 9.4759 9.6306 9.6306 10.0645 10.0645 10.1041 10.1041 10.3332 10.3332 11.5812 11.5812 11.9350 11.9350 12.2924 12.2924 12.4321 12.4321 15.8735 15.8735 17.8789 17.8789 18.0529 18.0529 k = 0.3684 0.2274 0.8661 ( 4749 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9303 -40.9303 -40.9297 -40.9297 -36.4905 -36.4905 -36.4885 -36.4885 -36.4354 -36.4354 -36.4316 -36.4316 -21.6395 -21.6395 -4.6007 -4.6007 -3.5230 -3.5230 -3.4604 -3.4604 3.9194 3.9194 5.7504 5.7504 7.5305 7.5305 7.5607 7.5607 8.8691 8.8691 9.0436 9.0436 9.2008 9.2008 9.2781 9.2781 9.4798 9.4798 9.6481 9.6481 10.0549 10.0549 10.1026 10.1026 10.3045 10.3045 11.5727 11.5727 11.9475 11.9475 12.3112 12.3112 12.4627 12.4627 15.9090 15.9090 17.8890 17.8890 17.9745 17.9745 k = 0.3816 0.2355 0.8566 ( 4756 PWs) bands (ev): -72.1070 -72.1070 -72.1068 -72.1068 -40.9303 -40.9303 -40.9296 -40.9296 -36.4903 -36.4903 -36.4885 -36.4885 -36.4356 -36.4356 -36.4317 -36.4317 -21.6395 -21.6395 -4.6005 -4.6005 -3.5225 -3.5225 -3.4604 -3.4604 3.9210 3.9210 5.7372 5.7372 7.5392 7.5392 7.5697 7.5697 8.8509 8.8509 9.0501 9.0501 9.1998 9.1998 9.2735 9.2735 9.4848 9.4848 9.6638 9.6638 10.0442 10.0442 10.1009 10.1009 10.2727 10.2727 11.5683 11.5683 11.9581 11.9581 12.3317 12.3317 12.4962 12.4962 15.9462 15.9462 17.8927 17.8927 17.9120 17.9120 k = 0.3947 0.2436 0.8470 ( 4753 PWs) bands (ev): -72.1070 -72.1070 -72.1068 -72.1068 -40.9304 -40.9304 -40.9296 -40.9296 -36.4900 -36.4900 -36.4886 -36.4886 -36.4358 -36.4358 -36.4317 -36.4317 -21.6396 -21.6396 -4.6002 -4.6002 -3.5220 -3.5220 -3.4605 -3.4605 3.9229 3.9229 5.7225 5.7225 7.5490 7.5490 7.5796 7.5796 8.8320 8.8320 9.0567 9.0567 9.1996 9.1996 9.2690 9.2690 9.4909 9.4909 9.6775 9.6775 10.0327 10.0327 10.0989 10.0989 10.2384 10.2384 11.5684 11.5684 11.9669 11.9669 12.3535 12.3535 12.5324 12.5324 15.9843 15.9843 17.8326 17.8326 17.9235 17.9235 k = 0.4079 0.2517 0.8375 ( 4744 PWs) bands (ev): -72.1070 -72.1070 -72.1067 -72.1067 -40.9305 -40.9305 -40.9295 -40.9295 -36.4897 -36.4897 -36.4886 -36.4886 -36.4360 -36.4360 -36.4318 -36.4318 -21.6396 -21.6396 -4.6000 -4.6000 -3.5215 -3.5215 -3.4606 -3.4606 3.9250 3.9250 5.7064 5.7064 7.5600 7.5600 7.5904 7.5904 8.8125 8.8125 9.0635 9.0635 9.2003 9.2003 9.2646 9.2646 9.4978 9.4978 9.6889 9.6889 10.0205 10.0205 10.0966 10.0966 10.2021 10.2021 11.5732 11.5732 11.9742 11.9742 12.3766 12.3766 12.5707 12.5707 16.0224 16.0224 17.7726 17.7726 17.9449 17.9449 k = 0.4211 0.2599 0.8280 ( 4750 PWs) bands (ev): -72.1070 -72.1070 -72.1067 -72.1067 -40.9306 -40.9306 -40.9294 -40.9294 -36.4894 -36.4894 -36.4886 -36.4886 -36.4362 -36.4362 -36.4318 -36.4318 -21.6397 -21.6397 -4.5997 -4.5997 -3.5209 -3.5209 -3.4607 -3.4607 3.9273 3.9273 5.6889 5.6889 7.5720 7.5720 7.6020 7.6020 8.7925 8.7925 9.0703 9.0703 9.2017 9.2017 9.2605 9.2605 9.5052 9.5052 9.6977 9.6977 10.0076 10.0076 10.0930 10.0930 10.1652 10.1652 11.5825 11.5825 11.9801 11.9801 12.4008 12.4008 12.6106 12.6106 16.0598 16.0598 17.7191 17.7191 17.9704 17.9704 k = 0.4342 0.2680 0.8184 ( 4754 PWs) bands (ev): -72.1071 -72.1071 -72.1067 -72.1067 -40.9307 -40.9307 -40.9293 -40.9293 -36.4891 -36.4891 -36.4887 -36.4887 -36.4365 -36.4365 -36.4318 -36.4318 -21.6398 -21.6398 -4.5994 -4.5994 -3.5202 -3.5202 -3.4608 -3.4608 3.9299 3.9299 5.6701 5.6701 7.5848 7.5848 7.6146 7.6146 8.7723 8.7723 9.0769 9.0769 9.2038 9.2038 9.2570 9.2570 9.5130 9.5130 9.7038 9.7038 9.9943 9.9943 10.0855 10.0855 10.1313 10.1313 11.5962 11.5962 11.9849 11.9849 12.4264 12.4264 12.6513 12.6513 16.0952 16.0952 17.6727 17.6727 17.9993 17.9993 k = 0.4474 0.2761 0.8089 ( 4748 PWs) bands (ev): -72.1071 -72.1071 -72.1066 -72.1066 -40.9308 -40.9308 -40.9291 -40.9291 -36.4888 -36.4888 -36.4886 -36.4886 -36.4367 -36.4367 -36.4319 -36.4319 -21.6398 -21.6398 -4.5991 -4.5991 -3.5195 -3.5195 -3.4610 -3.4610 3.9326 3.9326 5.6503 5.6503 7.5981 7.5981 7.6279 7.6279 8.7518 8.7518 9.0833 9.0833 9.2064 9.2064 9.2545 9.2545 9.5208 9.5208 9.7068 9.7068 9.9809 9.9809 10.0654 10.0654 10.1102 10.1102 11.6136 11.6136 11.9889 11.9889 12.4534 12.4534 12.6925 12.6925 16.1277 16.1277 17.6335 17.6335 18.0311 18.0311 k = 0.4605 0.2842 0.7993 ( 4746 PWs) bands (ev): -72.1071 -72.1071 -72.1066 -72.1066 -40.9309 -40.9309 -40.9290 -40.9290 -36.4888 -36.4888 -36.4883 -36.4883 -36.4370 -36.4370 -36.4320 -36.4320 -21.6399 -21.6399 -4.5988 -4.5988 -3.5188 -3.5188 -3.4611 -3.4611 3.9354 3.9354 5.6297 5.6297 7.6117 7.6117 7.6422 7.6422 8.7313 8.7313 9.0893 9.0893 9.2095 9.2095 9.2529 9.2529 9.5280 9.5280 9.7061 9.7061 9.9678 9.9678 10.0332 10.0332 10.1026 10.1026 11.6342 11.6342 11.9924 11.9924 12.4820 12.4820 12.7334 12.7334 16.1560 16.1560 17.6019 17.6019 18.0650 18.0650 k = 0.4737 0.2923 0.7898 ( 4748 PWs) bands (ev): -72.1072 -72.1072 -72.1066 -72.1066 -40.9310 -40.9310 -40.9289 -40.9289 -36.4888 -36.4888 -36.4879 -36.4879 -36.4373 -36.4373 -36.4320 -36.4320 -21.6400 -21.6400 -4.5984 -4.5984 -3.5180 -3.5180 -3.4613 -3.4613 3.9383 3.9383 5.6084 5.6084 7.6252 7.6252 7.6574 7.6574 8.7108 8.7108 9.0945 9.0945 9.2128 9.2128 9.2526 9.2526 9.5340 9.5340 9.7010 9.7010 9.9555 9.9555 9.9997 9.9997 10.0994 10.0994 11.6571 11.6571 11.9955 11.9955 12.5127 12.5127 12.7734 12.7734 16.1789 16.1789 17.5781 17.5781 18.0997 18.0997 k = 0.4868 0.3005 0.7802 ( 4750 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9311 -40.9311 -40.9288 -40.9288 -36.4889 -36.4889 -36.4875 -36.4875 -36.4376 -36.4376 -36.4321 -36.4321 -21.6401 -21.6401 -4.5981 -4.5981 -3.5171 -3.5171 -3.4614 -3.4614 3.9411 3.9411 5.5867 5.5867 7.6384 7.6384 7.6735 7.6735 8.6904 8.6904 9.0988 9.0988 9.2166 9.2166 9.2535 9.2535 9.5384 9.5384 9.6903 9.6903 9.9446 9.9446 9.9700 9.9700 10.0977 10.0977 11.6815 11.6815 11.9985 11.9985 12.5457 12.5457 12.8122 12.8122 16.1951 16.1951 17.5624 17.5624 18.1330 18.1330 k = 0.5000 0.3086 0.7707 ( 4750 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9313 -40.9313 -40.9286 -40.9286 -36.4890 -36.4890 -36.4871 -36.4871 -36.4379 -36.4379 -36.4321 -36.4321 -21.6402 -21.6402 -4.5977 -4.5977 -3.5162 -3.5162 -3.4616 -3.4616 3.9438 3.9438 5.5648 5.5648 7.6510 7.6510 7.6905 7.6905 8.6703 8.6703 9.1018 9.1018 9.2207 9.2207 9.2555 9.2555 9.5404 9.5404 9.6736 9.6736 9.9325 9.9325 9.9496 9.9496 10.0969 10.0969 11.7065 11.7065 12.0016 12.0016 12.5815 12.5815 12.8491 12.8491 16.2036 16.2036 17.5549 17.5549 18.1584 18.1584 k = 0.5000 0.3086 0.7707 ( 4750 PWs) bands (ev): -72.1072 -72.1072 -72.1065 -72.1065 -40.9313 -40.9313 -40.9286 -40.9286 -36.4890 -36.4890 -36.4871 -36.4871 -36.4379 -36.4379 -36.4321 -36.4321 -21.6402 -21.6402 -4.5977 -4.5977 -3.5162 -3.5162 -3.4616 -3.4616 3.9438 3.9438 5.5648 5.5648 7.6510 7.6510 7.6905 7.6905 8.6703 8.6703 9.1018 9.1018 9.2207 9.2207 9.2555 9.2555 9.5404 9.5404 9.6736 9.6736 9.9325 9.9325 9.9496 9.9496 10.0969 10.0969 11.7065 11.7065 12.0016 12.0016 12.5815 12.5815 12.8491 12.8491 16.2036 16.2036 17.5549 17.5549 18.1584 18.1584 k = 0.5000 0.3086 0.7523 ( 4750 PWs) bands (ev): -72.1073 -72.1073 -72.1064 -72.1064 -40.9315 -40.9315 -40.9283 -40.9283 -36.4891 -36.4891 -36.4862 -36.4862 -36.4385 -36.4385 -36.4323 -36.4323 -21.6403 -21.6403 -4.5969 -4.5969 -3.5143 -3.5143 -3.4619 -3.4619 3.9489 3.9489 5.5215 5.5215 7.6746 7.6746 7.7257 7.7257 8.6317 8.6317 9.1054 9.1054 9.2280 9.2280 9.2605 9.2605 9.5414 9.5414 9.6354 9.6354 9.9026 9.9026 9.9261 9.9261 10.0960 10.0960 11.7561 11.7561 12.0089 12.0089 12.6560 12.6560 12.9204 12.9204 16.2123 16.2123 17.5485 17.5485 18.1191 18.1191 k = 0.5000 0.3086 0.7340 ( 4740 PWs) bands (ev): -72.1074 -72.1074 -72.1063 -72.1063 -40.9318 -40.9318 -40.9280 -40.9280 -36.4892 -36.4892 -36.4852 -36.4852 -36.4392 -36.4392 -36.4324 -36.4324 -21.6405 -21.6405 -4.5960 -4.5960 -3.5123 -3.5123 -3.4622 -3.4622 3.9538 3.9538 5.4763 5.4763 7.6985 7.6985 7.7640 7.7640 8.5926 8.5926 9.1068 9.1068 9.2329 9.2329 9.2662 9.2662 9.5421 9.5421 9.5972 9.5972 9.8734 9.8734 9.9032 9.9032 10.0952 10.0952 11.8083 11.8083 12.0196 12.0196 12.7359 12.7359 12.9961 12.9961 16.2217 16.2217 17.5420 17.5420 18.0201 18.0201 k = 0.5000 0.3086 0.7156 ( 4746 PWs) bands (ev): -72.1075 -72.1075 -72.1062 -72.1062 -40.9321 -40.9321 -40.9277 -40.9277 -36.4894 -36.4894 -36.4841 -36.4841 -36.4399 -36.4399 -36.4325 -36.4325 -21.6407 -21.6407 -4.5950 -4.5950 -3.5101 -3.5101 -3.4626 -3.4626 3.9586 3.9586 5.4295 5.4295 7.7223 7.7223 7.8051 7.8051 8.5531 8.5531 9.1056 9.1056 9.2351 9.2351 9.2717 9.2717 9.5406 9.5406 9.5612 9.5612 9.8458 9.8458 9.8824 9.8824 10.0944 10.0944 11.8597 11.8597 12.0363 12.0363 12.8209 12.8209 13.0758 13.0758 16.2318 16.2318 17.5354 17.5354 17.9135 17.9135 k = 0.5000 0.3086 0.6973 ( 4742 PWs) bands (ev): -72.1076 -72.1076 -72.1061 -72.1061 -40.9325 -40.9325 -40.9273 -40.9273 -36.4896 -36.4896 -36.4830 -36.4830 -36.4406 -36.4406 -36.4327 -36.4327 -21.6410 -21.6410 -4.5940 -4.5940 -3.5077 -3.5077 -3.4629 -3.4629 3.9631 3.9631 5.3816 5.3816 7.7459 7.7459 7.8489 7.8489 8.5136 8.5136 9.1011 9.1011 9.2342 9.2342 9.2760 9.2760 9.5198 9.5198 9.5451 9.5451 9.8205 9.8205 9.8660 9.8660 10.0936 10.0936 11.9050 11.9050 12.0643 12.0643 12.9108 12.9108 13.1592 13.1592 16.2427 16.2427 17.5289 17.5289 17.8040 17.8040 k = 0.5000 0.3086 0.6789 ( 4750 PWs) bands (ev): -72.1077 -72.1077 -72.1060 -72.1060 -40.9328 -40.9328 -40.9270 -40.9270 -36.4899 -36.4899 -36.4818 -36.4818 -36.4414 -36.4414 -36.4329 -36.4329 -21.6412 -21.6412 -4.5929 -4.5929 -3.5052 -3.5052 -3.4633 -3.4633 3.9671 3.9671 5.3326 5.3326 7.7689 7.7689 7.8951 7.8951 8.4741 8.4741 9.0931 9.0931 9.2289 9.2289 9.2784 9.2784 9.4887 9.4887 9.5404 9.5404 9.7982 9.7982 9.8561 9.8561 10.0931 10.0931 11.9382 11.9382 12.1090 12.1090 13.0052 13.0052 13.2460 13.2460 16.2542 16.2542 17.5224 17.5224 17.6931 17.6931 k = 0.5000 0.3086 0.6606 ( 4750 PWs) bands (ev): -72.1078 -72.1078 -72.1059 -72.1059 -40.9332 -40.9332 -40.9266 -40.9266 -36.4901 -36.4901 -36.4805 -36.4805 -36.4422 -36.4422 -36.4330 -36.4330 -21.6414 -21.6414 -4.5917 -4.5917 -3.5025 -3.5025 -3.4637 -3.4637 3.9705 3.9705 5.2830 5.2830 7.7913 7.7913 7.9436 7.9436 8.4351 8.4351 9.0811 9.0811 9.2178 9.2178 9.2784 9.2784 9.4624 9.4624 9.5337 9.5337 9.7797 9.7797 9.8544 9.8544 10.0928 10.0928 11.9595 11.9595 12.1699 12.1699 13.1041 13.1041 13.3358 13.3358 16.2664 16.2664 17.5159 17.5159 17.5815 17.5815 k = 0.5000 0.3086 0.6422 ( 4758 PWs) bands (ev): -72.1079 -72.1079 -72.1058 -72.1058 -40.9336 -40.9336 -40.9262 -40.9262 -36.4904 -36.4904 -36.4792 -36.4792 -36.4430 -36.4430 -36.4332 -36.4332 -21.6417 -21.6417 -4.5905 -4.5905 -3.4996 -3.4996 -3.4640 -3.4640 3.9732 3.9732 5.2330 5.2330 7.8129 7.8129 7.9938 7.9938 8.3966 8.3966 9.0651 9.0651 9.1996 9.1996 9.2752 9.2752 9.4432 9.4432 9.5238 9.5238 9.7655 9.7655 9.8618 9.8618 10.0927 10.0927 11.9733 11.9733 12.2423 12.2423 13.2071 13.2071 13.4286 13.4286 16.2794 16.2794 17.4697 17.4697 17.5092 17.5092 k = 0.5000 0.3086 0.6239 ( 4754 PWs) bands (ev): -72.1081 -72.1081 -72.1057 -72.1057 -40.9340 -40.9340 -40.9257 -40.9257 -36.4907 -36.4907 -36.4779 -36.4779 -36.4438 -36.4438 -36.4334 -36.4334 -21.6420 -21.6420 -4.5893 -4.5893 -3.4966 -3.4966 -3.4643 -3.4643 3.9750 3.9750 5.1828 5.1828 7.8337 7.8337 8.0450 8.0450 8.3595 8.3595 9.0451 9.0451 9.1742 9.1742 9.2687 9.2687 9.4318 9.4318 9.5116 9.5116 9.7561 9.7561 9.8781 9.8781 10.0932 10.0932 11.9831 11.9831 12.3223 12.3223 13.3142 13.3142 13.5241 13.5241 16.2932 16.2932 17.3583 17.3583 17.5016 17.5016 k = 0.5000 0.3086 0.6055 ( 4762 PWs) bands (ev): -72.1082 -72.1082 -72.1056 -72.1056 -40.9344 -40.9344 -40.9253 -40.9253 -36.4911 -36.4911 -36.4765 -36.4765 -36.4446 -36.4446 -36.4336 -36.4336 -21.6422 -21.6422 -4.5879 -4.5879 -3.4935 -3.4935 -3.4647 -3.4647 3.9759 3.9759 5.1325 5.1325 7.8535 7.8535 8.0954 8.0954 8.3251 8.3251 9.0213 9.0213 9.1427 9.1427 9.2586 9.2586 9.4273 9.4273 9.4985 9.4985 9.7515 9.7515 9.9026 9.9026 10.0943 10.0943 11.9908 11.9908 12.4075 12.4075 13.4249 13.4249 13.6221 13.6221 16.3077 16.3077 17.2478 17.2478 17.4919 17.4919 k = 0.5000 0.3086 0.5872 ( 4762 PWs) bands (ev): -72.1083 -72.1083 -72.1055 -72.1055 -40.9348 -40.9348 -40.9248 -40.9248 -36.4915 -36.4915 -36.4750 -36.4750 -36.4454 -36.4454 -36.4338 -36.4338 -21.6425 -21.6425 -4.5865 -4.5865 -3.4902 -3.4902 -3.4650 -3.4650 3.9758 3.9758 5.0824 5.0824 7.8722 7.8722 8.1401 8.1401 8.2983 8.2983 8.9942 8.9942 9.1070 9.1070 9.2454 9.2454 9.4275 9.4275 9.4864 9.4864 9.7514 9.7514 9.9338 9.9338 10.0964 10.0964 11.9972 11.9972 12.4969 12.4969 13.5392 13.5392 13.7224 13.7224 16.3230 16.3230 17.1384 17.1384 17.4767 17.4767 k = 0.5000 0.3086 0.5688 ( 4756 PWs) bands (ev): -72.1084 -72.1084 -72.1054 -72.1054 -40.9352 -40.9352 -40.9243 -40.9243 -36.4919 -36.4919 -36.4736 -36.4736 -36.4462 -36.4462 -36.4340 -36.4340 -21.6428 -21.6428 -4.5851 -4.5851 -3.4868 -3.4868 -3.4652 -3.4652 3.9745 3.9745 5.0327 5.0327 7.8899 7.8899 8.1643 8.1643 8.2934 8.2934 8.9641 8.9641 9.0684 9.0684 9.2300 9.2300 9.4290 9.4290 9.4780 9.4780 9.7556 9.7556 9.9705 9.9705 10.1001 10.1001 12.0029 12.0029 12.5894 12.5894 13.6567 13.6567 13.8249 13.8249 16.3393 16.3393 17.0308 17.0308 17.4469 17.4469 k = 0.5000 0.3086 0.5505 ( 4764 PWs) bands (ev): -72.1085 -72.1085 -72.1053 -72.1053 -40.9357 -40.9357 -40.9239 -40.9239 -36.4924 -36.4924 -36.4721 -36.4721 -36.4469 -36.4469 -36.4342 -36.4342 -21.6431 -21.6431 -4.5837 -4.5837 -3.4834 -3.4834 -3.4654 -3.4654 3.9720 3.9720 4.9834 4.9834 7.9064 7.9064 8.1548 8.1548 8.3235 8.3235 8.9315 8.9315 9.0283 9.0283 9.2131 9.2131 9.4274 9.4274 9.4769 9.4769 9.7636 9.7636 10.0104 10.0104 10.1066 10.1066 12.0081 12.0081 12.6847 12.6847 13.7771 13.7771 13.9295 13.9295 16.3565 16.3565 16.9250 16.9250 17.3839 17.3839 k = 0.5000 0.3086 0.5321 ( 4756 PWs) bands (ev): -72.1087 -72.1087 -72.1051 -72.1051 -40.9361 -40.9361 -40.9234 -40.9234 -36.4929 -36.4929 -36.4705 -36.4705 -36.4477 -36.4477 -36.4344 -36.4344 -21.6434 -21.6434 -4.5821 -4.5821 -3.4799 -3.4799 -3.4655 -3.4655 3.9682 3.9682 4.9347 4.9347 7.9216 7.9216 8.1267 8.1267 8.3732 8.3732 8.8971 8.8971 8.9876 8.9876 9.1959 9.1959 9.4211 9.4211 9.4843 9.4843 9.7749 9.7749 10.0491 10.0491 10.1202 10.1202 12.0129 12.0129 12.7821 12.7821 13.9003 13.9003 14.0362 14.0362 16.3748 16.3748 16.8215 16.8215 17.2799 17.2799 k = 0.5000 0.3086 0.5138 ( 4756 PWs) bands (ev): -72.1088 -72.1088 -72.1050 -72.1050 -40.9366 -40.9366 -40.9229 -40.9229 -36.4935 -36.4935 -36.4690 -36.4690 -36.4484 -36.4484 -36.4346 -36.4346 -21.6437 -21.6437 -4.5806 -4.5806 -3.4765 -3.4765 -3.4654 -3.4654 3.9632 3.9632 4.8868 4.8868 7.9352 7.9352 8.0927 8.0927 8.4295 8.4295 8.8614 8.8614 8.9468 8.9468 9.1793 9.1793 9.4121 9.4121 9.4974 9.4974 9.7889 9.7889 10.0777 10.0777 10.1494 10.1494 12.0174 12.0174 12.8811 12.8811 14.0259 14.0259 14.1449 14.1449 16.3943 16.3943 16.7208 16.7208 17.1523 17.1523 k = 0.5000 0.3086 0.4954 ( 4756 PWs) bands (ev): -72.1089 -72.1089 -72.1049 -72.1049 -40.9371 -40.9371 -40.9224 -40.9224 -36.4941 -36.4941 -36.4675 -36.4675 -36.4491 -36.4491 -36.4348 -36.4348 -21.6440 -21.6440 -4.5791 -4.5791 -3.4733 -3.4733 -3.4649 -3.4649 3.9569 3.9569 4.8397 4.8397 7.9463 7.9463 8.0578 8.0578 8.4881 8.4881 8.8247 8.8247 8.9066 8.9066 9.1639 9.1639 9.4023 9.4023 9.5141 9.5141 9.8052 9.8052 10.0945 10.0945 10.1959 10.1959 12.0217 12.0217 12.9814 12.9814 14.1534 14.1534 14.2555 14.2555 16.4150 16.4150 16.6231 16.6231 17.0151 17.0151 k = 0.5000 0.3086 0.4771 ( 4752 PWs) bands (ev): -72.1090 -72.1090 -72.1047 -72.1047 -40.9375 -40.9375 -40.9219 -40.9219 -36.4947 -36.4947 -36.4659 -36.4659 -36.4498 -36.4498 -36.4350 -36.4350 -21.6443 -21.6443 -4.5775 -4.5775 -3.4710 -3.4710 -3.4635 -3.4635 3.9493 3.9493 4.7936 4.7936 7.9518 7.9518 8.0265 8.0265 8.5468 8.5468 8.7876 8.7876 8.8675 8.8675 9.1504 9.1504 9.3925 9.3925 9.5332 9.5332 9.8235 9.8235 10.1070 10.1070 10.2520 10.2520 12.0257 12.0257 13.0825 13.0825 14.2824 14.2824 14.3682 14.3682 16.4372 16.4372 16.5291 16.5291 16.8740 16.8740 k = 0.5000 0.3086 0.4587 ( 4754 PWs) bands (ev): -72.1092 -72.1092 -72.1046 -72.1046 -40.9380 -40.9380 -40.9214 -40.9214 -36.4954 -36.4954 -36.4643 -36.4643 -36.4504 -36.4504 -36.4352 -36.4352 -21.6446 -21.6446 -4.5759 -4.5759 -3.4697 -3.4697 -3.4609 -3.4609 3.9405 3.9405 4.7485 4.7485 7.9425 7.9425 8.0086 8.0086 8.6042 8.6042 8.7503 8.7503 8.8300 8.8300 9.1391 9.1391 9.3829 9.3829 9.5540 9.5540 9.8434 9.8434 10.1197 10.1197 10.3135 10.3135 12.0294 12.0294 13.1839 13.1839 14.4121 14.4121 14.4830 14.4830 16.4392 16.4392 16.4608 16.4608 16.7316 16.7316 k = 0.5000 0.3086 0.4404 ( 4746 PWs) bands (ev): -72.1093 -72.1093 -72.1045 -72.1045 -40.9384 -40.9384 -40.9209 -40.9209 -36.4961 -36.4961 -36.4628 -36.4628 -36.4510 -36.4510 -36.4354 -36.4354 -21.6449 -21.6449 -4.5743 -4.5743 -3.4691 -3.4691 -3.4575 -3.4575 3.9304 3.9304 4.7046 4.7046 7.9148 7.9148 8.0082 8.0082 8.6574 8.6574 8.7132 8.7132 8.7966 8.7966 9.1305 9.1305 9.3738 9.3738 9.5759 9.5759 9.8648 9.8648 10.1343 10.1343 10.3790 10.3790 12.0329 12.0329 13.2849 13.2849 14.5417 14.5417 14.6003 14.6003 16.3539 16.3539 16.4855 16.4855 16.5900 16.5900 k = 0.5000 0.3086 0.4220 ( 4734 PWs) bands (ev): -72.1094 -72.1094 -72.1043 -72.1043 -40.9389 -40.9389 -40.9205 -40.9205 -36.4968 -36.4968 -36.4613 -36.4613 -36.4515 -36.4515 -36.4356 -36.4356 -21.6452 -21.6452 -4.5727 -4.5727 -3.4689 -3.4689 -3.4537 -3.4537 3.9193 3.9193 4.6619 4.6619 7.8793 7.8793 8.0150 8.0150 8.6766 8.6766 8.6954 8.6954 8.7776 8.7776 9.1246 9.1246 9.3652 9.3652 9.5983 9.5983 9.8876 9.8876 10.1518 10.1518 10.4476 10.4476 12.0360 12.0360 13.3850 13.3850 14.6700 14.6700 14.7207 14.7207 16.2738 16.2738 16.4435 16.4435 16.5179 16.5179 k = 0.5000 0.3086 0.4037 ( 4724 PWs) bands (ev): -72.1096 -72.1096 -72.1042 -72.1042 -40.9393 -40.9393 -40.9200 -40.9200 -36.4975 -36.4975 -36.4597 -36.4597 -36.4520 -36.4520 -36.4358 -36.4358 -21.6455 -21.6455 -4.5711 -4.5711 -3.4689 -3.4689 -3.4498 -3.4498 3.9071 3.9071 4.6205 4.6205 7.8415 7.8415 8.0237 8.0237 8.6406 8.6406 8.6918 8.6918 8.7986 8.7986 9.1214 9.1214 9.3574 9.3574 9.6205 9.6205 9.9119 9.9119 10.1727 10.1727 10.5190 10.5190 12.0389 12.0389 13.4833 13.4833 14.7961 14.7961 14.8445 14.8445 16.1995 16.1995 16.3050 16.3050 16.5464 16.5464 k = 0.5000 0.3086 0.3853 ( 4722 PWs) bands (ev): -72.1097 -72.1097 -72.1040 -72.1040 -40.9398 -40.9398 -40.9195 -40.9195 -36.4983 -36.4983 -36.4583 -36.4583 -36.4525 -36.4525 -36.4360 -36.4360 -21.6458 -21.6458 -4.5695 -4.5695 -3.4689 -3.4689 -3.4457 -3.4457 3.8939 3.8939 4.5805 4.5805 7.8031 7.8031 8.0328 8.0328 8.6056 8.6056 8.6649 8.6649 8.8409 8.8409 9.1211 9.1211 9.3504 9.3504 9.6416 9.6416 9.9377 9.9377 10.1977 10.1977 10.5929 10.5929 12.0413 12.0413 13.5788 13.5788 14.9198 14.9198 14.9708 14.9708 16.1285 16.1285 16.1705 16.1705 16.5791 16.5791 k = 0.5000 0.3086 0.3670 ( 4722 PWs) bands (ev): -72.1098 -72.1098 -72.1039 -72.1039 -40.9402 -40.9402 -40.9190 -40.9190 -36.4991 -36.4991 -36.4568 -36.4568 -36.4529 -36.4529 -36.4361 -36.4361 -21.6461 -21.6461 -4.5679 -4.5679 -3.4689 -3.4689 -3.4416 -3.4416 3.8800 3.8800 4.5419 4.5419 7.7649 7.7649 8.0419 8.0419 8.5715 8.5715 8.6339 8.6339 8.8844 8.8844 9.1238 9.1238 9.3446 9.3446 9.6609 9.6609 9.9653 9.9653 10.2273 10.2273 10.6689 10.6689 12.0433 12.0433 13.6706 13.6706 15.0419 15.0419 15.0979 15.0979 16.0209 16.0209 16.0828 16.0828 16.6152 16.6152 k = 0.5000 0.3086 0.3486 ( 4714 PWs) bands (ev): -72.1099 -72.1099 -72.1038 -72.1038 -40.9406 -40.9406 -40.9186 -40.9186 -36.4999 -36.4999 -36.4554 -36.4554 -36.4533 -36.4533 -36.4363 -36.4363 -21.6464 -21.6464 -4.5664 -4.5664 -3.4689 -3.4689 -3.4375 -3.4375 3.8654 3.8654 4.5048 4.5048 7.7273 7.7273 8.0508 8.0508 8.5386 8.5386 8.6027 8.6027 8.9242 8.9242 9.1300 9.1300 9.3402 9.3402 9.6776 9.6776 9.9946 9.9946 10.2620 10.2620 10.7468 10.7468 12.0449 12.0449 13.7573 13.7573 15.1633 15.1633 15.2241 15.2241 15.8883 15.8883 16.0322 16.0322 16.6547 16.6547 k = 0.5000 0.3086 0.3303 ( 4718 PWs) bands (ev): -72.1101 -72.1101 -72.1037 -72.1037 -40.9411 -40.9411 -40.9182 -40.9182 -36.5007 -36.5007 -36.4541 -36.4541 -36.4536 -36.4536 -36.4364 -36.4364 -21.6467 -21.6467 -4.5649 -4.5649 -3.4689 -3.4689 -3.4335 -3.4335 3.8503 3.8503 4.4693 4.4693 7.6906 7.6906 8.0595 8.0595 8.5069 8.5069 8.5723 8.5723 8.9584 8.9584 9.1401 9.1401 9.3375 9.3375 9.6913 9.6913 10.0251 10.0251 10.3020 10.3020 10.8264 10.8264 12.0459 12.0459 13.8374 13.8374 15.2840 15.2840 15.3473 15.3473 15.7569 15.7569 15.9949 15.9949 16.6980 16.6980 k = 0.5000 0.3086 0.3119 ( 4716 PWs) bands (ev): -72.1102 -72.1102 -72.1035 -72.1035 -40.9415 -40.9415 -40.9177 -40.9177 -36.5015 -36.5015 -36.4540 -36.4540 -36.4527 -36.4527 -36.4366 -36.4366 -21.6470 -21.6470 -4.5634 -4.5634 -3.4689 -3.4689 -3.4295 -3.4295 3.8348 3.8348 4.4354 4.4354 7.6549 7.6549 8.0679 8.0679 8.4766 8.4766 8.5431 8.5431 8.9856 8.9856 9.1547 9.1547 9.3366 9.3366 9.7018 9.7018 10.0567 10.0567 10.3477 10.3477 10.9072 10.9072 12.0463 12.0463 13.9096 13.9096 15.4033 15.4033 15.4646 15.4646 15.6310 15.6310 15.9710 15.9710 16.7454 16.7454 k = 0.5000 0.3086 0.2936 ( 4716 PWs) bands (ev): -72.1103 -72.1103 -72.1034 -72.1034 -40.9419 -40.9419 -40.9173 -40.9173 -36.5023 -36.5023 -36.4543 -36.4543 -36.4515 -36.4515 -36.4367 -36.4367 -21.6472 -21.6472 -4.5620 -4.5620 -3.4689 -3.4689 -3.4255 -3.4255 3.8190 3.8190 4.4032 4.4032 7.6205 7.6205 8.0761 8.0761 8.4478 8.4478 8.5152 8.5152 9.0053 9.0053 9.1739 9.1739 9.3377 9.3377 9.7091 9.7091 10.0884 10.0884 10.3991 10.3991 10.9890 10.9890 12.0460 12.0460 13.9722 13.9722 15.4765 15.4765 15.5368 15.5368 15.5937 15.5937 15.9619 15.9619 16.7969 16.7969 k = 0.5000 0.3086 0.2752 ( 4704 PWs) bands (ev): -72.1104 -72.1104 -72.1033 -72.1033 -40.9422 -40.9422 -40.9169 -40.9169 -36.5030 -36.5030 -36.4545 -36.4545 -36.4503 -36.4503 -36.4368 -36.4368 -21.6475 -21.6475 -4.5606 -4.5606 -3.4688 -3.4688 -3.4217 -3.4217 3.8033 3.8033 4.3727 4.3727 7.5877 7.5877 8.0839 8.0839 8.4206 8.4206 8.4887 8.4887 9.0182 9.0182 9.1967 9.1967 9.3410 9.3410 9.7137 9.7137 10.1195 10.1195 10.4558 10.4558 11.0713 11.0713 12.0450 12.0450 14.0242 14.0242 15.3673 15.3673 15.6480 15.6480 15.6959 15.6959 15.9692 15.9692 16.8519 16.8519 k = 0.5000 0.3086 0.2569 ( 4708 PWs) bands (ev): -72.1105 -72.1105 -72.1032 -72.1032 -40.9426 -40.9426 -40.9166 -40.9166 -36.5038 -36.5038 -36.4548 -36.4548 -36.4492 -36.4492 -36.4368 -36.4368 -21.6477 -21.6477 -4.5593 -4.5593 -3.4688 -3.4688 -3.4180 -3.4180 3.7876 3.7876 4.3439 4.3439 7.5563 7.5563 8.0914 8.0914 8.3950 8.3950 8.4637 8.4637 9.0254 9.0254 9.2218 9.2218 9.3463 9.3463 9.7156 9.7156 10.1497 10.1497 10.5174 10.5174 11.1539 11.1539 12.0431 12.0431 14.0645 14.0645 15.2491 15.2491 15.7644 15.7644 15.7964 15.7964 15.9946 15.9946 16.9095 16.9095 k = 0.5000 0.3086 0.2385 ( 4702 PWs) bands (ev): -72.1106 -72.1106 -72.1031 -72.1031 -40.9429 -40.9429 -40.9162 -40.9162 -36.5045 -36.5045 -36.4550 -36.4550 -36.4481 -36.4481 -36.4369 -36.4369 -21.6479 -21.6479 -4.5580 -4.5580 -3.4687 -3.4687 -3.4145 -3.4145 3.7722 3.7722 4.3170 4.3170 7.5266 7.5266 8.0987 8.0987 8.3710 8.3710 8.4404 8.4404 9.0285 9.0285 9.2479 9.2479 9.3536 9.3536 9.7153 9.7153 10.1785 10.1785 10.5830 10.5830 11.2360 11.2360 12.0401 12.0401 14.0930 14.0930 15.1338 15.1338 15.8768 15.8768 15.8906 15.8906 16.0395 16.0395 16.9675 16.9675 k = 0.5000 0.3086 0.2202 ( 4702 PWs) bands (ev): -72.1107 -72.1107 -72.1030 -72.1030 -40.9432 -40.9432 -40.9159 -40.9159 -36.5052 -36.5052 -36.4551 -36.4551 -36.4472 -36.4472 -36.4369 -36.4369 -21.6482 -21.6482 -4.5569 -4.5569 -3.4687 -3.4687 -3.4111 -3.4111 3.7572 3.7572 4.2919 4.2919 7.4989 7.4989 8.1055 8.1055 8.3488 8.3488 8.4185 8.4185 9.0285 9.0285 9.2739 9.2739 9.3625 9.3625 9.7131 9.7131 10.2057 10.2057 10.6517 10.6517 11.3174 11.3174 12.0361 12.0361 14.1102 14.1102 15.0228 15.0228 15.9709 15.9709 15.9893 15.9893 16.1051 16.1051 17.0222 17.0222 k = 0.5000 0.3086 0.2018 ( 4698 PWs) bands (ev): -72.1108 -72.1108 -72.1029 -72.1029 -40.9435 -40.9435 -40.9155 -40.9155 -36.5059 -36.5059 -36.4553 -36.4553 -36.4463 -36.4463 -36.4369 -36.4369 -21.6484 -21.6484 -4.5558 -4.5558 -3.4686 -3.4686 -3.4079 -3.4079 3.7428 3.7428 4.2686 4.2686 7.4730 7.4730 8.1119 8.1119 8.3284 8.3284 8.3983 8.3983 9.0265 9.0265 9.2993 9.2993 9.3728 9.3728 9.7092 9.7092 10.2311 10.2311 10.7227 10.7227 11.3972 11.3972 12.0310 12.0310 14.1171 14.1171 14.9167 14.9167 16.0503 16.0503 16.0881 16.0881 16.1902 16.1902 17.0684 17.0684 k = 0.5000 0.3086 0.1835 ( 4702 PWs) bands (ev): -72.1109 -72.1109 -72.1028 -72.1028 -40.9438 -40.9438 -40.9153 -40.9153 -36.5065 -36.5065 -36.4554 -36.4554 -36.4455 -36.4455 -36.4368 -36.4368 -21.6486 -21.6486 -4.5547 -4.5547 -3.4686 -3.4686 -3.4049 -3.4049 3.7291 3.7291 4.2473 4.2473 7.4491 7.4491 8.1179 8.1179 8.3098 8.3098 8.3797 8.3797 9.0230 9.0230 9.3235 9.3235 9.3841 9.3841 9.7040 9.7040 10.2545 10.2545 10.7946 10.7946 11.4749 11.4749 12.0246 12.0246 14.1153 14.1153 14.8162 14.8162 16.1237 16.1237 16.1817 16.1817 16.2888 16.2888 17.0912 17.0912 k = 0.5000 0.3086 0.1651 ( 4694 PWs) bands (ev): -72.1109 -72.1109 -72.1028 -72.1028 -40.9441 -40.9441 -40.9150 -40.9150 -36.5071 -36.5071 -36.4555 -36.4555 -36.4449 -36.4449 -36.4367 -36.4367 -21.6487 -21.6487 -4.5538 -4.5538 -3.4685 -3.4685 -3.4021 -3.4021 3.7163 3.7163 4.2279 4.2279 7.4273 7.4273 8.1233 8.1233 8.2933 8.2933 8.3628 8.3628 9.0186 9.0186 9.3464 9.3464 9.3961 9.3961 9.6976 9.6976 10.2761 10.2761 10.8666 10.8666 11.5496 11.5496 12.0170 12.0170 14.1064 14.1064 14.7220 14.7220 16.1913 16.1913 16.2747 16.2747 16.3927 16.3927 17.0378 17.0378 k = 0.5000 0.3086 0.1468 ( 4694 PWs) bands (ev): -72.1110 -72.1110 -72.1027 -72.1027 -40.9443 -40.9443 -40.9148 -40.9148 -36.5076 -36.5076 -36.4556 -36.4556 -36.4443 -36.4443 -36.4366 -36.4366 -21.6489 -21.6489 -4.5529 -4.5529 -3.4684 -3.4684 -3.3996 -3.3996 3.7044 3.7044 4.2105 4.2105 7.4077 7.4077 8.1281 8.1281 8.2787 8.2787 8.3475 8.3475 9.0137 9.0137 9.3675 9.3675 9.4085 9.4085 9.6903 9.6903 10.2956 10.2956 10.9373 10.9373 11.6205 11.6205 12.0080 12.0080 14.0925 14.0925 14.6346 14.6346 16.2529 16.2529 16.3687 16.3687 16.4961 16.4961 16.9712 16.9712 k = 0.5000 0.3086 0.1284 ( 4698 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9445 -40.9445 -40.9145 -40.9145 -36.5081 -36.5081 -36.4557 -36.4557 -36.4439 -36.4439 -36.4365 -36.4365 -21.6490 -21.6490 -4.5522 -4.5522 -3.4684 -3.4684 -3.3973 -3.3973 3.6937 3.6937 4.1951 4.1951 7.3902 7.3902 8.1323 8.1323 8.2662 8.2662 8.3339 8.3339 9.0086 9.0086 9.3866 9.3866 9.4213 9.4213 9.6823 9.6823 10.3130 10.3130 11.0056 11.0056 11.6867 11.6867 11.9977 11.9977 14.0751 14.0751 14.5549 14.5549 16.3086 16.3086 16.4596 16.4596 16.5954 16.5954 16.9134 16.9134 k = 0.5000 0.3086 0.1101 ( 4694 PWs) bands (ev): -72.1111 -72.1111 -72.1026 -72.1026 -40.9447 -40.9447 -40.9144 -40.9144 -36.5085 -36.5085 -36.4558 -36.4558 -36.4435 -36.4435 -36.4363 -36.4363 -21.6491 -21.6491 -4.5515 -4.5515 -3.4683 -3.4683 -3.3953 -3.3953 3.6842 3.6842 4.1817 4.1817 7.3750 7.3750 8.1357 8.1357 8.2557 8.2557 8.3220 8.3220 9.0036 9.0036 9.4033 9.4033 9.4342 9.4342 9.6739 9.6739 10.3283 10.3283 11.0702 11.0702 11.7472 11.7472 11.9863 11.9863 14.0561 14.0561 14.4836 14.4836 16.3589 16.3589 16.5379 16.5379 16.6874 16.6874 16.8745 16.8745 k = 0.5000 0.3086 0.0917 ( 4686 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9448 -40.9448 -40.9142 -40.9142 -36.5089 -36.5089 -36.4558 -36.4558 -36.4432 -36.4432 -36.4362 -36.4362 -21.6492 -21.6492 -4.5509 -4.5509 -3.4682 -3.4682 -3.3936 -3.3936 3.6760 3.6760 4.1703 4.1703 7.3621 7.3621 8.1384 8.1384 8.2473 8.2473 8.3119 8.3119 8.9991 8.9991 9.4173 9.4173 9.4471 9.4471 9.6653 9.6653 10.3415 10.3415 11.1294 11.1294 11.8009 11.8009 11.9743 11.9743 14.0370 14.0370 14.4214 14.4214 16.4041 16.4041 16.5868 16.5868 16.7684 16.7684 16.8686 16.8686 k = 0.5000 0.3086 0.0734 ( 4690 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9450 -40.9450 -40.9141 -40.9141 -36.5092 -36.5092 -36.4559 -36.4559 -36.4429 -36.4429 -36.4361 -36.4361 -21.6493 -21.6493 -4.5505 -4.5505 -3.4682 -3.4682 -3.3922 -3.3922 3.6691 3.6691 4.1610 4.1610 7.3515 7.3515 8.1403 8.1403 8.2408 8.2408 8.3034 8.3034 8.9951 8.9951 9.4284 9.4284 9.4595 9.4595 9.6569 9.6569 10.3523 10.3523 11.1820 11.1820 11.8467 11.8467 11.9622 11.9622 14.0192 14.0192 14.3693 14.3693 16.4438 16.4438 16.5978 16.5978 16.8369 16.8369 16.8980 16.8980 k = 0.5000 0.3086 0.0550 ( 4692 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9451 -40.9451 -40.9140 -40.9140 -36.5094 -36.5094 -36.4559 -36.4559 -36.4428 -36.4428 -36.4359 -36.4359 -21.6494 -21.6494 -4.5501 -4.5501 -3.4682 -3.4682 -3.3910 -3.3910 3.6637 3.6637 4.1537 4.1537 7.3432 7.3432 8.1415 8.1415 8.2361 8.2361 8.2967 8.2967 8.9918 8.9918 9.4369 9.4369 9.4706 9.4706 9.6494 9.6494 10.3607 10.3607 11.2258 11.2258 11.8835 11.8835 11.9511 11.9511 14.0040 14.0040 14.3278 14.3278 16.4774 16.4774 16.5868 16.5868 16.8936 16.8936 16.9386 16.9386 k = 0.5000 0.3086 0.0367 ( 4690 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9451 -40.9451 -40.9139 -40.9139 -36.5096 -36.5096 -36.4560 -36.4560 -36.4427 -36.4427 -36.4358 -36.4358 -21.6494 -21.6494 -4.5498 -4.5498 -3.4681 -3.4681 -3.3902 -3.3902 3.6598 3.6598 4.1485 4.1485 7.3373 7.3373 8.1423 8.1423 8.2330 8.2330 8.2919 8.2919 8.9894 8.9894 9.4428 9.4428 9.4795 9.4795 9.6431 9.6431 10.3668 10.3668 11.2591 11.2591 11.9100 11.9100 11.9422 11.9422 13.9922 13.9922 14.2977 14.2977 16.5039 16.5039 16.5711 16.5711 16.9356 16.9356 16.9709 16.9709 k = 0.5000 0.3086 0.0183 ( 4686 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4358 -36.4358 -21.6495 -21.6495 -4.5497 -4.5497 -3.4681 -3.4681 -3.3898 -3.3898 3.6575 3.6575 4.1454 4.1454 7.3337 7.3337 8.1427 8.1427 8.2313 8.2313 8.2890 8.2890 8.9879 8.9879 9.4464 9.4464 9.4853 9.4853 9.6390 9.6390 10.3705 10.3705 11.2800 11.2800 11.9245 11.9245 11.9380 11.9380 13.9849 13.9849 14.2794 14.2794 16.5218 16.5218 16.5586 16.5586 16.9574 16.9574 16.9896 16.9896 k = 0.5000 0.3086-0.0000 ( 4682 PWs) bands (ev): -72.1112 -72.1112 -72.1025 -72.1025 -40.9452 -40.9452 -40.9138 -40.9138 -36.5097 -36.5097 -36.4560 -36.4560 -36.4426 -36.4426 -36.4357 -36.4357 -21.6495 -21.6495 -4.5496 -4.5496 -3.4681 -3.4681 -3.3896 -3.3896 3.6567 3.6567 4.1443 4.1443 7.3325 7.3325 8.1428 8.1428 8.2307 8.2307 8.2880 8.2880 8.9874 8.9874 9.4476 9.4476 9.4874 9.4874 9.6375 9.6375 10.3718 10.3718 11.2871 11.2871 11.9272 11.9272 11.9387 11.9387 13.9824 13.9824 14.2733 14.2733 16.5288 16.5288 16.5534 16.5534 16.9613 16.9613 16.9922 16.9922 k = 0.0000 0.0000 0.9520 ( 4722 PWs) bands (ev): -72.1068 -72.1068 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5252 -3.5252 -3.4597 -3.4597 3.9135 3.9135 5.8029 5.8029 7.5043 7.5043 7.5236 7.5236 8.9364 8.9364 9.0296 9.0296 9.1469 9.1469 9.2415 9.2415 9.5368 9.5368 9.8953 9.8953 10.0571 10.0571 10.0986 10.0986 10.1325 10.1325 11.4794 11.4794 11.9783 11.9783 12.2042 12.2042 12.4739 12.4739 16.1616 16.1616 17.5925 17.5925 17.7393 17.7393 k = 0.0156 0.0096 0.9520 ( 4730 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5252 -3.5252 -3.4597 -3.4597 3.9135 3.9135 5.8029 5.8029 7.5042 7.5042 7.5236 7.5236 8.9366 8.9366 9.0297 9.0297 9.1469 9.1469 9.2423 9.2423 9.5365 9.5365 9.8852 9.8852 10.0654 10.0654 10.0985 10.0985 10.1340 10.1340 11.4807 11.4807 11.9776 11.9776 12.2043 12.2043 12.4724 12.4724 16.1562 16.1562 17.5983 17.5983 17.7415 17.7415 k = 0.0312 0.0193 0.9520 ( 4730 PWs) bands (ev): -72.1069 -72.1069 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5251 -3.5251 -3.4597 -3.4597 3.9135 3.9135 5.8028 5.8028 7.5040 7.5040 7.5237 7.5237 8.9370 8.9370 9.0299 9.0299 9.1469 9.1469 9.2448 9.2448 9.5355 9.5355 9.8602 9.8602 10.0837 10.0837 10.0985 10.0985 10.1403 10.1403 11.4843 11.4843 11.9756 11.9756 12.2046 12.2046 12.4679 12.4679 16.1407 16.1407 17.6155 17.6155 17.7477 17.7477 k = 0.0469 0.0289 0.9520 ( 4726 PWs) bands (ev): -72.1068 -72.1068 -72.1068 -72.1068 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5251 -3.5251 -3.4598 -3.4598 3.9136 3.9136 5.8026 5.8026 7.5037 7.5037 7.5239 7.5239 8.9378 8.9378 9.0304 9.0304 9.1473 9.1473 9.2486 9.2486 9.5340 9.5340 9.8277 9.8277 10.0982 10.0982 10.1001 10.1001 10.1560 10.1560 11.4904 11.4904 11.9722 11.9722 12.2052 12.2052 12.4606 12.4606 16.1160 16.1160 17.6440 17.6440 17.7574 17.7574 k = 0.0625 0.0386 0.9520 ( 4738 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5251 -3.5251 -3.4598 -3.4598 3.9137 3.9137 5.8024 5.8024 7.5034 7.5034 7.5240 7.5240 8.9389 8.9389 9.0308 9.0308 9.1484 9.1484 9.2535 9.2535 9.5318 9.5318 9.7921 9.7921 10.0985 10.0985 10.1079 10.1079 10.1824 10.1824 11.4988 11.4988 11.9672 11.9672 12.2059 12.2059 12.4508 12.4508 16.0838 16.0838 17.6835 17.6835 17.7694 17.7694 k = 0.0781 0.0482 0.9520 ( 4738 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5251 -3.5251 -3.4598 -3.4598 3.9138 3.9138 5.8022 5.8022 7.5029 7.5029 7.5243 7.5243 8.9402 8.9402 9.0309 9.0309 9.1506 9.1506 9.2593 9.2593 9.5291 9.5291 9.7555 9.7555 10.0986 10.0986 10.1112 10.1112 10.2141 10.2141 11.5095 11.5095 11.9609 11.9609 12.2069 12.2069 12.4389 12.4389 16.0459 16.0459 17.7335 17.7335 17.7831 17.7831 k = 0.0938 0.0579 0.9520 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5251 -3.5251 -3.4599 -3.4599 3.9139 3.9139 5.8019 5.8019 7.5024 7.5024 7.5245 7.5245 8.9419 8.9419 9.0306 9.0306 9.1542 9.1542 9.2654 9.2654 9.5258 9.5258 9.7190 9.7190 10.0988 10.0988 10.1124 10.1124 10.2471 10.2471 11.5224 11.5224 11.9528 11.9528 12.2082 12.2082 12.4252 12.4252 16.0044 16.0044 17.7895 17.7895 17.8017 17.8017 k = 0.1094 0.0675 0.9520 ( 4756 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5250 -3.5250 -3.4599 -3.4599 3.9141 3.9141 5.8015 5.8015 7.5019 7.5019 7.5247 7.5247 8.9437 8.9437 9.0299 9.0299 9.1595 9.1595 9.2718 9.2718 9.5220 9.5220 9.6833 9.6833 10.0991 10.0991 10.1129 10.1129 10.2796 10.2796 11.5373 11.5373 11.9431 11.9431 12.2097 12.2097 12.4104 12.4104 15.9612 15.9612 17.8093 17.8093 17.8663 17.8663 k = 0.1250 0.0771 0.9520 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5250 -3.5250 -3.4600 -3.4600 3.9142 3.9142 5.8012 5.8012 7.5014 7.5014 7.5250 7.5250 8.9458 8.9458 9.0285 9.0285 9.1666 9.1666 9.2781 9.2781 9.5177 9.5177 9.6492 9.6492 10.0993 10.0993 10.1129 10.1129 10.3105 10.3105 11.5540 11.5540 11.9318 11.9318 12.2113 12.2113 12.3949 12.3949 15.9180 15.9180 17.8227 17.8227 17.9459 17.9459 k = 0.1406 0.0868 0.9520 ( 4762 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5250 -3.5250 -3.4600 -3.4600 3.9144 3.9144 5.8009 5.8009 7.5009 7.5009 7.5252 7.5252 8.9480 8.9480 9.0266 9.0266 9.1755 9.1755 9.2839 9.2839 9.5129 9.5129 9.6170 9.6170 10.0997 10.0997 10.1127 10.1127 10.3391 10.3391 11.5722 11.5722 11.9188 11.9188 12.2133 12.2133 12.3794 12.3794 15.8763 15.8763 17.8348 17.8348 18.0347 18.0347 k = 0.1562 0.0964 0.9520 ( 4760 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5249 -3.5249 -3.4600 -3.4600 3.9145 3.9145 5.8006 5.8006 7.5004 7.5004 7.5254 7.5254 8.9503 8.9503 9.0244 9.0244 9.1859 9.1859 9.2889 9.2889 9.5074 9.5074 9.5878 9.5878 10.1000 10.1000 10.1124 10.1124 10.3650 10.3650 11.5918 11.5918 11.9042 11.9042 12.2154 12.2154 12.3644 12.3644 15.8376 15.8376 17.8457 17.8457 18.1317 18.1317 k = 0.1719 0.1061 0.9520 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5249 -3.5249 -3.4601 -3.4601 3.9147 3.9147 5.8004 5.8004 7.5000 7.5000 7.5256 7.5256 8.9526 8.9526 9.0220 9.0220 9.1978 9.1978 9.2926 9.2926 9.5012 9.5012 9.5623 9.5623 10.1004 10.1004 10.1119 10.1119 10.3877 10.3877 11.6121 11.6121 11.8883 11.8883 12.2177 12.2177 12.3505 12.3505 15.8030 15.8030 17.8551 17.8551 18.2363 18.2363 k = 0.1875 0.1157 0.9520 ( 4750 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5249 -3.5249 -3.4601 -3.4601 3.9148 3.9148 5.8001 5.8001 7.4997 7.4997 7.5257 7.5257 8.9548 8.9548 9.0196 9.0196 9.2106 9.2106 9.2945 9.2945 9.4937 9.4937 9.5419 9.5419 10.1009 10.1009 10.1114 10.1114 10.4067 10.4067 11.6327 11.6327 11.8715 11.8715 12.2200 12.2200 12.3380 12.3380 15.7735 15.7735 17.8630 17.8630 18.3477 18.3477 k = 0.2031 0.1254 0.9520 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5248 -3.5248 -3.4602 -3.4602 3.9149 3.9149 5.7999 5.7999 7.4994 7.4994 7.5258 7.5258 8.9567 8.9567 9.0173 9.0173 9.2237 9.2237 9.2943 9.2943 9.4848 9.4848 9.5276 9.5276 10.1014 10.1014 10.1108 10.1108 10.4219 10.4219 11.6524 11.6524 11.8548 11.8548 12.2221 12.2221 12.3277 12.3277 15.7497 15.7497 17.8692 17.8692 18.4653 18.4653 k = 0.2188 0.1350 0.9520 ( 4754 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5248 -3.5248 -3.4602 -3.4602 3.9149 3.9149 5.7998 5.7998 7.4993 7.4993 7.5258 7.5258 8.9583 8.9583 9.0155 9.0155 9.2362 9.2362 9.2918 9.2918 9.4760 9.4760 9.5190 9.5190 10.1018 10.1018 10.1103 10.1103 10.4329 10.4329 11.6698 11.6698 11.8397 11.8397 12.2239 12.2239 12.3199 12.3199 15.7322 15.7322 17.8737 17.8737 18.5882 18.5882 k = 0.2344 0.1447 0.9520 ( 4756 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6015 -4.6015 -3.5248 -3.5248 -3.4602 -3.4602 3.9150 3.9150 5.7997 5.7997 7.4992 7.4992 7.5258 7.5258 8.9594 8.9594 9.0143 9.0143 9.2463 9.2463 9.2880 9.2880 9.4697 9.4697 9.5146 9.5146 10.1022 10.1022 10.1098 10.1098 10.4396 10.4396 11.6824 11.6824 11.8286 11.8286 12.2249 12.2249 12.3151 12.3151 15.7216 15.7216 17.8764 17.8764 18.7155 18.7155 k = 0.2500 0.1543 0.9520 ( 4764 PWs) bands (ev): -72.1069 -72.1069 -72.1069 -72.1069 -40.9300 -40.9300 -40.9300 -40.9300 -36.4915 -36.4915 -36.4884 -36.4884 -36.4347 -36.4347 -36.4315 -36.4315 -21.6393 -21.6393 -4.6016 -4.6016 -3.5248 -3.5248 -3.4602 -3.4602 3.9150 3.9150 5.7997 5.7997 7.4993 7.4993 7.5257 7.5257 8.9597 8.9597 9.0138 9.0138 9.2503 9.2503 9.2858 9.2858 9.4674 9.4674 9.5133 9.5133 10.1026 10.1026 10.1094 10.1094 10.4419 10.4419 11.6868 11.6868 11.8247 11.8247 12.2250 12.2250 12.3136 12.3136 15.7180 15.7180 17.8772 17.8772 18.8412 18.8412 Writing output data file SrxSiPdx2.save init_run : 0.56s CPU 0.85s WALL ( 1 calls) electrons : 268.72s CPU 271.97s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 268.72s CPU 271.96s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.14s CPU 0.25s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.10s WALL ( 341 calls) cegterg : 245.04s CPU 247.55s WALL ( 360 calls) Called by sum_band: Called by *egterg: h_psi : 167.91s CPU 170.15s WALL ( 6667 calls) s_psi : 8.13s CPU 8.06s WALL ( 6667 calls) g_psi : 0.41s CPU 0.31s WALL ( 5966 calls) cdiaghg : 66.14s CPU 67.09s WALL ( 6307 calls) cegterg:over : 9.04s CPU 8.97s WALL ( 5966 calls) cegterg:upda : 7.40s CPU 7.34s WALL ( 5966 calls) cegterg:last : 3.72s CPU 3.75s WALL ( 1042 calls) cdiaghg:chol : 3.68s CPU 3.87s WALL ( 6307 calls) cdiaghg:inve : 2.61s CPU 2.75s WALL ( 6307 calls) cdiaghg:para : 4.50s CPU 4.57s WALL ( 12614 calls) Called by h_psi: h_psi:vloc : 150.85s CPU 152.78s WALL ( 6667 calls) h_psi:vnl : 16.76s CPU 17.06s WALL ( 6667 calls) add_vuspsi : 8.68s CPU 9.09s WALL ( 6667 calls) General routines calbec : 8.04s CPU 7.95s WALL ( 6667 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 137.41s CPU 139.35s WALL ( 900672 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.25s CPU 0.35s WALL ( 682 calls) Parallel routines fft_scatter : 45.74s CPU 46.29s WALL ( 900695 calls) PWSCF : 4m51.62s CPU 5m19.63s WALL This run was terminated on: 21:15:21 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=