Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:42:38 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: ./ZrxAl2Fex4.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 56 47 13 2130 1634 245 Max 57 48 14 2136 1650 249 Sum 2051 1707 485 76779 59081 8867 bravais-lattice index = 14 lattice parameter (alat) = 12.4069 a.u. unit-cell volume = 1238.0906 (a.u.)^3 number of atoms/cell = 13 number of atomic types = 3 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.406851 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.143088 celldm(5)= -0.143088 celldm(6)= -0.713824 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.713824 0.700325 0.000000 ) a(3) = ( -0.143088 -0.350162 0.925695 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.019276 0.540134 ) b(2) = ( 0.000000 1.427909 0.540134 ) b(3) = ( 0.000000 0.000000 1.080269 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 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 Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 4.00 91.22400 Zr( 1.00) Fe 8.00 55.84500 Fe( 1.00) Al 3.00 26.98150 Al( 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= 264 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 2) = ( 0.0000000 0.0000000 0.0207744), wk = 0.0037879 k( 3) = ( 0.0000000 0.0000000 0.0415488), wk = 0.0037879 k( 4) = ( 0.0000000 0.0000000 0.0623232), wk = 0.0037879 k( 5) = ( 0.0000000 0.0000000 0.0830976), wk = 0.0037879 k( 6) = ( 0.0000000 0.0000000 0.1038720), wk = 0.0037879 k( 7) = ( 0.0000000 0.0000000 0.1246464), wk = 0.0037879 k( 8) = ( 0.0000000 0.0000000 0.1454208), wk = 0.0037879 k( 9) = ( 0.0000000 0.0000000 0.1661952), wk = 0.0037879 k( 10) = ( 0.0000000 0.0000000 0.1869696), wk = 0.0037879 k( 11) = ( 0.0000000 0.0000000 0.2077440), wk = 0.0037879 k( 12) = ( 0.0000000 0.0000000 0.2285184), wk = 0.0037879 k( 13) = ( 0.0000000 0.0000000 0.2492928), wk = 0.0037879 k( 14) = ( 0.0000000 0.0000000 0.2700672), wk = 0.0037879 k( 15) = ( 0.0000000 0.0000000 0.2908416), wk = 0.0037879 k( 16) = ( 0.0000000 0.0000000 0.3116160), wk = 0.0037879 k( 17) = ( 0.0000000 0.0000000 0.3323904), wk = 0.0037879 k( 18) = ( 0.0000000 0.0000000 0.3531648), wk = 0.0037879 k( 19) = ( 0.0000000 0.0000000 0.3739392), wk = 0.0037879 k( 20) = ( 0.0000000 0.0000000 0.3947136), wk = 0.0037879 k( 21) = ( 0.0000000 0.0000000 0.4154880), wk = 0.0037879 k( 22) = ( 0.0000000 0.0000000 0.4362624), wk = 0.0037879 k( 23) = ( 0.0000000 0.0000000 0.4570368), wk = 0.0037879 k( 24) = ( 0.0000000 0.0000000 0.4778112), wk = 0.0037879 k( 25) = ( 0.0000000 0.0000000 0.4985856), wk = 0.0037879 k( 26) = ( 0.0000000 0.0000000 0.5193600), wk = 0.0037879 k( 27) = ( 0.0000000 0.0000000 0.5401344), wk = 0.0037879 k( 28) = ( 0.0000000 0.0000000 0.5401344), wk = 0.0037879 k( 29) = ( -0.0192308 0.0078583 0.5401344), wk = 0.0037879 k( 30) = ( -0.0384615 0.0157166 0.5401344), wk = 0.0037879 k( 31) = ( -0.0576923 0.0235750 0.5401344), wk = 0.0037879 k( 32) = ( -0.0769231 0.0314333 0.5401344), wk = 0.0037879 k( 33) = ( -0.0961538 0.0392916 0.5401344), wk = 0.0037879 k( 34) = ( -0.1153846 0.0471499 0.5401344), wk = 0.0037879 k( 35) = ( -0.1346154 0.0550083 0.5401344), wk = 0.0037879 k( 36) = ( -0.1538461 0.0628666 0.5401344), wk = 0.0037879 k( 37) = ( -0.1730769 0.0707249 0.5401344), wk = 0.0037879 k( 38) = ( -0.1923077 0.0785832 0.5401344), wk = 0.0037879 k( 39) = ( -0.2115385 0.0864416 0.5401344), wk = 0.0037879 k( 40) = ( -0.2307692 0.0942999 0.5401344), wk = 0.0037879 k( 41) = ( -0.2500000 0.1021582 0.5401344), wk = 0.0037879 k( 42) = ( -0.2692308 0.1100165 0.5401344), wk = 0.0037879 k( 43) = ( -0.2884615 0.1178749 0.5401344), wk = 0.0037879 k( 44) = ( -0.3076923 0.1257332 0.5401344), wk = 0.0037879 k( 45) = ( -0.3269231 0.1335915 0.5401344), wk = 0.0037879 k( 46) = ( -0.3461538 0.1414498 0.5401344), wk = 0.0037879 k( 47) = ( -0.3653846 0.1493082 0.5401344), wk = 0.0037879 k( 48) = ( -0.3846154 0.1571665 0.5401344), wk = 0.0037879 k( 49) = ( -0.4038462 0.1650248 0.5401344), wk = 0.0037879 k( 50) = ( -0.4230769 0.1728831 0.5401344), wk = 0.0037879 k( 51) = ( -0.4423077 0.1807415 0.5401344), wk = 0.0037879 k( 52) = ( -0.4615385 0.1885998 0.5401344), wk = 0.0037879 k( 53) = ( -0.4807692 0.1964581 0.5401344), wk = 0.0037879 k( 54) = ( -0.5000000 0.2043164 0.5401344), wk = 0.0037879 k( 55) = ( -0.5000000 0.2043164 0.5401344), wk = 0.0037879 k( 56) = ( -0.4864865 0.1987944 0.5255362), wk = 0.0037879 k( 57) = ( -0.4729730 0.1932723 0.5109380), wk = 0.0037879 k( 58) = ( -0.4594595 0.1877502 0.4963397), wk = 0.0037879 k( 59) = ( -0.4459459 0.1822282 0.4817415), wk = 0.0037879 k( 60) = ( -0.4324324 0.1767061 0.4671433), wk = 0.0037879 k( 61) = ( -0.4189189 0.1711840 0.4525451), wk = 0.0037879 k( 62) = ( -0.4054054 0.1656620 0.4379468), wk = 0.0037879 k( 63) = ( -0.3918919 0.1601399 0.4233486), wk = 0.0037879 k( 64) = ( -0.3783784 0.1546178 0.4087504), wk = 0.0037879 k( 65) = ( -0.3648649 0.1490958 0.3941521), wk = 0.0037879 k( 66) = ( -0.3513514 0.1435737 0.3795539), wk = 0.0037879 k( 67) = ( -0.3378378 0.1380516 0.3649557), wk = 0.0037879 k( 68) = ( -0.3243243 0.1325296 0.3503575), wk = 0.0037879 k( 69) = ( -0.3108108 0.1270075 0.3357592), wk = 0.0037879 k( 70) = ( -0.2972973 0.1214854 0.3211610), wk = 0.0037879 k( 71) = ( -0.2837838 0.1159634 0.3065628), wk = 0.0037879 k( 72) = ( -0.2702703 0.1104413 0.2919646), wk = 0.0037879 k( 73) = ( -0.2567568 0.1049192 0.2773663), wk = 0.0037879 k( 74) = ( -0.2432432 0.0993972 0.2627681), wk = 0.0037879 k( 75) = ( -0.2297297 0.0938751 0.2481699), wk = 0.0037879 k( 76) = ( -0.2162162 0.0883531 0.2335716), wk = 0.0037879 k( 77) = ( -0.2027027 0.0828310 0.2189734), wk = 0.0037879 k( 78) = ( -0.1891892 0.0773089 0.2043752), wk = 0.0037879 k( 79) = ( -0.1756757 0.0717869 0.1897770), wk = 0.0037879 k( 80) = ( -0.1621622 0.0662648 0.1751787), wk = 0.0037879 k( 81) = ( -0.1486486 0.0607427 0.1605805), wk = 0.0037879 k( 82) = ( -0.1351351 0.0552207 0.1459823), wk = 0.0037879 k( 83) = ( -0.1216216 0.0496986 0.1313840), wk = 0.0037879 k( 84) = ( -0.1081081 0.0441765 0.1167858), wk = 0.0037879 k( 85) = ( -0.0945946 0.0386545 0.1021876), wk = 0.0037879 k( 86) = ( -0.0810811 0.0331324 0.0875894), wk = 0.0037879 k( 87) = ( -0.0675676 0.0276103 0.0729911), wk = 0.0037879 k( 88) = ( -0.0540540 0.0220883 0.0583929), wk = 0.0037879 k( 89) = ( -0.0405405 0.0165662 0.0437947), wk = 0.0037879 k( 90) = ( -0.0270270 0.0110441 0.0291965), wk = 0.0037879 k( 91) = ( -0.0135135 0.0055221 0.0145982), wk = 0.0037879 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 94) = ( 0.0077556 0.0189794 0.0000000), wk = 0.0037879 k( 95) = ( 0.0155112 0.0379587 0.0000000), wk = 0.0037879 k( 96) = ( 0.0232668 0.0569381 0.0000000), wk = 0.0037879 k( 97) = ( 0.0310224 0.0759174 0.0000000), wk = 0.0037879 k( 98) = ( 0.0387779 0.0948968 0.0000000), wk = 0.0037879 k( 99) = ( 0.0465335 0.1138762 0.0000000), wk = 0.0037879 k( 100) = ( 0.0542891 0.1328555 0.0000000), wk = 0.0037879 k( 101) = ( 0.0620447 0.1518349 0.0000000), wk = 0.0037879 k( 102) = ( 0.0698003 0.1708143 0.0000000), wk = 0.0037879 k( 103) = ( 0.0775559 0.1897936 0.0000000), wk = 0.0037879 k( 104) = ( 0.0853115 0.2087730 0.0000000), wk = 0.0037879 k( 105) = ( 0.0930671 0.2277523 0.0000000), wk = 0.0037879 k( 106) = ( 0.1008227 0.2467317 0.0000000), wk = 0.0037879 k( 107) = ( 0.1085783 0.2657111 0.0000000), wk = 0.0037879 k( 108) = ( 0.1163339 0.2846904 0.0000000), wk = 0.0037879 k( 109) = ( 0.1240895 0.3036698 0.0000000), wk = 0.0037879 k( 110) = ( 0.1318450 0.3226491 0.0000000), wk = 0.0037879 k( 111) = ( 0.1396006 0.3416285 0.0000000), wk = 0.0037879 k( 112) = ( 0.1473562 0.3606079 0.0000000), wk = 0.0037879 k( 113) = ( 0.1551118 0.3795872 0.0000000), wk = 0.0037879 k( 114) = ( 0.1628674 0.3985666 0.0000000), wk = 0.0037879 k( 115) = ( 0.1706230 0.4175460 0.0000000), wk = 0.0037879 k( 116) = ( 0.1783786 0.4365253 0.0000000), wk = 0.0037879 k( 117) = ( 0.1861342 0.4555047 0.0000000), wk = 0.0037879 k( 118) = ( 0.1938898 0.4744840 0.0000000), wk = 0.0037879 k( 119) = ( 0.2016454 0.4934634 0.0000000), wk = 0.0037879 k( 120) = ( 0.2094010 0.5124428 0.0000000), wk = 0.0037879 k( 121) = ( 0.2171565 0.5314221 0.0000000), wk = 0.0037879 k( 122) = ( 0.2249121 0.5504015 0.0000000), wk = 0.0037879 k( 123) = ( 0.2326677 0.5693808 0.0000000), wk = 0.0037879 k( 124) = ( 0.2404233 0.5883602 0.0000000), wk = 0.0037879 k( 125) = ( 0.2481789 0.6073396 0.0000000), wk = 0.0037879 k( 126) = ( 0.2559345 0.6263189 0.0000000), wk = 0.0037879 k( 127) = ( 0.2636901 0.6452983 0.0000000), wk = 0.0037879 k( 128) = ( 0.2714457 0.6642777 0.0000000), wk = 0.0037879 k( 129) = ( 0.2792013 0.6832570 0.0000000), wk = 0.0037879 k( 130) = ( 0.2869569 0.7022364 0.0000000), wk = 0.0037879 k( 131) = ( 0.2947125 0.7212157 0.0000000), wk = 0.0037879 k( 132) = ( 0.3024680 0.7401951 0.0000000), wk = 0.0037879 k( 133) = ( 0.3102236 0.7591745 0.0000000), wk = 0.0037879 k( 134) = ( 0.3179792 0.7781538 0.0000000), wk = 0.0037879 k( 135) = ( 0.3257348 0.7971332 0.0000000), wk = 0.0037879 k( 136) = ( 0.3334904 0.8161125 0.0000000), wk = 0.0037879 k( 137) = ( 0.3334904 0.8161125 0.0000000), wk = 0.0037879 k( 138) = ( 0.3305086 0.8088155 0.0192905), wk = 0.0037879 k( 139) = ( 0.3275268 0.8015185 0.0385810), wk = 0.0037879 k( 140) = ( 0.3245450 0.7942215 0.0578715), wk = 0.0037879 k( 141) = ( 0.3215632 0.7869245 0.0771621), wk = 0.0037879 k( 142) = ( 0.3185814 0.7796275 0.0964526), wk = 0.0037879 k( 143) = ( 0.3155996 0.7723305 0.1157431), wk = 0.0037879 k( 144) = ( 0.3126178 0.7650334 0.1350336), wk = 0.0037879 k( 145) = ( 0.3096360 0.7577364 0.1543241), wk = 0.0037879 k( 146) = ( 0.3066542 0.7504394 0.1736146), wk = 0.0037879 k( 147) = ( 0.3036724 0.7431424 0.1929052), wk = 0.0037879 k( 148) = ( 0.3006906 0.7358454 0.2121957), wk = 0.0037879 k( 149) = ( 0.2977088 0.7285484 0.2314862), wk = 0.0037879 k( 150) = ( 0.2947270 0.7212514 0.2507767), wk = 0.0037879 k( 151) = ( 0.2917452 0.7139543 0.2700672), wk = 0.0037879 k( 152) = ( 0.2887634 0.7066573 0.2893577), wk = 0.0037879 k( 153) = ( 0.2857816 0.6993603 0.3086482), wk = 0.0037879 k( 154) = ( 0.2827998 0.6920633 0.3279388), wk = 0.0037879 k( 155) = ( 0.2798180 0.6847663 0.3472293), wk = 0.0037879 k( 156) = ( 0.2768362 0.6774693 0.3665198), wk = 0.0037879 k( 157) = ( 0.2738544 0.6701723 0.3858103), wk = 0.0037879 k( 158) = ( 0.2708726 0.6628752 0.4051008), wk = 0.0037879 k( 159) = ( 0.2678908 0.6555782 0.4243913), wk = 0.0037879 k( 160) = ( 0.2649090 0.6482812 0.4436818), wk = 0.0037879 k( 161) = ( 0.2619272 0.6409842 0.4629724), wk = 0.0037879 k( 162) = ( 0.2589454 0.6336872 0.4822629), wk = 0.0037879 k( 163) = ( 0.2559636 0.6263902 0.5015534), wk = 0.0037879 k( 164) = ( 0.2529818 0.6190931 0.5208439), wk = 0.0037879 k( 165) = ( 0.2500000 0.6117961 0.5401344), wk = 0.0037879 k( 166) = ( 0.2500000 0.6117961 0.5401344), wk = 0.0037879 k( 167) = ( 0.2368421 0.6171729 0.5259204), wk = 0.0037879 k( 168) = ( 0.2236842 0.6225496 0.5117063), wk = 0.0037879 k( 169) = ( 0.2105263 0.6279264 0.4974922), wk = 0.0037879 k( 170) = ( 0.1973684 0.6333031 0.4832782), wk = 0.0037879 k( 171) = ( 0.1842105 0.6386799 0.4690641), wk = 0.0037879 k( 172) = ( 0.1710526 0.6440566 0.4548500), wk = 0.0037879 k( 173) = ( 0.1578947 0.6494334 0.4406360), wk = 0.0037879 k( 174) = ( 0.1447368 0.6548101 0.4264219), wk = 0.0037879 k( 175) = ( 0.1315790 0.6601869 0.4122079), wk = 0.0037879 k( 176) = ( 0.1184210 0.6655636 0.3979938), wk = 0.0037879 k( 177) = ( 0.1052632 0.6709404 0.3837797), wk = 0.0037879 k( 178) = ( 0.0921053 0.6763171 0.3695657), wk = 0.0037879 k( 179) = ( 0.0789474 0.6816939 0.3553516), wk = 0.0037879 k( 180) = ( 0.0657895 0.6870706 0.3411375), wk = 0.0037879 k( 181) = ( 0.0526316 0.6924474 0.3269235), wk = 0.0037879 k( 182) = ( 0.0394737 0.6978241 0.3127094), wk = 0.0037879 k( 183) = ( 0.0263158 0.7032009 0.2984953), wk = 0.0037879 k( 184) = ( 0.0131579 0.7085776 0.2842813), wk = 0.0037879 k( 185) = ( 0.0000000 0.7139543 0.2700672), wk = 0.0037879 k( 186) = ( 0.0000000 0.7139543 0.2700672), wk = 0.0037879 k( 187) = ( -0.0151586 0.7093108 0.2823430), wk = 0.0037879 k( 188) = ( -0.0303173 0.7046672 0.2946188), wk = 0.0037879 k( 189) = ( -0.0454760 0.7000237 0.3068946), wk = 0.0037879 k( 190) = ( -0.0606346 0.6953801 0.3191703), wk = 0.0037879 k( 191) = ( -0.0757933 0.6907366 0.3314461), wk = 0.0037879 k( 192) = ( -0.0909519 0.6860930 0.3437219), wk = 0.0037879 k( 193) = ( -0.1061106 0.6814495 0.3559977), wk = 0.0037879 k( 194) = ( -0.1212692 0.6768059 0.3682735), wk = 0.0037879 k( 195) = ( -0.1364279 0.6721624 0.3805493), wk = 0.0037879 k( 196) = ( -0.1515865 0.6675188 0.3928250), wk = 0.0037879 k( 197) = ( -0.1667452 0.6628752 0.4051008), wk = 0.0037879 k( 198) = ( -0.1819039 0.6582317 0.4173766), wk = 0.0037879 k( 199) = ( -0.1970625 0.6535881 0.4296524), wk = 0.0037879 k( 200) = ( -0.2122212 0.6489446 0.4419282), wk = 0.0037879 k( 201) = ( -0.2273798 0.6443010 0.4542040), wk = 0.0037879 k( 202) = ( -0.2425385 0.6396575 0.4664797), wk = 0.0037879 k( 203) = ( -0.2576971 0.6350139 0.4787555), wk = 0.0037879 k( 204) = ( -0.2728558 0.6303703 0.4910313), wk = 0.0037879 k( 205) = ( -0.2880144 0.6257268 0.5033071), wk = 0.0037879 k( 206) = ( -0.3031731 0.6210832 0.5155829), wk = 0.0037879 k( 207) = ( -0.3183318 0.6164397 0.5278586), wk = 0.0037879 k( 208) = ( -0.3334904 0.6117961 0.5401344), wk = 0.0037879 k( 209) = ( -0.3334904 0.6117961 0.5401344), wk = 0.0037879 k( 210) = ( -0.3410590 0.5932743 0.5401344), wk = 0.0037879 k( 211) = ( -0.3486276 0.5747525 0.5401344), wk = 0.0037879 k( 212) = ( -0.3561963 0.5562307 0.5401344), wk = 0.0037879 k( 213) = ( -0.3637649 0.5377089 0.5401344), wk = 0.0037879 k( 214) = ( -0.3713335 0.5191871 0.5401344), wk = 0.0037879 k( 215) = ( -0.3789021 0.5006653 0.5401344), wk = 0.0037879 k( 216) = ( -0.3864707 0.4821435 0.5401344), wk = 0.0037879 k( 217) = ( -0.3940394 0.4636217 0.5401344), wk = 0.0037879 k( 218) = ( -0.4016080 0.4450999 0.5401344), wk = 0.0037879 k( 219) = ( -0.4091766 0.4265781 0.5401344), wk = 0.0037879 k( 220) = ( -0.4167452 0.4080563 0.5401344), wk = 0.0037879 k( 221) = ( -0.4243138 0.3895345 0.5401344), wk = 0.0037879 k( 222) = ( -0.4318824 0.3710127 0.5401344), wk = 0.0037879 k( 223) = ( -0.4394511 0.3524909 0.5401344), wk = 0.0037879 k( 224) = ( -0.4470197 0.3339691 0.5401344), wk = 0.0037879 k( 225) = ( -0.4545883 0.3154473 0.5401344), wk = 0.0037879 k( 226) = ( -0.4621569 0.2969255 0.5401344), wk = 0.0037879 k( 227) = ( -0.4697255 0.2784036 0.5401344), wk = 0.0037879 k( 228) = ( -0.4772941 0.2598818 0.5401344), wk = 0.0037879 k( 229) = ( -0.4848628 0.2413600 0.5401344), wk = 0.0037879 k( 230) = ( -0.4924314 0.2228382 0.5401344), wk = 0.0037879 k( 231) = ( -0.5000000 0.2043164 0.5401344), wk = 0.0037879 k( 232) = ( 0.0000000 0.0000000 0.5401344), wk = 0.0037879 k( 233) = ( 0.0078125 0.0191186 0.5401344), wk = 0.0037879 k( 234) = ( 0.0156250 0.0382373 0.5401344), wk = 0.0037879 k( 235) = ( 0.0234375 0.0573559 0.5401344), wk = 0.0037879 k( 236) = ( 0.0312500 0.0764745 0.5401344), wk = 0.0037879 k( 237) = ( 0.0390625 0.0955931 0.5401344), wk = 0.0037879 k( 238) = ( 0.0468750 0.1147118 0.5401344), wk = 0.0037879 k( 239) = ( 0.0546875 0.1338304 0.5401344), wk = 0.0037879 k( 240) = ( 0.0625000 0.1529490 0.5401344), wk = 0.0037879 k( 241) = ( 0.0703125 0.1720677 0.5401344), wk = 0.0037879 k( 242) = ( 0.0781250 0.1911863 0.5401344), wk = 0.0037879 k( 243) = ( 0.0859375 0.2103049 0.5401344), wk = 0.0037879 k( 244) = ( 0.0937500 0.2294235 0.5401344), wk = 0.0037879 k( 245) = ( 0.1015625 0.2485422 0.5401344), wk = 0.0037879 k( 246) = ( 0.1093750 0.2676608 0.5401344), wk = 0.0037879 k( 247) = ( 0.1171875 0.2867794 0.5401344), wk = 0.0037879 k( 248) = ( 0.1250000 0.3058981 0.5401344), wk = 0.0037879 k( 249) = ( 0.1328125 0.3250167 0.5401344), wk = 0.0037879 k( 250) = ( 0.1406250 0.3441353 0.5401344), wk = 0.0037879 k( 251) = ( 0.1484375 0.3632540 0.5401344), wk = 0.0037879 k( 252) = ( 0.1562500 0.3823726 0.5401344), wk = 0.0037879 k( 253) = ( 0.1640625 0.4014912 0.5401344), wk = 0.0037879 k( 254) = ( 0.1718750 0.4206098 0.5401344), wk = 0.0037879 k( 255) = ( 0.1796875 0.4397285 0.5401344), wk = 0.0037879 k( 256) = ( 0.1875000 0.4588471 0.5401344), wk = 0.0037879 k( 257) = ( 0.1953125 0.4779657 0.5401344), wk = 0.0037879 k( 258) = ( 0.2031250 0.4970844 0.5401344), wk = 0.0037879 k( 259) = ( 0.2109375 0.5162030 0.5401344), wk = 0.0037879 k( 260) = ( 0.2187500 0.5353216 0.5401344), wk = 0.0037879 k( 261) = ( 0.2265625 0.5544402 0.5401344), wk = 0.0037879 k( 262) = ( 0.2343750 0.5735589 0.5401344), wk = 0.0037879 k( 263) = ( 0.2421875 0.5926775 0.5401344), wk = 0.0037879 k( 264) = ( 0.2500000 0.6117961 0.5401344), wk = 0.0037879 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 2) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0037879 k( 3) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0037879 k( 4) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0037879 k( 5) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0037879 k( 6) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0037879 k( 7) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0037879 k( 8) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0037879 k( 9) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0037879 k( 10) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0037879 k( 11) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0037879 k( 12) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0037879 k( 13) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0037879 k( 14) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0037879 k( 15) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0037879 k( 16) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0037879 k( 17) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0037879 k( 18) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0037879 k( 19) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0037879 k( 20) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0037879 k( 21) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0037879 k( 22) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0037879 k( 23) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0037879 k( 24) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0037879 k( 25) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0037879 k( 26) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0037879 k( 27) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037879 k( 28) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037879 k( 29) = ( -0.0192308 0.0192308 0.5000000), wk = 0.0037879 k( 30) = ( -0.0384615 0.0384615 0.5000000), wk = 0.0037879 k( 31) = ( -0.0576923 0.0576923 0.5000000), wk = 0.0037879 k( 32) = ( -0.0769231 0.0769231 0.5000000), wk = 0.0037879 k( 33) = ( -0.0961538 0.0961538 0.5000000), wk = 0.0037879 k( 34) = ( -0.1153846 0.1153846 0.5000000), wk = 0.0037879 k( 35) = ( -0.1346154 0.1346154 0.5000000), wk = 0.0037879 k( 36) = ( -0.1538461 0.1538461 0.5000000), wk = 0.0037879 k( 37) = ( -0.1730769 0.1730769 0.5000000), wk = 0.0037879 k( 38) = ( -0.1923077 0.1923077 0.5000000), wk = 0.0037879 k( 39) = ( -0.2115385 0.2115385 0.5000000), wk = 0.0037879 k( 40) = ( -0.2307692 0.2307692 0.5000000), wk = 0.0037879 k( 41) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0037879 k( 42) = ( -0.2692308 0.2692308 0.5000000), wk = 0.0037879 k( 43) = ( -0.2884615 0.2884615 0.5000000), wk = 0.0037879 k( 44) = ( -0.3076923 0.3076923 0.5000000), wk = 0.0037879 k( 45) = ( -0.3269231 0.3269231 0.5000000), wk = 0.0037879 k( 46) = ( -0.3461538 0.3461538 0.5000000), wk = 0.0037879 k( 47) = ( -0.3653846 0.3653846 0.5000000), wk = 0.0037879 k( 48) = ( -0.3846154 0.3846154 0.5000000), wk = 0.0037879 k( 49) = ( -0.4038462 0.4038462 0.5000000), wk = 0.0037879 k( 50) = ( -0.4230769 0.4230769 0.5000000), wk = 0.0037879 k( 51) = ( -0.4423077 0.4423077 0.5000000), wk = 0.0037879 k( 52) = ( -0.4615385 0.4615385 0.5000000), wk = 0.0037879 k( 53) = ( -0.4807692 0.4807692 0.5000000), wk = 0.0037879 k( 54) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0037879 k( 55) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0037879 k( 56) = ( -0.4864865 0.4864865 0.4864865), wk = 0.0037879 k( 57) = ( -0.4729730 0.4729730 0.4729730), wk = 0.0037879 k( 58) = ( -0.4594595 0.4594595 0.4594595), wk = 0.0037879 k( 59) = ( -0.4459459 0.4459459 0.4459459), wk = 0.0037879 k( 60) = ( -0.4324324 0.4324324 0.4324324), wk = 0.0037879 k( 61) = ( -0.4189189 0.4189189 0.4189189), wk = 0.0037879 k( 62) = ( -0.4054054 0.4054054 0.4054054), wk = 0.0037879 k( 63) = ( -0.3918919 0.3918919 0.3918919), wk = 0.0037879 k( 64) = ( -0.3783784 0.3783784 0.3783784), wk = 0.0037879 k( 65) = ( -0.3648649 0.3648649 0.3648649), wk = 0.0037879 k( 66) = ( -0.3513514 0.3513514 0.3513514), wk = 0.0037879 k( 67) = ( -0.3378378 0.3378378 0.3378378), wk = 0.0037879 k( 68) = ( -0.3243243 0.3243243 0.3243243), wk = 0.0037879 k( 69) = ( -0.3108108 0.3108108 0.3108108), wk = 0.0037879 k( 70) = ( -0.2972973 0.2972973 0.2972973), wk = 0.0037879 k( 71) = ( -0.2837838 0.2837838 0.2837838), wk = 0.0037879 k( 72) = ( -0.2702703 0.2702703 0.2702703), wk = 0.0037879 k( 73) = ( -0.2567568 0.2567568 0.2567568), wk = 0.0037879 k( 74) = ( -0.2432432 0.2432432 0.2432432), wk = 0.0037879 k( 75) = ( -0.2297297 0.2297297 0.2297297), wk = 0.0037879 k( 76) = ( -0.2162162 0.2162162 0.2162162), wk = 0.0037879 k( 77) = ( -0.2027027 0.2027027 0.2027027), wk = 0.0037879 k( 78) = ( -0.1891892 0.1891892 0.1891892), wk = 0.0037879 k( 79) = ( -0.1756757 0.1756757 0.1756757), wk = 0.0037879 k( 80) = ( -0.1621622 0.1621622 0.1621622), wk = 0.0037879 k( 81) = ( -0.1486486 0.1486486 0.1486487), wk = 0.0037879 k( 82) = ( -0.1351351 0.1351351 0.1351351), wk = 0.0037879 k( 83) = ( -0.1216216 0.1216216 0.1216216), wk = 0.0037879 k( 84) = ( -0.1081081 0.1081081 0.1081081), wk = 0.0037879 k( 85) = ( -0.0945946 0.0945946 0.0945946), wk = 0.0037879 k( 86) = ( -0.0810811 0.0810811 0.0810811), wk = 0.0037879 k( 87) = ( -0.0675676 0.0675676 0.0675676), wk = 0.0037879 k( 88) = ( -0.0540540 0.0540540 0.0540540), wk = 0.0037879 k( 89) = ( -0.0405405 0.0405405 0.0405405), wk = 0.0037879 k( 90) = ( -0.0270270 0.0270270 0.0270270), wk = 0.0037879 k( 91) = ( -0.0135135 0.0135135 0.0135135), wk = 0.0037879 k( 92) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 93) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 94) = ( 0.0077556 0.0077556 -0.0077556), wk = 0.0037879 k( 95) = ( 0.0155112 0.0155112 -0.0155112), wk = 0.0037879 k( 96) = ( 0.0232668 0.0232668 -0.0232668), wk = 0.0037879 k( 97) = ( 0.0310224 0.0310224 -0.0310224), wk = 0.0037879 k( 98) = ( 0.0387779 0.0387779 -0.0387780), wk = 0.0037879 k( 99) = ( 0.0465335 0.0465335 -0.0465335), wk = 0.0037879 k( 100) = ( 0.0542891 0.0542891 -0.0542891), wk = 0.0037879 k( 101) = ( 0.0620447 0.0620447 -0.0620447), wk = 0.0037879 k( 102) = ( 0.0698003 0.0698003 -0.0698003), wk = 0.0037879 k( 103) = ( 0.0775559 0.0775559 -0.0775559), wk = 0.0037879 k( 104) = ( 0.0853115 0.0853115 -0.0853115), wk = 0.0037879 k( 105) = ( 0.0930671 0.0930671 -0.0930671), wk = 0.0037879 k( 106) = ( 0.1008227 0.1008227 -0.1008227), wk = 0.0037879 k( 107) = ( 0.1085783 0.1085783 -0.1085783), wk = 0.0037879 k( 108) = ( 0.1163339 0.1163339 -0.1163339), wk = 0.0037879 k( 109) = ( 0.1240895 0.1240895 -0.1240895), wk = 0.0037879 k( 110) = ( 0.1318450 0.1318450 -0.1318450), wk = 0.0037879 k( 111) = ( 0.1396006 0.1396006 -0.1396006), wk = 0.0037879 k( 112) = ( 0.1473562 0.1473562 -0.1473562), wk = 0.0037879 k( 113) = ( 0.1551118 0.1551118 -0.1551118), wk = 0.0037879 k( 114) = ( 0.1628674 0.1628674 -0.1628674), wk = 0.0037879 k( 115) = ( 0.1706230 0.1706230 -0.1706230), wk = 0.0037879 k( 116) = ( 0.1783786 0.1783786 -0.1783786), wk = 0.0037879 k( 117) = ( 0.1861342 0.1861342 -0.1861342), wk = 0.0037879 k( 118) = ( 0.1938898 0.1938898 -0.1938898), wk = 0.0037879 k( 119) = ( 0.2016454 0.2016454 -0.2016454), wk = 0.0037879 k( 120) = ( 0.2094010 0.2094009 -0.2094010), wk = 0.0037879 k( 121) = ( 0.2171565 0.2171565 -0.2171565), wk = 0.0037879 k( 122) = ( 0.2249121 0.2249121 -0.2249121), wk = 0.0037879 k( 123) = ( 0.2326677 0.2326677 -0.2326677), wk = 0.0037879 k( 124) = ( 0.2404233 0.2404233 -0.2404233), wk = 0.0037879 k( 125) = ( 0.2481789 0.2481789 -0.2481789), wk = 0.0037879 k( 126) = ( 0.2559345 0.2559345 -0.2559345), wk = 0.0037879 k( 127) = ( 0.2636901 0.2636901 -0.2636901), wk = 0.0037879 k( 128) = ( 0.2714457 0.2714457 -0.2714457), wk = 0.0037879 k( 129) = ( 0.2792013 0.2792013 -0.2792013), wk = 0.0037879 k( 130) = ( 0.2869569 0.2869569 -0.2869569), wk = 0.0037879 k( 131) = ( 0.2947125 0.2947125 -0.2947125), wk = 0.0037879 k( 132) = ( 0.3024680 0.3024680 -0.3024680), wk = 0.0037879 k( 133) = ( 0.3102236 0.3102236 -0.3102236), wk = 0.0037879 k( 134) = ( 0.3179792 0.3179792 -0.3179792), wk = 0.0037879 k( 135) = ( 0.3257348 0.3257348 -0.3257348), wk = 0.0037879 k( 136) = ( 0.3334904 0.3334904 -0.3334904), wk = 0.0037879 k( 137) = ( 0.3334904 0.3334904 -0.3334904), wk = 0.0037879 k( 138) = ( 0.3305086 0.3305086 -0.3126515), wk = 0.0037879 k( 139) = ( 0.3275268 0.3275268 -0.2918125), wk = 0.0037879 k( 140) = ( 0.3245450 0.3245450 -0.2709736), wk = 0.0037879 k( 141) = ( 0.3215632 0.3215632 -0.2501346), wk = 0.0037879 k( 142) = ( 0.3185814 0.3185814 -0.2292957), wk = 0.0037879 k( 143) = ( 0.3155996 0.3155996 -0.2084568), wk = 0.0037879 k( 144) = ( 0.3126178 0.3126178 -0.1876178), wk = 0.0037879 k( 145) = ( 0.3096360 0.3096360 -0.1667789), wk = 0.0037879 k( 146) = ( 0.3066542 0.3066542 -0.1459399), wk = 0.0037879 k( 147) = ( 0.3036724 0.3036724 -0.1251010), wk = 0.0037879 k( 148) = ( 0.3006906 0.3006906 -0.1042620), wk = 0.0037879 k( 149) = ( 0.2977088 0.2977088 -0.0834231), wk = 0.0037879 k( 150) = ( 0.2947270 0.2947270 -0.0625842), wk = 0.0037879 k( 151) = ( 0.2917452 0.2917452 -0.0417452), wk = 0.0037879 k( 152) = ( 0.2887634 0.2887634 -0.0209063), wk = 0.0037879 k( 153) = ( 0.2857816 0.2857816 -0.0000673), wk = 0.0037879 k( 154) = ( 0.2827998 0.2827998 0.0207716), wk = 0.0037879 k( 155) = ( 0.2798180 0.2798180 0.0416106), wk = 0.0037879 k( 156) = ( 0.2768362 0.2768362 0.0624495), wk = 0.0037879 k( 157) = ( 0.2738544 0.2738544 0.0832885), wk = 0.0037879 k( 158) = ( 0.2708726 0.2708726 0.1041274), wk = 0.0037879 k( 159) = ( 0.2678908 0.2678908 0.1249663), wk = 0.0037879 k( 160) = ( 0.2649090 0.2649090 0.1458053), wk = 0.0037879 k( 161) = ( 0.2619272 0.2619272 0.1666442), wk = 0.0037879 k( 162) = ( 0.2589454 0.2589454 0.1874832), wk = 0.0037879 k( 163) = ( 0.2559636 0.2559636 0.2083221), wk = 0.0037879 k( 164) = ( 0.2529818 0.2529818 0.2291611), wk = 0.0037879 k( 165) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037879 k( 166) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037879 k( 167) = ( 0.2368421 0.2631579 0.2368421), wk = 0.0037879 k( 168) = ( 0.2236842 0.2763158 0.2236842), wk = 0.0037879 k( 169) = ( 0.2105263 0.2894737 0.2105263), wk = 0.0037879 k( 170) = ( 0.1973684 0.3026316 0.1973684), wk = 0.0037879 k( 171) = ( 0.1842105 0.3157895 0.1842105), wk = 0.0037879 k( 172) = ( 0.1710526 0.3289474 0.1710526), wk = 0.0037879 k( 173) = ( 0.1578947 0.3421053 0.1578947), wk = 0.0037879 k( 174) = ( 0.1447368 0.3552632 0.1447368), wk = 0.0037879 k( 175) = ( 0.1315790 0.3684211 0.1315790), wk = 0.0037879 k( 176) = ( 0.1184210 0.3815789 0.1184211), wk = 0.0037879 k( 177) = ( 0.1052632 0.3947368 0.1052632), wk = 0.0037879 k( 178) = ( 0.0921053 0.4078947 0.0921053), wk = 0.0037879 k( 179) = ( 0.0789474 0.4210526 0.0789474), wk = 0.0037879 k( 180) = ( 0.0657895 0.4342105 0.0657895), wk = 0.0037879 k( 181) = ( 0.0526316 0.4473684 0.0526316), wk = 0.0037879 k( 182) = ( 0.0394737 0.4605263 0.0394737), wk = 0.0037879 k( 183) = ( 0.0263158 0.4736842 0.0263158), wk = 0.0037879 k( 184) = ( 0.0131579 0.4868421 0.0131579), wk = 0.0037879 k( 185) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0037879 k( 186) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0037879 k( 187) = ( -0.0151586 0.5075686 0.0151586), wk = 0.0037879 k( 188) = ( -0.0303173 0.5151372 0.0303173), wk = 0.0037879 k( 189) = ( -0.0454760 0.5227059 0.0454760), wk = 0.0037879 k( 190) = ( -0.0606346 0.5302745 0.0606346), wk = 0.0037879 k( 191) = ( -0.0757933 0.5378431 0.0757933), wk = 0.0037879 k( 192) = ( -0.0909519 0.5454117 0.0909519), wk = 0.0037879 k( 193) = ( -0.1061106 0.5529803 0.1061106), wk = 0.0037879 k( 194) = ( -0.1212692 0.5605489 0.1212692), wk = 0.0037879 k( 195) = ( -0.1364279 0.5681176 0.1364279), wk = 0.0037879 k( 196) = ( -0.1515865 0.5756862 0.1515865), wk = 0.0037879 k( 197) = ( -0.1667452 0.5832548 0.1667452), wk = 0.0037879 k( 198) = ( -0.1819039 0.5908234 0.1819039), wk = 0.0037879 k( 199) = ( -0.1970625 0.5983920 0.1970625), wk = 0.0037879 k( 200) = ( -0.2122212 0.6059606 0.2122212), wk = 0.0037879 k( 201) = ( -0.2273798 0.6135293 0.2273798), wk = 0.0037879 k( 202) = ( -0.2425385 0.6210979 0.2425385), wk = 0.0037879 k( 203) = ( -0.2576971 0.6286665 0.2576971), wk = 0.0037879 k( 204) = ( -0.2728558 0.6362351 0.2728558), wk = 0.0037879 k( 205) = ( -0.2880144 0.6438037 0.2880144), wk = 0.0037879 k( 206) = ( -0.3031731 0.6513724 0.3031731), wk = 0.0037879 k( 207) = ( -0.3183318 0.6589410 0.3183318), wk = 0.0037879 k( 208) = ( -0.3334904 0.6665096 0.3334904), wk = 0.0037879 k( 209) = ( -0.3334904 0.6665096 0.3334904), wk = 0.0037879 k( 210) = ( -0.3410590 0.6589410 0.3410590), wk = 0.0037879 k( 211) = ( -0.3486276 0.6513724 0.3486276), wk = 0.0037879 k( 212) = ( -0.3561963 0.6438037 0.3561963), wk = 0.0037879 k( 213) = ( -0.3637649 0.6362351 0.3637649), wk = 0.0037879 k( 214) = ( -0.3713335 0.6286665 0.3713335), wk = 0.0037879 k( 215) = ( -0.3789021 0.6210979 0.3789021), wk = 0.0037879 k( 216) = ( -0.3864707 0.6135293 0.3864707), wk = 0.0037879 k( 217) = ( -0.3940394 0.6059606 0.3940394), wk = 0.0037879 k( 218) = ( -0.4016080 0.5983920 0.4016080), wk = 0.0037879 k( 219) = ( -0.4091766 0.5908234 0.4091766), wk = 0.0037879 k( 220) = ( -0.4167452 0.5832548 0.4167452), wk = 0.0037879 k( 221) = ( -0.4243138 0.5756862 0.4243138), wk = 0.0037879 k( 222) = ( -0.4318824 0.5681176 0.4318824), wk = 0.0037879 k( 223) = ( -0.4394511 0.5605489 0.4394511), wk = 0.0037879 k( 224) = ( -0.4470197 0.5529803 0.4470197), wk = 0.0037879 k( 225) = ( -0.4545883 0.5454117 0.4545883), wk = 0.0037879 k( 226) = ( -0.4621569 0.5378431 0.4621569), wk = 0.0037879 k( 227) = ( -0.4697255 0.5302745 0.4697255), wk = 0.0037879 k( 228) = ( -0.4772941 0.5227058 0.4772941), wk = 0.0037879 k( 229) = ( -0.4848628 0.5151372 0.4848628), wk = 0.0037879 k( 230) = ( -0.4924314 0.5075686 0.4924314), wk = 0.0037879 k( 231) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0037879 k( 232) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037879 k( 233) = ( 0.0078125 0.0078125 0.4921875), wk = 0.0037879 k( 234) = ( 0.0156250 0.0156250 0.4843750), wk = 0.0037879 k( 235) = ( 0.0234375 0.0234375 0.4765625), wk = 0.0037879 k( 236) = ( 0.0312500 0.0312500 0.4687500), wk = 0.0037879 k( 237) = ( 0.0390625 0.0390625 0.4609375), wk = 0.0037879 k( 238) = ( 0.0468750 0.0468750 0.4531250), wk = 0.0037879 k( 239) = ( 0.0546875 0.0546875 0.4453125), wk = 0.0037879 k( 240) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0037879 k( 241) = ( 0.0703125 0.0703125 0.4296875), wk = 0.0037879 k( 242) = ( 0.0781250 0.0781250 0.4218750), wk = 0.0037879 k( 243) = ( 0.0859375 0.0859375 0.4140625), wk = 0.0037879 k( 244) = ( 0.0937500 0.0937500 0.4062500), wk = 0.0037879 k( 245) = ( 0.1015625 0.1015625 0.3984375), wk = 0.0037879 k( 246) = ( 0.1093750 0.1093750 0.3906250), wk = 0.0037879 k( 247) = ( 0.1171875 0.1171875 0.3828125), wk = 0.0037879 k( 248) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0037879 k( 249) = ( 0.1328125 0.1328125 0.3671875), wk = 0.0037879 k( 250) = ( 0.1406250 0.1406250 0.3593750), wk = 0.0037879 k( 251) = ( 0.1484375 0.1484375 0.3515625), wk = 0.0037879 k( 252) = ( 0.1562500 0.1562500 0.3437500), wk = 0.0037879 k( 253) = ( 0.1640625 0.1640625 0.3359375), wk = 0.0037879 k( 254) = ( 0.1718750 0.1718750 0.3281250), wk = 0.0037879 k( 255) = ( 0.1796875 0.1796875 0.3203125), wk = 0.0037879 k( 256) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0037879 k( 257) = ( 0.1953125 0.1953125 0.3046875), wk = 0.0037879 k( 258) = ( 0.2031250 0.2031250 0.2968750), wk = 0.0037879 k( 259) = ( 0.2109375 0.2109375 0.2890625), wk = 0.0037879 k( 260) = ( 0.2187500 0.2187500 0.2812500), wk = 0.0037879 k( 261) = ( 0.2265625 0.2265625 0.2734375), wk = 0.0037879 k( 262) = ( 0.2343750 0.2343750 0.2656250), wk = 0.0037879 k( 263) = ( 0.2421875 0.2421875 0.2578125), wk = 0.0037879 k( 264) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0037879 Dense grid: 76779 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 59081 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.49 Mb ( 442, 72) NL pseudopotentials 1.43 Mb ( 221, 424) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 2132) G-vector shells 0.01 Mb ( 958) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.94 Mb ( 442, 288) Each subspace H/S matrix 0.08 Mb ( 72, 72) Each matrix 0.93 Mb ( 424, 2, 72) The potential is recalculated from file : ./ZrxAl2Fex4.save/charge-density.dat Starting wfc are 154 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.8 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 6.6 secs Computing kpt #: 4 total cpu time spent up to now is 8.0 secs Computing kpt #: 5 total cpu time spent up to now is 9.4 secs Computing kpt #: 6 total cpu time spent up to now is 10.8 secs Computing kpt #: 7 total cpu time spent up to now is 12.3 secs Computing kpt #: 8 total cpu time spent up to now is 13.7 secs Computing kpt #: 9 total cpu time spent up to now is 15.3 secs Computing kpt #: 10 total cpu time spent up to now is 16.7 secs Computing kpt #: 11 total cpu time spent up to now is 18.2 secs Computing kpt #: 12 total cpu time spent up to now is 19.7 secs Computing kpt #: 13 total cpu time spent up to now is 21.2 secs Computing kpt #: 14 total cpu time spent up to now is 22.8 secs Computing kpt #: 15 total cpu time spent up to now is 24.4 secs Computing kpt #: 16 total cpu time spent up to now is 26.0 secs Computing kpt #: 17 total cpu time spent up to now is 27.7 secs Computing kpt #: 18 total cpu time spent up to now is 29.5 secs Computing kpt #: 19 total cpu time spent up to now is 31.3 secs Computing kpt #: 20 total cpu time spent up to now is 33.3 secs Computing kpt #: 21 total cpu time spent up to now is 35.4 secs Computing kpt #: 22 total cpu time spent up to now is 37.3 secs Computing kpt #: 23 total cpu time spent up to now is 39.2 secs Computing kpt #: 24 total cpu time spent up to now is 41.1 secs Computing kpt #: 25 total cpu time spent up to now is 43.0 secs Computing kpt #: 26 total cpu time spent up to now is 44.5 secs Computing kpt #: 27 total cpu time spent up to now is 46.1 secs Computing kpt #: 28 total cpu time spent up to now is 47.7 secs Computing kpt #: 29 total cpu time spent up to now is 49.3 secs Computing kpt #: 30 total cpu time spent up to now is 50.9 secs Computing kpt #: 31 total cpu time spent up to now is 52.4 secs Computing kpt #: 32 total cpu time spent up to now is 54.0 secs Computing kpt #: 33 total cpu time spent up to now is 55.5 secs Computing kpt #: 34 total cpu time spent up to now is 57.1 secs Computing kpt #: 35 total cpu time spent up to now is 58.7 secs Computing kpt #: 36 total cpu time spent up to now is 60.3 secs Computing kpt #: 37 total cpu time spent up to now is 61.9 secs Computing kpt #: 38 total cpu time spent up to now is 63.5 secs Computing kpt #: 39 total cpu time spent up to now is 65.0 secs Computing kpt #: 40 total cpu time spent up to now is 66.6 secs Computing kpt #: 41 total cpu time spent up to now is 68.2 secs Computing kpt #: 42 total cpu time spent up to now is 69.8 secs Computing kpt #: 43 total cpu time spent up to now is 71.4 secs Computing kpt #: 44 total cpu time spent up to now is 73.0 secs Computing kpt #: 45 total cpu time spent up to now is 74.6 secs Computing kpt #: 46 total cpu time spent up to now is 76.1 secs Computing kpt #: 47 total cpu time spent up to now is 77.7 secs Computing kpt #: 48 total cpu time spent up to now is 79.5 secs Computing kpt #: 49 total cpu time spent up to now is 81.3 secs Computing kpt #: 50 total cpu time spent up to now is 83.1 secs Computing kpt #: 51 total cpu time spent up to now is 85.0 secs Computing kpt #: 52 total cpu time spent up to now is 87.3 secs Computing kpt #: 53 total cpu time spent up to now is 90.0 secs Computing kpt #: 54 total cpu time spent up to now is 91.9 secs Computing kpt #: 55 total cpu time spent up to now is 93.8 secs Computing kpt #: 56 total cpu time spent up to now is 96.0 secs Computing kpt #: 57 total cpu time spent up to now is 97.9 secs Computing kpt #: 58 total cpu time spent up to now is 99.8 secs Computing kpt #: 59 total cpu time spent up to now is 101.5 secs Computing kpt #: 60 total cpu time spent up to now is 103.1 secs Computing kpt #: 61 total cpu time spent up to now is 104.8 secs Computing kpt #: 62 total cpu time spent up to now is 106.5 secs Computing kpt #: 63 total cpu time spent up to now is 108.5 secs Computing kpt #: 64 total cpu time spent up to now is 110.4 secs Computing kpt #: 65 total cpu time spent up to now is 112.3 secs Computing kpt #: 66 total cpu time spent up to now is 114.5 secs Computing kpt #: 67 total cpu time spent up to now is 116.5 secs Computing kpt #: 68 total cpu time spent up to now is 118.3 secs Computing kpt #: 69 total cpu time spent up to now is 120.2 secs Computing kpt #: 70 total cpu time spent up to now is 121.8 secs Computing kpt #: 71 total cpu time spent up to now is 123.4 secs Computing kpt #: 72 total cpu time spent up to now is 124.9 secs Computing kpt #: 73 total cpu time spent up to now is 126.5 secs Computing kpt #: 74 total cpu time spent up to now is 128.0 secs Computing kpt #: 75 total cpu time spent up to now is 129.5 secs Computing kpt #: 76 total cpu time spent up to now is 131.0 secs Computing kpt #: 77 total cpu time spent up to now is 132.5 secs Computing kpt #: 78 total cpu time spent up to now is 134.1 secs Computing kpt #: 79 total cpu time spent up to now is 135.6 secs Computing kpt #: 80 total cpu time spent up to now is 137.1 secs Computing kpt #: 81 total cpu time spent up to now is 138.6 secs Computing kpt #: 82 total cpu time spent up to now is 140.1 secs Computing kpt #: 83 total cpu time spent up to now is 141.6 secs Computing kpt #: 84 total cpu time spent up to now is 143.1 secs Computing kpt #: 85 total cpu time spent up to now is 144.6 secs Computing kpt #: 86 total cpu time spent up to now is 146.0 secs Computing kpt #: 87 total cpu time spent up to now is 147.5 secs Computing kpt #: 88 total cpu time spent up to now is 148.9 secs Computing kpt #: 89 total cpu time spent up to now is 150.3 secs Computing kpt #: 90 total cpu time spent up to now is 151.7 secs Computing kpt #: 91 total cpu time spent up to now is 153.1 secs Computing kpt #: 92 total cpu time spent up to now is 154.5 secs Computing kpt #: 93 total cpu time spent up to now is 155.9 secs Computing kpt #: 94 total cpu time spent up to now is 157.3 secs Computing kpt #: 95 total cpu time spent up to now is 158.7 secs Computing kpt #: 96 total cpu time spent up to now is 160.1 secs Computing kpt #: 97 total cpu time spent up to now is 161.6 secs Computing kpt #: 98 total cpu time spent up to now is 163.0 secs Computing kpt #: 99 total cpu time spent up to now is 164.4 secs Computing kpt #: 100 total cpu time spent up to now is 165.9 secs Computing kpt #: 101 total cpu time spent up to now is 167.3 secs Computing kpt #: 102 total cpu time spent up to now is 168.8 secs Computing kpt #: 103 total cpu time spent up to now is 170.3 secs Computing kpt #: 104 total cpu time spent up to now is 171.8 secs Computing kpt #: 105 total cpu time spent up to now is 173.2 secs Computing kpt #: 106 total cpu time spent up to now is 174.7 secs Computing kpt #: 107 total cpu time spent up to now is 176.3 secs Computing kpt #: 108 total cpu time spent up to now is 177.8 secs Computing kpt #: 109 total cpu time spent up to now is 179.3 secs Computing kpt #: 110 total cpu time spent up to now is 180.8 secs Computing kpt #: 111 total cpu time spent up to now is 182.4 secs Computing kpt #: 112 total cpu time spent up to now is 183.9 secs Computing kpt #: 113 total cpu time spent up to now is 185.5 secs Computing kpt #: 114 total cpu time spent up to now is 187.2 secs Computing kpt #: 115 total cpu time spent up to now is 188.9 secs Computing kpt #: 116 total cpu time spent up to now is 191.2 secs Computing kpt #: 117 total cpu time spent up to now is 193.4 secs Computing kpt #: 118 total cpu time spent up to now is 195.6 secs Computing kpt #: 119 total cpu time spent up to now is 197.4 secs Computing kpt #: 120 total cpu time spent up to now is 199.0 secs Computing kpt #: 121 total cpu time spent up to now is 200.6 secs Computing kpt #: 122 total cpu time spent up to now is 202.2 secs Computing kpt #: 123 total cpu time spent up to now is 203.7 secs Computing kpt #: 124 total cpu time spent up to now is 205.4 secs Computing kpt #: 125 total cpu time spent up to now is 207.2 secs Computing kpt #: 126 total cpu time spent up to now is 208.8 secs Computing kpt #: 127 total cpu time spent up to now is 210.4 secs Computing kpt #: 128 total cpu time spent up to now is 211.9 secs Computing kpt #: 129 total cpu time spent up to now is 213.5 secs Computing kpt #: 130 total cpu time spent up to now is 215.0 secs Computing kpt #: 131 total cpu time spent up to now is 216.6 secs Computing kpt #: 132 total cpu time spent up to now is 218.2 secs Computing kpt #: 133 total cpu time spent up to now is 219.8 secs Computing kpt #: 134 total cpu time spent up to now is 221.6 secs Computing kpt #: 135 total cpu time spent up to now is 223.5 secs Computing kpt #: 136 total cpu time spent up to now is 225.4 secs Computing kpt #: 137 total cpu time spent up to now is 227.6 secs Computing kpt #: 138 total cpu time spent up to now is 229.8 secs Computing kpt #: 139 total cpu time spent up to now is 232.0 secs Computing kpt #: 140 total cpu time spent up to now is 234.6 secs Computing kpt #: 141 total cpu time spent up to now is 237.7 secs Computing kpt #: 142 total cpu time spent up to now is 240.6 secs Computing kpt #: 143 total cpu time spent up to now is 243.6 secs Computing kpt #: 144 total cpu time spent up to now is 246.6 secs Computing kpt #: 145 total cpu time spent up to now is 249.7 secs Computing kpt #: 146 total cpu time spent up to now is 252.9 secs Computing kpt #: 147 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 256.7 secs Computing kpt #: 148 total cpu time spent up to now is 259.2 secs Computing kpt #: 149 total cpu time spent up to now is 261.0 secs Computing kpt #: 150 total cpu time spent up to now is 263.2 secs Computing kpt #: 151 total cpu time spent up to now is 264.9 secs Computing kpt #: 152 total cpu time spent up to now is 266.9 secs Computing kpt #: 153 total cpu time spent up to now is 268.7 secs Computing kpt #: 154 total cpu time spent up to now is 270.4 secs Computing kpt #: 155 total cpu time spent up to now is 272.6 secs Computing kpt #: 156 total cpu time spent up to now is 274.8 secs Computing kpt #: 157 total cpu time spent up to now is 277.0 secs Computing kpt #: 158 total cpu time spent up to now is 279.0 secs Computing kpt #: 159 total cpu time spent up to now is 281.2 secs Computing kpt #: 160 total cpu time spent up to now is 283.2 secs Computing kpt #: 161 total cpu time spent up to now is 285.2 secs Computing kpt #: 162 total cpu time spent up to now is 287.3 secs Computing kpt #: 163 total cpu time spent up to now is 289.4 secs Computing kpt #: 164 total cpu time spent up to now is 291.6 secs Computing kpt #: 165 total cpu time spent up to now is 293.4 secs Computing kpt #: 166 total cpu time spent up to now is 295.2 secs Computing kpt #: 167 total cpu time spent up to now is 297.4 secs Computing kpt #: 168 total cpu time spent up to now is 299.6 secs Computing kpt #: 169 total cpu time spent up to now is 301.7 secs Computing kpt #: 170 total cpu time spent up to now is 303.8 secs Computing kpt #: 171 total cpu time spent up to now is 305.8 secs Computing kpt #: 172 total cpu time spent up to now is 307.6 secs Computing kpt #: 173 total cpu time spent up to now is 309.1 secs Computing kpt #: 174 total cpu time spent up to now is 310.9 secs Computing kpt #: 175 total cpu time spent up to now is 312.7 secs Computing kpt #: 176 total cpu time spent up to now is 314.4 secs Computing kpt #: 177 total cpu time spent up to now is 316.1 secs Computing kpt #: 178 total cpu time spent up to now is 318.4 secs Computing kpt #: 179 total cpu time spent up to now is 320.2 secs Computing kpt #: 180 total cpu time spent up to now is 321.9 secs Computing kpt #: 181 total cpu time spent up to now is 323.6 secs Computing kpt #: 182 total cpu time spent up to now is 325.4 secs Computing kpt #: 183 total cpu time spent up to now is 328.0 secs Computing kpt #: 184 total cpu time spent up to now is 329.8 secs Computing kpt #: 185 total cpu time spent up to now is 332.2 secs Computing kpt #: 186 total cpu time spent up to now is 334.0 secs Computing kpt #: 187 total cpu time spent up to now is 335.9 secs Computing kpt #: 188 total cpu time spent up to now is 337.6 secs Computing kpt #: 189 total cpu time spent up to now is 339.9 secs Computing kpt #: 190 total cpu time spent up to now is 342.2 secs Computing kpt #: 191 total cpu time spent up to now is 344.4 secs Computing kpt #: 192 total cpu time spent up to now is 346.6 secs Computing kpt #: 193 total cpu time spent up to now is 348.5 secs Computing kpt #: 194 total cpu time spent up to now is 350.3 secs Computing kpt #: 195 total cpu time spent up to now is 352.5 secs Computing kpt #: 196 total cpu time spent up to now is 354.7 secs Computing kpt #: 197 total cpu time spent up to now is 356.8 secs Computing kpt #: 198 total cpu time spent up to now is 359.0 secs Computing kpt #: 199 total cpu time spent up to now is 361.2 secs Computing kpt #: 200 total cpu time spent up to now is 363.2 secs Computing kpt #: 201 total cpu time spent up to now is 365.4 secs Computing kpt #: 202 total cpu time spent up to now is 367.6 secs Computing kpt #: 203 total cpu time spent up to now is 369.9 secs Computing kpt #: 204 total cpu time spent up to now is 372.1 secs Computing kpt #: 205 total cpu time spent up to now is 374.5 secs Computing kpt #: 206 total cpu time spent up to now is 376.7 secs Computing kpt #: 207 total cpu time spent up to now is 378.6 secs Computing kpt #: 208 total cpu time spent up to now is 380.6 secs Computing kpt #: 209 total cpu time spent up to now is 382.5 secs Computing kpt #: 210 total cpu time spent up to now is 384.7 secs Computing kpt #: 211 total cpu time spent up to now is 387.3 secs Computing kpt #: 212 total cpu time spent up to now is 388.9 secs Computing kpt #: 213 total cpu time spent up to now is 390.5 secs Computing kpt #: 214 total cpu time spent up to now is 392.0 secs Computing kpt #: 215 total cpu time spent up to now is 393.6 secs Computing kpt #: 216 total cpu time spent up to now is 395.2 secs Computing kpt #: 217 total cpu time spent up to now is 396.8 secs Computing kpt #: 218 total cpu time spent up to now is 398.3 secs Computing kpt #: 219 total cpu time spent up to now is 399.9 secs Computing kpt #: 220 total cpu time spent up to now is 401.5 secs Computing kpt #: 221 total cpu time spent up to now is 403.1 secs Computing kpt #: 222 total cpu time spent up to now is 404.7 secs Computing kpt #: 223 total cpu time spent up to now is 406.3 secs Computing kpt #: 224 total cpu time spent up to now is 407.8 secs Computing kpt #: 225 total cpu time spent up to now is 409.4 secs Computing kpt #: 226 total cpu time spent up to now is 411.0 secs Computing kpt #: 227 total cpu time spent up to now is 412.8 secs Computing kpt #: 228 total cpu time spent up to now is 414.5 secs Computing kpt #: 229 total cpu time spent up to now is 416.4 secs Computing kpt #: 230 total cpu time spent up to now is 418.3 secs Computing kpt #: 231 total cpu time spent up to now is 420.2 secs Computing kpt #: 232 total cpu time spent up to now is 421.7 secs Computing kpt #: 233 total cpu time spent up to now is 423.3 secs Computing kpt #: 234 total cpu time spent up to now is 424.9 secs Computing kpt #: 235 total cpu time spent up to now is 426.7 secs Computing kpt #: 236 total cpu time spent up to now is 428.6 secs Computing kpt #: 237 total cpu time spent up to now is 430.4 secs Computing kpt #: 238 total cpu time spent up to now is 432.3 secs Computing kpt #: 239 total cpu time spent up to now is 434.2 secs Computing kpt #: 240 total cpu time spent up to now is 436.0 secs Computing kpt #: 241 total cpu time spent up to now is 437.9 secs Computing kpt #: 242 total cpu time spent up to now is 439.5 secs Computing kpt #: 243 total cpu time spent up to now is 441.0 secs Computing kpt #: 244 total cpu time spent up to now is 442.6 secs Computing kpt #: 245 total cpu time spent up to now is 444.2 secs Computing kpt #: 246 total cpu time spent up to now is 445.7 secs Computing kpt #: 247 total cpu time spent up to now is 447.3 secs Computing kpt #: 248 total cpu time spent up to now is 448.9 secs Computing kpt #: 249 total cpu time spent up to now is 450.5 secs Computing kpt #: 250 total cpu time spent up to now is 452.0 secs Computing kpt #: 251 total cpu time spent up to now is 453.6 secs Computing kpt #: 252 total cpu time spent up to now is 455.1 secs Computing kpt #: 253 total cpu time spent up to now is 456.8 secs Computing kpt #: 254 total cpu time spent up to now is 458.3 secs Computing kpt #: 255 total cpu time spent up to now is 459.9 secs Computing kpt #: 256 total cpu time spent up to now is 461.4 secs Computing kpt #: 257 total cpu time spent up to now is 463.0 secs Computing kpt #: 258 total cpu time spent up to now is 464.5 secs Computing kpt #: 259 total cpu time spent up to now is 466.1 secs Computing kpt #: 260 total cpu time spent up to now is 467.7 secs Computing kpt #: 261 total cpu time spent up to now is 469.7 secs Computing kpt #: 262 total cpu time spent up to now is 471.5 secs Computing kpt #: 263 total cpu time spent up to now is 473.3 secs Computing kpt #: 264 total cpu time spent up to now is 475.2 secs ethr = 1.67E-08, avg # of iterations = 26.9 total cpu time spent up to now is 475.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7383 PWs) bands (ev): -0.6711 -0.6711 3.0645 3.0645 3.0706 3.0706 3.3982 3.3982 3.8030 3.8030 4.9059 4.9059 5.1729 5.1729 6.1137 6.1137 6.1707 6.1707 6.1749 6.1749 6.4182 6.4182 6.7912 6.7912 6.8051 6.8051 6.9721 6.9721 7.0250 7.0250 7.2021 7.2021 7.8845 7.8845 7.9295 7.9295 7.9296 7.9296 8.1085 8.1085 8.2987 8.2987 8.4459 8.4459 8.7122 8.7122 8.7201 8.7201 8.8808 8.8808 9.0388 9.0388 9.0443 9.0443 9.3748 9.3748 9.4603 9.4603 9.9239 9.9239 9.9489 9.9489 9.9887 9.9887 10.0098 10.0098 10.5056 10.5056 11.2859 11.2859 11.2880 11.2880 k = 0.0000 0.0000 0.0208 ( 7375 PWs) bands (ev): -0.6696 -0.6696 3.0319 3.0319 3.0688 3.0688 3.4214 3.4214 3.8178 3.8178 4.9031 4.9031 5.1737 5.1737 6.1116 6.1116 6.1585 6.1585 6.1733 6.1733 6.4345 6.4345 6.7786 6.7786 6.8026 6.8026 6.9854 6.9854 7.0251 7.0251 7.2041 7.2041 7.8831 7.8831 7.9270 7.9270 7.9305 7.9305 8.1094 8.1094 8.2945 8.2945 8.4466 8.4466 8.7126 8.7126 8.7207 8.7207 8.8846 8.8846 9.0396 9.0396 9.0475 9.0475 9.3750 9.3750 9.4624 9.4624 9.9240 9.9240 9.9488 9.9488 9.9888 9.9888 10.0098 10.0098 10.5046 10.5046 11.2844 11.2844 11.2874 11.2874 k = 0.0000 0.0000 0.0415 ( 7377 PWs) bands (ev): -0.6653 -0.6653 2.9492 2.9492 3.0706 3.0706 3.4680 3.4680 3.8625 3.8625 4.8945 4.8945 5.1758 5.1758 6.1051 6.1051 6.1232 6.1232 6.1750 6.1750 6.4754 6.4754 6.7409 6.7409 6.8050 6.8050 7.0136 7.0136 7.0263 7.0263 7.2110 7.2110 7.8786 7.8786 7.9226 7.9226 7.9310 7.9310 8.1118 8.1118 8.2821 8.2821 8.4485 8.4485 8.7133 8.7133 8.7230 8.7230 8.8960 8.8960 9.0414 9.0414 9.0576 9.0576 9.3756 9.3756 9.4689 9.4689 9.9241 9.9241 9.9488 9.9488 9.9889 9.9889 10.0098 10.0098 10.5017 10.5017 11.2800 11.2800 11.2859 11.2859 k = 0.0000 0.0000 0.0623 ( 7373 PWs) bands (ev): -0.6581 -0.6581 2.8458 2.8458 3.0740 3.0740 3.5124 3.5124 3.9358 3.9358 4.8805 4.8805 5.1795 5.1795 6.0778 6.0778 6.0941 6.0941 6.1782 6.1782 6.5293 6.5293 6.6937 6.6937 6.8099 6.8099 7.0266 7.0266 7.0446 7.0446 7.2244 7.2244 7.8708 7.8708 7.9170 7.9170 7.9314 7.9314 8.1154 8.1154 8.2626 8.2626 8.4514 8.4514 8.7136 8.7136 8.7271 8.7271 8.9145 8.9145 9.0443 9.0443 9.0742 9.0742 9.3767 9.3767 9.4797 9.4797 9.9243 9.9243 9.9487 9.9487 9.9892 9.9892 10.0097 10.0097 10.4970 10.4970 11.2726 11.2726 11.2835 11.2835 k = 0.0000 0.0000 0.0831 ( 7366 PWs) bands (ev): -0.6480 -0.6480 2.7337 2.7337 3.0786 3.0786 3.5483 3.5483 4.0318 4.0318 4.8613 4.8613 5.1848 5.1848 6.0293 6.0293 6.0772 6.0772 6.1827 6.1827 6.5900 6.5900 6.6447 6.6447 6.8143 6.8143 7.0319 7.0319 7.0664 7.0664 7.2460 7.2460 7.8598 7.8598 7.9109 7.9109 7.9318 7.9318 8.1195 8.1195 8.2371 8.2371 8.4553 8.4553 8.7132 8.7132 8.7327 8.7327 8.9393 8.9393 9.0488 9.0488 9.0963 9.0963 9.3783 9.3783 9.4945 9.4945 9.9245 9.9245 9.9486 9.9486 9.9895 9.9895 10.0096 10.0096 10.4904 10.4904 11.2624 11.2624 11.2802 11.2802 k = 0.0000 0.0000 0.1039 ( 7368 PWs) bands (ev): -0.6350 -0.6350 2.6180 2.6180 3.0846 3.0846 3.5780 3.5780 4.1431 4.1431 4.8375 4.8375 5.1915 5.1915 5.9800 5.9800 6.0539 6.0539 6.1884 6.1884 6.5975 6.5975 6.6550 6.6550 6.8157 6.8157 7.0419 7.0419 7.0795 7.0795 7.2752 7.2752 7.8458 7.8458 7.9052 7.9052 7.9321 7.9321 8.1237 8.1237 8.2069 8.2069 8.4598 8.4598 8.7117 8.7117 8.7393 8.7393 8.9695 8.9695 9.0551 9.0551 9.1229 9.1229 9.3805 9.3805 9.5132 9.5132 9.9249 9.9249 9.9485 9.9485 9.9898 9.9898 10.0095 10.0095 10.4821 10.4821 11.2495 11.2495 11.2760 11.2760 k = 0.0000 0.0000 0.1246 ( 7382 PWs) bands (ev): -0.6192 -0.6192 2.5010 2.5010 3.0918 3.0918 3.6047 3.6047 4.2637 4.2637 4.8094 4.8094 5.1998 5.1998 5.9313 5.9313 6.0233 6.0233 6.1953 6.1953 6.5549 6.5549 6.7224 6.7224 6.8122 6.8122 7.0582 7.0582 7.0851 7.0851 7.3095 7.3095 7.8296 7.8296 7.9002 7.9002 7.9326 7.9326 8.1276 8.1276 8.1731 8.1731 8.4647 8.4647 8.7091 8.7091 8.7467 8.7467 9.0039 9.0039 9.0640 9.0640 9.1530 9.1530 9.3837 9.3837 9.5356 9.5356 9.9252 9.9252 9.9483 9.9483 9.9903 9.9903 10.0094 10.0094 10.4721 10.4721 11.2341 11.2341 11.2709 11.2709 k = 0.0000 0.0000 0.1454 ( 7384 PWs) bands (ev): -0.6007 -0.6007 2.3839 2.3839 3.1002 3.1002 3.6309 3.6309 4.3899 4.3899 4.7778 4.7778 5.2097 5.2097 5.8838 5.8838 5.9850 5.9850 6.2034 6.2034 6.5182 6.5182 6.7915 6.7915 6.8031 6.8031 7.0808 7.0808 7.0862 7.0862 7.3458 7.3458 7.8118 7.8118 7.8960 7.8960 7.9332 7.9332 8.1301 8.1301 8.1376 8.1376 8.4699 8.4699 8.7049 8.7049 8.7545 8.7545 9.0406 9.0406 9.0763 9.0763 9.1858 9.1858 9.3881 9.3881 9.5612 9.5612 9.9257 9.9257 9.9481 9.9481 9.9908 9.9908 10.0093 10.0093 10.4606 10.4606 11.2164 11.2164 11.2649 11.2649 k = 0.0000 0.0000 0.1662 ( 7398 PWs) bands (ev): -0.5793 -0.5793 2.2677 2.2677 3.1099 3.1099 3.6578 3.6578 4.5191 4.5191 4.7432 4.7432 5.2209 5.2209 5.8380 5.8380 5.9391 5.9391 6.2125 6.2125 6.4882 6.4882 6.7877 6.7877 6.8624 6.8624 7.0825 7.0825 7.1111 7.1111 7.3822 7.3822 7.7931 7.7931 7.8926 7.8926 7.9339 7.9339 8.0982 8.0982 8.1342 8.1342 8.4750 8.4750 8.6989 8.6989 8.7628 8.7628 9.0758 9.0758 9.0949 9.0949 9.2202 9.2202 9.3941 9.3941 9.5899 9.5899 9.9262 9.9262 9.9479 9.9479 9.9915 9.9915 10.0092 10.0092 10.4476 10.4476 11.1966 11.1966 11.2579 11.2579 k = 0.0000 0.0000 0.1870 ( 7384 PWs) bands (ev): -0.5552 -0.5552 2.1527 2.1527 3.1207 3.1207 3.6862 3.6862 4.6494 4.6494 4.7061 4.7061 5.2336 5.2336 5.7942 5.7942 5.8868 5.8868 6.2226 6.2226 6.4647 6.4647 6.7677 6.7677 6.9338 6.9338 7.0777 7.0777 7.1456 7.1456 7.4173 7.4173 7.7738 7.7738 7.8903 7.8903 7.9348 7.9348 8.0591 8.0591 8.1361 8.1361 8.4799 8.4799 8.6909 8.6909 8.7715 8.7715 9.1019 9.1019 9.1261 9.1261 9.2557 9.2557 9.4024 9.4024 9.6212 9.6212 9.9269 9.9269 9.9477 9.9477 9.9922 9.9922 10.0091 10.0091 10.4333 10.4333 11.1751 11.1751 11.2499 11.2499 k = 0.0000 0.0000 0.2077 ( 7378 PWs) bands (ev): -0.5285 -0.5285 2.0395 2.0395 3.1325 3.1325 3.7165 3.7165 4.6672 4.6672 4.7790 4.7790 5.2476 5.2476 5.7524 5.7524 5.8298 5.8298 6.2336 6.2336 6.4472 6.4472 6.7437 6.7437 7.0053 7.0053 7.0717 7.0717 7.1837 7.1837 7.4502 7.4502 7.7543 7.7543 7.8890 7.8890 7.9358 7.9358 8.0194 8.0194 8.1373 8.1373 8.4845 8.4845 8.6806 8.6806 8.7804 8.7804 9.1256 9.1256 9.1619 9.1619 9.2917 9.2917 9.4139 9.4139 9.6548 9.6548 9.9275 9.9275 9.9475 9.9475 9.9930 9.9930 10.0091 10.0091 10.4180 10.4180 11.1520 11.1520 11.2406 11.2406 k = 0.0000 0.0000 0.2285 ( 7384 PWs) bands (ev): -0.4991 -0.4991 1.9282 1.9282 3.1453 3.1453 3.7490 3.7490 4.6271 4.6271 4.9058 4.9058 5.2627 5.2627 5.7128 5.7128 5.7706 5.7706 6.2454 6.2454 6.4349 6.4349 6.7167 6.7167 7.0601 7.0601 7.0818 7.0818 7.2242 7.2242 7.4804 7.4804 7.7347 7.7347 7.8890 7.8890 7.9370 7.9370 7.9797 7.9797 8.1375 8.1375 8.4886 8.4886 8.6680 8.6680 8.7896 8.7896 9.1522 9.1522 9.1952 9.1952 9.3274 9.3274 9.4294 9.4294 9.6902 9.6902 9.9283 9.9283 9.9472 9.9472 9.9938 9.9938 10.0092 10.0092 10.4016 10.4016 11.1278 11.1278 11.2298 11.2298 k = 0.0000 0.0000 0.2493 ( 7404 PWs) bands (ev): -0.4672 -0.4672 1.8192 1.8192 3.1591 3.1591 3.7839 3.7839 4.5862 4.5862 5.0262 5.0262 5.2789 5.2789 5.6755 5.6755 5.7131 5.7131 6.2579 6.2579 6.4271 6.4271 6.6873 6.6873 7.0549 7.0549 7.1511 7.1511 7.2660 7.2660 7.5074 7.5074 7.7155 7.7155 7.8900 7.8900 7.9377 7.9377 7.9411 7.9411 8.1367 8.1367 8.4919 8.4919 8.6531 8.6531 8.7989 8.7989 9.1828 9.1828 9.2238 9.2238 9.3624 9.3624 9.4495 9.4495 9.7271 9.7271 9.9290 9.9290 9.9470 9.9470 9.9945 9.9945 10.0093 10.0093 10.3846 10.3846 11.1027 11.1027 11.2168 11.2168 k = 0.0000 0.0000 0.2701 ( 7400 PWs) bands (ev): -0.4329 -0.4329 1.7128 1.7128 3.1735 3.1735 3.8213 3.8213 4.5451 4.5451 5.1335 5.1335 5.2961 5.2961 5.6405 5.6405 5.6644 5.6644 6.2709 6.2709 6.4232 6.4232 6.6563 6.6563 7.0470 7.0470 7.2222 7.2222 7.3081 7.3081 7.5303 7.5303 7.6971 7.6971 7.8906 7.8906 7.9038 7.9038 7.9401 7.9401 8.1349 8.1349 8.4947 8.4947 8.6359 8.6359 8.8084 8.8084 9.2176 9.2176 9.2468 9.2468 9.3964 9.3964 9.4739 9.4739 9.7649 9.7649 9.9298 9.9298 9.9467 9.9467 9.9953 9.9953 10.0095 10.0095 10.3670 10.3670 11.0771 11.0771 11.2005 11.2005 k = 0.0000 0.0000 0.2908 ( 7400 PWs) bands (ev): -0.3963 -0.3963 1.6091 1.6091 3.1887 3.1887 3.8610 3.8610 4.5042 4.5042 5.2139 5.2139 5.3140 5.3140 5.6080 5.6080 5.6381 5.6381 6.2842 6.2842 6.4229 6.4229 6.6242 6.6242 7.0388 7.0388 7.2924 7.2924 7.3497 7.3497 7.5479 7.5479 7.6806 7.6806 7.8625 7.8625 7.8985 7.8985 7.9420 7.9420 8.1319 8.1319 8.4967 8.4967 8.6167 8.6167 8.8178 8.8178 9.2546 9.2546 9.2668 9.2668 9.4291 9.4291 9.5013 9.5013 9.8034 9.8034 9.9306 9.9306 9.9464 9.9464 9.9960 9.9960 10.0099 10.0099 10.3491 10.3491 11.0514 11.0514 11.1790 11.1790 k = 0.0000 0.0000 0.3116 ( 7390 PWs) bands (ev): -0.3576 -0.3576 1.5084 1.5084 3.2043 3.2043 3.9033 3.9033 4.4640 4.4640 5.2472 5.2472 5.3324 5.3324 5.5780 5.5780 5.6541 5.6541 6.2977 6.2977 6.4263 6.4263 6.5917 6.5917 7.0307 7.0307 7.3604 7.3604 7.3909 7.3909 7.5577 7.5577 7.6684 7.6684 7.8267 7.8267 7.9038 7.9038 7.9442 7.9442 8.1277 8.1277 8.4979 8.4979 8.5956 8.5956 8.8272 8.8272 9.2746 9.2746 9.3039 9.3039 9.4604 9.4604 9.5295 9.5295 9.8418 9.8418 9.9315 9.9315 9.9461 9.9461 9.9967 9.9967 10.0104 10.0104 10.3311 10.3311 11.0259 11.0259 11.1488 11.1488 k = 0.0000 0.0000 0.3324 ( 7392 PWs) bands (ev): -0.3171 -0.3171 1.4110 1.4110 3.2201 3.2201 3.9480 3.9480 4.4249 4.4249 5.2302 5.2302 5.3512 5.3512 5.5505 5.5505 5.7147 5.7147 6.3112 6.3112 6.4338 6.4338 6.5593 6.5593 7.0227 7.0227 7.4189 7.4189 7.4376 7.4376 7.5564 7.5564 7.6634 7.6634 7.7923 7.7923 7.9109 7.9109 7.9468 7.9468 8.1222 8.1222 8.4983 8.4983 8.5727 8.5727 8.8364 8.8364 9.2847 9.2847 9.3522 9.3522 9.4901 9.4901 9.5568 9.5568 9.8798 9.8798 9.9323 9.9323 9.9458 9.9458 9.9972 9.9972 10.0111 10.0111 10.3133 10.3133 11.0010 11.0010 11.1049 11.1049 k = 0.0000 0.0000 0.3532 ( 7398 PWs) bands (ev): -0.2749 -0.2749 1.3173 1.3173 3.2360 3.2360 3.9951 3.9951 4.3874 4.3874 5.1827 5.1827 5.3699 5.3699 5.5255 5.5255 5.7988 5.7988 6.3245 6.3245 6.4465 6.4465 6.5276 6.5276 7.0149 7.0149 7.4580 7.4580 7.4986 7.4986 7.5438 7.5438 7.6658 7.6658 7.7599 7.7599 7.9196 7.9196 7.9498 7.9498 8.1155 8.1155 8.4979 8.4979 8.5483 8.5483 8.8452 8.8452 9.2921 9.2921 9.4055 9.4055 9.5181 9.5181 9.5813 9.5813 9.9166 9.9166 9.9333 9.9333 9.9457 9.9457 9.9976 9.9976 10.0120 10.0120 10.2958 10.2958 10.9771 10.9771 11.0426 11.0426 k = 0.0000 0.0000 0.3739 ( 7398 PWs) bands (ev): -0.2316 -0.2316 1.2277 1.2277 3.2517 3.2517 4.0444 4.0444 4.3519 4.3519 5.1210 5.1210 5.3883 5.3883 5.5031 5.5031 5.8879 5.8879 6.3374 6.3374 6.4653 6.4653 6.4977 6.4977 7.0073 7.0073 7.4901 7.4901 7.5218 7.5218 7.5614 7.5614 7.6724 7.6724 7.7301 7.7301 7.9296 7.9296 7.9532 7.9532 8.1077 8.1077 8.4968 8.4968 8.5230 8.5230 8.8535 8.8535 9.2979 9.2979 9.4628 9.4628 9.5447 9.5447 9.6021 9.6021 9.9335 9.9335 9.9445 9.9445 9.9534 9.9534 9.9982 9.9982 10.0131 10.0131 10.2789 10.2789 10.9543 10.9543 10.9621 10.9621 k = 0.0000 0.0000 0.3947 ( 7400 PWs) bands (ev): -0.1876 -0.1876 1.1429 1.1429 3.2669 3.2669 4.0959 4.0959 4.3190 4.3190 5.0530 5.0530 5.4062 5.4062 5.4833 5.4833 5.9713 5.9713 6.3495 6.3495 6.4659 6.4659 6.4965 6.4965 6.9997 6.9997 7.4942 7.4942 7.5184 7.5184 7.6205 7.6205 7.6794 7.6794 7.7043 7.7043 7.9407 7.9407 7.9572 7.9572 8.0988 8.0988 8.4924 8.4924 8.4994 8.4994 8.8613 8.8613 9.3025 9.3025 9.5220 9.5220 9.5719 9.5719 9.6186 9.6186 9.9344 9.9344 9.9448 9.9448 9.9838 9.9838 10.0004 10.0004 10.0151 10.0151 10.2628 10.2628 10.8676 10.8676 10.9336 10.9336 k = 0.0000 0.0000 0.4155 ( 7396 PWs) bands (ev): -0.1438 -0.1438 1.0636 1.0636 3.2812 3.2812 4.1494 4.1494 4.2890 4.2890 4.9825 4.9825 5.4229 5.4229 5.4661 5.4661 6.0427 6.0427 6.3606 6.3606 6.4401 6.4401 6.5350 6.5350 6.9921 6.9921 7.4629 7.4629 7.5420 7.5420 7.6695 7.6695 7.6799 7.6799 7.6944 7.6944 7.9522 7.9522 7.9617 7.9617 8.0890 8.0890 8.4690 8.4690 8.4943 8.4943 8.8683 8.8683 9.3065 9.3065 9.5698 9.5698 9.6117 9.6117 9.6314 9.6314 9.9352 9.9352 9.9447 9.9447 9.9955 9.9955 10.0105 10.0105 10.0261 10.0261 10.2476 10.2476 10.7658 10.7658 10.9147 10.9147 k = 0.0000 0.0000 0.4363 ( 7400 PWs) bands (ev): -0.1012 -0.1012 0.9908 0.9908 3.2943 3.2943 4.2044 4.2044 4.2627 4.2627 4.9114 4.9114 5.4381 5.4381 5.4516 5.4516 6.0988 6.0988 6.3706 6.3706 6.4163 6.4163 6.5855 6.5855 6.9838 6.9838 7.4285 7.4285 7.5617 7.5617 7.6532 7.6532 7.6994 7.6994 7.7286 7.7286 7.9637 7.9637 7.9668 7.9668 8.0788 8.0788 8.4429 8.4429 8.4918 8.4918 8.8744 8.8744 9.3098 9.3098 9.5951 9.5951 9.6376 9.6376 9.6781 9.6781 9.9359 9.9359 9.9446 9.9446 9.9967 9.9967 10.0136 10.0136 10.0520 10.0520 10.2333 10.2333 10.6607 10.6607 10.8980 10.8980 k = 0.0000 0.0000 0.4570 ( 7412 PWs) bands (ev): -0.0612 -0.0612 0.9262 0.9262 3.3057 3.3057 4.2389 4.2389 4.2621 4.2621 4.8413 4.8413 5.4393 5.4393 5.4519 5.4519 6.1396 6.1396 6.3787 6.3787 6.3961 6.3961 6.6451 6.6451 6.9743 6.9743 7.3925 7.3925 7.5775 7.5775 7.6357 7.6357 7.7055 7.7055 7.7740 7.7740 7.9719 7.9719 7.9749 7.9749 8.0684 8.0684 8.4181 8.4181 8.4894 8.4894 8.8796 8.8796 9.3127 9.3127 9.6117 9.6117 9.6424 9.6424 9.7520 9.7520 9.9366 9.9366 9.9447 9.9447 9.9971 9.9971 10.0147 10.0147 10.0773 10.0773 10.2200 10.2200 10.5553 10.5553 10.8840 10.8840 k = 0.0000 0.0000 0.4778 ( 7408 PWs) bands (ev): -0.0258 -0.0258 0.8716 0.8716 3.3151 3.3151 4.2214 4.2214 4.3181 4.3181 4.7736 4.7736 5.4301 5.4301 5.4628 5.4628 6.1672 6.1672 6.3775 6.3775 6.3876 6.3876 6.7093 6.7093 6.9621 6.9621 7.3571 7.3571 7.5895 7.5895 7.6216 7.6216 7.7104 7.7104 7.8124 7.8124 7.9776 7.9776 7.9842 7.9842 8.0584 8.0584 8.3959 8.3959 8.4872 8.4872 8.8838 8.8838 9.3151 9.3151 9.6241 9.6241 9.6446 9.6446 9.8296 9.8296 9.9373 9.9373 9.9453 9.9453 9.9976 9.9976 10.0155 10.0155 10.0996 10.0996 10.2077 10.2077 10.4520 10.4520 10.8728 10.8728 k = 0.0000 0.0000 0.4986 ( 7410 PWs) bands (ev): 0.0025 0.0025 0.8296 0.8296 3.3221 3.3221 4.2082 4.2082 4.3725 4.3725 4.7109 4.7109 5.4234 5.4234 5.4710 5.4710 6.1846 6.1846 6.3660 6.3660 6.3919 6.3919 6.7722 6.7722 6.9454 6.9454 7.3260 7.3260 7.5979 7.5979 7.6114 7.6114 7.7140 7.7140 7.8420 7.8420 7.9831 7.9831 7.9914 7.9914 8.0496 8.0496 8.3779 8.3779 8.4855 8.4855 8.8868 8.8868 9.3168 9.3168 9.6328 9.6328 9.6451 9.6451 9.9031 9.9031 9.9388 9.9388 9.9499 9.9499 9.9989 9.9989 10.0161 10.0161 10.1181 10.1181 10.1965 10.1965 10.3539 10.3539 10.8647 10.8647 k = 0.0000 0.0000 0.5194 ( 7410 PWs) bands (ev): 0.0211 0.0211 0.8028 0.8028 3.3265 3.3265 4.2001 4.2001 4.4185 4.4185 4.6600 4.6600 5.4194 5.4194 5.4761 5.4761 6.1941 6.1941 6.3586 6.3586 6.3949 6.3949 6.8277 6.8277 6.9224 6.9224 7.3038 7.3038 7.6028 7.6028 7.6051 7.6051 7.7161 7.7161 7.8608 7.8608 7.9874 7.9874 7.9960 7.9960 8.0433 8.0433 8.3661 8.3661 8.4844 8.4844 8.8886 8.8886 9.3180 9.3180 9.6382 9.6382 9.6449 9.6449 9.9321 9.9321 9.9409 9.9409 9.9817 9.9817 10.0088 10.0088 10.0190 10.0190 10.1316 10.1316 10.1867 10.1867 10.2689 10.2689 10.8598 10.8598 k = 0.0000 0.0000 0.5401 ( 7414 PWs) bands (ev): 0.0275 0.0275 0.7936 0.7936 3.3280 3.3280 4.1974 4.1974 4.4390 4.4390 4.6378 4.6378 5.4181 5.4181 5.4778 5.4778 6.1971 6.1971 6.3560 6.3560 6.3959 6.3959 6.8594 6.8594 6.9025 6.9025 7.2957 7.2957 7.6029 7.6029 7.6046 7.6046 7.7169 7.7169 7.8673 7.8673 7.9891 7.9891 7.9976 7.9976 8.0408 8.0408 8.3620 8.3620 8.4840 8.4840 8.8892 8.8892 9.3183 9.3183 9.6401 9.6401 9.6447 9.6447 9.9341 9.9341 9.9414 9.9414 9.9905 9.9905 10.0147 10.0147 10.0413 10.0413 10.1370 10.1370 10.1808 10.1808 10.2279 10.2279 10.8581 10.8581 k = 0.0000 0.0000 0.5401 ( 7414 PWs) bands (ev): 0.0275 0.0275 0.7936 0.7936 3.3280 3.3280 4.1974 4.1974 4.4390 4.4390 4.6378 4.6378 5.4181 5.4181 5.4778 5.4778 6.1971 6.1971 6.3560 6.3560 6.3959 6.3959 6.8594 6.8594 6.9025 6.9025 7.2957 7.2957 7.6029 7.6029 7.6046 7.6046 7.7169 7.7169 7.8673 7.8673 7.9891 7.9891 7.9976 7.9976 8.0408 8.0408 8.3620 8.3620 8.4840 8.4840 8.8892 8.8892 9.3183 9.3183 9.6401 9.6401 9.6447 9.6447 9.9341 9.9341 9.9414 9.9414 9.9905 9.9905 10.0147 10.0147 10.0413 10.0413 10.1370 10.1370 10.1808 10.1808 10.2279 10.2279 10.8581 10.8581 k =-0.0192 0.0079 0.5401 ( 7410 PWs) bands (ev): 0.0288 0.0288 0.7950 0.7950 3.3141 3.3141 4.1714 4.1714 4.4541 4.4541 4.6636 4.6636 5.4153 5.4153 5.4770 5.4770 6.1992 6.1992 6.3556 6.3556 6.4005 6.4005 6.8602 6.8602 6.9013 6.9013 7.2960 7.2960 7.5966 7.5966 7.6040 7.6040 7.7258 7.7258 7.8674 7.8674 7.9858 7.9858 8.0013 8.0013 8.0416 8.0416 8.3620 8.3620 8.4835 8.4835 8.8902 8.8902 9.3118 9.3118 9.6344 9.6344 9.6362 9.6362 9.9336 9.9336 9.9417 9.9417 9.9900 9.9900 10.0145 10.0145 10.0415 10.0415 10.1465 10.1465 10.1864 10.1864 10.2329 10.2329 10.8494 10.8494 k =-0.0385 0.0157 0.5401 ( 7418 PWs) bands (ev): 0.0328 0.0328 0.7993 0.7993 3.2745 3.2745 4.1062 4.1062 4.4973 4.4973 4.7283 4.7283 5.4071 5.4071 5.4747 5.4747 6.2054 6.2054 6.3543 6.3543 6.4143 6.4143 6.8625 6.8625 6.8977 6.8977 7.2969 7.2969 7.5804 7.5804 7.6043 7.6043 7.7478 7.7478 7.8678 7.8678 7.9806 7.9806 8.0078 8.0078 8.0441 8.0441 8.3618 8.3618 8.4822 8.4822 8.8930 8.8930 9.2928 9.2928 9.6058 9.6058 9.6246 9.6246 9.9322 9.9322 9.9423 9.9423 9.9884 9.9884 10.0138 10.0138 10.0418 10.0418 10.1729 10.1729 10.2027 10.2027 10.2474 10.2474 10.8252 10.8252 k =-0.0577 0.0236 0.5401 ( 7426 PWs) bands (ev): 0.0394 0.0394 0.8063 0.8063 3.2143 3.2143 4.0210 4.0210 4.5634 4.5634 4.8125 4.8125 5.3939 5.3939 5.4710 5.4710 6.2155 6.2155 6.3522 6.3522 6.4368 6.4368 6.8663 6.8663 6.8918 6.8918 7.2983 7.2983 7.5615 7.5615 7.6049 7.6049 7.7759 7.7759 7.8684 7.8684 7.9754 7.9754 8.0153 8.0153 8.0483 8.0483 8.3616 8.3616 8.4799 8.4799 8.8977 8.8977 9.2630 9.2630 9.5636 9.5636 9.6066 9.6066 9.9300 9.9300 9.9430 9.9430 9.9852 9.9852 10.0130 10.0130 10.0421 10.0421 10.2117 10.2117 10.2283 10.2283 10.2702 10.2702 10.7901 10.7901 k =-0.0769 0.0314 0.5401 ( 7414 PWs) bands (ev): 0.0485 0.0485 0.8162 0.8162 3.1393 3.1393 3.9264 3.9264 4.6468 4.6468 4.9056 4.9056 5.3766 5.3766 5.4659 5.4659 6.2296 6.2296 6.3495 6.3495 6.4670 6.4670 6.8715 6.8715 6.8837 6.8837 7.3003 7.3003 7.5434 7.5434 7.6058 7.6058 7.8062 7.8062 7.8692 7.8692 7.9705 7.9705 8.0234 8.0234 8.0544 8.0544 8.3613 8.3613 8.4765 8.4765 8.9041 8.9041 9.2246 9.2246 9.5122 9.5122 9.5835 9.5835 9.9268 9.9268 9.9436 9.9436 9.9802 9.9802 10.0123 10.0123 10.0422 10.0422 10.2565 10.2565 10.2633 10.2633 10.3000 10.3000 10.7488 10.7488 k =-0.0962 0.0393 0.5401 ( 7408 PWs) bands (ev): 0.0603 0.0603 0.8288 0.8288 3.0543 3.0543 3.8273 3.8273 4.7425 4.7425 5.0023 5.0023 5.3559 5.3559 5.4599 5.4599 6.2475 6.2475 6.3461 6.3461 6.5043 6.5043 6.8725 6.8725 6.8788 6.8788 7.3030 7.3030 7.5276 7.5276 7.6070 7.6070 7.8364 7.8364 7.8706 7.8706 7.9659 7.9659 8.0321 8.0321 8.0627 8.0627 8.3610 8.3610 8.4719 8.4719 8.9122 8.9122 9.1798 9.1798 9.4548 9.4548 9.5568 9.5568 9.9219 9.9219 9.9441 9.9441 9.9734 9.9734 10.0116 10.0116 10.0422 10.0422 10.2967 10.2967 10.3131 10.3131 10.3353 10.3353 10.7051 10.7051 k =-0.1154 0.0471 0.5401 ( 7418 PWs) bands (ev): 0.0746 0.0746 0.8442 0.8442 2.9627 2.9627 3.7262 3.7262 4.8468 4.8468 5.1001 5.1001 5.3327 5.3327 5.4530 5.4530 6.2688 6.2688 6.3423 6.3423 6.5478 6.5478 6.8604 6.8604 6.8862 6.8862 7.3062 7.3062 7.5147 7.5147 7.6084 7.6084 7.8628 7.8628 7.8746 7.8746 7.9615 7.9615 8.0414 8.0414 8.0734 8.0734 8.3605 8.3605 8.4659 8.4659 8.9218 8.9218 9.1310 9.1310 9.3935 9.3935 9.5276 9.5276 9.9137 9.9137 9.9446 9.9446 9.9655 9.9655 10.0112 10.0112 10.0419 10.0419 10.3382 10.3382 10.3676 10.3676 10.3752 10.3752 10.6619 10.6619 k =-0.1346 0.0550 0.5401 ( 7420 PWs) bands (ev): 0.0915 0.0915 0.8624 0.8624 2.8673 2.8673 3.6242 3.6242 4.9569 4.9569 5.1972 5.1972 5.3077 5.3077 5.4458 5.4458 6.2935 6.2935 6.3383 6.3383 6.5965 6.5965 6.8463 6.8463 6.8950 6.8950 7.3101 7.3101 7.5051 7.5051 7.6100 7.6100 7.8705 7.8705 7.8950 7.8950 7.9574 7.9574 8.0513 8.0513 8.0867 8.0867 8.3598 8.3598 8.4581 8.4581 8.9328 8.9328 9.0802 9.0802 9.3296 9.3296 9.4969 9.4969 9.8996 9.8996 9.9449 9.9449 9.9581 9.9581 10.0110 10.0110 10.0415 10.0415 10.3819 10.3819 10.4154 10.4154 10.4270 10.4270 10.6218 10.6218 k =-0.1538 0.0629 0.5401 ( 7416 PWs) bands (ev): 0.1109 0.1109 0.8832 0.8832 2.7696 2.7696 3.5223 3.5223 5.0708 5.0708 5.2816 5.2816 5.2917 5.2917 5.4394 5.4394 6.3197 6.3197 6.3357 6.3357 6.6497 6.6497 6.8306 6.8306 6.9046 6.9046 7.3147 7.3147 7.4988 7.4988 7.6119 7.6119 7.8723 7.8723 7.9181 7.9181 7.9538 7.9538 8.0617 8.0617 8.1024 8.1024 8.3591 8.3591 8.4482 8.4482 8.9450 8.9450 9.0291 9.0291 9.2640 9.2640 9.4656 9.4656 9.8774 9.8774 9.9452 9.9452 9.9524 9.9524 10.0109 10.0109 10.0410 10.0410 10.4272 10.4272 10.4598 10.4598 10.4852 10.4852 10.5870 10.5870 k =-0.1731 0.0707 0.5401 ( 7420 PWs) bands (ev): 0.1327 0.1327 0.9067 0.9067 2.6710 2.6710 3.4209 3.4209 5.1870 5.1870 5.2551 5.2551 5.3759 5.3759 5.4408 5.4408 6.3268 6.3268 6.3553 6.3553 6.7068 6.7068 6.8139 6.8139 6.9151 6.9151 7.3200 7.3200 7.4956 7.4956 7.6140 7.6140 7.8738 7.8738 7.9369 7.9369 7.9519 7.9519 8.0727 8.0727 8.1197 8.1197 8.3581 8.3581 8.4358 8.4358 8.9572 8.9572 8.9805 8.9805 9.1974 9.1974 9.4341 9.4341 9.8462 9.8462 9.9454 9.9454 9.9487 9.9487 10.0111 10.0111 10.0404 10.0404 10.4732 10.4732 10.5052 10.5052 10.5441 10.5441 10.5595 10.5595 k =-0.1923 0.0786 0.5401 ( 7410 PWs) bands (ev): 0.1569 0.1569 0.9328 0.9328 2.5724 2.5724 3.3205 3.3205 5.2282 5.2282 5.3046 5.3046 5.4058 5.4058 5.4935 5.4935 6.3231 6.3231 6.3889 6.3889 6.7665 6.7665 6.7971 6.7971 6.9262 6.9262 7.3261 7.3261 7.4954 7.4954 7.6163 7.6163 7.8753 7.8753 7.9427 7.9427 7.9603 7.9603 8.0842 8.0842 8.1375 8.1375 8.3568 8.3568 8.4206 8.4206 8.9319 8.9319 8.9733 8.9733 9.1301 9.1301 9.4030 9.4030 9.8065 9.8065 9.9449 9.9449 9.9468 9.9468 10.0113 10.0113 10.0398 10.0398 10.5170 10.5170 10.5407 10.5407 10.5537 10.5537 10.6035 10.6035 k =-0.2115 0.0864 0.5401 ( 7390 PWs) bands (ev): 0.1834 0.1834 0.9614 0.9614 2.4745 2.4745 3.2213 3.2213 5.2020 5.2020 5.4013 5.4013 5.4226 5.4226 5.5764 5.5764 6.3191 6.3191 6.4260 6.4260 6.7778 6.7778 6.8311 6.8311 6.9377 6.9377 7.3332 7.3332 7.4979 7.4979 7.6188 7.6188 7.8766 7.8766 7.9401 7.9401 7.9748 7.9748 8.0961 8.0961 8.1540 8.1540 8.3550 8.3550 8.4027 8.4027 8.8906 8.8906 8.9868 8.9868 9.0629 9.0629 9.3727 9.3727 9.7590 9.7590 9.9436 9.9436 9.9466 9.9466 10.0116 10.0116 10.0392 10.0392 10.5230 10.5230 10.5718 10.5718 10.5994 10.5994 10.6629 10.6629 k =-0.2308 0.0943 0.5401 ( 7394 PWs) bands (ev): 0.2121 0.2121 0.9925 0.9925 2.3779 2.3779 3.1236 3.1236 5.1765 5.1765 5.3943 5.3943 5.5383 5.5383 5.6588 5.6588 6.3155 6.3155 6.4659 6.4659 6.7605 6.7605 6.8961 6.8961 6.9497 6.9497 7.3412 7.3412 7.5027 7.5027 7.6214 7.6214 7.8779 7.8779 7.9366 7.9366 7.9885 7.9885 8.1084 8.1084 8.1668 8.1668 8.3514 8.3514 8.3835 8.3835 8.8551 8.8551 8.9886 8.9886 9.0076 9.0076 9.3434 9.3434 9.7051 9.7051 9.9424 9.9424 9.9468 9.9468 10.0119 10.0119 10.0386 10.0386 10.5201 10.5201 10.6189 10.6189 10.6469 10.6469 10.7223 10.7223 k =-0.2500 0.1022 0.5401 ( 7392 PWs) bands (ev): 0.2429 0.2429 1.0259 1.0259 2.2830 2.2830 3.0277 3.0277 5.1519 5.1519 5.3863 5.3863 5.6521 5.6521 5.7373 5.7373 6.3127 6.3127 6.5083 6.5083 6.7436 6.7436 6.9587 6.9587 6.9662 6.9662 7.3505 7.3505 7.5095 7.5095 7.6241 7.6241 7.8791 7.8791 7.9327 7.9327 8.0014 8.0014 8.1209 8.1209 8.1730 8.1730 8.3426 8.3426 8.3683 8.3683 8.8263 8.8263 8.9257 8.9257 9.0168 9.0168 9.3154 9.3154 9.6463 9.6463 9.9415 9.9415 9.9470 9.9470 10.0123 10.0123 10.0381 10.0381 10.5239 10.5239 10.6665 10.6665 10.6955 10.6955 10.7819 10.7819 k =-0.2692 0.1100 0.5401 ( 7392 PWs) bands (ev): 0.2756 0.2756 1.0614 1.0614 2.1902 2.1902 2.9339 2.9339 5.1285 5.1285 5.3782 5.3782 5.7624 5.7624 5.8109 5.8109 6.3112 6.3112 6.5526 6.5526 6.7283 6.7283 6.9734 6.9734 7.0320 7.0320 7.3612 7.3612 7.5179 7.5179 7.6270 7.6270 7.8802 7.8802 7.9284 7.9284 8.0136 8.0136 8.1334 8.1334 8.1690 8.1690 8.3278 8.3278 8.3613 8.3613 8.8041 8.8041 8.8592 8.8592 9.0290 9.0290 9.2888 9.2888 9.5845 9.5845 9.9407 9.9407 9.9473 9.9473 10.0127 10.0127 10.0376 10.0376 10.5347 10.5347 10.7129 10.7129 10.7458 10.7458 10.8415 10.8415 k =-0.2885 0.1179 0.5401 ( 7402 PWs) bands (ev): 0.3101 0.3101 1.0991 1.0991 2.0999 2.0999 2.8424 2.8424 5.1065 5.1065 5.3705 5.3705 5.8671 5.8671 5.8790 5.8790 6.3119 6.3119 6.5969 6.5969 6.7163 6.7163 6.9857 6.9857 7.1010 7.1010 7.3736 7.3736 7.5276 7.5276 7.6298 7.6298 7.8812 7.8812 7.9237 7.9237 8.0252 8.0252 8.1425 8.1425 8.1551 8.1551 8.3146 8.3146 8.3581 8.3581 8.7822 8.7822 8.7996 8.7996 9.0393 9.0393 9.2638 9.2638 9.5215 9.5215 9.9401 9.9401 9.9476 9.9476 10.0131 10.0131 10.0372 10.0372 10.5518 10.5518 10.7573 10.7573 10.7988 10.7988 10.9015 10.9015 k =-0.3077 0.1257 0.5401 ( 7412 PWs) bands (ev): 0.3461 0.3461 1.1385 1.1385 2.0126 2.0126 2.7535 2.7535 5.0860 5.0860 5.3631 5.3631 5.9402 5.9402 5.9649 5.9649 6.3162 6.3162 6.6348 6.6348 6.7140 6.7140 6.9978 6.9978 7.1704 7.1704 7.3880 7.3880 7.5383 7.5383 7.6327 7.6327 7.8820 7.8820 7.9183 7.9183 8.0359 8.0359 8.1190 8.1190 8.1612 8.1612 8.3060 8.3060 8.3559 8.3559 8.7239 8.7239 8.7829 8.7829 9.0461 9.0461 9.2407 9.2407 9.4598 9.4598 9.9395 9.9395 9.9478 9.9478 10.0135 10.0135 10.0369 10.0369 10.5748 10.5748 10.7990 10.7990 10.8545 10.8545 10.9620 10.9620 k =-0.3269 0.1336 0.5401 ( 7414 PWs) bands (ev): 0.3832 0.3832 1.1795 1.1795 1.9287 1.9287 2.6675 2.6675 5.0672 5.0672 5.3563 5.3563 5.9958 5.9958 6.0504 6.0504 6.3267 6.3267 6.6510 6.6510 6.7364 6.7364 7.0096 7.0096 7.2394 7.2394 7.4049 7.4049 7.5496 7.5496 7.6356 7.6356 7.8827 7.8827 7.9120 7.9120 8.0417 8.0417 8.0844 8.0844 8.1734 8.1734 8.3006 8.3006 8.3543 8.3543 8.6599 8.6599 8.7777 8.7777 9.0476 9.0476 9.2195 9.2195 9.4021 9.4021 9.9390 9.9390 9.9481 9.9481 10.0139 10.0139 10.0366 10.0366 10.6033 10.6033 10.8378 10.8378 10.9131 10.9131 11.0233 11.0233 k =-0.3462 0.1414 0.5401 ( 7398 PWs) bands (ev): 0.4211 0.4211 1.2216 1.2216 1.8488 1.8488 2.5851 2.5851 5.0501 5.0501 5.3501 5.3501 6.0448 6.0448 6.1190 6.1190 6.3479 6.3479 6.6486 6.6486 6.7800 6.7800 7.0212 7.0212 7.3072 7.3072 7.4248 7.4248 7.5613 7.5613 7.6383 7.6383 7.8832 7.8832 7.9045 7.9045 8.0186 8.0186 8.0727 8.0727 8.1856 8.1856 8.2958 8.2958 8.3528 8.3528 8.5973 8.5973 8.7765 8.7765 9.0411 9.0411 9.2003 9.2003 9.3522 9.3522 9.9387 9.9387 9.9484 9.9484 10.0143 10.0143 10.0364 10.0364 10.6369 10.6369 10.8735 10.8735 10.9743 10.9743 11.0856 11.0856 k =-0.3654 0.1493 0.5401 ( 7398 PWs) bands (ev): 0.4592 0.4592 1.2643 1.2643 1.7734 1.7734 2.5066 2.5066 5.0349 5.0349 5.3445 5.3445 6.0873 6.0873 6.1657 6.1657 6.3831 6.3831 6.6413 6.6413 6.8302 6.8302 7.0323 7.0323 7.3730 7.3730 7.4480 7.4480 7.5731 7.5731 7.6409 7.6409 7.8832 7.8832 7.8954 7.8954 7.9722 7.9722 8.0813 8.0813 8.1972 8.1972 8.2905 8.2905 8.3514 8.3514 8.5371 8.5371 8.7778 8.7778 9.0241 9.0241 9.1832 9.1832 9.3133 9.3133 9.9383 9.9383 9.9486 9.9486 10.0145 10.0145 10.0362 10.0362 10.6754 10.6754 10.9060 10.9060 11.0377 11.0377 11.1493 11.1493 k =-0.3846 0.1572 0.5401 ( 7400 PWs) bands (ev): 0.4967 0.4967 1.3069 1.3069 1.7035 1.7035 2.4329 2.4329 5.0215 5.0215 5.3396 5.3396 6.1233 6.1233 6.1927 6.1927 6.4293 6.4293 6.6337 6.6337 6.8815 6.8815 7.0427 7.0427 7.4357 7.4357 7.4751 7.4751 7.5849 7.5849 7.6433 7.6433 7.8797 7.8797 7.8869 7.8869 7.9222 7.9222 8.0930 8.0930 8.2080 8.2080 8.2841 8.2841 8.3501 8.3501 8.4803 8.4803 8.7805 8.7805 8.9963 8.9963 9.1683 9.1683 9.2871 9.2871 9.9381 9.9381 9.9488 9.9488 10.0148 10.0148 10.0360 10.0360 10.7184 10.7184 10.9349 10.9349 11.1030 11.1030 11.2147 11.2147 k =-0.4038 0.1650 0.5401 ( 7404 PWs) bands (ev): 0.5327 0.5327 1.3484 1.3484 1.6400 1.6400 2.3650 2.3650 5.0102 5.0102 5.3354 5.3354 6.1531 6.1531 6.2071 6.2071 6.4781 6.4781 6.6270 6.6270 6.9312 6.9312 7.0524 7.0524 7.4937 7.4937 7.5063 7.5063 7.5967 7.5967 7.6455 7.6455 7.8627 7.8627 7.8743 7.8743 7.8864 7.8864 8.1053 8.1053 8.2178 8.2178 8.2766 8.2766 8.3489 8.3489 8.4282 8.4282 8.7840 8.7840 8.9608 8.9608 9.1555 9.1555 9.2719 9.2719 9.9379 9.9379 9.9490 9.9490 10.0151 10.0151 10.0360 10.0360 10.7656 10.7656 10.9600 10.9600 11.1693 11.1693 11.2818 11.2818 k =-0.4231 0.1729 0.5401 ( 7400 PWs) bands (ev): 0.5658 0.5658 1.3874 1.3874 1.5843 1.5843 2.3044 2.3044 5.0008 5.0008 5.3319 5.3319 6.1766 6.1766 6.2151 6.2151 6.5225 6.5225 6.6218 6.6218 6.9774 6.9774 7.0610 7.0610 7.5408 7.5408 7.5461 7.5461 7.6086 7.6086 7.6473 7.6473 7.8201 7.8201 7.8502 7.8502 7.8856 7.8856 8.1174 8.1174 8.2260 8.2260 8.2686 8.2686 8.3477 8.3477 8.3823 8.3823 8.7876 8.7876 8.9227 8.9227 9.1450 9.1450 9.2642 9.2642 9.9377 9.9377 9.9491 9.9491 10.0153 10.0153 10.0359 10.0359 10.8166 10.8166 10.9810 10.9810 11.2354 11.2354 11.3195 11.3195 k =-0.4423 0.1807 0.5401 ( 7382 PWs) bands (ev): 0.5946 0.5946 1.4218 1.4218 1.5380 1.5380 2.2530 2.2530 4.9935 4.9935 5.3292 5.3292 6.1936 6.1936 6.2204 6.2204 6.5584 6.5584 6.6184 6.6184 7.0174 7.0174 7.0683 7.0683 7.5789 7.5789 7.5896 7.5896 7.6213 7.6213 7.6490 7.6490 7.7753 7.7753 7.8265 7.8265 7.8855 7.8855 8.1288 8.1288 8.2318 8.2318 8.2618 8.2618 8.3430 8.3430 8.3477 8.3477 8.7908 8.7908 8.8872 8.8872 9.1368 9.1368 9.2609 9.2609 9.9376 9.9376 9.9493 9.9493 10.0155 10.0155 10.0359 10.0359 10.8707 10.8707 10.9979 10.9979 11.2610 11.2610 11.2996 11.2996 k =-0.4615 0.1886 0.5401 ( 7382 PWs) bands (ev): 0.6171 0.6171 1.4493 1.4493 1.5032 1.5032 2.2132 2.2132 4.9883 4.9883 5.3272 5.3272 6.2043 6.2043 6.2249 6.2249 6.5833 6.5833 6.6175 6.6175 7.0484 7.0484 7.0745 7.0745 7.6170 7.6170 7.6231 7.6231 7.6360 7.6360 7.6507 7.6507 7.7351 7.7351 7.7990 7.7990 7.8855 7.8855 8.1384 8.1384 8.2334 8.2334 8.2590 8.2590 8.3139 8.3139 8.3461 8.3461 8.7934 8.7934 8.8585 8.8585 9.1309 9.1309 9.2598 9.2598 9.9375 9.9375 9.9494 9.9494 10.0155 10.0155 10.0359 10.0359 10.9264 10.9264 11.0108 11.0108 11.1986 11.1986 11.3578 11.3578 k =-0.4808 0.1965 0.5401 ( 7386 PWs) bands (ev): 0.6316 0.6316 1.4661 1.4661 1.4826 1.4826 2.1878 2.1878 4.9851 4.9851 5.3261 5.3261 6.2094 6.2094 6.2285 6.2285 6.5957 6.5957 6.6197 6.6197 7.0662 7.0662 7.0806 7.0806 7.6412 7.6412 7.6483 7.6483 7.6535 7.6535 7.6588 7.6588 7.7011 7.7011 7.7703 7.7703 7.8856 7.8856 8.1452 8.1452 8.2312 8.2312 8.2619 8.2619 8.2933 8.2933 8.3455 8.3455 8.7950 8.7950 8.8398 8.8398 9.1273 9.1273 9.2596 9.2596 9.9374 9.9374 9.9494 9.9494 10.0156 10.0156 10.0358 10.0358 10.9784 10.9784 11.0221 11.0221 11.1387 11.1387 11.4023 11.4023 k =-0.5000 0.2043 0.5401 ( 7382 PWs) bands (ev): 0.6366 0.6366 1.4684 1.4684 1.4791 1.4791 2.1790 2.1790 4.9841 4.9841 5.3257 5.3257 6.2108 6.2108 6.2299 6.2299 6.5987 6.5987 6.6216 6.6216 7.0708 7.0708 7.0843 7.0843 7.6461 7.6461 7.6553 7.6553 7.6702 7.6702 7.6710 7.6710 7.6805 7.6805 7.7543 7.7543 7.8856 7.8856 8.1477 8.1477 8.2297 8.2297 8.2653 8.2653 8.2844 8.2844 8.3453 8.3453 8.7955 8.7955 8.8334 8.8334 9.1262 9.1262 9.2596 9.2596 9.9374 9.9374 9.9494 9.9494 10.0156 10.0156 10.0358 10.0358 11.0011 11.0011 11.0369 11.0369 11.1022 11.1022 11.4201 11.4201 k =-0.5000 0.2043 0.5401 ( 7382 PWs) bands (ev): 0.6366 0.6366 1.4684 1.4684 1.4791 1.4791 2.1790 2.1790 4.9841 4.9841 5.3257 5.3257 6.2108 6.2108 6.2299 6.2299 6.5987 6.5987 6.6216 6.6216 7.0708 7.0708 7.0843 7.0843 7.6461 7.6461 7.6553 7.6553 7.6702 7.6702 7.6710 7.6710 7.6805 7.6805 7.7543 7.7543 7.8856 7.8856 8.1477 8.1477 8.2297 8.2297 8.2653 8.2653 8.2844 8.2844 8.3453 8.3453 8.7955 8.7955 8.8334 8.8334 9.1262 9.1262 9.2596 9.2596 9.9374 9.9374 9.9494 9.9494 10.0156 10.0156 10.0358 10.0358 11.0011 11.0011 11.0369 11.0369 11.1022 11.1022 11.4201 11.4201 k =-0.4865 0.1988 0.5255 ( 7390 PWs) bands (ev): 0.6317 0.6317 1.4689 1.4689 1.4797 1.4797 2.1877 2.1877 4.9851 4.9851 5.3261 5.3261 6.2092 6.2092 6.2287 6.2287 6.5962 6.5962 6.6192 6.6192 7.0666 7.0666 7.0803 7.0803 7.6407 7.6407 7.6414 7.6414 7.6540 7.6540 7.6757 7.6757 7.6897 7.6897 7.7717 7.7717 7.8856 7.8856 8.1452 8.1452 8.2303 8.2303 8.2637 8.2637 8.2923 8.2923 8.3455 8.3455 8.7950 8.7950 8.8397 8.8397 9.1273 9.1273 9.2596 9.2596 9.9374 9.9374 9.9494 9.9494 10.0156 10.0156 10.0358 10.0358 10.9754 10.9754 11.0267 11.0267 11.1371 11.1371 11.4009 11.4009 k =-0.4730 0.1933 0.5109 ( 7386 PWs) bands (ev): 0.6170 0.6170 1.4701 1.4701 1.4824 1.4824 2.2132 2.2132 4.9882 4.9882 5.3272 5.3272 6.2021 6.2021 6.2273 6.2273 6.5885 6.5885 6.6124 6.6124 7.0537 7.0537 7.0695 7.0695 7.6028 7.6028 7.6217 7.6217 7.6518 7.6518 7.6748 7.6748 7.7011 7.7011 7.8091 7.8091 7.8855 7.8855 8.1377 8.1377 8.2257 8.2257 8.2744 8.2744 8.3068 8.3068 8.3462 8.3462 8.7933 8.7933 8.8576 8.8576 9.1309 9.1309 9.2601 9.2601 9.9375 9.9375 9.9493 9.9493 10.0155 10.0155 10.0359 10.0359 10.9140 10.9140 11.0312 11.0312 11.1909 11.1909 11.3428 11.3428 k =-0.4595 0.1878 0.4963 ( 7378 PWs) bands (ev): 0.5932 0.5932 1.4714 1.4714 1.4884 1.4884 2.2540 2.2540 4.9934 4.9934 5.3291 5.3291 6.1867 6.1867 6.2284 6.2284 6.5749 6.5749 6.6020 6.6020 7.0321 7.0321 7.0540 7.0540 7.5620 7.5620 7.5887 7.5887 7.6510 7.6510 7.6730 7.6730 7.7133 7.7133 7.8541 7.8541 7.8853 7.8853 8.1257 8.1257 8.2159 8.2159 8.2979 8.2979 8.3258 8.3258 8.3474 8.3474 8.7907 8.7907 8.8840 8.8840 9.1369 9.1369 9.2626 9.2626 9.9376 9.9376 9.9493 9.9493 10.0154 10.0154 10.0360 10.0360 10.8441 10.8441 11.0437 11.0437 11.2427 11.2427 11.2599 11.2599 k =-0.4459 0.1822 0.4817 ( 7392 PWs) bands (ev): 0.5612 0.5612 1.4738 1.4738 1.4978 1.4978 2.3081 2.3081 5.0007 5.0007 5.3316 5.3316 6.1630 6.1630 6.2319 6.2319 6.5553 6.5553 6.5880 6.5880 7.0038 7.0038 7.0346 7.0346 7.5215 7.5215 7.5454 7.5454 7.6505 7.6505 7.6706 7.6706 7.7250 7.7250 7.8830 7.8830 7.9057 7.9057 8.1103 8.1103 8.2054 8.2054 8.3172 8.3172 8.3489 8.3489 8.3600 8.3600 8.7872 8.7872 8.9142 8.9142 9.1446 9.1446 9.2702 9.2702 9.9377 9.9377 9.9491 9.9491 10.0152 10.0152 10.0361 10.0361 10.7711 10.7711 11.0613 11.0613 11.1672 11.1672 11.2915 11.2915 k =-0.4324 0.1767 0.4671 ( 7392 PWs) bands (ev): 0.5222 0.5222 1.4785 1.4785 1.5105 1.5105 2.3733 2.3733 5.0100 5.0100 5.3346 5.3346 6.1313 6.1313 6.2370 6.2370 6.5307 6.5307 6.5695 6.5695 6.9712 6.9712 7.0122 7.0122 7.4826 7.4826 7.4942 7.4942 7.6502 7.6502 7.6677 7.6677 7.7348 7.7348 7.8812 7.8812 7.9604 7.9604 8.0929 8.0929 8.1952 8.1952 8.3281 8.3281 8.3519 8.3519 8.4091 8.4091 8.7828 8.7828 8.9430 8.9430 9.1515 9.1515 9.2883 9.2883 9.9379 9.9379 9.9490 9.9490 10.0150 10.0150 10.0365 10.0365 10.6966 10.6966 11.0646 11.0646 11.0936 11.0936 11.3343 11.3343 k =-0.4189 0.1712 0.4525 ( 7402 PWs) bands (ev): 0.4775 0.4775 1.4863 1.4863 1.5262 1.5262 2.4476 2.4476 5.0213 5.0213 5.3380 5.3380 6.0921 6.0921 6.2436 6.2436 6.5023 6.5023 6.5448 6.5448 6.9361 6.9361 6.9881 6.9881 7.4373 7.4373 7.4461 7.4461 7.6500 7.6500 7.6643 7.6643 7.7420 7.7420 7.8773 7.8773 8.0196 8.0196 8.0746 8.0746 8.1850 8.1850 8.3346 8.3346 8.3559 8.3559 8.4672 8.4672 8.7777 8.7777 8.9664 8.9664 9.1543 9.1543 9.3222 9.3222 9.9381 9.9381 9.9487 9.9487 10.0146 10.0146 10.0370 10.0370 10.6216 10.6216 10.9786 10.9786 11.1160 11.1160 11.3716 11.3716 k =-0.4054 0.1657 0.4379 ( 7396 PWs) bands (ev): 0.4283 0.4283 1.4976 1.4976 1.5449 1.5449 2.5295 2.5295 5.0348 5.0348 5.3417 5.3417 6.0453 6.0453 6.2514 6.2514 6.4713 6.4713 6.5123 6.5123 6.8997 6.8997 6.9640 6.9640 7.3766 7.3766 7.4123 7.4123 7.6497 7.6497 7.6609 7.6609 7.7467 7.7467 7.8712 7.8712 8.0566 8.0566 8.0822 8.0822 8.1748 8.1748 8.3381 8.3381 8.3613 8.3613 8.5310 8.5310 8.7719 8.7719 8.9829 8.9829 9.1518 9.1518 9.3726 9.3726 9.9385 9.9385 9.9485 9.9485 10.0142 10.0142 10.0380 10.0380 10.5467 10.5467 10.8901 10.8901 11.1485 11.1485 11.4029 11.4029 k =-0.3919 0.1601 0.4233 ( 7414 PWs) bands (ev): 0.3757 0.3757 1.5126 1.5126 1.5664 1.5664 2.6175 2.6175 5.0502 5.0502 5.3455 5.3455 5.9915 5.9915 6.2604 6.2604 6.4383 6.4383 6.4709 6.4709 6.8631 6.8631 6.9416 6.9416 7.3133 7.3133 7.3814 7.3814 7.6483 7.6483 7.6584 7.6584 7.7491 7.7491 7.8626 7.8626 8.0396 8.0396 8.1456 8.1456 8.1656 8.1656 8.3392 8.3392 8.3682 8.3682 8.5985 8.5985 8.7656 8.7656 8.9930 8.9930 9.1452 9.1452 9.4364 9.4364 9.9389 9.9389 9.9482 9.9482 10.0137 10.0137 10.0395 10.0395 10.4727 10.4727 10.8049 10.8049 11.1858 11.1858 11.4169 11.4169 k =-0.3784 0.1546 0.4088 ( 7410 PWs) bands (ev): 0.3207 0.3207 1.5312 1.5312 1.5908 1.5908 2.7106 2.7106 5.0677 5.0677 5.3491 5.3491 5.9310 5.9310 6.2701 6.2701 6.4035 6.4035 6.4205 6.4205 6.8269 6.8269 6.9223 6.9223 7.2487 7.2487 7.3536 7.3536 7.6447 7.6447 7.6578 7.6578 7.7497 7.7497 7.8512 7.8512 8.0239 8.0239 8.1510 8.1510 8.2152 8.2152 8.3383 8.3383 8.3771 8.3771 8.6680 8.6680 8.7588 8.7588 8.9980 8.9980 9.1360 9.1360 9.5094 9.5094 9.9395 9.9395 9.9479 9.9479 10.0131 10.0131 10.0420 10.0420 10.3998 10.3998 10.7235 10.7235 11.2272 11.2272 11.3893 11.3893 k =-0.3649 0.1491 0.3942 ( 7406 PWs) bands (ev): 0.2643 0.2643 1.5534 1.5534 1.6181 1.6181 2.8078 2.8078 5.0872 5.0872 5.3524 5.3524 5.8645 5.8645 6.2793 6.2793 6.3564 6.3564 6.3733 6.3733 6.7917 6.7917 6.9069 6.9069 7.1835 7.1835 7.3290 7.3290 7.6393 7.6393 7.6584 7.6584 7.7488 7.7488 7.8372 7.8372 8.0098 8.0098 8.1390 8.1390 8.2810 8.2810 8.3367 8.3367 8.3882 8.3882 8.7348 8.7348 8.7553 8.7553 8.9989 8.9989 9.1256 9.1256 9.5876 9.5876 9.9402 9.9402 9.9475 9.9475 10.0123 10.0123 10.0459 10.0459 10.3287 10.3287 10.6461 10.6461 11.2724 11.2724 11.3507 11.3507 k =-0.3514 0.1436 0.3796 ( 7406 PWs) bands (ev): 0.2070 0.2070 1.5790 1.5790 1.6482 1.6482 2.9084 2.9084 5.1087 5.1087 5.3550 5.3550 5.7926 5.7926 6.2677 6.2677 6.3098 6.3098 6.3376 6.3376 6.7579 6.7579 6.8955 6.8955 7.1184 7.1184 7.3075 7.3075 7.6327 7.6327 7.6589 7.6589 7.7467 7.7467 7.8212 7.8212 7.9972 7.9972 8.1260 8.1260 8.3228 8.3228 8.3572 8.3572 8.4022 8.4022 8.7403 8.7403 8.8125 8.8125 8.9965 8.9965 9.1150 9.1150 9.6675 9.6675 9.9413 9.9413 9.9471 9.9471 10.0112 10.0112 10.0522 10.0522 10.2597 10.2597 10.5727 10.5727 11.3018 11.3018 11.3238 11.3238 k =-0.3378 0.1381 0.3650 ( 7406 PWs) bands (ev): 0.1496 0.1496 1.6081 1.6081 1.6811 1.6811 3.0116 3.0116 5.1321 5.1321 5.3568 5.3568 5.7160 5.7160 6.1965 6.1965 6.3015 6.3015 6.3159 6.3159 6.7260 6.7260 6.8878 6.8878 7.0540 7.0540 7.2891 7.2891 7.6250 7.6250 7.6575 7.6575 7.7437 7.7437 7.8046 7.8046 7.9862 7.9862 8.1125 8.1125 8.3206 8.3206 8.4067 8.4067 8.4316 8.4316 8.7314 8.7314 8.8823 8.8823 8.9912 8.9912 9.1049 9.1049 9.7450 9.7450 9.9428 9.9428 9.9466 9.9466 10.0096 10.0096 10.0629 10.0629 10.1937 10.1937 10.5033 10.5033 11.2492 11.2492 11.3748 11.3748 k =-0.3243 0.1325 0.3504 ( 7398 PWs) bands (ev): 0.0926 0.0926 1.6404 1.6404 1.7168 1.7168 3.1169 3.1169 5.1575 5.1575 5.3574 5.3574 5.6353 5.6353 6.1098 6.1098 6.2683 6.2683 6.3287 6.3287 6.6963 6.6963 6.8833 6.8833 6.9905 6.9905 7.2738 7.2738 7.6163 7.6163 7.6518 7.6518 7.7399 7.7399 7.7898 7.7898 7.9766 7.9766 8.0984 8.0984 8.3140 8.3140 8.4276 8.4276 8.4938 8.4938 8.7212 8.7212 8.9501 8.9501 8.9840 8.9840 9.0959 9.0959 9.8141 9.8141 9.9446 9.9446 9.9464 9.9464 10.0068 10.0068 10.0810 10.0810 10.1328 10.1328 10.4377 10.4377 11.1879 11.1879 11.4304 11.4304 k =-0.3108 0.1270 0.3358 ( 7390 PWs) bands (ev): 0.0362 0.0362 1.6759 1.6759 1.7552 1.7552 3.2237 3.2237 5.1848 5.1848 5.3564 5.3564 5.5513 5.5513 6.0159 6.0159 6.2352 6.2352 6.3443 6.3443 6.6689 6.6689 6.8815 6.8815 6.9286 6.9286 7.2617 7.2617 7.6065 7.6065 7.6386 7.6386 7.7354 7.7354 7.7802 7.7802 7.9682 7.9682 8.0841 8.0841 8.3063 8.3063 8.4457 8.4457 8.5593 8.5593 8.7101 8.7101 8.9706 8.9706 9.0192 9.0192 9.0883 9.0883 9.8663 9.8663 9.9439 9.9439 9.9490 9.9490 10.0011 10.0011 10.0728 10.0728 10.1205 10.1205 10.3756 10.3756 11.1200 11.1200 11.4888 11.4888 k =-0.2973 0.1215 0.3212 ( 7390 PWs) bands (ev): -0.0190 -0.0190 1.7145 1.7145 1.7964 1.7964 3.3314 3.3314 5.2140 5.2140 5.3529 5.3529 5.4653 5.4653 5.9165 5.9165 6.2031 6.2031 6.3612 6.3612 6.6442 6.6442 6.8675 6.8675 6.8827 6.8827 7.2526 7.2526 7.5955 7.5955 7.6158 7.6158 7.7305 7.7305 7.7780 7.7780 7.9609 7.9609 8.0697 8.0697 8.2980 8.2980 8.4643 8.4643 8.6233 8.6233 8.6983 8.6983 8.9586 8.9586 9.0770 9.0770 9.0868 9.0868 9.8947 9.8947 9.9390 9.9390 9.9509 9.9509 9.9890 9.9890 10.0377 10.0377 10.1719 10.1719 10.3170 10.3170 11.0469 11.0469 11.5030 11.5030 k =-0.2838 0.1160 0.3066 ( 7402 PWs) bands (ev): -0.0729 -0.0729 1.7560 1.7560 1.8403 1.8403 3.4396 3.4396 5.2451 5.2451 5.3396 5.3396 5.3852 5.3852 5.8128 5.8128 6.1723 6.1723 6.3792 6.3792 6.6222 6.6222 6.8093 6.8093 6.8848 6.8848 7.2465 7.2465 7.5832 7.5832 7.5840 7.5840 7.7252 7.7252 7.7829 7.7829 7.9546 7.9546 8.0556 8.0556 8.2892 8.2892 8.4836 8.4836 8.6767 8.6767 8.6942 8.6942 8.9444 8.9444 9.0757 9.0757 9.1421 9.1421 9.8916 9.8916 9.9270 9.9270 9.9489 9.9489 9.9822 9.9822 10.0238 10.0238 10.2396 10.2396 10.2618 10.2618 10.9701 10.9701 11.4989 11.4989 k =-0.2703 0.1104 0.2920 ( 7408 PWs) bands (ev): -0.1252 -0.1252 1.8005 1.8005 1.8869 1.8869 3.5475 3.5475 5.2721 5.2721 5.2783 5.2783 5.3551 5.3551 5.7059 5.7059 6.1431 6.1431 6.3981 6.3981 6.6031 6.6031 6.7528 6.7528 6.8888 6.8888 7.2432 7.2432 7.5448 7.5448 7.5695 7.5695 7.7198 7.7198 7.7934 7.7934 7.9491 7.9491 8.0418 8.0418 8.2801 8.2801 8.5032 8.5032 8.6688 8.6688 8.7481 8.7481 8.9291 8.9291 9.0715 9.0715 9.1965 9.1965 9.8506 9.8506 9.9262 9.9262 9.9475 9.9475 9.9840 9.9840 10.0189 10.0189 10.2077 10.2077 10.3178 10.3178 10.8918 10.8918 11.4920 11.4920 k =-0.2568 0.1049 0.2774 ( 7418 PWs) bands (ev): -0.1757 -0.1757 1.8478 1.8478 1.9361 1.9361 3.6547 3.6547 5.1814 5.1814 5.3123 5.3123 5.3461 5.3461 5.5963 5.5963 6.1159 6.1159 6.4180 6.4180 6.5869 6.5869 6.6985 6.6985 6.8942 6.8942 7.2428 7.2428 7.5002 7.5002 7.5542 7.5542 7.7142 7.7142 7.8081 7.8081 7.9442 7.9442 8.0286 8.0286 8.2708 8.2708 8.5230 8.5230 8.6543 8.6543 8.8048 8.8048 8.9132 8.9132 9.0679 9.0679 9.2454 9.2454 9.7993 9.7993 9.9276 9.9276 9.9468 9.9468 9.9864 9.9864 10.0165 10.0165 10.1567 10.1567 10.3985 10.3985 10.8141 10.8141 11.4826 11.4826 k =-0.2432 0.0994 0.2628 ( 7406 PWs) bands (ev): -0.2243 -0.2243 1.8979 1.8979 1.9878 1.9878 3.7602 3.7602 5.0872 5.0872 5.3344 5.3344 5.3518 5.3518 5.4849 5.4849 6.0908 6.0908 6.4386 6.4386 6.5736 6.5736 6.6465 6.6465 6.9009 6.9009 7.2447 7.2447 7.4512 7.4512 7.5375 7.5375 7.7089 7.7089 7.8260 7.8260 7.9400 7.9400 8.0163 8.0163 8.2613 8.2613 8.5426 8.5426 8.6387 8.6387 8.8584 8.8584 8.8970 8.8970 9.0650 9.0650 9.2876 9.2876 9.7463 9.7463 9.9286 9.9286 9.9465 9.9465 9.9878 9.9878 10.0150 10.0150 10.1072 10.1072 10.4799 10.4799 10.7394 10.7394 11.4710 11.4710 k =-0.2297 0.0939 0.2482 ( 7394 PWs) bands (ev): -0.2708 -0.2708 1.9507 1.9507 2.0422 2.0422 3.8634 3.8634 4.9920 4.9920 5.3261 5.3261 5.3721 5.3721 5.3888 5.3888 6.0682 6.0682 6.4600 6.4600 6.5630 6.5630 6.5971 6.5971 6.9085 6.9085 7.2487 7.2487 7.3986 7.3986 7.5193 7.5193 7.7040 7.7040 7.8467 7.8467 7.9362 7.9362 8.0049 8.0049 8.2517 8.2517 8.5618 8.5618 8.6228 8.6228 8.8807 8.8807 8.9080 8.9080 9.0626 9.0626 9.3224 9.3224 9.6935 9.6935 9.9290 9.9290 9.9463 9.9463 9.9872 9.9872 10.0137 10.0137 10.0593 10.0593 10.5601 10.5601 10.6703 10.6703 11.4578 11.4578 k =-0.2162 0.0884 0.2336 ( 7400 PWs) bands (ev): -0.3151 -0.3151 2.0062 2.0062 2.0989 2.0989 3.9627 3.9627 4.8972 4.8972 5.2585 5.2585 5.3155 5.3155 5.4287 5.4287 6.0485 6.0485 6.4816 6.4816 6.5488 6.5488 6.5569 6.5569 6.9169 6.9169 7.2541 7.2541 7.3432 7.3432 7.4997 7.4997 7.6997 7.6997 7.8698 7.8698 7.9328 7.9328 7.9945 7.9945 8.2419 8.2419 8.5799 8.5799 8.6070 8.6070 8.8647 8.8647 8.9530 8.9530 9.0611 9.0611 9.3489 9.3489 9.6412 9.6412 9.9291 9.9291 9.9462 9.9462 9.9801 9.9801 10.0113 10.0113 10.0184 10.0184 10.6084 10.6084 10.6387 10.6387 11.4432 11.4432 k =-0.2027 0.0828 0.2190 ( 7400 PWs) bands (ev): -0.3570 -0.3570 2.0642 2.0642 2.1581 2.1581 4.0566 4.0566 4.8042 4.8042 5.1446 5.1446 5.3039 5.3039 5.4704 5.4704 6.0319 6.0319 6.4960 6.4960 6.5136 6.5136 6.5507 6.5507 6.9261 6.9261 7.2594 7.2594 7.2861 7.2861 7.4787 7.4787 7.6968 7.6968 7.8949 7.8949 7.9298 7.9298 7.9853 7.9853 8.2319 8.2319 8.5860 8.5860 8.6024 8.6024 8.8491 8.8491 8.9921 8.9921 9.0609 9.0609 9.3669 9.3669 9.5895 9.5895 9.9285 9.9285 9.9459 9.9459 9.9474 9.9474 9.9989 9.9989 10.0127 10.0127 10.5574 10.5574 10.7133 10.7133 11.4279 11.4279 k =-0.1892 0.0773 0.2044 ( 7398 PWs) bands (ev): -0.3966 -0.3966 2.1247 2.1247 2.2197 2.2197 4.1415 4.1415 4.7159 4.7159 5.0307 5.0307 5.2916 5.2916 5.5138 5.5138 6.0188 6.0188 6.4611 6.4611 6.5298 6.5298 6.5482 6.5482 6.9357 6.9357 7.2240 7.2240 7.2675 7.2675 7.4566 7.4566 7.6958 7.6958 7.9218 7.9218 7.9271 7.9271 7.9772 7.9772 8.2216 8.2216 8.5714 8.5714 8.6179 8.6179 8.8341 8.8341 9.0222 9.0222 9.0642 9.0642 9.3763 9.3763 9.5385 9.5385 9.8972 9.8972 9.9293 9.9293 9.9465 9.9465 9.9958 9.9958 10.0118 10.0118 10.5171 10.5171 10.7846 10.7846 11.4123 11.4123 k =-0.1757 0.0718 0.1898 ( 7390 PWs) bands (ev): -0.4337 -0.4337 2.1877 2.1877 2.2834 2.2834 4.2105 4.2105 4.6390 4.6390 4.9172 4.9172 5.2788 5.2788 5.5589 5.5589 6.0095 6.0095 6.4224 6.4224 6.5470 6.5470 6.5542 6.5542 6.9457 6.9457 7.1628 7.1628 7.2716 7.2716 7.4335 7.4335 7.6973 7.6973 7.9245 7.9245 7.9502 7.9502 7.9706 7.9706 8.2112 8.2112 8.5555 8.5555 8.6339 8.6339 8.8196 8.8196 9.0379 9.0379 9.0756 9.0756 9.3781 9.3781 9.4883 9.4883 9.8460 9.8460 9.9287 9.9287 9.9467 9.9467 9.9946 9.9946 10.0112 10.0112 10.4879 10.4879 10.8520 10.8520 11.3966 11.3966 k =-0.1622 0.0663 0.1752 ( 7378 PWs) bands (ev): -0.4683 -0.4683 2.2531 2.2531 2.3492 2.3492 4.2484 4.2484 4.5880 4.5880 4.8046 4.8046 5.2659 5.2659 5.6055 5.6055 6.0043 6.0043 6.3860 6.3860 6.5501 6.5501 6.5775 6.5775 6.9558 6.9558 7.1000 7.1000 7.2732 7.2732 7.4097 7.4097 7.7022 7.7022 7.9222 7.9222 7.9622 7.9622 7.9826 7.9826 8.2005 8.2005 8.5400 8.5400 8.6489 8.6489 8.8060 8.8060 9.0421 9.0421 9.0907 9.0907 9.3740 9.3740 9.4390 9.4390 9.7948 9.7948 9.9282 9.9282 9.9470 9.9470 9.9938 9.9938 10.0106 10.0106 10.4689 10.4689 10.9151 10.9151 11.3814 11.3814 k =-0.1486 0.0607 0.1606 ( 7394 PWs) bands (ev): -0.5003 -0.5003 2.3207 2.3207 2.4169 2.4169 4.2360 4.2360 4.5815 4.5815 4.6931 4.6931 5.2531 5.2531 5.6536 5.6536 6.0033 6.0033 6.3523 6.3523 6.5552 6.5552 6.6016 6.6016 6.9654 6.9654 7.0368 7.0368 7.2708 7.2708 7.3854 7.3854 7.7109 7.7109 7.9202 7.9202 7.9573 7.9573 8.0136 8.0136 8.1897 8.1897 8.5253 8.5253 8.6626 8.6626 8.7932 8.7932 9.0425 9.0425 9.0998 9.0998 9.3659 9.3659 9.3916 9.3916 9.7452 9.7452 9.9276 9.9276 9.9472 9.9472 9.9931 9.9931 10.0101 10.0101 10.4586 10.4586 10.9737 10.9737 11.3669 11.3669 k =-0.1351 0.0552 0.1460 ( 7397 PWs) bands (ev): -0.5296 -0.5296 2.3905 2.3905 2.4863 2.4863 4.1792 4.1792 4.5832 4.5832 4.6133 4.6133 5.2406 5.2406 5.7030 5.7030 6.0065 6.0065 6.3214 6.3214 6.5631 6.5631 6.6258 6.6258 6.9626 6.9626 6.9849 6.9849 7.2632 7.2632 7.3609 7.3609 7.7240 7.7240 7.9183 7.9183 7.9526 7.9526 8.0462 8.0462 8.1788 8.1788 8.5116 8.5116 8.6749 8.6749 8.7813 8.7813 9.0416 9.0416 9.0990 9.0990 9.3396 9.3396 9.3638 9.3638 9.6983 9.6983 9.9270 9.9270 9.9474 9.9474 9.9925 9.9925 10.0098 10.0098 10.4552 10.4552 11.0275 11.0275 11.3533 11.3533 k =-0.1216 0.0497 0.1314 ( 7391 PWs) bands (ev): -0.5563 -0.5563 2.4623 2.4623 2.5571 2.5571 4.1000 4.1000 4.4754 4.4754 4.6607 4.6607 5.2287 5.2287 5.7538 5.7538 6.0137 6.0137 6.2933 6.2933 6.5742 6.5742 6.6500 6.6500 6.9038 6.9038 6.9883 6.9883 7.2498 7.2498 7.3366 7.3366 7.7412 7.7412 7.9167 7.9167 7.9485 7.9485 8.0795 8.0795 8.1681 8.1681 8.4990 8.4990 8.6857 8.6857 8.7705 8.7705 9.0396 9.0396 9.0875 9.0875 9.2947 9.2947 9.3589 9.3589 9.6549 9.6549 9.9265 9.9265 9.9476 9.9476 9.9919 9.9919 10.0096 10.0096 10.4568 10.4568 11.0764 11.0764 11.3407 11.3407 k =-0.1081 0.0442 0.1168 ( 7379 PWs) bands (ev): -0.5802 -0.5802 2.5360 2.5360 2.6289 2.6289 4.0118 4.0118 4.3702 4.3702 4.7103 4.7103 5.2177 5.2177 5.8058 5.8058 6.0245 6.0245 6.2682 6.2682 6.5887 6.5887 6.6738 6.6738 6.8391 6.8391 6.9969 6.9969 7.2303 7.2303 7.3129 7.3129 7.7618 7.7618 7.9154 7.9154 7.9448 7.9448 8.1130 8.1130 8.1578 8.1578 8.4877 8.4877 8.6947 8.6947 8.7607 8.7607 9.0354 9.0354 9.0686 9.0686 9.2504 9.2504 9.3588 9.3588 9.6152 9.6152 9.9260 9.9260 9.9479 9.9479 9.9912 9.9912 10.0096 10.0096 10.4617 10.4617 11.1204 11.1204 11.3294 11.3294 k =-0.0946 0.0387 0.1022 ( 7377 PWs) bands (ev): -0.6014 -0.6014 2.6114 2.6114 2.7012 2.7012 3.9200 3.9200 4.2681 4.2681 4.7566 4.7566 5.2075 5.2075 5.8587 5.8587 6.0380 6.0380 6.2459 6.2459 6.6071 6.6071 6.6969 6.6969 6.7742 6.7742 7.0049 7.0049 7.2049 7.2049 7.2902 7.2902 7.7848 7.7848 7.9144 7.9144 7.9416 7.9416 8.1425 8.1425 8.1517 8.1517 8.4777 8.4777 8.7020 8.7020 8.7518 8.7518 9.0220 9.0220 9.0523 9.0523 9.2080 9.2080 9.3615 9.3615 9.5795 9.5795 9.9255 9.9255 9.9481 9.9481 9.9907 9.9907 10.0096 10.0096 10.4687 10.4687 11.1593 11.1593 11.3194 11.3194 k =-0.0811 0.0331 0.0876 ( 7365 PWs) bands (ev): -0.6198 -0.6198 2.6880 2.6880 2.7731 2.7731 3.8273 3.8273 4.1702 4.1702 4.7973 4.7973 5.1986 5.1986 5.9125 5.9125 6.0532 6.0532 6.2265 6.2265 6.6296 6.6296 6.7086 6.7086 6.7204 6.7204 7.0118 7.0118 7.1740 7.1740 7.2690 7.2690 7.8086 7.8086 7.9139 7.9139 7.9389 7.9389 8.1374 8.1374 8.1802 8.1802 8.4691 8.4691 8.7074 8.7074 8.7440 8.7440 8.9956 8.9956 9.0462 9.0462 9.1685 9.1685 9.3656 9.3656 9.5478 9.5478 9.9251 9.9251 9.9483 9.9483 9.9902 9.9902 10.0096 10.0096 10.4765 10.4765 11.1931 11.1931 11.3107 11.3107 k =-0.0676 0.0276 0.0730 ( 7367 PWs) bands (ev): -0.6354 -0.6354 2.7655 2.7655 2.8435 2.8435 3.7353 3.7353 4.0777 4.0777 4.8315 4.8315 5.1908 5.1908 5.9665 5.9665 6.0688 6.0688 6.2101 6.2101 6.6461 6.6461 6.6565 6.6565 6.7403 6.7403 7.0172 7.0172 7.1384 7.1384 7.2498 7.2498 7.8317 7.8317 7.9141 7.9141 7.9365 7.9365 8.1292 8.1292 8.2110 8.2110 8.4619 8.4619 8.7108 8.7108 8.7373 8.7373 8.9657 8.9657 9.0439 9.0439 9.1328 9.1328 9.3697 9.3697 9.5206 9.5206 9.9248 9.9248 9.9485 9.9485 9.9898 9.9898 10.0096 10.0096 10.4842 10.4842 11.2217 11.2217 11.3034 11.3034 k =-0.0541 0.0221 0.0584 ( 7371 PWs) bands (ev): -0.6482 -0.6482 2.8430 2.8430 2.9105 2.9105 3.6455 3.6455 3.9926 3.9926 4.8589 4.8589 5.1844 5.1844 6.0203 6.0203 6.0834 6.0834 6.1967 6.1967 6.5847 6.5847 6.6874 6.6874 6.7591 6.7591 7.0210 7.0210 7.0994 7.0994 7.2332 7.2332 7.8521 7.8521 7.9154 7.9154 7.9344 7.9344 8.1220 8.1220 8.2392 8.2392 8.4561 8.4561 8.7126 8.7126 8.7316 8.7316 8.9376 8.9376 9.0426 9.0426 9.1018 9.1018 9.3728 9.3728 9.4982 9.4982 9.9245 9.9245 9.9486 9.9486 9.9894 9.9894 10.0097 10.0097 10.4913 10.4913 11.2451 11.2451 11.2975 11.2975 k =-0.0405 0.0166 0.0438 ( 7375 PWs) bands (ev): -0.6582 -0.6582 2.9186 2.9186 2.9713 2.9713 3.5599 3.5599 3.9177 3.9177 4.8798 4.8798 5.1794 5.1794 6.0724 6.0724 6.0961 6.0961 6.1863 6.1863 6.5264 6.5264 6.7212 6.7212 6.7754 6.7754 7.0231 7.0231 7.0587 7.0587 7.2198 7.2198 7.8679 7.8679 7.9183 7.9183 7.9328 7.9328 8.1163 8.1163 8.2635 8.2635 8.4517 8.4517 8.7131 8.7131 8.7269 8.7269 8.9138 8.9138 9.0418 9.0418 9.0764 9.0764 9.3746 9.3746 9.4810 9.4810 9.9242 9.9242 9.9487 9.9487 9.9891 9.9891 10.0097 10.0097 10.4973 10.4973 11.2634 11.2634 11.2929 11.2929 k =-0.0270 0.0110 0.0292 ( 7385 PWs) bands (ev): -0.6653 -0.6653 2.9886 2.9886 3.0216 3.0216 3.4826 3.4826 3.8573 3.8573 4.8944 4.8944 5.1758 5.1758 6.1055 6.1055 6.1204 6.1204 6.1788 6.1788 6.4742 6.4742 6.7552 6.7552 6.7884 6.7884 7.0169 7.0169 7.0262 7.0262 7.2100 7.2100 7.8780 7.8780 7.9227 7.9227 7.9316 7.9316 8.1120 8.1120 8.2824 8.2824 8.4485 8.4485 8.7128 8.7128 8.7233 8.7233 8.8958 8.8958 9.0410 9.0410 9.0578 9.0578 9.3751 9.3751 9.4692 9.4692 9.9240 9.9240 9.9488 9.9488 9.9889 9.9889 10.0098 10.0098 10.5018 10.5018 11.2764 11.2764 11.2896 11.2896 k =-0.0135 0.0055 0.0146 ( 7379 PWs) bands (ev): -0.6696 -0.6696 3.0438 3.0438 3.0561 3.0561 3.4226 3.4226 3.8172 3.8172 4.9031 4.9031 5.1736 5.1736 6.1116 6.1116 6.1574 6.1574 6.1745 6.1745 6.4342 6.4342 6.7823 6.7823 6.7986 6.7986 6.9857 6.9857 7.0251 7.0251 7.2041 7.2041 7.8831 7.8831 7.9270 7.9270 7.9306 7.9306 8.1094 8.1094 8.2945 8.2945 8.4466 8.4466 8.7124 8.7124 8.7209 8.7209 8.8846 8.8846 9.0400 9.0400 9.0471 9.0471 9.3749 9.3749 9.4624 9.4624 9.9239 9.9239 9.9488 9.9488 9.9887 9.9887 10.0098 10.0098 10.5046 10.5046 11.2840 11.2840 11.2879 11.2879 k = 0.0000 0.0000 0.0000 ( 7383 PWs) bands (ev): -0.6711 -0.6711 3.0645 3.0645 3.0706 3.0706 3.3982 3.3982 3.8030 3.8030 4.9059 4.9059 5.1729 5.1729 6.1137 6.1137 6.1707 6.1707 6.1749 6.1749 6.4182 6.4182 6.7912 6.7912 6.8051 6.8051 6.9721 6.9721 7.0250 7.0250 7.2021 7.2021 7.8845 7.8845 7.9295 7.9295 7.9296 7.9296 8.1085 8.1085 8.2987 8.2987 8.4459 8.4459 8.7122 8.7122 8.7201 8.7201 8.8808 8.8808 9.0388 9.0388 9.0443 9.0443 9.3748 9.3748 9.4603 9.4603 9.9239 9.9239 9.9489 9.9489 9.9887 9.9887 10.0098 10.0098 10.5056 10.5056 11.2859 11.2859 11.2880 11.2880 k = 0.0000 0.0000 0.0000 ( 7383 PWs) bands (ev): -0.6711 -0.6711 3.0645 3.0645 3.0706 3.0706 3.3982 3.3982 3.8030 3.8030 4.9059 4.9059 5.1729 5.1729 6.1137 6.1137 6.1707 6.1707 6.1749 6.1749 6.4182 6.4182 6.7912 6.7912 6.8051 6.8051 6.9721 6.9721 7.0250 7.0250 7.2021 7.2021 7.8845 7.8845 7.9295 7.9295 7.9296 7.9296 8.1085 8.1085 8.2987 8.2987 8.4459 8.4459 8.7122 8.7122 8.7201 8.7201 8.8808 8.8808 9.0388 9.0388 9.0443 9.0443 9.3748 9.3748 9.4603 9.4603 9.9239 9.9239 9.9489 9.9489 9.9887 9.9887 10.0098 10.0098 10.5056 10.5056 11.2859 11.2859 11.2880 11.2880 k = 0.0078 0.0190 0.0000 ( 7367 PWs) bands (ev): -0.6696 -0.6696 3.0654 3.0654 3.0715 3.0715 3.3994 3.3994 3.8046 3.8046 4.9047 4.9047 5.1618 5.1618 6.1109 6.1109 6.1529 6.1529 6.1572 6.1572 6.4307 6.4307 6.8046 6.8046 6.8188 6.8188 6.9732 6.9732 7.0256 7.0256 7.2027 7.2027 7.8860 7.8860 7.9303 7.9303 7.9306 7.9306 8.1091 8.1091 8.2993 8.2993 8.4463 8.4463 8.7129 8.7129 8.7210 8.7210 8.8823 8.8823 9.0384 9.0384 9.0438 9.0438 9.3753 9.3753 9.4634 9.4634 9.9228 9.9228 9.9484 9.9484 9.9876 9.9876 10.0094 10.0094 10.5051 10.5051 11.2861 11.2861 11.2882 11.2882 k = 0.0155 0.0380 0.0000 ( 7371 PWs) bands (ev): -0.6651 -0.6651 3.0681 3.0681 3.0742 3.0742 3.4030 3.4030 3.8094 3.8094 4.8999 4.8999 5.1310 5.1310 6.1005 6.1005 6.1062 6.1062 6.1083 6.1083 6.4667 6.4667 6.8404 6.8404 6.8552 6.8552 6.9765 6.9765 7.0273 7.0273 7.2044 7.2044 7.8904 7.8904 7.9331 7.9331 7.9334 7.9334 8.1108 8.1108 8.3011 8.3011 8.4475 8.4475 8.7151 8.7151 8.7237 8.7237 8.8868 8.8868 9.0374 9.0374 9.0426 9.0426 9.3770 9.3770 9.4729 9.4729 9.9193 9.9193 9.9471 9.9471 9.9842 9.9842 10.0081 10.0081 10.5038 10.5038 11.2868 11.2868 11.2889 11.2889 k = 0.0233 0.0569 0.0000 ( 7371 PWs) bands (ev): -0.6578 -0.6578 3.0725 3.0725 3.0787 3.0787 3.4091 3.4091 3.8174 3.8174 4.8869 4.8869 5.0893 5.0893 6.0322 6.0322 6.0372 6.0372 6.0897 6.0897 6.5221 6.5221 6.8892 6.8892 6.9053 6.9053 6.9822 6.9822 7.0303 7.0303 7.2073 7.2073 7.8981 7.8981 7.9379 7.9379 7.9380 7.9380 8.1137 8.1137 8.3042 8.3042 8.4494 8.4494 8.7187 8.7187 8.7282 8.7282 8.8944 8.8944 9.0356 9.0356 9.0406 9.0406 9.3798 9.3798 9.4886 9.4886 9.9135 9.9135 9.9449 9.9449 9.9786 9.9786 10.0060 10.0060 10.5017 10.5017 11.2880 11.2880 11.2902 11.2902 k = 0.0310 0.0759 0.0000 ( 7355 PWs) bands (ev): -0.6474 -0.6474 3.0787 3.0787 3.0850 3.0850 3.4176 3.4176 3.8285 3.8285 4.8560 4.8560 5.0508 5.0508 5.9465 5.9465 5.9517 5.9517 6.0709 6.0709 6.5920 6.5920 6.9426 6.9426 6.9608 6.9608 6.9902 6.9902 7.0346 7.0346 7.2115 7.2115 7.9093 7.9093 7.9443 7.9443 7.9452 7.9452 8.1177 8.1177 8.3085 8.3085 8.4520 8.4520 8.7235 8.7235 8.7342 8.7342 8.9050 8.9050 9.0331 9.0331 9.0378 9.0378 9.3837 9.3837 9.5107 9.5107 9.9054 9.9054 9.9419 9.9419 9.9709 9.9709 10.0032 10.0032 10.4989 10.4989 11.2898 11.2898 11.2922 11.2922 k = 0.0388 0.0949 0.0000 ( 7359 PWs) bands (ev): -0.6341 -0.6341 3.0867 3.0867 3.0930 3.0930 3.4284 3.4284 3.8429 3.8429 4.7986 4.7986 5.0289 5.0289 5.8517 5.8517 5.8571 5.8571 6.0470 6.0470 6.6720 6.6720 6.9945 6.9945 7.0009 7.0009 7.0159 7.0159 7.0407 7.0407 7.2167 7.2167 7.9244 7.9244 7.9525 7.9525 7.9554 7.9554 8.1228 8.1228 8.3141 8.3141 8.4554 8.4554 8.7293 8.7293 8.7417 8.7417 8.9184 8.9184 9.0301 9.0301 9.0344 9.0344 9.3887 9.3887 9.5388 9.5388 9.8950 9.8950 9.9377 9.9377 9.9613 9.9613 9.9996 9.9996 10.4954 10.4954 11.2925 11.2925 11.2950 11.2950 k = 0.0465 0.1139 0.0000 ( 7367 PWs) bands (ev): -0.6179 -0.6179 3.0963 3.0963 3.1027 3.1027 3.4415 3.4415 3.8604 3.8604 4.7179 4.7179 5.0235 5.0235 5.7510 5.7510 5.7567 5.7567 6.0180 6.0180 6.7584 6.7584 7.0141 7.0141 7.0357 7.0357 7.0541 7.0541 7.0669 7.0669 7.2231 7.2231 7.9435 7.9435 7.9625 7.9625 7.9689 7.9689 8.1291 8.1291 8.3209 8.3209 8.4595 8.4595 8.7358 8.7358 8.7503 8.7503 8.9345 8.9345 9.0263 9.0263 9.0304 9.0304 9.3948 9.3948 9.5730 9.5730 9.8824 9.8824 9.9319 9.9319 9.9506 9.9506 9.9955 9.9955 10.4914 10.4914 11.2962 11.2962 11.2988 11.2988 k = 0.0543 0.1329 0.0000 ( 7375 PWs) bands (ev): -0.5987 -0.5987 3.1075 3.1075 3.1141 3.1141 3.4568 3.4568 3.8810 3.8810 4.6228 4.6228 5.0285 5.0285 5.6466 5.6466 5.6527 5.6527 5.9843 5.9843 6.8485 6.8485 7.0300 7.0300 7.0501 7.0501 7.0891 7.0891 7.1115 7.1115 7.2306 7.2306 7.9665 7.9665 7.9743 7.9743 7.9857 7.9857 8.1365 8.1365 8.3289 8.3289 8.4644 8.4644 8.7428 8.7428 8.7600 8.7600 8.9530 8.9530 9.0221 9.0221 9.0262 9.0262 9.4022 9.4022 9.6129 9.6129 9.8677 9.8677 9.9230 9.9230 9.9404 9.9404 9.9909 9.9909 10.4873 10.4873 11.3010 11.3010 11.3039 11.3039 k = 0.0620 0.1518 0.0000 ( 7351 PWs) bands (ev): -0.5766 -0.5766 3.1203 3.1203 3.1270 3.1270 3.4743 3.4743 3.9048 3.9048 4.5193 4.5193 5.0397 5.0397 5.5399 5.5399 5.5464 5.5464 5.9461 5.9461 6.9401 6.9401 7.0483 7.0483 7.0603 7.0603 7.1223 7.1223 7.1484 7.1484 7.2393 7.2393 7.9879 7.9879 7.9930 7.9930 8.0056 8.0056 8.1450 8.1450 8.3382 8.3382 8.4699 8.4699 8.7500 8.7500 8.7703 8.7703 8.9734 8.9734 9.0175 9.0175 9.0224 9.0224 9.4107 9.4107 9.6582 9.6582 9.8508 9.8508 9.9093 9.9093 9.9325 9.9325 9.9858 9.9858 10.4834 10.4834 11.3075 11.3075 11.3107 11.3107 k = 0.0698 0.1708 0.0000 ( 7351 PWs) bands (ev): -0.5516 -0.5516 3.1346 3.1346 3.1415 3.1415 3.4937 3.4937 3.9317 3.9317 4.4108 4.4108 5.0552 5.0552 5.4320 5.4320 5.4388 5.4388 5.9038 5.9038 7.0316 7.0316 7.0653 7.0653 7.0751 7.0751 7.1482 7.1482 7.1771 7.1771 7.2491 7.2491 8.0031 8.0031 8.0219 8.0219 8.0281 8.0281 8.1546 8.1546 8.3488 8.3488 8.4762 8.4762 8.7570 8.7570 8.7810 8.7810 8.9925 8.9925 9.0125 9.0125 9.0217 9.0217 9.4205 9.4205 9.7079 9.7079 9.8319 9.8319 9.8918 9.8918 9.9263 9.9263 9.9807 9.9807 10.4804 10.4804 11.3157 11.3157 11.3194 11.3194 k = 0.0776 0.1898 0.0000 ( 7335 PWs) bands (ev): -0.5237 -0.5237 3.1502 3.1502 3.1573 3.1573 3.5150 3.5150 3.9618 3.9618 4.2992 4.2992 5.0741 5.0741 5.3236 5.3236 5.3308 5.3308 5.8578 5.8578 7.0775 7.0775 7.0985 7.0985 7.1217 7.1217 7.1667 7.1667 7.1981 7.1981 7.2600 7.2600 8.0203 8.0203 8.0513 8.0513 8.0529 8.0529 8.1652 8.1652 8.3606 8.3606 8.4832 8.4832 8.7635 8.7635 8.7918 8.7918 8.9999 8.9999 9.0070 9.0070 9.0350 9.0350 9.4316 9.4316 9.7609 9.7609 9.8111 9.8111 9.8716 9.8716 9.9207 9.9207 9.9754 9.9754 10.4792 10.4792 11.3260 11.3260 11.3302 11.3302 k = 0.0853 0.2088 0.0000 ( 7363 PWs) bands (ev): -0.4928 -0.4928 3.1670 3.1670 3.1743 3.1743 3.5380 3.5380 3.9949 3.9949 4.1857 4.1857 5.0959 5.0959 5.2154 5.2154 5.2231 5.2231 5.8087 5.8087 7.0894 7.0894 7.1260 7.1260 7.1784 7.1784 7.2035 7.2035 7.2172 7.2172 7.2726 7.2726 8.0389 8.0389 8.0761 8.0761 8.0824 8.0824 8.1769 8.1769 8.3735 8.3735 8.4908 8.4908 8.7691 8.7691 8.8021 8.8021 8.9974 8.9974 9.0012 9.0012 9.0604 9.0604 9.4440 9.4440 9.7882 9.7882 9.8154 9.8154 9.8490 9.8490 9.9154 9.9154 9.9704 9.9704 10.4814 10.4814 11.3387 11.3387 11.3435 11.3435 k = 0.0931 0.2278 0.0000 ( 7363 PWs) bands (ev): -0.4591 -0.4591 3.1849 3.1849 3.1924 3.1924 3.5625 3.5625 4.0312 4.0312 4.0712 4.0712 5.1080 5.1080 5.1160 5.1160 5.1205 5.1205 5.7570 5.7570 7.1019 7.1019 7.1564 7.1564 7.1847 7.1847 7.2171 7.2171 7.2780 7.2780 7.3038 7.3038 8.0592 8.0592 8.0994 8.0994 8.1109 8.1109 8.1897 8.1897 8.3876 8.3876 8.4991 8.4991 8.7732 8.7732 8.8115 8.8115 8.9925 8.9925 8.9952 8.9952 9.0900 9.0900 9.4581 9.4581 9.7636 9.7636 9.8246 9.8246 9.8683 9.8683 9.9105 9.9105 9.9661 9.9661 10.4893 10.4893 11.3541 11.3541 11.3596 11.3596 k = 0.1008 0.2467 0.0000 ( 7375 PWs) bands (ev): -0.4225 -0.4225 3.2035 3.2035 3.2114 3.2114 3.5883 3.5883 3.9564 3.9564 4.0704 4.0704 5.0019 5.0019 5.0105 5.0105 5.1472 5.1472 5.7033 5.7033 7.1153 7.1153 7.1809 7.1809 7.1948 7.1948 7.2187 7.2187 7.2956 7.2956 7.3824 7.3824 8.0811 8.0811 8.1204 8.1204 8.1367 8.1367 8.2035 8.2035 8.4027 8.4027 8.5081 8.5081 8.7756 8.7756 8.8195 8.8195 8.9867 8.9867 8.9896 8.9896 9.1218 9.1218 9.4740 9.4740 9.7373 9.7373 9.7984 9.7984 9.9060 9.9060 9.9143 9.9143 9.9647 9.9647 10.5057 10.5057 11.3724 11.3724 11.3789 11.3789 k = 0.1086 0.2657 0.0000 ( 7375 PWs) bands (ev): -0.3830 -0.3830 3.2227 3.2227 3.2308 3.2308 3.6150 3.6150 3.8417 3.8417 4.1127 4.1127 4.8977 4.8977 4.9068 4.9068 5.1764 5.1764 5.6482 5.6482 7.1294 7.1294 7.1802 7.1802 7.2154 7.2154 7.2289 7.2289 7.3107 7.3107 7.4614 7.4614 8.1046 8.1046 8.1383 8.1383 8.1587 8.1587 8.2182 8.2182 8.4189 8.4189 8.5177 8.5177 8.7759 8.7759 8.8255 8.8255 8.9803 8.9803 8.9845 8.9845 9.1550 9.1550 9.4919 9.4919 9.7093 9.7093 9.7707 9.7707 9.9020 9.9020 9.9399 9.9399 9.9757 9.9757 10.5341 10.5341 11.3939 11.3939 11.4015 11.4015 k = 0.1163 0.2847 0.0000 ( 7375 PWs) bands (ev): -0.3406 -0.3406 3.2420 3.2420 3.2504 3.2504 3.6422 3.6422 3.7275 3.7275 4.1580 4.1580 4.7960 4.7960 4.8057 4.8057 5.2078 5.2078 5.5925 5.5925 7.1437 7.1437 7.1748 7.1748 7.2084 7.2084 7.2679 7.2679 7.3266 7.3266 7.5373 7.5373 8.1295 8.1295 8.1524 8.1524 8.1763 8.1763 8.2340 8.2340 8.4359 8.4359 8.5279 8.5279 8.7737 8.7737 8.8288 8.8288 8.9737 8.9737 8.9796 8.9796 9.1891 9.1891 9.5121 9.5121 9.6798 9.6798 9.7416 9.7416 9.8986 9.8986 9.9427 9.9427 9.9983 9.9983 10.5772 10.5772 11.4189 11.4189 11.4276 11.4276 k = 0.1241 0.3037 0.0000 ( 7375 PWs) bands (ev): -0.2954 -0.2954 3.2608 3.2608 3.2697 3.2697 3.6140 3.6140 3.6697 3.6697 4.2063 4.2063 4.6974 4.6974 4.7077 4.7077 5.2414 5.2414 5.5370 5.5370 7.1537 7.1537 7.1717 7.1717 7.1985 7.1985 7.3096 7.3096 7.3432 7.3432 7.6099 7.6099 8.1552 8.1552 8.1629 8.1629 8.1890 8.1890 8.2506 8.2506 8.4539 8.4539 8.5387 8.5387 8.7688 8.7688 8.8288 8.8288 8.9670 8.9670 8.9745 8.9745 9.2235 9.2235 9.5347 9.5347 9.6488 9.6488 9.7116 9.7116 9.8958 9.8958 9.9406 9.9406 10.0130 10.0130 10.6357 10.6357 11.4473 11.4473 11.4573 11.4573 k = 0.1318 0.3226 0.0000 ( 7379 PWs) bands (ev): -0.2474 -0.2474 3.2787 3.2787 3.2879 3.2879 3.5015 3.5015 3.6967 3.6967 4.2575 4.2575 4.6029 4.6029 4.6137 4.6137 5.2771 5.2771 5.4825 5.4825 7.1481 7.1481 7.1829 7.1829 7.1862 7.1862 7.3536 7.3536 7.3608 7.3608 7.6790 7.6790 8.1667 8.1667 8.1844 8.1844 8.1968 8.1968 8.2682 8.2682 8.4726 8.4726 8.5501 8.5501 8.7611 8.7611 8.8250 8.8250 8.9603 8.9603 8.9689 8.9689 9.2576 9.2576 9.5594 9.5594 9.6165 9.6165 9.6819 9.6819 9.8938 9.8938 9.9379 9.9379 10.0162 10.0162 10.7080 10.7080 11.4792 11.4792 11.4906 11.4906 k = 0.1396 0.3416 0.0000 ( 7375 PWs) bands (ev): -0.1966 -0.1966 3.2946 3.2946 3.3041 3.3041 3.3902 3.3902 3.7228 3.7228 4.3117 4.3117 4.5134 4.5134 4.5247 4.5247 5.3149 5.3149 5.4299 5.4299 7.1360 7.1360 7.1721 7.1721 7.2000 7.2000 7.3792 7.3792 7.3997 7.3997 7.7447 7.7447 8.1678 8.1678 8.1996 8.1996 8.2135 8.2135 8.2868 8.2868 8.4919 8.4919 8.5621 8.5621 8.7506 8.7506 8.8172 8.8172 8.9532 8.9532 8.9624 8.9624 9.2906 9.2906 9.5822 9.5822 9.5832 9.5832 9.6564 9.6564 9.8927 9.8927 9.9351 9.9351 10.0093 10.0093 10.7909 10.7909 11.5147 11.5147 11.5277 11.5277 k = 0.1474 0.3606 0.0000 ( 7383 PWs) bands (ev): -0.1430 -0.1430 3.2800 3.2800 3.3077 3.3077 3.3173 3.3173 3.7472 3.7472 4.3686 4.3686 4.4303 4.4303 4.4420 4.4420 5.3548 5.3548 5.3802 5.3802 7.1219 7.1219 7.1566 7.1566 7.2187 7.2187 7.3984 7.3984 7.4477 7.4477 7.8071 7.8071 8.1644 8.1644 8.1977 8.1977 8.2440 8.2440 8.3062 8.3062 8.5119 8.5119 8.5745 8.5745 8.7374 8.7374 8.8055 8.8055 8.9454 8.9454 8.9545 8.9545 9.3219 9.3219 9.5480 9.5480 9.5852 9.5852 9.6550 9.6550 9.8924 9.8924 9.9322 9.9322 9.9950 9.9950 10.8806 10.8806 11.5536 11.5536 11.5683 11.5683 k = 0.1551 0.3796 0.0000 ( 7375 PWs) bands (ev): -0.0866 -0.0866 3.1717 3.1717 3.3160 3.3160 3.3259 3.3259 3.7690 3.7690 4.3549 4.3549 4.3666 4.3666 4.4288 4.4288 5.3345 5.3345 5.3966 5.3966 7.1066 7.1066 7.1403 7.1403 7.2386 7.2386 7.4185 7.4185 7.4975 7.4975 7.8664 7.8664 8.1570 8.1570 8.1914 8.1914 8.2756 8.2756 8.3265 8.3265 8.5322 8.5322 8.5875 8.5875 8.7215 8.7215 8.7901 8.7901 8.9366 8.9366 8.9451 8.9451 9.3511 9.3511 9.5121 9.5121 9.5601 9.5601 9.6854 9.6854 9.8933 9.8933 9.9278 9.9278 9.9764 9.9764 10.9734 10.9734 11.5958 11.5958 11.6123 11.6123 k = 0.1629 0.3986 0.0000 ( 7375 PWs) bands (ev): -0.0275 -0.0275 3.0649 3.0649 3.3184 3.3184 3.3283 3.3283 3.7873 3.7873 4.2893 4.2893 4.3011 4.3011 4.4914 4.4914 5.2940 5.2940 5.4403 5.4403 7.0906 7.0906 7.1232 7.1232 7.2593 7.2593 7.4393 7.4393 7.5487 7.5487 7.9227 7.9227 8.1459 8.1459 8.1809 8.1809 8.3082 8.3082 8.3477 8.3477 8.5529 8.5529 8.6009 8.6009 8.7034 8.7034 8.7711 8.7711 8.9264 8.9264 8.9340 8.9340 9.3774 9.3774 9.4751 9.4751 9.5270 9.5270 9.7284 9.7284 9.8952 9.8952 9.9176 9.9176 9.9595 9.9595 11.0658 11.0658 11.6410 11.6410 11.6596 11.6596 k = 0.1706 0.4175 0.0000 ( 7375 PWs) bands (ev): 0.0343 0.0343 2.9597 2.9597 3.3129 3.3129 3.3224 3.3224 3.8012 3.8012 4.2353 4.2353 4.2468 4.2468 4.5568 4.5568 5.2599 5.2599 5.4859 5.4859 7.0741 7.0741 7.1057 7.1057 7.2809 7.2809 7.4608 7.4608 7.6010 7.6010 7.9761 7.9761 8.1315 8.1315 8.1667 8.1667 8.3416 8.3416 8.3701 8.3701 8.5734 8.5734 8.6148 8.6148 8.6832 8.6832 8.7489 8.7489 8.9146 8.9146 8.9210 8.9210 9.3997 9.3997 9.4372 9.4372 9.4929 9.4929 9.7780 9.7780 9.8959 9.8959 9.8986 9.8986 9.9512 9.9512 11.1546 11.1546 11.6879 11.6879 11.7099 11.7099 k = 0.1784 0.4365 0.0000 ( 7383 PWs) bands (ev): 0.0988 0.0988 2.8564 2.8564 3.2979 3.2979 3.3067 3.3067 3.8097 3.8097 4.1947 4.1947 4.2055 4.2055 4.6249 4.6249 5.2334 5.2334 5.5334 5.5334 7.0573 7.0573 7.0880 7.0880 7.3033 7.3033 7.4829 7.4829 7.6542 7.6542 8.0266 8.0266 8.1141 8.1141 8.1491 8.1491 8.3749 8.3749 8.3942 8.3942 8.5926 8.5926 8.6290 8.6290 8.6621 8.6621 8.7236 8.7236 8.9012 8.9012 8.9063 8.9063 9.3984 9.3984 9.4117 9.4117 9.4655 9.4655 9.8316 9.8316 9.8659 9.8659 9.9043 9.9043 9.9495 9.9495 11.2369 11.2369 11.6817 11.6818 11.7470 11.7470 k = 0.1861 0.4555 0.0000 ( 7383 PWs) bands (ev): 0.1660 0.1660 2.7549 2.7549 3.2724 3.2724 3.2801 3.2801 3.8120 3.8120 4.1684 4.1684 4.1783 4.1783 4.6958 4.6958 5.2155 5.2155 5.5826 5.5826 7.0404 7.0404 7.0702 7.0702 7.3265 7.3265 7.5058 7.5058 7.7079 7.7079 8.0729 8.0729 8.0953 8.0953 8.1285 8.1285 8.4058 8.4058 8.4222 8.4222 8.6044 8.6044 8.6436 8.6436 8.6462 8.6462 8.6957 8.6957 8.8862 8.8862 8.8900 8.8900 9.3588 9.3588 9.3947 9.3947 9.4642 9.4642 9.8316 9.8316 9.8806 9.8806 9.9207 9.9207 9.9510 9.9510 11.3104 11.3104 11.5778 11.5778 11.6912 11.6912 k = 0.1939 0.4745 0.0000 ( 7383 PWs) bands (ev): 0.2358 0.2358 2.6554 2.6554 3.2363 3.2363 3.2427 3.2427 3.8073 3.8073 4.1566 4.1566 4.1651 4.1651 4.7692 4.7692 5.2070 5.2070 5.6335 5.6335 7.0235 7.0235 7.0525 7.0525 7.3504 7.3504 7.5292 7.5292 7.7617 7.7617 8.0694 8.0694 8.1051 8.1051 8.1212 8.1212 8.4326 8.4326 8.4557 8.4557 8.5929 8.5929 8.6512 8.6512 8.6587 8.6587 8.6654 8.6654 8.8697 8.8697 8.8726 8.8726 9.3185 9.3185 9.3593 9.3593 9.4787 9.4787 9.7951 9.7951 9.9014 9.9014 9.9542 9.9542 9.9708 9.9708 11.3736 11.3736 11.4717 11.4717 11.6265 11.6265 k = 0.2016 0.4935 0.0000 ( 7399 PWs) bands (ev): 0.3081 0.3081 2.5578 2.5578 3.1905 3.1905 3.1955 3.1955 3.7955 3.7955 4.1582 4.1582 4.1652 4.1652 4.8453 4.8453 5.2085 5.2085 5.6861 5.6861 7.0068 7.0068 7.0349 7.0349 7.3750 7.3750 7.5531 7.5531 7.8153 7.8153 8.0448 8.0448 8.0793 8.0793 8.1633 8.1633 8.4576 8.4576 8.4920 8.4920 8.5669 8.5669 8.6330 8.6330 8.6682 8.6682 8.6742 8.6742 8.8518 8.8518 8.8544 8.8544 9.2775 9.2775 9.3194 9.3194 9.4955 9.4955 9.7576 9.7576 9.9106 9.9106 9.9589 9.9589 10.0375 10.0375 11.3668 11.3668 11.4261 11.4261 11.5616 11.5616 k = 0.2094 0.5124 0.0000 ( 7395 PWs) bands (ev): 0.3830 0.3830 2.4624 2.4624 3.1367 3.1367 3.1403 3.1403 3.7764 3.7764 4.1715 4.1715 4.1771 4.1771 4.9239 4.9239 5.2201 5.2201 5.7403 5.7403 6.9902 6.9902 7.0176 7.0176 7.4002 7.4002 7.5775 7.5775 7.8681 7.8681 8.0178 8.0178 8.0514 8.0514 8.2031 8.2031 8.4821 8.4821 8.5298 8.5298 8.5364 8.5364 8.5990 8.5990 8.6860 8.6860 8.6905 8.6905 8.8329 8.8329 8.8362 8.8362 9.2361 9.2361 9.2779 9.2779 9.5120 9.5120 9.7198 9.7198 9.9188 9.9188 9.9647 9.9647 10.1101 10.1101 11.2640 11.2640 11.4662 11.4662 11.4991 11.4991 k = 0.2172 0.5314 0.0000 ( 7407 PWs) bands (ev): 0.4604 0.4604 2.3691 2.3691 3.0765 3.0765 3.0789 3.0789 3.7505 3.7505 4.1946 4.1946 4.1988 4.1988 5.0049 5.0049 5.2414 5.2414 5.7960 5.7960 6.9739 6.9739 7.0006 7.0006 7.4260 7.4260 7.6024 7.6024 7.9195 7.9195 7.9889 7.9889 8.0217 8.0217 8.2399 8.2399 8.5036 8.5036 8.5051 8.5051 8.5650 8.5650 8.5682 8.5682 8.7019 8.7019 8.7071 8.7071 8.8129 8.8129 8.8197 8.8197 9.1941 9.1941 9.2353 9.2353 9.5279 9.5279 9.6825 9.6825 9.9274 9.9274 9.9716 9.9716 10.1866 10.1866 11.1641 11.1641 11.4288 11.4288 11.5055 11.5055 k = 0.2249 0.5504 0.0000 ( 7403 PWs) bands (ev): 0.5402 0.5402 2.2779 2.2779 3.0117 3.0117 3.0132 3.0132 3.7185 3.7185 4.2258 4.2258 4.2288 4.2288 5.0884 5.0884 5.2720 5.2720 5.8531 5.8531 6.9578 6.9578 6.9840 6.9840 7.4524 7.4524 7.6276 7.6276 7.9586 7.9586 7.9686 7.9686 7.9908 7.9908 8.2737 8.2737 8.4692 8.4692 8.5120 8.5120 8.5462 8.5462 8.6068 8.6068 8.7141 8.7141 8.7223 8.7223 8.7923 8.7923 8.8080 8.8080 9.1518 9.1518 9.1920 9.1920 9.5430 9.5430 9.6463 9.6463 9.9369 9.9369 9.9797 9.9797 10.2665 10.2665 11.0678 11.0678 11.3646 11.3646 11.5318 11.5318 k = 0.2327 0.5694 0.0000 ( 7411 PWs) bands (ev): 0.6224 0.6224 2.1889 2.1889 2.9434 2.9434 2.9449 2.9449 3.6811 3.6811 4.2636 4.2636 4.2655 4.2655 5.1742 5.1742 5.3111 5.3111 5.9117 5.9117 6.9421 6.9421 6.9677 6.9677 7.4794 7.4794 7.6531 7.6531 7.9268 7.9268 7.9567 7.9567 8.0165 8.0165 8.3041 8.3041 8.4335 8.4335 8.4813 8.4813 8.5644 8.5644 8.6454 8.6454 8.7163 8.7163 8.7374 8.7374 8.7711 8.7711 8.8060 8.8060 9.1093 9.1093 9.1481 9.1481 9.5571 9.5571 9.6119 9.6119 9.9472 9.9472 9.9888 9.9888 10.3490 10.3490 10.9761 10.9761 11.3003 11.3003 11.5530 11.5530 k = 0.2404 0.5884 0.0000 ( 7387 PWs) bands (ev): 0.7068 0.7068 2.1022 2.1022 2.8730 2.8730 2.8751 2.8751 3.6394 3.6394 4.3068 4.3068 4.3078 4.3078 5.2623 5.2623 5.3578 5.3578 5.9715 5.9715 6.9268 6.9268 6.9519 6.9519 7.5069 7.5069 7.6787 7.6787 7.8941 7.8941 7.9226 7.9226 8.0599 8.0599 8.3303 8.3303 8.3969 8.3969 8.4442 8.4442 8.5892 8.5892 8.6832 8.6832 8.7066 8.7066 8.7501 8.7501 8.7530 8.7530 8.8150 8.8150 9.0670 9.0670 9.1039 9.1039 9.5704 9.5704 9.5798 9.5798 9.9586 9.9586 9.9991 9.9991 10.4332 10.4332 10.8903 10.8903 11.2366 11.2366 11.5700 11.5700 k = 0.2482 0.6073 0.0000 ( 7387 PWs) bands (ev): 0.7935 0.7935 2.0178 2.0178 2.8016 2.8016 2.8044 2.8044 3.5943 3.5943 4.3543 4.3543 4.3549 4.3549 5.3526 5.3526 5.4113 5.4113 6.0325 6.0325 6.9119 6.9119 6.9366 6.9366 7.5347 7.5347 7.7041 7.7041 7.8606 7.8606 7.8872 7.8872 8.0989 8.0989 8.3498 8.3498 8.3597 8.3597 8.4086 8.4086 8.6151 8.6151 8.6898 8.6898 8.7134 8.7134 8.7356 8.7356 8.7686 8.7686 8.8305 8.8305 9.0251 9.0251 9.0594 9.0594 9.5506 9.5506 9.5826 9.5826 9.9710 9.9710 10.0105 10.0105 10.5161 10.5161 10.8136 10.8136 11.1735 11.1735 11.5575 11.5575 k = 0.2559 0.6263 0.0000 ( 7387 PWs) bands (ev): 0.8823 0.8823 1.9357 1.9357 2.7300 2.7300 2.7336 2.7336 3.5467 3.5467 4.4052 4.4052 4.4063 4.4063 5.4451 5.4451 5.4708 5.4708 6.0946 6.0946 6.8973 6.8973 6.9217 6.9217 7.5630 7.5630 7.7285 7.7285 7.8274 7.8274 7.8509 7.8509 8.1326 8.1326 8.3223 8.3223 8.3474 8.3474 8.3905 8.3905 8.6413 8.6413 8.6696 8.6696 8.7014 8.7014 8.7613 8.7613 8.7840 8.7840 8.8490 8.8490 8.9847 8.9847 9.0150 9.0150 9.5250 9.5250 9.5938 9.5938 9.9846 9.9846 10.0232 10.0232 10.5863 10.5863 10.7579 10.7579 11.1113 11.1113 11.4724 11.4724 k = 0.2637 0.6453 0.0000 ( 7411 PWs) bands (ev): 0.9730 0.9730 1.8559 1.8559 2.6588 2.6588 2.6630 2.6630 3.4975 3.4975 4.4592 4.4592 4.4611 4.4611 5.5352 5.5352 5.5398 5.5398 6.1577 6.1577 6.8831 6.8831 6.9072 6.9072 7.5915 7.5915 7.7471 7.7471 7.7993 7.7993 7.8138 7.8138 8.1595 8.1595 8.2851 8.2851 8.3151 8.3151 8.3978 8.3978 8.6479 8.6479 8.6664 8.6664 8.6809 8.6809 8.7916 8.7916 8.7984 8.7984 8.8685 8.8685 8.9485 8.9485 8.9713 8.9713 9.5035 9.5035 9.6038 9.6038 9.9993 9.9993 10.0370 10.0370 10.5992 10.5992 10.7681 10.7681 11.0501 11.0501 11.3892 11.3892 k = 0.2714 0.6643 0.0000 ( 7399 PWs) bands (ev): 1.0656 1.0656 1.7785 1.7785 2.5883 2.5883 2.5932 2.5932 3.4475 3.4475 4.5162 4.5162 4.5187 4.5187 5.6045 5.6045 5.6361 5.6361 6.2217 6.2217 6.8694 6.8694 6.8932 6.8932 7.6202 7.6202 7.7381 7.7381 7.7763 7.7763 7.7984 7.7984 8.1782 8.1782 8.2490 8.2490 8.2770 8.2770 8.4067 8.4067 8.6256 8.6256 8.6561 8.6561 8.6952 8.6952 8.8093 8.8093 8.8108 8.8108 8.8870 8.8870 8.9253 8.9253 8.9310 8.9310 9.4865 9.4865 9.6127 9.6127 10.0154 10.0154 10.0522 10.0522 10.5573 10.5573 10.8417 10.8417 10.9900 10.9900 11.3080 11.3080 k = 0.2792 0.6833 0.0000 ( 7383 PWs) bands (ev): 1.1598 1.1598 1.7035 1.7035 2.5190 2.5190 2.5244 2.5244 3.3974 3.3974 4.5756 4.5756 4.5788 4.5788 5.6776 5.6776 5.7345 5.7345 6.2865 6.2865 6.8559 6.8559 6.8796 6.8796 7.6486 7.6486 7.7065 7.7065 7.7390 7.7390 7.8196 7.8196 8.1837 8.1837 8.2180 8.2180 8.2382 8.2382 8.4121 8.4121 8.6030 8.6030 8.6337 8.6337 8.7214 8.7214 8.7999 8.7999 8.8159 8.8159 8.8866 8.8866 8.9163 8.9163 8.9289 8.9289 9.4744 9.4744 9.6203 9.6203 10.0327 10.0327 10.0687 10.0687 10.5074 10.5074 10.9311 10.9311 10.9322 10.9322 11.2289 11.2289 k = 0.2870 0.7022 0.0000 ( 7402 PWs) bands (ev): 1.2555 1.2555 1.6309 1.6309 2.4510 2.4510 2.4569 2.4569 3.3479 3.3479 4.6372 4.6372 4.6410 4.6410 5.7540 5.7540 5.8347 5.8347 6.3519 6.3519 6.8428 6.8428 6.8663 6.8663 7.6707 7.6707 7.6727 7.6727 7.7058 7.7058 7.8448 7.8448 8.1639 8.1639 8.1996 8.1996 8.2035 8.2035 8.4132 8.4132 8.5804 8.5804 8.6109 8.6109 8.7467 8.7467 8.7699 8.7699 8.8000 8.8000 8.8752 8.8752 8.9329 8.9329 8.9533 8.9533 9.4673 9.4673 9.6268 9.6268 10.0513 10.0513 10.0866 10.0866 10.4616 10.4616 10.8735 10.8735 11.0268 11.0268 11.1518 11.1518 k = 0.2947 0.7212 0.0000 ( 7398 PWs) bands (ev): 1.3522 1.3522 1.5607 1.5607 2.3846 2.3846 2.3910 2.3910 3.2998 3.2998 4.7007 4.7007 4.7052 4.7052 5.8333 5.8333 5.9365 5.9365 6.4179 6.4179 6.8300 6.8300 6.8535 6.8535 7.6338 7.6338 7.6558 7.6558 7.7137 7.7137 7.8708 7.8708 8.1312 8.1312 8.1618 8.1618 8.1924 8.1924 8.4099 8.4099 8.5578 8.5578 8.5880 8.5880 8.7283 8.7283 8.7636 8.7636 8.7754 8.7754 8.8810 8.8810 8.9513 8.9513 8.9850 8.9850 9.4652 9.4652 9.6322 9.6322 10.0714 10.0714 10.1060 10.1060 10.4230 10.4230 10.8173 10.8173 11.0761 11.0761 11.1228 11.1228 k = 0.3025 0.7402 0.0000 ( 7406 PWs) bands (ev): 1.4497 1.4497 1.4930 1.4930 2.3200 2.3200 2.3267 2.3267 3.2537 3.2537 4.7659 4.7659 4.7709 4.7709 5.9150 5.9150 6.0400 6.0400 6.4843 6.4843 6.8176 6.8176 6.8410 6.8410 7.5966 7.5966 7.6192 7.6192 7.7416 7.7416 7.8972 7.8972 8.0970 8.0970 8.1249 8.1249 8.1732 8.1732 8.4025 8.4025 8.5354 8.5354 8.5650 8.5650 8.6866 8.6866 8.7202 8.7202 8.8011 8.8011 8.8929 8.8929 8.9681 8.9681 9.0186 9.0186 9.4680 9.4680 9.6370 9.6370 10.0930 10.0930 10.1270 10.1270 10.3927 10.3927 10.7625 10.7625 11.0034 11.0034 11.2157 11.2157 k = 0.3102 0.7592 0.0000 ( 7414 PWs) bands (ev): 1.4278 1.4278 1.5474 1.5474 2.2572 2.2572 2.2643 2.2643 3.2105 3.2105 4.8326 4.8326 4.8382 4.8382 5.9986 5.9986 6.1449 6.1449 6.5509 6.5509 6.8053 6.8053 6.8289 6.8289 7.5595 7.5595 7.5814 7.5814 7.7709 7.7709 7.9235 7.9235 8.0632 8.0632 8.0890 8.0890 8.1438 8.1438 8.3913 8.3913 8.5132 8.5132 8.5416 8.5416 8.6438 8.6438 8.6748 8.6748 8.8269 8.8269 8.9061 8.9061 8.9822 8.9822 9.0524 9.0524 9.4753 9.4753 9.6414 9.6414 10.1161 10.1161 10.1495 10.1495 10.3712 10.3712 10.7093 10.7093 10.9324 10.9324 11.3035 11.3035 k = 0.3180 0.7782 0.0000 ( 7422 PWs) bands (ev): 1.3650 1.3650 1.6446 1.6446 2.1964 2.1964 2.2039 2.2039 3.1710 3.1710 4.9006 4.9006 4.9068 4.9068 6.0838 6.0838 6.2511 6.2511 6.6175 6.6175 6.7934 6.7934 6.8170 6.8170 7.5226 7.5226 7.5438 7.5438 7.8004 7.8004 7.9497 7.9497 8.0302 8.0302 8.0543 8.0543 8.1039 8.1039 8.3767 8.3767 8.4911 8.4911 8.5174 8.5174 8.6012 8.6012 8.6286 8.6286 8.8523 8.8523 8.9195 8.9195 8.9926 8.9926 9.0854 9.0854 9.4868 9.4868 9.6463 9.6463 10.1408 10.1408 10.1737 10.1737 10.3584 10.3584 10.6577 10.6577 10.8635 10.8635 11.3808 11.3808 k = 0.3257 0.7971 0.0000 ( 7442 PWs) bands (ev): 1.3048 1.3048 1.7404 1.7404 2.1377 2.1377 2.1454 2.1454 3.1365 3.1365 4.9696 4.9696 4.9764 4.9764 6.1702 6.1702 6.3584 6.3584 6.6839 6.6839 6.7816 6.7816 6.8056 6.8056 7.4863 7.4863 7.5066 7.5066 7.8299 7.8299 7.9757 7.9757 7.9980 7.9980 8.0209 8.0209 8.0538 8.0538 8.3592 8.3592 8.4692 8.4692 8.4915 8.4915 8.5603 8.5603 8.5822 8.5822 8.8772 8.8772 8.9322 8.9322 8.9985 8.9985 9.1172 9.1172 9.5018 9.5018 9.6523 9.6523 10.1671 10.1671 10.1996 10.1996 10.3541 10.3541 10.6077 10.6077 10.7966 10.7966 11.4399 11.4399 k = 0.3335 0.8161 0.0000 ( 7442 PWs) bands (ev): 1.2471 1.2471 1.8336 1.8336 2.0812 2.0812 2.0892 2.0892 3.1082 3.1082 5.0396 5.0396 5.0470 5.0470 6.2574 6.2574 6.4668 6.4668 6.7491 6.7491 6.7700 6.7700 6.7954 6.7954 7.4508 7.4508 7.4704 7.4704 7.8591 7.8591 7.9653 7.9653 7.9883 7.9883 7.9953 7.9953 8.0021 8.0021 8.3394 8.3394 8.4470 8.4470 8.4620 8.4620 8.5231 8.5231 8.5362 8.5362 8.9016 8.9016 8.9431 8.9431 9.0000 9.0000 9.1474 9.1474 9.5200 9.5200 9.6603 9.6603 10.1951 10.1951 10.2273 10.2273 10.3580 10.3580 10.5596 10.5596 10.7320 10.7320 11.4719 11.4719 k = 0.3335 0.8161 0.0000 ( 7442 PWs) bands (ev): 1.2471 1.2471 1.8336 1.8336 2.0812 2.0812 2.0892 2.0892 3.1082 3.1082 5.0396 5.0396 5.0470 5.0470 6.2574 6.2574 6.4668 6.4668 6.7491 6.7491 6.7700 6.7700 6.7954 6.7954 7.4508 7.4508 7.4704 7.4704 7.8591 7.8591 7.9653 7.9653 7.9883 7.9883 7.9953 7.9953 8.0021 8.0021 8.3394 8.3394 8.4470 8.4470 8.4620 8.4620 8.5231 8.5231 8.5362 8.5362 8.9016 8.9016 8.9431 8.9431 9.0000 9.0000 9.1474 9.1474 9.5200 9.5200 9.6603 9.6603 10.1951 10.1951 10.2273 10.2273 10.3580 10.3580 10.5596 10.5596 10.7320 10.7320 11.4719 11.4719 k = 0.3305 0.8088 0.0193 ( 7436 PWs) bands (ev): 1.2650 1.2650 1.7977 1.7977 2.1029 2.1029 2.1148 2.1148 3.1232 3.1232 5.0069 5.0069 5.0182 5.0182 6.2287 6.2287 6.4279 6.4279 6.7109 6.7109 6.7779 6.7779 6.8040 6.8040 7.4615 7.4615 7.4814 7.4814 7.8465 7.8465 7.9765 7.9765 7.9919 7.9919 8.0006 8.0006 8.0197 8.0197 8.3448 8.3448 8.4579 8.4579 8.4783 8.4783 8.5370 8.5370 8.5530 8.5530 8.8917 8.8917 8.9413 8.9413 9.0012 9.0012 9.1371 9.1371 9.5137 9.5137 9.6569 9.6569 10.1758 10.1758 10.2101 10.2101 10.3681 10.3681 10.5783 10.5783 10.7525 10.7525 11.4658 11.4658 k = 0.3275 0.8015 0.0386 ( 7419 PWs) bands (ev): 1.2754 1.2754 1.7620 1.7620 2.1196 2.1196 2.1535 2.1535 3.1493 3.1493 4.9577 4.9577 4.9916 4.9916 6.2091 6.2091 6.3960 6.3960 6.6631 6.6631 6.7823 6.7823 6.8156 6.8156 7.4659 7.4659 7.4875 7.4875 7.8328 7.8328 7.9812 7.9812 7.9883 7.9883 8.0082 8.0082 8.0457 8.0457 8.3476 8.3476 8.4699 8.4699 8.5025 8.5025 8.5516 8.5516 8.5681 8.5681 8.8804 8.8804 8.9433 8.9433 9.0045 9.0045 9.1288 9.1288 9.5103 9.5103 9.6532 9.6532 10.1408 10.1408 10.1912 10.1912 10.3934 10.3934 10.5976 10.5976 10.7649 10.7649 11.4605 11.4605 k = 0.3245 0.7942 0.0579 ( 7412 PWs) bands (ev): 1.2796 1.2796 1.7275 1.7275 2.1302 2.1302 2.2042 2.2042 3.1861 3.1861 4.8935 4.8935 4.9667 4.9667 6.1957 6.1957 6.3736 6.3736 6.6108 6.6108 6.7833 6.7833 6.8249 6.8249 7.4625 7.4625 7.4898 7.4898 7.8199 7.8199 7.9780 7.9780 7.9911 7.9911 8.0138 8.0138 8.0723 8.0723 8.3509 8.3509 8.4804 8.4804 8.5298 8.5298 8.5678 8.5678 8.5815 8.5815 8.8678 8.8678 8.9495 8.9495 9.0095 9.0095 9.1229 9.1229 9.5100 9.5100 9.6489 9.6489 10.0986 10.0986 10.1740 10.1740 10.4230 10.4230 10.6168 10.6168 10.7689 10.7689 11.4569 11.4569 k = 0.3216 0.7869 0.0772 ( 7408 PWs) bands (ev): 1.2788 1.2788 1.6947 1.6947 2.1357 2.1357 2.2648 2.2648 3.2329 3.2329 4.8166 4.8166 4.9428 4.9428 6.1840 6.1840 6.3643 6.3643 6.5552 6.5552 6.7816 6.7816 6.8298 6.8298 7.4511 7.4511 7.4894 7.4894 7.8091 7.8091 7.9744 7.9744 7.9939 7.9939 8.0181 8.0181 8.0990 8.0990 8.3554 8.3554 8.4897 8.4897 8.5499 8.5499 8.5902 8.5902 8.5943 8.5943 8.8538 8.8538 8.9600 8.9600 9.0161 9.0161 9.1199 9.1199 9.5131 9.5131 9.6431 9.6431 10.0566 10.0566 10.1567 10.1567 10.4524 10.4524 10.6350 10.6350 10.7651 10.7651 11.4564 11.4564 k = 0.3186 0.7796 0.0965 ( 7394 PWs) bands (ev): 1.2743 1.2743 1.6641 1.6641 2.1367 2.1367 2.3338 2.3338 3.2886 3.2886 4.7292 4.7292 4.9200 4.9200 6.1700 6.1700 6.3701 6.3701 6.4967 6.4967 6.7773 6.7773 6.8291 6.8291 7.4328 7.4328 7.4867 7.4867 7.8014 7.8014 7.9710 7.9710 7.9961 7.9961 8.0224 8.0224 8.1253 8.1253 8.3609 8.3609 8.4977 8.4977 8.5588 8.5588 8.6025 8.6025 8.6240 8.6240 8.8385 8.8385 8.9745 8.9745 9.0240 9.0240 9.1201 9.1201 9.5201 9.5201 9.6350 9.6350 10.0183 10.0183 10.1388 10.1388 10.4801 10.4801 10.6508 10.6508 10.7540 10.7540 11.4604 11.4604 k = 0.3156 0.7723 0.1157 ( 7401 PWs) bands (ev): 1.2675 1.2675 1.6356 1.6356 2.1340 2.1340 2.4097 2.4097 3.3522 3.3522 4.6336 4.6336 4.8982 4.8982 6.1527 6.1527 6.3901 6.3901 6.4357 6.4357 6.7703 6.7703 6.8222 6.8222 7.4090 7.4090 7.4827 7.4827 7.7970 7.7970 7.9671 7.9671 7.9984 7.9984 8.0277 8.0277 8.1506 8.1506 8.3667 8.3667 8.5042 8.5042 8.5611 8.5611 8.6102 8.6102 8.6586 8.6586 8.8217 8.8217 8.9922 8.9922 9.0334 9.0334 9.1237 9.1237 9.5310 9.5310 9.6236 9.6236 9.9861 9.9861 10.1203 10.1203 10.5056 10.5056 10.6626 10.6626 10.7369 10.7369 11.4703 11.4703 k = 0.3126 0.7650 0.1350 ( 7397 PWs) bands (ev): 1.2594 1.2594 1.6096 1.6096 2.1287 2.1287 2.4916 2.4916 3.4223 3.4223 4.5318 4.5318 4.8773 4.8773 6.1336 6.1336 6.3722 6.3722 6.4214 6.4214 6.7602 6.7602 6.8086 6.8086 7.3812 7.3812 7.4784 7.4784 7.7959 7.7959 7.9625 7.9625 8.0011 8.0011 8.0348 8.0348 8.1745 8.1745 8.3722 8.3722 8.5090 8.5090 8.5594 8.5594 8.6152 8.6152 8.6927 8.6927 8.8034 8.8034 9.0120 9.0120 9.0448 9.0448 9.1311 9.1311 9.5458 9.5458 9.6086 9.6086 9.9617 9.9617 10.1012 10.1012 10.5289 10.5289 10.6691 10.6691 10.7149 10.7149 11.4875 11.4875 k = 0.3096 0.7577 0.1543 ( 7400 PWs) bands (ev): 1.2509 1.2509 1.5858 1.5858 2.1215 2.1215 2.5785 2.5785 3.4980 3.4980 4.4255 4.4255 4.8574 4.8574 6.1141 6.1141 6.3068 6.3068 6.4603 6.4603 6.7470 6.7470 6.7884 6.7884 7.3507 7.3507 7.4751 7.4751 7.7975 7.7975 7.9569 7.9569 8.0046 8.0046 8.0438 8.0438 8.1967 8.1967 8.3769 8.3769 8.5119 8.5119 8.5552 8.5552 8.6171 8.6171 8.7251 8.7251 8.7836 8.7836 9.0319 9.0319 9.0594 9.0594 9.1418 9.1418 9.5639 9.5639 9.5905 9.5905 9.9456 9.9456 10.0817 10.0817 10.5499 10.5499 10.6692 10.6692 10.6893 10.6893 11.5126 11.5126 k = 0.3067 0.7504 0.1736 ( 7402 PWs) bands (ev): 1.2426 1.2426 1.5645 1.5645 2.1130 2.1130 2.6695 2.6695 3.5781 3.5781 4.3163 4.3163 4.8384 4.8384 6.0956 6.0956 6.2394 6.2394 6.5038 6.5038 6.7305 6.7305 6.7622 6.7622 7.3187 7.3187 7.4736 7.4736 7.8014 7.8014 7.9504 7.9504 8.0092 8.0092 8.0543 8.0543 8.2170 8.2170 8.3803 8.3803 8.5128 8.5128 8.5491 8.5491 8.6156 8.6156 8.7539 8.7539 8.7640 8.7640 9.0497 9.0497 9.0791 9.0791 9.1555 9.1555 9.5676 9.5676 9.5877 9.5877 9.9378 9.9378 10.0618 10.0618 10.5683 10.5683 10.6589 10.6589 10.6659 10.6659 11.5457 11.5457 k = 0.3037 0.7431 0.1929 ( 7390 PWs) bands (ev): 1.2350 1.2350 1.5457 1.5457 2.1039 2.1039 2.7641 2.7641 3.6618 3.6618 4.2055 4.2055 4.8203 4.8203 6.0788 6.0788 6.1702 6.1702 6.5481 6.5481 6.7116 6.7116 6.7315 6.7315 7.2865 7.2865 7.4744 7.4744 7.8071 7.8071 7.9432 7.9432 8.0154 8.0154 8.0659 8.0659 8.2350 8.2350 8.3821 8.3821 8.5114 8.5114 8.5417 8.5417 8.6104 8.6104 8.7398 8.7398 8.7845 8.7845 9.0653 9.0653 9.1036 9.1036 9.1714 9.1714 9.5466 9.5466 9.6113 9.6113 9.9373 9.9373 10.0418 10.0418 10.5819 10.5819 10.6310 10.6310 10.6553 10.6553 11.5858 11.5858 k = 0.3007 0.7358 0.2122 ( 7381 PWs) bands (ev): 1.2285 1.2285 1.5293 1.5293 2.0945 2.0945 2.8617 2.8617 3.7477 3.7477 4.0946 4.0946 4.8029 4.8029 6.0641 6.0641 6.0995 6.0995 6.5852 6.5852 6.6869 6.6869 6.7069 6.7069 7.2550 7.2550 7.4774 7.4774 7.8141 7.8141 7.9354 7.9354 8.0234 8.0234 8.0781 8.0781 8.2508 8.2508 8.3822 8.3822 8.5074 8.5074 8.5334 8.5334 8.6015 8.6015 8.7174 8.7174 8.8110 8.8110 9.0805 9.0805 9.1307 9.1307 9.1884 9.1884 9.5262 9.5262 9.6371 9.6371 9.9432 9.9432 10.0218 10.0218 10.5835 10.5835 10.6032 10.6032 10.6490 10.6490 11.6050 11.6050 k = 0.2977 0.7285 0.2315 ( 7385 PWs) bands (ev): 1.2235 1.2235 1.5153 1.5153 2.0850 2.0850 2.9620 2.9620 3.8319 3.8319 3.9880 3.9880 4.7863 4.7863 6.0268 6.0268 6.0524 6.0524 6.5956 6.5956 6.6494 6.6494 6.7144 6.7144 7.2252 7.2252 7.4825 7.4825 7.8222 7.8222 7.9271 7.9271 8.0330 8.0330 8.0907 8.0907 8.2642 8.2642 8.3804 8.3804 8.5005 8.5005 8.5243 8.5243 8.5887 8.5887 8.6952 8.6952 8.8363 8.8363 9.0964 9.0964 9.1589 9.1589 9.2056 9.2056 9.5086 9.5086 9.6633 9.6633 9.9544 9.9544 10.0022 10.0022 10.5652 10.5652 10.5786 10.5786 10.6540 10.6540 11.5801 11.5801 k = 0.2947 0.7213 0.2508 ( 7394 PWs) bands (ev): 1.2202 1.2202 1.5037 1.5037 2.0757 2.0757 3.0644 3.0644 3.8495 3.8495 3.9506 3.9506 4.7704 4.7704 5.9534 5.9534 6.0429 6.0429 6.5743 6.5743 6.6074 6.6074 6.7507 6.7507 7.1980 7.1980 7.4892 7.4892 7.8311 7.8311 7.9186 7.9186 8.0444 8.0444 8.1033 8.1033 8.2755 8.2755 8.3769 8.3769 8.4901 8.4901 8.5147 8.5147 8.5722 8.5722 8.6740 8.6740 8.8609 8.8609 9.1137 9.1137 9.1867 9.1867 9.2225 9.2225 9.4953 9.4953 9.6884 9.6884 9.9693 9.9693 9.9840 9.9840 10.5395 10.5395 10.5506 10.5506 10.6669 10.6669 11.5459 11.5459 k = 0.2917 0.7140 0.2701 ( 7395 PWs) bands (ev): 1.2187 1.2187 1.4944 1.4944 2.0665 2.0665 3.1687 3.1687 3.7515 3.7515 4.0315 4.0315 4.7551 4.7551 5.8788 5.8788 6.0364 6.0364 6.5375 6.5375 6.5635 6.5635 6.7964 6.7964 7.1747 7.1747 7.4972 7.4972 7.8407 7.8407 7.9102 7.9102 8.0573 8.0573 8.1156 8.1156 8.2847 8.2847 8.3717 8.3717 8.4757 8.4757 8.5045 8.5045 8.5533 8.5533 8.6542 8.6542 8.8851 8.8851 9.1324 9.1324 9.2110 9.2110 9.2407 9.2407 9.4871 9.4871 9.7109 9.7109 9.9624 9.9624 9.9926 9.9926 10.5133 10.5133 10.5199 10.5199 10.6827 10.6827 11.5043 11.5043 k = 0.2888 0.7067 0.2894 ( 7397 PWs) bands (ev): 1.2193 1.2193 1.4875 1.4875 2.0575 2.0575 3.2744 3.2744 3.6461 3.6461 4.1227 4.1227 4.7403 4.7403 5.8033 5.8033 6.0329 6.0329 6.4934 6.4934 6.5186 6.5186 6.8411 6.8411 7.1572 7.1572 7.5060 7.5060 7.8507 7.8507 7.9020 7.9020 8.0716 8.0716 8.1271 8.1271 8.2922 8.2922 8.3650 8.3650 8.4565 8.4565 8.4938 8.4938 8.5336 8.5336 8.6357 8.6357 8.9093 8.9093 9.1525 9.1525 9.2271 9.2271 9.2640 9.2640 9.4843 9.4843 9.7290 9.7290 9.9450 9.9450 10.0162 10.0162 10.4793 10.4793 10.4982 10.4982 10.6996 10.6996 11.4569 11.4569 k = 0.2858 0.6994 0.3086 ( 7389 PWs) bands (ev): 1.2219 1.2219 1.4828 1.4828 2.0485 2.0485 3.3811 3.3811 3.5424 3.5424 4.2153 4.2153 4.7260 4.7260 5.7272 5.7272 6.0325 6.0325 6.4450 6.4450 6.4735 6.4735 6.8778 6.8778 7.1495 7.1495 7.5154 7.5154 7.8609 7.8609 7.8944 7.8944 8.0870 8.0870 8.1375 8.1375 8.2982 8.2982 8.3570 8.3570 8.4324 8.4324 8.4826 8.4826 8.5148 8.5148 8.6181 8.6181 8.9339 8.9339 9.1737 9.1737 9.2359 9.2359 9.2920 9.2920 9.4862 9.4862 9.7412 9.7412 9.9283 9.9283 10.0428 10.0428 10.4426 10.4426 10.4840 10.4840 10.7168 10.7168 11.4051 11.4051 k = 0.2828 0.6921 0.3279 ( 7393 PWs) bands (ev): 1.2268 1.2268 1.4802 1.4802 2.0392 2.0392 3.4418 3.4418 3.4889 3.4889 4.3076 4.3076 4.7119 4.7119 5.6508 5.6508 6.0353 6.0353 6.3934 6.3934 6.4295 6.4295 6.8999 6.8999 7.1566 7.1566 7.5250 7.5250 7.8699 7.8699 7.8889 7.8889 8.1035 8.1035 8.1460 8.1460 8.3031 8.3031 8.3478 8.3478 8.4047 8.4047 8.4709 8.4709 8.4976 8.4976 8.6010 8.6010 8.9590 8.9590 9.1951 9.1951 9.2413 9.2413 9.3216 9.3216 9.4917 9.4917 9.7465 9.7465 9.9125 9.9125 10.0702 10.0702 10.4075 10.4075 10.4768 10.4768 10.7342 10.7342 11.3504 11.3504 k = 0.2798 0.6848 0.3472 ( 7388 PWs) bands (ev): 1.2340 1.2340 1.4795 1.4795 2.0292 2.0292 3.3462 3.3462 3.5964 3.5964 4.3987 4.3987 4.6980 4.6980 5.5743 5.5743 6.0413 6.0413 6.3396 6.3396 6.3873 6.3873 6.9034 6.9034 7.1812 7.1812 7.5346 7.5346 7.8728 7.8728 7.8906 7.8906 8.1206 8.1206 8.1517 8.1517 8.3071 8.3071 8.3373 8.3373 8.3761 8.3761 8.4588 8.4588 8.4817 8.4817 8.5839 8.5839 8.9847 8.9847 9.2135 9.2135 9.2482 9.2482 9.3516 9.3516 9.4997 9.4997 9.7446 9.7446 9.8971 9.8971 10.0948 10.0948 10.3786 10.3786 10.4772 10.4772 10.7515 10.7515 11.2940 11.2940 k = 0.2768 0.6775 0.3665 ( 7387 PWs) bands (ev): 1.2435 1.2435 1.4806 1.4806 2.0182 2.0182 3.2560 3.2560 3.7038 3.7038 4.4877 4.4877 4.6841 4.6841 5.4982 5.4982 6.0505 6.0505 6.2848 6.2848 6.3477 6.3477 6.8908 6.8908 7.2201 7.2201 7.5441 7.5441 7.8693 7.8693 7.8996 7.8996 8.1373 8.1373 8.1534 8.1534 8.3101 8.3101 8.3249 8.3249 8.3512 8.3512 8.4464 8.4464 8.4668 8.4668 8.5666 8.5666 9.0109 9.0109 9.2232 9.2232 9.2630 9.2630 9.3814 9.3814 9.5091 9.5091 9.7366 9.7366 9.8811 9.8811 10.1098 10.1098 10.3627 10.3627 10.4853 10.4853 10.7687 10.7687 11.2369 11.2369 k = 0.2739 0.6702 0.3858 ( 7402 PWs) bands (ev): 1.2554 1.2554 1.4831 1.4831 2.0056 2.0056 3.1724 3.1724 3.8104 3.8104 4.5737 4.5737 4.6702 4.6702 5.4229 5.4229 6.0625 6.0625 6.2302 6.2302 6.3111 6.3111 6.8671 6.8671 7.2675 7.2675 7.5533 7.5533 7.8653 7.8653 7.9102 7.9102 8.1423 8.1423 8.1598 8.1598 8.3053 8.3053 8.3160 8.3160 8.3351 8.3351 8.4339 8.4339 8.4527 8.4527 8.5490 8.5490 9.0377 9.0377 9.2250 9.2250 9.2850 9.2850 9.4108 9.4108 9.5197 9.5197 9.7237 9.7237 9.8637 9.8637 10.1080 10.1080 10.3676 10.3676 10.5006 10.5006 10.7856 10.7856 11.1801 11.1801 k = 0.2709 0.6629 0.4051 ( 7400 PWs) bands (ev): 1.2697 1.2697 1.4866 1.4866 1.9910 1.9910 3.0964 3.0964 3.9153 3.9153 4.6523 4.6523 4.6592 4.6592 5.3490 5.3490 6.0765 6.0765 6.1778 6.1778 6.2783 6.2783 6.8361 6.8361 7.3192 7.3192 7.5622 7.5622 7.8622 7.8622 7.9209 7.9209 8.1267 8.1267 8.1769 8.1769 8.2920 8.2920 8.3134 8.3134 8.3295 8.3295 8.4214 8.4214 8.4393 8.4393 8.5310 8.5310 9.0647 9.0647 9.2238 9.2238 9.3091 9.3091 9.4393 9.4393 9.5313 9.5313 9.7077 9.7077 9.8445 9.8445 10.0881 10.0881 10.3942 10.3942 10.5222 10.5222 10.8022 10.8022 11.1242 11.1242 k = 0.2679 0.6556 0.4244 ( 7395 PWs) bands (ev): 1.2865 1.2865 1.4904 1.4904 1.9741 1.9741 3.0293 3.0293 4.0177 4.0177 4.6409 4.6409 4.7323 4.7323 5.2771 5.2771 6.0871 6.0871 6.1340 6.1340 6.2496 6.2496 6.8005 6.8005 7.3726 7.3726 7.5706 7.5706 7.8605 7.8605 7.9309 7.9309 8.1000 8.1000 8.1947 8.1947 8.2831 8.2831 8.3077 8.3077 8.3317 8.3317 8.4094 8.4094 8.4269 8.4269 8.5126 8.5126 9.0917 9.0917 9.2216 9.2216 9.3326 9.3326 9.4667 9.4667 9.5444 9.5444 9.6899 9.6899 9.8236 9.8236 10.0562 10.0562 10.4369 10.4369 10.5491 10.5491 10.8184 10.8184 11.0698 11.0698 k = 0.2649 0.6483 0.4437 ( 7389 PWs) bands (ev): 1.3058 1.3058 1.4937 1.4937 1.9551 1.9551 2.9719 2.9719 4.1161 4.1161 4.6257 4.6257 4.8018 4.8018 5.2083 5.2083 6.0656 6.0656 6.1282 6.1282 6.2258 6.2258 6.7620 6.7620 7.4257 7.4257 7.5785 7.5785 7.8604 7.8604 7.9401 7.9401 8.0653 8.0653 8.2121 8.2121 8.2786 8.2786 8.3022 8.3022 8.3369 8.3369 8.3982 8.3982 8.4158 8.4158 8.4939 8.4939 9.1181 9.1181 9.2190 9.2190 9.3540 9.3540 9.4926 9.4926 9.5596 9.5596 9.6722 9.6722 9.8016 9.8016 10.0182 10.0182 10.4894 10.4894 10.5799 10.5799 10.8339 10.8339 11.0175 11.0175 k = 0.2619 0.6410 0.4630 ( 7387 PWs) bands (ev): 1.3275 1.3275 1.4950 1.4950 1.9345 1.9345 2.9252 2.9252 4.2088 4.2088 4.6098 4.6098 4.8628 4.8628 5.1440 5.1440 6.0271 6.0271 6.1456 6.1456 6.2075 6.2075 6.7226 6.7226 7.4772 7.4772 7.5858 7.5858 7.8621 7.8621 7.9479 7.9479 8.0256 8.0256 8.2283 8.2283 8.2763 8.2763 8.2982 8.2982 8.3432 8.3432 8.3883 8.3883 8.4066 8.4066 8.4748 8.4748 9.1432 9.1432 9.2161 9.2161 9.3718 9.3718 9.5161 9.5161 9.5770 9.5770 9.6565 9.6565 9.7791 9.7791 9.9780 9.9780 10.5479 10.5479 10.6135 10.6135 10.8486 10.8486 10.9681 10.9681 k = 0.2589 0.6337 0.4823 ( 7399 PWs) bands (ev): 1.3517 1.3517 1.4924 1.4924 1.9140 1.9140 2.8894 2.8894 4.2926 4.2926 4.5936 4.5936 4.9134 4.9134 5.0863 5.0863 5.9928 5.9928 6.1638 6.1638 6.1964 6.1964 6.6847 6.6847 7.5251 7.5251 7.5924 7.5924 7.8654 7.8654 7.9541 7.9541 7.9840 7.9840 8.2428 8.2428 8.2747 8.2747 8.2955 8.2955 8.3498 8.3498 8.3807 8.3807 8.4001 8.4001 8.4556 8.4556 9.1658 9.1658 9.2131 9.2131 9.3853 9.3853 9.5356 9.5356 9.5954 9.5954 9.6462 9.6462 9.7571 9.7571 9.9387 9.9387 10.6097 10.6097 10.6486 10.6486 10.8617 10.8617 10.9228 10.9228 k = 0.2560 0.6264 0.5016 ( 7402 PWs) bands (ev): 1.3784 1.3784 1.4838 1.4838 1.8962 1.8962 2.8645 2.8645 4.3628 4.3628 4.5782 4.5782 4.9519 4.9519 5.0383 5.0383 5.9665 5.9665 6.1744 6.1744 6.1963 6.1963 6.6518 6.6518 7.5665 7.5665 7.5983 7.5983 7.8703 7.8703 7.9436 7.9436 7.9587 7.9587 8.2548 8.2548 8.2734 8.2734 8.2932 8.2932 8.3558 8.3558 8.3765 8.3765 8.3973 8.3973 8.4367 8.4367 9.1848 9.1848 9.2102 9.2102 9.3943 9.3943 9.5486 9.5486 9.6113 9.6113 9.6457 9.6457 9.7371 9.7371 9.9036 9.9036 10.6696 10.6696 10.6864 10.6864 10.8680 10.8680 10.8871 10.8871 k = 0.2530 0.6191 0.5208 ( 7410 PWs) bands (ev): 1.4076 1.4076 1.4665 1.4665 1.8838 1.8838 2.8501 2.8501 4.4110 4.4110 4.5669 4.5669 4.9769 4.9769 5.0046 5.0046 5.9503 5.9503 6.1779 6.1779 6.2023 6.2023 6.6286 6.6286 7.5958 7.5958 7.6037 7.6037 7.8757 7.8757 7.9110 7.9110 7.9612 7.9612 8.2638 8.2638 8.2722 8.2722 8.2907 8.2907 8.3598 8.3598 8.3765 8.3765 8.3987 8.3987 8.4191 8.4191 9.1984 9.1984 9.2072 9.2072 9.3992 9.3992 9.5541 9.5541 9.6221 9.6221 9.6540 9.6540 9.7216 9.7216 9.8774 9.8774 10.7054 10.7054 10.7416 10.7416 10.8474 10.8474 10.8764 10.8764 k = 0.2500 0.6118 0.5401 ( 7416 PWs) bands (ev): 1.4370 1.4370 1.4412 1.4412 1.8793 1.8793 2.8455 2.8455 4.4277 4.4277 4.5635 4.5635 4.9874 4.9874 4.9903 4.9903 5.9448 5.9448 6.1805 6.1805 6.2036 6.2036 6.6201 6.6201 7.6043 7.6043 7.6087 7.6087 7.8784 7.8784 7.8974 7.8974 7.9620 7.9620 8.2678 8.2678 8.2712 8.2712 8.2893 8.2893 8.3613 8.3613 8.3782 8.3782 8.4018 8.4018 8.4089 8.4089 9.2043 9.2043 9.2052 9.2052 9.4007 9.4007 9.5550 9.5550 9.6266 9.6266 9.6592 9.6592 9.7152 9.7152 9.8673 9.8673 10.7176 10.7176 10.7862 10.7862 10.8287 10.8287 10.8568 10.8568 k = 0.2500 0.6118 0.5401 ( 7416 PWs) bands (ev): 1.4370 1.4370 1.4412 1.4412 1.8793 1.8793 2.8455 2.8455 4.4277 4.4277 4.5635 4.5635 4.9874 4.9874 4.9903 4.9903 5.9448 5.9448 6.1805 6.1805 6.2036 6.2036 6.6201 6.6201 7.6043 7.6043 7.6087 7.6087 7.8784 7.8784 7.8974 7.8974 7.9620 7.9620 8.2678 8.2678 8.2712 8.2712 8.2893 8.2893 8.3613 8.3613 8.3782 8.3782 8.4018 8.4018 8.4089 8.4089 9.2043 9.2043 9.2052 9.2052 9.4007 9.4007 9.5550 9.5550 9.6266 9.6266 9.6592 9.6592 9.7152 9.7152 9.8673 9.8673 10.7176 10.7176 10.7862 10.7862 10.8287 10.8287 10.8568 10.8568 k = 0.2368 0.6172 0.5259 ( 7414 PWs) bands (ev): 1.4342 1.4342 1.4392 1.4392 1.8854 1.8854 2.8488 2.8488 4.4163 4.4163 4.5600 4.5600 4.9890 4.9890 4.9936 4.9936 5.9514 5.9514 6.1772 6.1772 6.2017 6.2017 6.6292 6.6292 7.5965 7.5965 7.6014 7.6014 7.8837 7.8837 7.9046 7.9046 7.9614 7.9614 8.2643 8.2643 8.2721 8.2721 8.2907 8.2907 8.3606 8.3606 8.3763 8.3763 8.4023 8.4023 8.4149 8.4149 9.2020 9.2020 9.2030 9.2030 9.3995 9.3995 9.5542 9.5542 9.6194 9.6194 9.6561 9.6561 9.7210 9.7210 9.8781 9.8781 10.7049 10.7049 10.7388 10.7388 10.8439 10.8439 10.8955 10.8955 k = 0.2237 0.6225 0.5117 ( 7400 PWs) bands (ev): 1.4243 1.4243 1.4357 1.4357 1.9031 1.9031 2.8587 2.8587 4.3837 4.3837 4.5498 4.5498 4.9914 4.9914 5.0043 5.0043 5.9708 5.9708 6.1624 6.1624 6.2033 6.2033 6.6540 6.6540 7.5736 7.5736 7.5826 7.5826 7.8981 7.8981 7.9213 7.9213 7.9618 7.9618 8.2567 8.2567 8.2728 8.2728 8.2932 8.2932 8.3572 8.3572 8.3760 8.3760 8.4051 8.4051 8.4275 8.4275 9.1953 9.1953 9.1966 9.1966 9.3958 9.3958 9.5525 9.5525 9.5934 9.5934 9.6612 9.6612 9.7313 9.7313 9.9069 9.9069 10.6654 10.6654 10.6836 10.6836 10.8530 10.8530 10.9528 10.9528 k = 0.2105 0.6279 0.4975 ( 7398 PWs) bands (ev): 1.4084 1.4084 1.4308 1.4308 1.9308 1.9308 2.8751 2.8751 4.3339 4.3339 4.5333 4.5333 4.9938 4.9938 5.0191 5.0191 6.0024 6.0024 6.1379 6.1379 6.2118 6.2118 6.6896 6.6896 7.5404 7.5404 7.5558 7.5558 7.9181 7.9181 7.9321 7.9321 7.9745 7.9745 8.2467 8.2467 8.2734 8.2734 8.2952 8.2952 8.3517 8.3517 8.3811 8.3811 8.4101 8.4101 8.4427 8.4427 9.1844 9.1844 9.1863 9.1863 9.3892 9.3892 9.5491 9.5491 9.5593 9.5593 9.6751 9.6751 9.7412 9.7412 9.9470 9.9470 10.6034 10.6034 10.6443 10.6443 10.8612 10.8612 10.9858 10.9858 k = 0.1974 0.6333 0.4833 ( 7390 PWs) bands (ev): 1.3887 1.3887 1.4245 1.4245 1.9668 1.9668 2.8976 2.8976 4.2710 4.2710 4.5113 4.5113 4.9953 4.9953 5.0347 5.0347 6.0447 6.0447 6.1110 6.1110 6.2251 6.2251 6.7309 6.7309 7.5018 7.5018 7.5231 7.5231 7.9248 7.9248 7.9452 7.9452 8.0038 8.0038 8.2348 8.2348 8.2736 8.2736 8.2957 8.2957 8.3470 8.3470 8.3904 8.3904 8.4170 8.4170 8.4594 8.4594 9.1700 9.1700 9.1726 9.1726 9.3798 9.3798 9.5148 9.5148 9.5543 9.5543 9.6936 9.6936 9.7512 9.7512 9.9929 9.9929 10.5412 10.5412 10.6056 10.6056 10.8697 10.8697 11.0196 11.0196 k = 0.1842 0.6387 0.4691 ( 7392 PWs) bands (ev): 1.3670 1.3670 1.4168 1.4168 2.0094 2.0094 2.9261 2.9261 4.1987 4.1987 4.4844 4.4844 4.9944 4.9944 5.0488 5.0488 6.0816 6.0816 6.1010 6.1010 6.2425 6.2425 6.7735 6.7735 7.4614 7.4614 7.4865 7.4865 7.9146 7.9146 7.9708 7.9708 8.0388 8.0388 8.2211 8.2211 8.2734 8.2734 8.2950 8.2950 8.3439 8.3439 8.4030 8.4030 8.4255 8.4255 8.4771 8.4771 9.1527 9.1527 9.1560 9.1560 9.3676 9.3676 9.4732 9.4732 9.5574 9.5574 9.7148 9.7148 9.7616 9.7616 10.0408 10.0408 10.4818 10.4818 10.5682 10.5682 10.8797 10.8797 11.0535 11.0535 k = 0.1711 0.6441 0.4549 ( 7388 PWs) bands (ev): 1.3444 1.3444 1.4081 1.4081 2.0576 2.0576 2.9601 2.9601 4.1197 4.1197 4.4533 4.4533 4.9902 4.9902 5.0605 5.0605 6.0646 6.0646 6.1579 6.1579 6.2634 6.2634 6.8138 6.8138 7.4220 7.4220 7.4471 7.4471 7.9009 7.9009 7.9974 7.9974 8.0746 8.0746 8.2060 8.2060 8.2729 8.2729 8.2934 8.2934 8.3425 8.3425 8.4179 8.4179 8.4361 8.4361 8.4956 8.4956 9.1330 9.1330 9.1371 9.1371 9.3529 9.3529 9.4311 9.4311 9.5625 9.5625 9.7378 9.7378 9.7727 9.7727 10.0875 10.0875 10.4257 10.4257 10.5344 10.5344 10.8921 10.8921 11.0860 11.0860 k = 0.1579 0.6494 0.4406 ( 7392 PWs) bands (ev): 1.3219 1.3219 1.3987 1.3987 2.1103 2.1103 2.9993 2.9993 4.0361 4.0361 4.4181 4.4181 4.9819 4.9819 5.0693 5.0693 6.0524 6.0524 6.2229 6.2229 6.2878 6.2878 6.8482 6.8482 7.3864 7.3864 7.4060 7.4060 7.8852 7.8852 8.0236 8.0236 8.1092 8.1092 8.1901 8.1901 8.2724 8.2724 8.2917 8.2917 8.3423 8.3423 8.4335 8.4335 8.4499 8.4499 8.5146 8.5146 9.1114 9.1114 9.1164 9.1164 9.3357 9.3357 9.3894 9.3894 9.5693 9.5693 9.7617 9.7617 9.7845 9.7845 10.1296 10.1296 10.3734 10.3734 10.5066 10.5066 10.9079 10.9079 11.1163 11.1163 k = 0.1447 0.6548 0.4264 ( 7386 PWs) bands (ev): 1.3000 1.3000 1.3889 1.3889 2.1669 2.1669 3.0433 3.0433 3.9492 3.9492 4.3793 4.3793 4.9694 4.9694 5.0756 5.0756 6.0487 6.0487 6.2908 6.2908 6.3162 6.3162 6.8730 6.8730 7.3569 7.3569 7.3647 7.3647 7.8680 7.8680 8.0481 8.0481 8.1395 8.1395 8.1754 8.1754 8.2725 8.2725 8.2904 8.2904 8.3430 8.3430 8.4482 8.4482 8.4680 8.4680 8.5341 8.5341 9.0885 9.0885 9.0944 9.0944 9.3151 9.3151 9.3497 9.3497 9.5773 9.5773 9.7849 9.7849 9.7981 9.7981 10.1630 10.1630 10.3255 10.3255 10.4879 10.4879 10.9279 10.9279 11.1441 11.1441 k = 0.1316 0.6602 0.4122 ( 7384 PWs) bands (ev): 1.2792 1.2792 1.3789 1.3789 2.2269 2.2269 3.0916 3.0916 3.8601 3.8601 4.3367 4.3367 4.9531 4.9531 5.0797 5.0797 6.0540 6.0540 6.3415 6.3415 6.3663 6.3663 6.8842 6.8842 7.3190 7.3190 7.3420 7.3420 7.8496 7.8496 8.0695 8.0695 8.1502 8.1502 8.1772 8.1772 8.2739 8.2739 8.2900 8.2900 8.3441 8.3441 8.4624 8.4624 8.4900 8.4900 8.5541 8.5541 9.0646 9.0646 9.0715 9.0715 9.2873 9.2873 9.3165 9.3165 9.5860 9.5860 9.8030 9.8030 9.8166 9.8166 10.1836 10.1836 10.2824 10.2824 10.4812 10.4812 10.9529 10.9529 11.1690 11.1690 k = 0.1184 0.6656 0.3980 ( 7380 PWs) bands (ev): 1.2598 1.2598 1.3690 1.3690 2.2901 2.2901 3.1439 3.1439 3.7698 3.7698 4.2905 4.2905 4.9338 4.9338 5.0820 5.0820 6.0681 6.0681 6.3749 6.3749 6.4363 6.4363 6.8796 6.8796 7.2757 7.2757 7.3373 7.3373 7.8302 7.8302 8.0833 8.0833 8.1426 8.1426 8.1964 8.1964 8.2773 8.2773 8.2912 8.2912 8.3456 8.3456 8.4770 8.4770 8.5147 8.5147 8.5743 8.5743 9.0401 9.0401 9.0482 9.0482 9.2505 9.2505 9.2920 9.2920 9.5954 9.5954 9.8165 9.8165 9.8388 9.8388 10.1896 10.1896 10.2450 10.2450 10.4868 10.4868 10.9836 10.9836 11.1912 11.1912 k = 0.1053 0.6709 0.3838 ( 7370 PWs) bands (ev): 1.2421 1.2421 1.3596 1.3596 2.3560 2.3560 3.1998 3.1998 3.6787 3.6787 4.2407 4.2407 4.9129 4.9129 5.0829 5.0829 6.0902 6.0902 6.4092 6.4092 6.5055 6.5055 6.8593 6.8593 7.2326 7.2326 7.3455 7.3455 7.8100 7.8100 8.0821 8.0821 8.1448 8.1448 8.2110 8.2110 8.2819 8.2819 8.2958 8.2958 8.3474 8.3474 8.4925 8.4925 8.5415 8.5415 8.5948 8.5948 9.0153 9.0153 9.0247 9.0247 9.2101 9.2101 9.2713 9.2713 9.6050 9.6050 9.8288 9.8288 9.8599 9.8599 10.1833 10.1833 10.2141 10.2141 10.5014 10.5014 11.0202 11.0202 11.2108 11.2108 k = 0.0921 0.6763 0.3696 ( 7382 PWs) bands (ev): 1.2262 1.2262 1.3507 1.3507 2.4247 2.4247 3.2587 3.2587 3.5873 3.5873 4.1873 4.1873 4.8916 4.8916 5.0829 5.0829 6.1196 6.1196 6.4450 6.4450 6.5712 6.5712 6.8262 6.8262 7.1904 7.1904 7.3636 7.3636 7.7890 7.7890 8.0684 8.0684 8.1563 8.1563 8.2195 8.2195 8.2856 8.2856 8.3049 8.3049 8.3494 8.3494 8.5089 8.5089 8.5701 8.5701 8.6154 8.6154 8.9905 8.9905 9.0013 9.0013 9.1692 9.1692 9.2521 9.2521 9.6148 9.6148 9.8404 9.8404 9.8777 9.8777 10.1698 10.1698 10.1903 10.1903 10.5199 10.5199 11.0620 11.0620 11.2281 11.2281 k = 0.0789 0.6817 0.3554 ( 7382 PWs) bands (ev): 1.2122 1.2122 1.3426 1.3426 2.4957 2.4957 3.3204 3.3204 3.4962 3.4962 4.1306 4.1306 4.8711 4.8711 5.0823 5.0823 6.1552 6.1552 6.4819 6.4819 6.6309 6.6309 6.7839 6.7839 7.1503 7.1503 7.3879 7.3879 7.7674 7.7674 8.0503 8.0503 8.1695 8.1695 8.2238 8.2238 8.2890 8.2890 8.3156 8.3156 8.3521 8.3521 8.5258 8.5258 8.6000 8.6000 8.6360 8.6360 8.9662 8.9662 8.9783 8.9783 9.1288 9.1288 9.2342 9.2342 9.6244 9.6244 9.8515 9.8515 9.8907 9.8907 10.1547 10.1547 10.1726 10.1726 10.5383 10.5383 11.1072 11.1072 11.2437 11.2437 k = 0.0658 0.6871 0.3411 ( 7370 PWs) bands (ev): 1.2003 1.2003 1.3355 1.3355 2.5691 2.5691 3.3840 3.3840 3.4058 3.4058 4.0707 4.0707 4.8523 4.8523 5.0813 5.0813 6.1961 6.1961 6.5196 6.5196 6.6820 6.6820 6.7355 6.7355 7.1136 7.1136 7.4155 7.4155 7.7455 7.7455 8.0314 8.0314 8.1813 8.1813 8.2260 8.2260 8.2926 8.2926 8.3249 8.3249 8.3555 8.3555 8.5427 8.5427 8.6308 8.6308 8.6567 8.6567 8.9428 8.9428 8.9560 8.9560 9.0898 9.0898 9.2179 9.2179 9.6337 9.6337 9.8619 9.8619 9.8980 9.8980 10.1397 10.1397 10.1624 10.1624 10.5546 10.5546 11.1528 11.1528 11.2586 11.2586 k = 0.0526 0.6924 0.3269 ( 7362 PWs) bands (ev): 1.1905 1.1905 1.3296 1.3296 2.6447 2.6447 3.3156 3.3156 3.4500 3.4500 4.0083 4.0083 4.8361 4.8361 5.0802 5.0802 6.2411 6.2411 6.5572 6.5572 6.6830 6.6830 6.7218 6.7218 7.0823 7.0823 7.4439 7.4439 7.7236 7.7236 8.0134 8.0134 8.1905 8.1905 8.2273 8.2273 8.2966 8.2966 8.3315 8.3315 8.3596 8.3596 8.5587 8.5587 8.6605 8.6605 8.6785 8.6785 8.9207 8.9207 8.9342 8.9342 9.0531 9.0531 9.2036 9.2036 9.6422 9.6422 9.8712 9.8712 9.9000 9.9000 10.1247 10.1247 10.1603 10.1603 10.5678 10.5678 11.1937 11.1937 11.2751 11.2751 k = 0.0395 0.6978 0.3127 ( 7368 PWs) bands (ev): 1.1828 1.1828 1.3248 1.3248 2.7223 2.7223 3.2268 3.2268 3.5166 3.5166 3.9441 3.9441 4.8231 4.8231 5.0792 5.0792 6.2895 6.2895 6.5935 6.5935 6.6290 6.6290 6.7469 6.7469 7.0586 7.0586 7.4712 7.4712 7.7024 7.7024 7.9977 7.9977 8.1969 8.1969 8.2283 8.2283 8.3007 8.3007 8.3354 8.3354 8.3640 8.3640 8.5728 8.5728 8.6845 8.6845 8.7043 8.7043 8.9009 8.9009 8.9128 8.9128 9.0205 9.0205 9.1917 9.1917 9.6497 9.6497 9.8791 9.8791 9.8984 9.8984 10.1112 10.1112 10.1634 10.1634 10.5778 10.5778 11.2235 11.2235 11.2957 11.2957 k = 0.0263 0.7032 0.2985 ( 7370 PWs) bands (ev): 1.1772 1.1772 1.3213 1.3213 2.8018 2.8018 3.1393 3.1393 3.5829 3.5829 3.8793 3.8793 4.8135 4.8135 5.0784 5.0784 6.3400 6.3400 6.5728 6.5728 6.6285 6.6285 6.7565 6.7565 7.0439 7.0439 7.4951 7.4951 7.6832 7.6832 7.9854 7.9854 8.2009 8.2009 8.2291 8.2291 8.3043 8.3043 8.3375 8.3375 8.3676 8.3676 8.5839 8.5839 8.7013 8.7013 8.7332 8.7332 8.8841 8.8841 8.8921 8.8921 8.9943 8.9943 9.1828 9.1828 9.6555 9.6555 9.8848 9.8848 9.8958 9.8958 10.1006 10.1006 10.1685 10.1685 10.5848 10.5848 11.2404 11.2404 11.3182 11.3182 k = 0.0132 0.7086 0.2843 ( 7370 PWs) bands (ev): 1.1739 1.1739 1.3192 1.3192 2.8827 2.8827 3.0536 3.0536 3.6454 3.6454 3.8178 3.8178 4.8077 4.8077 5.0779 5.0779 6.3901 6.3901 6.5202 6.5202 6.6554 6.6554 6.7542 6.7542 7.0369 7.0369 7.5126 7.5126 7.6687 7.6687 7.9775 7.9775 8.2031 8.2031 8.2297 8.2297 8.3068 8.3068 8.3386 8.3386 8.3700 8.3700 8.5911 8.5911 8.7120 8.7120 8.7585 8.7585 8.8702 8.8702 8.8758 8.8758 8.9773 8.9773 9.1773 9.1773 9.6592 9.6592 9.8872 9.8872 9.8947 9.8947 10.0938 10.0938 10.1727 10.1727 10.5889 10.5889 11.2483 11.2483 11.3324 11.3324 k = 0.0000 0.7140 0.2701 ( 7372 PWs) bands (ev): 1.1728 1.1728 1.3185 1.3185 2.9523 2.9523 2.9823 2.9823 3.6813 3.6813 3.7821 3.7821 4.8058 4.8058 5.0777 5.0777 6.4219 6.4219 6.4875 6.4875 6.6669 6.6669 6.7507 6.7507 7.0350 7.0350 7.5193 7.5193 7.6631 7.6631 7.9748 7.9748 8.2037 8.2037 8.2299 8.2299 8.3077 8.3077 8.3389 8.3389 8.3709 8.3709 8.5936 8.5936 8.7159 8.7159 8.7698 8.7698 8.8621 8.8621 8.8708 8.8708 8.9715 8.9715 9.1755 9.1755 9.6605 9.6605 9.8874 9.8874 9.8948 9.8948 10.0914 10.0914 10.1743 10.1743 10.5902 10.5902 11.2506 11.2506 11.3335 11.3335 k = 0.0000 0.7140 0.2701 ( 7372 PWs) bands (ev): 1.1728 1.1728 1.3185 1.3185 2.9523 2.9523 2.9823 2.9823 3.6813 3.6813 3.7821 3.7821 4.8058 4.8058 5.0777 5.0777 6.4219 6.4219 6.4875 6.4875 6.6669 6.6669 6.7507 6.7507 7.0350 7.0350 7.5193 7.5193 7.6631 7.6631 7.9748 7.9748 8.2037 8.2037 8.2299 8.2299 8.3077 8.3077 8.3389 8.3389 8.3709 8.3709 8.5936 8.5936 8.7159 8.7159 8.7698 8.7698 8.8621 8.8621 8.8708 8.8708 8.9715 8.9715 9.1755 9.1755 9.6605 9.6605 9.8874 9.8874 9.8948 9.8948 10.0914 10.0914 10.1743 10.1743 10.5902 10.5902 11.2506 11.2506 11.3335 11.3335 k =-0.0152 0.7093 0.2823 ( 7366 PWs) bands (ev): 1.1738 1.1738 1.3195 1.3195 2.9457 2.9457 2.9748 2.9748 3.6903 3.6903 3.7904 3.7904 4.7692 4.7692 5.1138 5.1138 6.4196 6.4196 6.4806 6.4806 6.6734 6.6734 6.7512 6.7512 7.0365 7.0365 7.5198 7.5198 7.6637 7.6637 7.9740 7.9740 8.2021 8.2021 8.2282 8.2282 8.3063 8.3063 8.3413 8.3413 8.3741 8.3741 8.5935 8.5935 8.7152 8.7152 8.7707 8.7707 8.8576 8.8576 8.8703 8.8703 8.9768 8.9768 9.1769 9.1769 9.6544 9.6544 9.8761 9.8761 9.9037 9.9037 10.0916 10.0916 10.1801 10.1801 10.5898 10.5898 11.2514 11.2514 11.3327 11.3327 k =-0.0303 0.7047 0.2946 ( 7376 PWs) bands (ev): 1.1766 1.1766 1.3223 1.3223 2.9264 2.9264 2.9534 2.9534 3.7160 3.7160 3.8144 3.8144 4.6895 4.6895 5.1920 5.1920 6.4129 6.4129 6.4625 6.4625 6.6901 6.6901 6.7529 6.7529 7.0410 7.0410 7.5214 7.5214 7.6654 7.6654 7.9717 7.9717 8.1958 8.1958 8.2254 8.2254 8.3026 8.3026 8.3474 8.3474 8.3833 8.3833 8.5931 8.5931 8.7135 8.7135 8.7728 8.7728 8.8471 8.8471 8.8687 8.8687 8.9901 8.9901 9.1814 9.1814 9.6368 9.6368 9.8593 9.8593 9.9131 9.9131 10.0920 10.0920 10.1967 10.1967 10.5885 10.5885 11.2536 11.2536 11.3241 11.3241 k =-0.0455 0.7000 0.3069 ( 7367 PWs) bands (ev): 1.1813 1.1813 1.3271 1.3271 2.8965 2.8965 2.9209 2.9209 3.7555 3.7555 3.8520 3.8520 4.5956 4.5956 5.2836 5.2836 6.4019 6.4019 6.4382 6.4382 6.7118 6.7118 6.7557 6.7557 7.0488 7.0488 7.5239 7.5239 7.6682 7.6682 7.9681 7.9681 8.1841 8.1841 8.2247 8.2247 8.2973 8.2973 8.3555 8.3555 8.3971 8.3971 8.5925 8.5925 8.7113 8.7113 8.7745 8.7745 8.8353 8.8353 8.8663 8.8663 9.0067 9.0067 9.1900 9.1900 9.6099 9.6099 9.8398 9.8398 9.9203 9.9203 10.0926 10.0926 10.2223 10.2223 10.5864 10.5864 11.2567 11.2567 11.3050 11.3050 k =-0.0606 0.6954 0.3192 ( 7378 PWs) bands (ev): 1.1879 1.1879 1.3337 1.3337 2.8586 2.8586 2.8805 2.8805 3.8053 3.8053 3.9007 3.9007 4.4972 4.4972 5.3792 5.3792 6.3871 6.3871 6.4112 6.4112 6.7342 6.7342 6.7599 6.7599 7.0604 7.0604 7.5271 7.5271 7.6721 7.6721 7.9633 7.9633 8.1683 8.1683 8.2263 8.2263 8.2904 8.2904 8.3643 8.3643 8.4137 8.4137 8.5917 8.5917 8.7092 8.7092 8.7730 8.7730 8.8259 8.8259 8.8638 8.8638 9.0228 9.0228 9.2036 9.2036 9.5761 9.5761 9.8177 9.8177 9.9250 9.9250 10.0936 10.0936 10.2545 10.2545 10.5836 10.5836 11.2580 11.2580 11.2815 11.2815 k =-0.0758 0.6907 0.3314 ( 7382 PWs) bands (ev): 1.1961 1.1961 1.3423 1.3423 2.8151 2.8151 2.8347 2.8347 3.8616 3.8616 3.9579 3.9579 4.3986 4.3986 5.4757 5.4757 6.3688 6.3688 6.3837 6.3837 6.7535 6.7535 6.7669 6.7669 7.0763 7.0763 7.5309 7.5309 7.6770 7.6770 7.9578 7.9578 8.1503 8.1503 8.2290 8.2290 8.2821 8.2821 8.3733 8.3733 8.4319 8.4319 8.5907 8.5907 8.7077 8.7077 8.7668 8.7668 8.8204 8.8204 8.8626 8.8626 9.0360 9.0360 9.2235 9.2235 9.5376 9.5376 9.7934 9.7934 9.9275 9.9275 10.0948 10.0948 10.2914 10.2914 10.5803 10.5803 11.2392 11.2392 11.2738 11.2738 k =-0.0910 0.6861 0.3437 ( 7382 PWs) bands (ev): 1.2058 1.2058 1.3528 1.3528 2.7677 2.7677 2.7859 2.7859 3.9200 3.9200 4.0216 4.0216 4.3035 4.3035 5.5716 5.5716 6.3477 6.3477 6.3572 6.3572 6.7651 6.7651 6.7796 6.7796 7.0968 7.0968 7.5348 7.5348 7.6829 7.6829 7.9519 7.9519 8.1314 8.1314 8.2320 8.2320 8.2726 8.2726 8.3818 8.3818 8.4508 8.4508 8.5894 8.5894 8.7072 8.7072 8.7574 8.7574 8.8157 8.8157 8.8644 8.8644 9.0451 9.0451 9.2499 9.2499 9.4959 9.4959 9.7671 9.7671 9.9278 9.9278 10.0964 10.0964 10.3312 10.3312 10.5765 10.5765 11.2050 11.2050 11.2789 11.2789 k =-0.1061 0.6814 0.3560 ( 7389 PWs) bands (ev): 1.2169 1.2169 1.3653 1.3653 2.7182 2.7182 2.7353 2.7353 3.9707 3.9707 4.0900 4.0900 4.2210 4.2210 5.6660 5.6660 6.3245 6.3245 6.3322 6.3322 6.7726 6.7726 6.7936 6.7936 7.1217 7.1217 7.5388 7.5388 7.6898 7.6898 7.9461 7.9461 8.1120 8.1120 8.2340 8.2340 8.2623 8.2623 8.3894 8.3894 8.4694 8.4694 8.5878 8.5878 8.7077 8.7077 8.7474 8.7474 8.8089 8.8089 8.8701 8.8701 9.0503 9.0503 9.2819 9.2819 9.4525 9.4525 9.7393 9.7393 9.9264 9.9264 10.0983 10.0983 10.3728 10.3728 10.5725 10.5725 11.1671 11.1671 11.2861 11.2861 k =-0.1213 0.6768 0.3683 ( 7391 PWs) bands (ev): 1.2291 1.2291 1.3798 1.3798 2.6675 2.6675 2.6842 2.6842 3.9826 3.9826 4.1611 4.1611 4.1822 4.1822 5.7585 5.7585 6.3009 6.3009 6.3085 6.3085 6.7797 6.7797 6.8049 6.8049 7.1508 7.1508 7.5424 7.5424 7.6974 7.6974 7.9409 7.9409 8.0927 8.0927 8.2329 8.2329 8.2527 8.2527 8.3955 8.3955 8.4873 8.4873 8.5859 8.5859 8.7086 8.7086 8.7391 8.7391 8.7991 8.7991 8.8789 8.8789 9.0521 9.0521 9.3180 9.3180 9.4087 9.4087 9.7104 9.7104 9.9236 9.9236 10.1007 10.1007 10.4151 10.4151 10.5680 10.5680 11.1275 11.1275 11.2940 11.2940 k =-0.1364 0.6722 0.3805 ( 7394 PWs) bands (ev): 1.2420 1.2420 1.3964 1.3964 2.6166 2.6166 2.6331 2.6331 3.9292 3.9292 4.2105 4.2105 4.2366 4.2366 5.8486 5.8486 6.2780 6.2780 6.2867 6.2867 6.7868 6.7868 6.8132 6.8132 7.1833 7.1833 7.5455 7.5455 7.7058 7.7058 7.9368 7.9368 8.0737 8.0737 8.2253 8.2253 8.2466 8.2466 8.3999 8.3999 8.5038 8.5038 8.5838 8.5838 8.7081 8.7081 8.7349 8.7349 8.7867 8.7867 8.8897 8.8897 9.0514 9.0514 9.3477 9.3477 9.3744 9.3744 9.6812 9.6812 9.9203 9.9203 10.1035 10.1035 10.4570 10.4570 10.5631 10.5631 11.0871 11.0871 11.3026 11.3026 k =-0.1516 0.6675 0.3928 ( 7387 PWs) bands (ev): 1.2553 1.2553 1.4152 1.4152 2.5660 2.5660 2.5827 2.5827 3.8466 3.8466 4.2732 4.2732 4.3119 4.3119 5.9356 5.9356 6.2558 6.2558 6.2681 6.2681 6.7938 6.7938 6.8189 6.8189 7.2182 7.2182 7.5478 7.5478 7.7149 7.7149 7.9343 7.9343 8.0553 8.0553 8.2121 8.2121 8.2424 8.2424 8.4023 8.4023 8.5181 8.5181 8.5817 8.5817 8.7042 8.7042 8.7371 8.7371 8.7721 8.7721 8.9015 8.9015 9.0487 9.0487 9.3152 9.3152 9.4045 9.4045 9.6524 9.6524 9.9172 9.9172 10.1069 10.1069 10.4978 10.4978 10.5577 10.5577 11.0467 11.0467 11.3117 11.3117 k =-0.1667 0.6629 0.4051 ( 7398 PWs) bands (ev): 1.2685 1.2685 1.4364 1.4364 2.5162 2.5162 2.5333 2.5333 3.7578 3.7578 4.3456 4.3456 4.3877 4.3877 6.0186 6.0186 6.2356 6.2356 6.2534 6.2534 6.8000 6.8000 6.8226 6.8226 7.2545 7.2545 7.5490 7.5490 7.7246 7.7246 7.9337 7.9337 8.0376 8.0376 8.1963 8.1963 8.2369 8.2369 8.4026 8.4026 8.5291 8.5291 8.5805 8.5805 8.6976 8.6976 8.7437 8.7437 8.7561 8.7561 8.9136 8.9136 9.0447 9.0447 9.2731 9.2731 9.4458 9.4458 9.6248 9.6248 9.9155 9.9155 10.1109 10.1109 10.5346 10.5346 10.5530 10.5530 11.0069 11.0069 11.3215 11.3215 k =-0.1819 0.6582 0.4174 ( 7396 PWs) bands (ev): 1.2811 1.2811 1.4600 1.4600 2.4676 2.4676 2.4851 2.4851 3.6692 3.6692 4.4212 4.4212 4.4632 4.4632 6.0942 6.0942 6.2214 6.2214 6.2432 6.2432 6.8051 6.8051 6.8252 6.8252 7.2915 7.2915 7.5491 7.5491 7.7346 7.7346 7.9352 7.9352 8.0212 8.0212 8.1789 8.1789 8.2288 8.2288 8.4011 8.4011 8.5353 8.5353 8.5813 8.5813 8.6895 8.6895 8.7355 8.7355 8.7563 8.7563 8.9254 8.9254 9.0396 9.0396 9.2324 9.2324 9.4859 9.4859 9.5998 9.5998 9.9166 9.9166 10.1156 10.1156 10.5397 10.5397 10.5756 10.5756 10.9683 10.9683 11.3320 11.3320 k =-0.1971 0.6536 0.4297 ( 7400 PWs) bands (ev): 1.2926 1.2926 1.4862 1.4862 2.4204 2.4204 2.4383 2.4383 3.5832 3.5832 4.4977 4.4977 4.5376 4.5376 6.1463 6.1463 6.2295 6.2295 6.2383 6.2383 6.8083 6.8083 6.8273 6.8273 7.3280 7.3280 7.5477 7.5477 7.7449 7.7449 7.9390 7.9390 8.0062 8.0062 8.1604 8.1604 8.2175 8.2175 8.3977 8.3977 8.5360 8.5360 8.5845 8.5845 8.6801 8.6801 8.7150 8.7150 8.7689 8.7689 8.9362 8.9362 9.0340 9.0340 9.1948 9.1948 9.5203 9.5203 9.5802 9.5802 9.9221 9.9221 10.1210 10.1210 10.5297 10.5297 10.6071 10.6071 10.9316 10.9316 11.3436 11.3436 k =-0.2122 0.6489 0.4419 ( 7391 PWs) bands (ev): 1.3023 1.3023 1.5151 1.5151 2.3748 2.3748 2.3928 2.3928 3.5013 3.5013 4.5736 4.5736 4.6100 4.6100 6.1550 6.1550 6.2373 6.2373 6.2824 6.2824 6.8092 6.8092 6.8294 6.8294 7.3632 7.3632 7.5449 7.5449 7.7554 7.7554 7.9450 7.9450 7.9933 7.9933 8.1410 8.1410 8.2029 8.2029 8.3930 8.3930 8.5323 8.5323 8.5885 8.5885 8.6690 8.6690 8.6921 8.6921 8.7833 8.7833 8.9452 8.9452 9.0283 9.0283 9.1618 9.1618 9.5354 9.5354 9.5785 9.5785 9.9338 9.9338 10.1272 10.1272 10.5165 10.5165 10.6336 10.6336 10.8978 10.8978 11.3562 11.3562 k =-0.2274 0.6443 0.4542 ( 7396 PWs) bands (ev): 1.3096 1.3096 1.5467 1.5467 2.3310 2.3310 2.3488 2.3488 3.4245 3.4245 4.6478 4.6478 4.6797 4.6797 6.1498 6.1498 6.2430 6.2430 6.3491 6.3491 6.8081 6.8081 6.8311 6.8311 7.3959 7.3959 7.5405 7.5405 7.7660 7.7660 7.9528 7.9528 7.9828 7.9828 8.1209 8.1209 8.1850 8.1850 8.3870 8.3870 8.5259 8.5259 8.5913 8.5913 8.6551 8.6551 8.6681 8.6681 8.7986 8.7986 8.9512 8.9512 9.0227 9.0227 9.1352 9.1352 9.5272 9.5272 9.5976 9.5976 9.9532 9.9532 10.1344 10.1344 10.5005 10.5005 10.6527 10.6527 10.8681 10.8681 11.3702 11.3702 k =-0.2425 0.6397 0.4665 ( 7404 PWs) bands (ev): 1.3140 1.3140 1.5810 1.5810 2.2891 2.2891 2.3062 2.3062 3.3540 3.3540 4.7194 4.7194 4.7459 4.7459 6.1456 6.1456 6.2549 6.2549 6.4164 6.4164 6.8055 6.8055 6.8315 6.8315 7.4249 7.4249 7.5346 7.5346 7.7768 7.7768 7.9615 7.9615 7.9756 7.9756 8.1003 8.1003 8.1641 8.1641 8.3802 8.3802 8.5177 8.5177 8.5907 8.5907 8.6345 8.6345 8.6476 8.6476 8.8145 8.8145 8.9531 8.9531 9.0176 9.0176 9.1168 9.1168 9.5164 9.5164 9.6165 9.6165 9.9807 9.9807 10.1425 10.1425 10.4816 10.4816 10.6620 10.6620 10.8439 10.8439 11.3853 11.3853 k =-0.2577 0.6350 0.4788 ( 7406 PWs) bands (ev): 1.3149 1.3149 1.6179 1.6179 2.2493 2.2493 2.2650 2.2650 3.2906 3.2906 4.7872 4.7872 4.8081 4.8081 6.1460 6.1460 6.2735 6.2735 6.4814 6.4814 6.8019 6.8019 6.8303 6.8303 7.4488 7.4488 7.5271 7.5271 7.7880 7.7880 7.9680 7.9680 7.9746 7.9746 8.0794 8.0794 8.1404 8.1404 8.3731 8.3731 8.5082 8.5082 8.5835 8.5835 8.6093 8.6093 8.6309 8.6309 8.8304 8.8304 8.9509 8.9509 9.0131 9.0131 9.1077 9.1077 9.5084 9.5084 9.6305 9.6305 10.0154 10.0154 10.1518 10.1518 10.4599 10.4599 10.6603 10.6603 10.8257 10.8257 11.4014 11.4014 k =-0.2729 0.6304 0.4910 ( 7410 PWs) bands (ev): 1.3116 1.3116 1.6574 1.6574 2.2115 2.2115 2.2252 2.2252 3.2354 3.2354 4.8504 4.8504 4.8657 4.8657 6.1526 6.1526 6.2990 6.2990 6.5434 6.5434 6.7976 6.7976 6.8268 6.8268 7.4660 7.4660 7.5182 7.5182 7.8000 7.8000 7.9693 7.9693 7.9816 7.9816 8.0587 8.0587 8.1142 8.1142 8.3659 8.3659 8.4977 8.4977 8.5633 8.5633 8.5902 8.5902 8.6143 8.6143 8.8462 8.8462 8.9463 8.9463 9.0091 9.0091 9.1069 9.1069 9.5040 9.5040 9.6402 9.6402 10.0556 10.0556 10.1624 10.1624 10.4360 10.4360 10.6484 10.6484 10.8119 10.8119 11.4179 11.4179 k =-0.2880 0.6257 0.5033 ( 7414 PWs) bands (ev): 1.3036 1.3036 1.6992 1.6992 2.1758 2.1758 2.1871 2.1871 3.1890 3.1890 4.9078 4.9078 4.9184 4.9184 6.1665 6.1665 6.3314 6.3314 6.6019 6.6019 6.7925 6.7925 6.8210 6.8210 7.4750 7.4750 7.5083 7.5083 7.8133 7.8133 7.9729 7.9729 7.9872 7.9872 8.0384 8.0384 8.0860 8.0860 8.3593 8.3593 8.4861 8.4861 8.5343 8.5343 8.5750 8.5750 8.5970 8.5970 8.8614 8.8614 8.9417 8.9417 9.0057 9.0057 9.1123 9.1123 9.5033 9.5033 9.6468 9.6468 10.0986 10.0986 10.1746 10.1746 10.4107 10.4107 10.6296 10.6296 10.7985 10.7985 11.4342 11.4342 k =-0.3032 0.6211 0.5156 ( 7420 PWs) bands (ev): 1.2905 1.2905 1.7430 1.7430 2.1421 2.1421 2.1512 2.1512 3.1522 3.1522 4.9585 4.9585 4.9664 4.9664 6.1884 6.1884 6.3706 6.3706 6.6567 6.6567 6.7865 6.7865 6.8129 6.8129 7.4747 7.4747 7.4977 7.4977 7.8281 7.8281 7.9795 7.9795 7.9879 7.9879 8.0197 8.0197 8.0563 8.0563 8.3533 8.3533 8.4735 8.4735 8.5052 8.5052 8.5585 8.5585 8.5783 8.5783 8.8758 8.8758 8.9393 8.9393 9.0029 9.0029 9.1217 9.1217 9.5059 9.5059 9.6518 9.6518 10.1405 10.1405 10.1892 10.1892 10.3858 10.3858 10.6070 10.6070 10.7820 10.7820 11.4493 11.4493 k =-0.3183 0.6164 0.5279 ( 7438 PWs) bands (ev): 1.2717 1.2717 1.7882 1.7882 2.1103 2.1103 2.1183 2.1183 3.1252 3.1252 5.0023 5.0023 5.0094 5.0094 6.2187 6.2187 6.4160 6.4160 6.7070 6.7070 6.7789 6.7789 6.8033 6.8033 7.4657 7.4657 7.4857 7.4857 7.8439 7.8439 7.9797 7.9797 7.9896 7.9896 8.0040 8.0040 8.0257 8.0257 8.3474 8.3474 8.4598 8.4598 8.4805 8.4805 8.5407 8.5407 8.5580 8.5580 8.8892 8.8892 8.9398 8.9398 9.0009 9.0009 9.1337 9.1337 9.5116 9.5116 9.6560 9.6560 10.1746 10.1746 10.2082 10.2082 10.3652 10.3652 10.5832 10.5832 10.7601 10.7601 11.4621 11.4621 k =-0.3335 0.6118 0.5401 ( 7442 PWs) bands (ev): 1.2471 1.2471 1.8336 1.8336 2.0812 2.0812 2.0892 2.0892 3.1082 3.1082 5.0396 5.0396 5.0470 5.0470 6.2574 6.2574 6.4668 6.4668 6.7491 6.7491 6.7700 6.7700 6.7954 6.7954 7.4508 7.4508 7.4704 7.4704 7.8591 7.8591 7.9653 7.9653 7.9883 7.9883 7.9953 7.9953 8.0021 8.0021 8.3394 8.3394 8.4470 8.4470 8.4620 8.4620 8.5231 8.5231 8.5362 8.5362 8.9016 8.9016 8.9431 8.9431 9.0000 9.0000 9.1474 9.1474 9.5200 9.5200 9.6603 9.6603 10.1951 10.1951 10.2273 10.2273 10.3580 10.3580 10.5596 10.5596 10.7320 10.7320 11.4719 11.4719 k =-0.3335 0.6118 0.5401 ( 7442 PWs) bands (ev): 1.2471 1.2471 1.8336 1.8336 2.0812 2.0812 2.0892 2.0892 3.1082 3.1082 5.0396 5.0396 5.0470 5.0470 6.2574 6.2574 6.4668 6.4668 6.7491 6.7491 6.7700 6.7700 6.7954 6.7954 7.4508 7.4508 7.4704 7.4704 7.8591 7.8591 7.9653 7.9653 7.9883 7.9883 7.9953 7.9953 8.0021 8.0021 8.3394 8.3394 8.4470 8.4470 8.4620 8.4620 8.5231 8.5231 8.5362 8.5362 8.9016 8.9016 8.9431 8.9431 9.0000 9.0000 9.1474 9.1474 9.5200 9.5200 9.6603 9.6603 10.1951 10.1951 10.2273 10.2273 10.3580 10.3580 10.5596 10.5596 10.7320 10.7320 11.4719 11.4719 k =-0.3411 0.5933 0.5401 ( 7450 PWs) bands (ev): 1.1933 1.1933 1.9203 1.9203 2.0282 2.0282 2.0364 2.0364 3.0883 3.0883 5.1087 5.1087 5.1166 5.1166 6.3429 6.3429 6.5734 6.5734 6.7589 6.7589 6.7799 6.7799 6.8180 6.8180 7.4170 7.4170 7.4359 7.4359 7.8863 7.8863 7.9165 7.9165 7.9478 7.9478 7.9586 7.9586 8.0267 8.0267 8.3182 8.3182 8.4242 8.4242 8.4279 8.4279 8.4923 8.4923 8.4928 8.4928 8.9248 8.9248 8.9495 8.9495 8.9989 8.9989 9.1750 9.1750 9.5403 9.5403 9.6705 9.6705 10.2240 10.2240 10.2560 10.2560 10.3691 10.3691 10.5143 10.5143 10.6711 10.6711 11.4733 11.4733 k =-0.3486 0.5748 0.5401 ( 7422 PWs) bands (ev): 1.1419 1.1419 1.9762 1.9762 1.9858 1.9858 2.0025 2.0025 3.0781 3.0781 5.1782 5.1782 5.1867 5.1867 6.4283 6.4283 6.6806 6.6806 6.7479 6.7479 6.7707 6.7707 6.8803 6.8803 7.3843 7.3843 7.4026 7.4026 7.8413 7.8413 7.9023 7.9023 7.9296 7.9296 7.9304 7.9304 8.0513 8.0513 8.2956 8.2956 8.3888 8.3888 8.3983 8.3983 8.4528 8.4528 8.4671 8.4671 8.9464 8.9464 8.9479 8.9479 9.0000 9.0000 9.2005 9.2005 9.5627 9.5627 9.6834 9.6834 10.2547 10.2547 10.2864 10.2864 10.3868 10.3868 10.4708 10.4708 10.6124 10.6124 11.4509 11.4509 k =-0.3562 0.5562 0.5401 ( 7438 PWs) bands (ev): 1.0929 1.0929 1.9284 1.9284 1.9374 1.9374 2.0744 2.0744 3.0800 3.0800 5.2481 5.2481 5.2571 5.2571 6.5133 6.5133 6.7370 6.7370 6.7602 6.7602 6.7882 6.7882 6.9432 6.9432 7.3528 7.3528 7.3705 7.3705 7.7555 7.7555 7.8841 7.8841 7.9028 7.9028 7.9496 7.9496 8.0756 8.0756 8.2720 8.2720 8.3467 8.3467 8.3655 8.3655 8.4202 8.4202 8.4455 8.4455 8.9326 8.9326 8.9692 8.9692 9.0060 9.0060 9.2237 9.2237 9.5866 9.5866 9.6989 9.6989 10.2870 10.2870 10.3185 10.3185 10.4103 10.4103 10.4292 10.4292 10.5560 10.5560 11.4151 11.4151 k =-0.3638 0.5377 0.5401 ( 7438 PWs) bands (ev): 1.0464 1.0464 1.8821 1.8821 1.8913 1.8913 2.1365 2.1365 3.0964 3.0964 5.3181 5.3181 5.3277 5.3277 6.5972 6.5972 6.7263 6.7263 6.7496 6.7496 6.8958 6.8958 7.0053 7.0053 7.3227 7.3227 7.3398 7.3398 7.6617 7.6617 7.8602 7.8602 7.8769 7.8769 7.9762 7.9762 8.0995 8.0995 8.2477 8.2477 8.3029 8.3029 8.3255 8.3255 8.3955 8.3955 8.4262 8.4262 8.9093 8.9093 8.9901 8.9901 9.0151 9.0151 9.2444 9.2444 9.6117 9.6117 9.7168 9.7168 10.3209 10.3209 10.3519 10.3519 10.3898 10.3898 10.4383 10.4383 10.5032 10.5032 11.3746 11.3746 k =-0.3713 0.5192 0.5401 ( 7430 PWs) bands (ev): 1.0023 1.0023 1.8381 1.8381 1.8474 1.8474 2.1861 2.1861 3.1292 3.1292 5.3881 5.3881 5.3982 5.3982 6.6793 6.6793 6.7157 6.7157 6.7392 6.7392 7.0034 7.0034 7.0665 7.0665 7.2941 7.2941 7.3106 7.3106 7.5612 7.5612 7.8370 7.8370 7.8524 7.8524 8.0031 8.0031 8.1229 8.1229 8.2229 8.2229 8.2586 8.2586 8.2815 8.2815 8.3755 8.3755 8.4084 8.4084 8.8797 8.8797 9.0100 9.0100 9.0253 9.0253 9.2623 9.2623 9.6376 9.6376 9.7366 9.7366 10.3500 10.3500 10.3561 10.3561 10.3895 10.3895 10.4432 10.4432 10.4811 10.4811 11.3345 11.3345 k =-0.3789 0.5007 0.5401 ( 7406 PWs) bands (ev): 0.9607 0.9607 1.7965 1.7965 1.8060 1.8060 2.2225 2.2225 3.1792 3.1792 5.4577 5.4577 5.4685 5.4685 6.7048 6.7048 6.7288 6.7288 6.7590 6.7590 7.1101 7.1101 7.1267 7.1267 7.2672 7.2672 7.2830 7.2830 7.4556 7.4556 7.8149 7.8149 7.8293 7.8293 8.0298 8.0298 8.1455 8.1455 8.1973 8.1973 8.2150 8.2150 8.2358 8.2358 8.3581 8.3581 8.3921 8.3921 8.8456 8.8456 9.0288 9.0288 9.0358 9.0358 9.2771 9.2771 9.6641 9.6641 9.7578 9.7578 10.3146 10.3146 10.3846 10.3846 10.4061 10.4061 10.4265 10.4265 10.5167 10.5167 11.2973 11.2973 k =-0.3865 0.4821 0.5401 ( 7394 PWs) bands (ev): 0.9216 0.9216 1.7572 1.7572 1.7668 1.7668 2.2463 2.2463 3.2459 3.2459 5.5269 5.5269 5.5382 5.5382 6.6946 6.6946 6.7185 6.7185 6.8327 6.8327 7.1841 7.1841 7.2161 7.2161 7.2432 7.2432 7.2570 7.2570 7.3478 7.3478 7.7942 7.7942 7.8077 7.8077 8.0558 8.0558 8.1580 8.1580 8.1697 8.1697 8.1834 8.1834 8.1893 8.1893 8.3422 8.3422 8.3768 8.3768 8.8083 8.8083 9.0460 9.0460 9.0464 9.0464 9.2887 9.2887 9.6907 9.6907 9.7798 9.7798 10.2806 10.2806 10.3471 10.3471 10.4358 10.4358 10.4656 10.4656 10.5598 10.5598 11.2644 11.2644 k =-0.3940 0.4636 0.5401 ( 7402 PWs) bands (ev): 0.8850 0.8850 1.7203 1.7203 1.7301 1.7301 2.2592 2.2592 3.3275 3.3275 5.5952 5.5952 5.6071 5.6071 6.6843 6.6843 6.7083 6.7083 6.8939 6.8939 7.2172 7.2172 7.2300 7.2300 7.2415 7.2415 7.2479 7.2479 7.3230 7.3230 7.7747 7.7747 7.7874 7.7874 8.0812 8.0812 8.1187 8.1187 8.1425 8.1425 8.1497 8.1497 8.1962 8.1962 8.3277 8.3277 8.3626 8.3626 8.7689 8.7689 9.0559 9.0559 9.0625 9.0625 9.2969 9.2969 9.7172 9.7172 9.8022 9.8022 10.2487 10.2487 10.3028 10.3028 10.4760 10.4760 10.5065 10.5065 10.6074 10.6074 11.2360 11.2360 k =-0.4016 0.4451 0.5401 ( 7406 PWs) bands (ev): 0.8509 0.8509 1.6859 1.6859 1.6958 1.6958 2.2638 2.2638 3.4214 3.4214 5.6624 5.6624 5.6750 5.6750 6.6744 6.6744 6.6984 6.6984 6.9182 6.9182 7.1700 7.1700 7.1958 7.1958 7.2126 7.2126 7.2961 7.2961 7.4262 7.4262 7.7565 7.7565 7.7685 7.7685 8.0742 8.0742 8.0956 8.0956 8.1059 8.1059 8.1259 8.1259 8.2188 8.2188 8.3142 8.3142 8.3493 8.3493 8.7282 8.7282 9.0653 9.0653 9.0770 9.0770 9.3016 9.3016 9.7433 9.7433 9.8244 9.8244 10.2188 10.2188 10.2603 10.2603 10.5182 10.5182 10.5489 10.5489 10.6588 10.6588 11.2121 11.2121 k =-0.4092 0.4266 0.5401 ( 7398 PWs) bands (ev): 0.8193 0.8193 1.6540 1.6540 1.6640 1.6640 2.2622 2.2622 3.5256 3.5256 5.7282 5.7282 5.7414 5.7414 6.6646 6.6646 6.6887 6.6887 6.8652 6.8652 7.1665 7.1665 7.1760 7.1760 7.1931 7.1931 7.3489 7.3489 7.5270 7.5270 7.7398 7.7398 7.7511 7.7511 8.0297 8.0297 8.0495 8.0495 8.1024 8.1024 8.1293 8.1293 8.2426 8.2426 8.3017 8.3017 8.3370 8.3370 8.6871 8.6871 9.0742 9.0742 9.0895 9.0895 9.3029 9.3029 9.7688 9.7688 9.8462 9.8462 10.1910 10.1910 10.2204 10.2204 10.5619 10.5619 10.5927 10.5927 10.7139 10.7139 11.1926 11.1926 k =-0.4167 0.4081 0.5401 ( 7406 PWs) bands (ev): 0.7901 0.7901 1.6245 1.6245 1.6347 1.6347 2.2564 2.2564 3.6378 3.6378 5.7921 5.7921 5.8059 5.8059 6.6550 6.6550 6.6793 6.6793 6.7577 6.7577 7.1579 7.1579 7.1714 7.1714 7.2153 7.2153 7.3996 7.3996 7.6245 7.6245 7.7243 7.7243 7.7351 7.7351 7.9856 7.9856 8.0038 8.0038 8.0794 8.0794 8.1516 8.1516 8.2676 8.2676 8.2903 8.2903 8.3257 8.3257 8.6459 8.6459 9.0824 9.0824 9.0995 9.0995 9.3009 9.3009 9.7933 9.7933 9.8669 9.8669 10.1654 10.1654 10.1832 10.1832 10.6068 10.6068 10.6378 10.6378 10.7721 10.7721 11.1770 11.1770 k =-0.4243 0.3895 0.5401 ( 7398 PWs) bands (ev): 0.7635 0.7635 1.5975 1.5975 1.6078 1.6078 2.2481 2.2481 3.7566 3.7566 5.8538 5.8538 5.8683 5.8683 6.6267 6.6267 6.6495 6.6495 6.6704 6.6704 7.1416 7.1416 7.1555 7.1555 7.2736 7.2736 7.4478 7.4478 7.7103 7.7103 7.7147 7.7147 7.7232 7.7232 7.9426 7.9426 7.9591 7.9591 8.0570 8.0570 8.1727 8.1727 8.2798 8.2798 8.2945 8.2945 8.3154 8.3154 8.6054 8.6054 9.0900 9.0900 9.1064 9.1064 9.2960 9.2960 9.8167 9.8167 9.8864 9.8864 10.1420 10.1420 10.1489 10.1489 10.6527 10.6527 10.6839 10.6839 10.8329 10.8329 11.1653 11.1653 k =-0.4319 0.3710 0.5401 ( 7406 PWs) bands (ev): 0.7395 0.7395 1.5731 1.5731 1.5834 1.5834 2.2383 2.2383 3.8805 3.8805 5.9127 5.9127 5.9278 5.9278 6.4934 6.4934 6.6387 6.6387 6.6619 6.6619 7.1272 7.1272 7.1410 7.1410 7.3346 7.3346 7.4936 7.4936 7.6977 7.6977 7.7069 7.7069 7.8048 7.8048 7.9009 7.9009 7.9157 7.9157 8.0352 8.0352 8.1925 8.1925 8.2703 8.2703 8.3055 8.3055 8.3249 8.3249 8.5659 8.5659 9.0969 9.0969 9.1093 9.1093 9.2890 9.2890 9.8386 9.8386 9.9044 9.9044 10.1176 10.1176 10.1208 10.1208 10.6991 10.6991 10.7306 10.7306 10.8956 10.8956 11.1573 11.1573 k =-0.4395 0.3525 0.5401 ( 7406 PWs) bands (ev): 0.7179 0.7179 1.5512 1.5512 1.5616 1.5616 2.2281 2.2281 4.0087 4.0087 5.9682 5.9682 5.9840 5.9840 6.3532 6.3532 6.6307 6.6307 6.6540 6.6540 7.1146 7.1146 7.1282 7.1282 7.3942 7.3942 7.5368 7.5368 7.6866 7.6866 7.6951 7.6951 7.8601 7.8601 7.8740 7.8740 7.8849 7.8849 8.0139 8.0139 8.2106 8.2106 8.2618 8.2618 8.2972 8.2972 8.3589 8.3589 8.5279 8.5279 9.1031 9.1031 9.1068 9.1068 9.2809 9.2809 9.8588 9.8588 9.9204 9.9204 10.0897 10.0897 10.1020 10.1020 10.7457 10.7457 10.7775 10.7775 10.9585 10.9585 11.1539 11.1539 k =-0.4470 0.3340 0.5401 ( 7394 PWs) bands (ev): 0.6989 0.6989 1.5318 1.5318 1.5423 1.5423 2.2179 2.2179 4.1402 4.1402 6.0199 6.0199 6.0362 6.0362 6.2103 6.2103 6.6235 6.6235 6.6468 6.6468 7.1037 7.1037 7.1172 7.1172 7.4505 7.4505 7.5770 7.5770 7.6769 7.6769 7.6849 7.6849 7.8230 7.8230 7.8345 7.8345 7.9539 7.9539 7.9932 7.9932 8.2271 8.2271 8.2544 8.2544 8.2898 8.2898 8.3989 8.3989 8.4917 8.4917 9.0974 9.0974 9.1085 9.1085 9.2732 9.2732 9.8771 9.8771 9.9341 9.9341 10.0655 10.0655 10.0856 10.0856 10.7918 10.7918 10.8241 10.8241 11.0176 11.0176 11.1578 11.1578 k =-0.4546 0.3154 0.5401 ( 7402 PWs) bands (ev): 0.6824 0.6824 1.5150 1.5150 1.5256 1.5256 2.2084 2.2084 4.2744 4.2744 6.0650 6.0650 6.0669 6.0669 6.0846 6.0846 6.6171 6.6171 6.6404 6.6404 7.0945 7.0945 7.1079 7.1079 7.5026 7.5026 7.6141 7.6141 7.6687 7.6687 7.6763 7.6763 7.7884 7.7884 7.7978 7.7978 7.9729 7.9729 8.0121 8.0121 8.2417 8.2417 8.2479 8.2479 8.2833 8.2833 8.4456 8.4456 8.4580 8.4580 9.0798 9.0798 9.1132 9.1132 9.2670 9.2670 9.8932 9.8932 9.9450 9.9450 10.0455 10.0455 10.0715 10.0715 10.8367 10.8367 10.8696 10.8696 11.0638 11.0638 11.1770 11.1770 k =-0.4622 0.2969 0.5401 ( 7402 PWs) bands (ev): 0.6684 0.6684 1.5008 1.5008 1.5114 1.5114 2.1999 2.1999 4.4105 4.4105 5.9205 5.9205 6.1085 6.1085 6.1262 6.1262 6.6116 6.6116 6.6348 6.6348 7.0869 7.0869 7.1003 7.1003 7.5494 7.5494 7.6459 7.6459 7.6622 7.6622 7.6711 7.6711 7.7573 7.7573 7.7645 7.7645 7.9533 7.9533 8.0584 8.0584 8.2422 8.2422 8.2545 8.2545 8.2778 8.2778 8.4271 8.4271 8.4993 8.4993 9.0536 9.0536 9.1172 9.1172 9.2629 9.2629 9.9070 9.9070 9.9523 9.9523 10.0304 10.0304 10.0599 10.0599 10.8793 10.8793 10.9128 10.9128 11.0879 11.0879 11.2189 11.2189 k =-0.4697 0.2784 0.5401 ( 7402 PWs) bands (ev): 0.6570 0.6570 1.4891 1.4891 1.4998 1.4998 2.1926 2.1926 4.5473 4.5473 5.7761 5.7761 6.1440 6.1440 6.1622 6.1622 6.6070 6.6070 6.6301 6.6301 7.0809 7.0809 7.0943 7.0943 7.5899 7.5899 7.6563 7.6563 7.6578 7.6578 7.6850 7.6850 7.7307 7.7307 7.7352 7.7352 7.9344 7.9344 8.0934 8.0934 8.2377 8.2377 8.2651 8.2651 8.2733 8.2733 8.3998 8.3998 8.5588 8.5588 9.0191 9.0191 9.1204 9.1204 9.2607 9.2607 9.9182 9.9182 9.9555 9.9555 10.0209 10.0209 10.0507 10.0507 10.9183 10.9183 10.9525 10.9525 11.0969 11.0969 11.2738 11.2738 k =-0.4773 0.2599 0.5401 ( 7386 PWs) bands (ev): 0.6481 0.6481 1.4801 1.4801 1.4907 1.4907 2.1868 2.1868 4.6834 4.6834 5.6342 5.6342 6.1726 6.1726 6.1912 6.1912 6.6034 6.6034 6.6264 6.6264 7.0764 7.0764 7.0898 7.0898 7.6229 7.6229 7.6530 7.6530 7.6550 7.6550 7.7061 7.7061 7.7104 7.7104 7.7136 7.7136 7.9168 7.9168 8.1185 8.1185 8.2342 8.2342 8.2698 8.2698 8.2734 8.2734 8.3771 8.3771 8.6219 8.6219 8.9772 8.9772 9.1229 9.1229 9.2597 9.2597 9.9268 9.9268 9.9550 9.9550 10.0166 10.0166 10.0440 10.0440 10.9520 10.9520 10.9868 10.9868 11.1003 11.1003 11.3290 11.3291 k =-0.4849 0.2414 0.5401 ( 7390 PWs) bands (ev): 0.6417 0.6417 1.4736 1.4736 1.4843 1.4843 2.1825 2.1825 4.8146 4.8146 5.4986 5.4986 6.1937 6.1937 6.2125 6.2125 6.6007 6.6007 6.6237 6.6237 7.0732 7.0732 7.0867 7.0867 7.6461 7.6461 7.6495 7.6495 7.6557 7.6557 7.6906 7.6906 7.6931 7.6931 7.7332 7.7332 7.9012 7.9012 8.1351 8.1351 8.2317 8.2317 8.2673 8.2673 8.2795 8.2795 8.3599 8.3599 8.6863 8.6863 8.9290 8.9290 9.1247 9.1247 9.2595 9.2595 9.9328 9.9328 9.9525 9.9525 10.0154 10.0154 10.0393 10.0393 10.9783 10.9783 11.0137 11.0137 11.1016 11.1016 11.3763 11.3763 k =-0.4924 0.2228 0.5401 ( 7382 PWs) bands (ev): 0.6379 0.6379 1.4697 1.4697 1.4804 1.4804 2.1799 2.1799 4.9291 4.9291 5.3815 5.3815 6.2065 6.2065 6.2255 6.2255 6.5992 6.5992 6.6222 6.6222 7.0714 7.0714 7.0849 7.0849 7.6470 7.6470 7.6534 7.6534 7.6652 7.6652 7.6769 7.6769 7.6836 7.6836 7.7486 7.7486 7.8899 7.8899 8.1446 8.1446 8.2302 8.2302 8.2658 8.2658 8.2832 8.2832 8.3491 8.3491 8.7493 8.7493 8.8762 8.8762 9.1258 9.1258 9.2596 9.2596 9.9362 9.9362 9.9503 9.9503 10.0155 10.0155 10.0367 10.0367 10.9952 10.9952 11.0309 11.0309 11.1021 11.1021 11.4085 11.4085 k =-0.5000 0.2043 0.5401 ( 7382 PWs) bands (ev): 0.6366 0.6366 1.4684 1.4684 1.4791 1.4791 2.1790 2.1790 4.9841 4.9841 5.3257 5.3257 6.2108 6.2108 6.2299 6.2299 6.5987 6.5987 6.6216 6.6216 7.0708 7.0708 7.0843 7.0843 7.6461 7.6461 7.6553 7.6553 7.6702 7.6702 7.6710 7.6710 7.6805 7.6805 7.7543 7.7543 7.8856 7.8856 8.1477 8.1477 8.2297 8.2297 8.2653 8.2653 8.2844 8.2844 8.3453 8.3453 8.7955 8.7955 8.8334 8.8334 9.1262 9.1262 9.2596 9.2596 9.9374 9.9374 9.9494 9.9494 10.0156 10.0156 10.0358 10.0358 11.0011 11.0011 11.0369 11.0369 11.1022 11.1022 11.4201 11.4201 k = 0.0000 0.0000 0.5401 ( 7414 PWs) bands (ev): 0.0275 0.0275 0.7936 0.7936 3.3280 3.3280 4.1974 4.1974 4.4390 4.4390 4.6378 4.6378 5.4181 5.4181 5.4778 5.4778 6.1971 6.1971 6.3560 6.3560 6.3959 6.3959 6.8594 6.8594 6.9025 6.9025 7.2957 7.2957 7.6029 7.6029 7.6046 7.6046 7.7169 7.7169 7.8673 7.8673 7.9891 7.9891 7.9976 7.9976 8.0408 8.0408 8.3620 8.3620 8.4840 8.4840 8.8892 8.8892 9.3183 9.3183 9.6401 9.6401 9.6447 9.6447 9.9341 9.9341 9.9414 9.9414 9.9905 9.9905 10.0147 10.0147 10.0413 10.0413 10.1370 10.1370 10.1808 10.1808 10.2279 10.2279 10.8581 10.8581 k = 0.0078 0.0191 0.5401 ( 7414 PWs) bands (ev): 0.0289 0.0289 0.7951 0.7951 3.3292 3.3292 4.1948 4.1948 4.4401 4.4401 4.6374 4.6374 5.3247 5.3247 5.5729 5.5729 6.1698 6.1698 6.3526 6.3526 6.4126 6.4126 6.8569 6.8569 6.9124 6.9124 7.2950 7.2950 7.6044 7.6044 7.6072 7.6072 7.7194 7.7194 7.8664 7.8664 7.9896 7.9896 7.9992 7.9992 8.0414 8.0414 8.3487 8.3487 8.4957 8.4957 8.8869 8.8869 9.3190 9.3190 9.6350 9.6350 9.6467 9.6467 9.9351 9.9351 9.9410 9.9410 9.9910 9.9910 10.0143 10.0143 10.0305 10.0305 10.1305 10.1305 10.1924 10.1924 10.2335 10.2335 10.8565 10.8565 k = 0.0156 0.0382 0.5401 ( 7426 PWs) bands (ev): 0.0332 0.0332 0.7995 0.7995 3.3328 3.3328 4.1869 4.1869 4.4435 4.4435 4.6362 4.6362 5.2103 5.2103 5.6928 5.6928 6.1061 6.1061 6.3429 6.3429 6.4452 6.4452 6.8496 6.8496 6.9408 6.9408 7.2930 7.2930 7.6082 7.6082 7.6155 7.6155 7.7270 7.7270 7.8638 7.8638 7.9911 7.9911 8.0039 8.0039 8.0431 8.0431 8.3178 8.3178 8.5217 8.5217 8.8798 8.8798 9.3210 9.3210 9.6246 9.6246 9.6481 9.6481 9.9364 9.9364 9.9399 9.9399 9.9882 9.9882 10.0049 10.0049 10.0186 10.0186 10.1163 10.1163 10.2175 10.2175 10.2477 10.2477 10.8516 10.8516 k = 0.0234 0.0574 0.5401 ( 7420 PWs) bands (ev): 0.0402 0.0402 0.8068 0.8068 3.3388 3.3388 4.1725 4.1725 4.4491 4.4491 4.6338 4.6338 5.1001 5.1001 5.8128 5.8128 6.0269 6.0269 6.3271 6.3271 6.4767 6.4767 6.8376 6.8376 6.9840 6.9840 7.2904 7.2904 7.6146 7.6146 7.6286 7.6286 7.7399 7.7399 7.8600 7.8600 7.9936 7.9936 8.0111 8.0111 8.0460 8.0460 8.2796 8.2796 8.5522 8.5522 8.8683 8.8683 9.3239 9.3239 9.6104 9.6104 9.6484 9.6484 9.9319 9.9319 9.9381 9.9381 9.9623 9.9623 10.0067 10.0067 10.0195 10.0195 10.0992 10.0992 10.2464 10.2464 10.2667 10.2667 10.8435 10.8435 k = 0.0312 0.0765 0.5401 ( 7420 PWs) bands (ev): 0.0500 0.0500 0.8170 0.8170 3.3472 3.3472 4.1501 4.1501 4.4570 4.4570 4.6296 4.6296 4.9974 4.9974 5.9279 5.9279 5.9445 5.9445 6.3052 6.3052 6.5030 6.5030 6.8209 6.8209 7.0369 7.0369 7.2879 7.2879 7.6236 7.6236 7.6457 7.6457 7.7585 7.7585 7.8557 7.8557 7.9971 7.9971 8.0203 8.0203 8.0501 8.0501 8.2381 8.2381 8.5830 8.5830 8.8527 8.8527 9.3276 9.3276 9.5929 9.5929 9.6478 9.6478 9.9051 9.9051 9.9328 9.9328 9.9482 9.9482 10.0166 10.0166 10.0241 10.0241 10.0817 10.0817 10.2749 10.2749 10.2882 10.2882 10.8321 10.8321 k = 0.0391 0.0956 0.5401 ( 7412 PWs) bands (ev): 0.0627 0.0627 0.8301 0.8301 3.3580 3.3580 4.1175 4.1175 4.4670 4.4670 4.6228 4.6228 4.9052 4.9052 5.8535 5.8535 6.0468 6.0468 6.2774 6.2774 6.5248 6.5248 6.8000 6.8000 7.0943 7.0943 7.2861 7.2861 7.6352 7.6352 7.6660 7.6660 7.7829 7.7829 7.8514 7.8514 8.0016 8.0016 8.0308 8.0308 8.0554 8.0554 8.1953 8.1953 8.6127 8.6127 8.8333 8.8333 9.3316 9.3316 9.5730 9.5730 9.6466 9.6466 9.8632 9.8632 9.9263 9.9263 9.9433 9.9433 10.0229 10.0229 10.0354 10.0354 10.0677 10.0677 10.3016 10.3016 10.3112 10.3112 10.8173 10.8173 k = 0.0469 0.1147 0.5401 ( 7412 PWs) bands (ev): 0.0781 0.0781 0.8462 0.8462 3.3712 3.3712 4.0723 4.0723 4.4792 4.4792 4.6122 4.6122 4.8265 4.8265 5.7682 5.7682 6.1570 6.1570 6.2442 6.2442 6.5434 6.5434 6.7750 6.7750 7.1519 7.1519 7.2855 7.2855 7.6494 7.6494 7.6887 7.6887 7.8130 7.8130 7.8477 7.8477 8.0071 8.0071 8.0421 8.0421 8.0621 8.0621 8.1525 8.1525 8.6404 8.6404 8.8105 8.8105 9.3355 9.3355 9.5514 9.5514 9.6448 9.6448 9.8184 9.8184 9.9181 9.9181 9.9376 9.9376 10.0249 10.0249 10.0377 10.0377 10.0724 10.0724 10.3264 10.3264 10.3346 10.3346 10.7990 10.7990 k = 0.0547 0.1338 0.5401 ( 7406 PWs) bands (ev): 0.0964 0.0964 0.8651 0.8651 3.3867 3.3867 4.0130 4.0130 4.4935 4.4935 4.5963 4.5963 4.7631 4.7631 5.6877 5.6877 6.2042 6.2042 6.2629 6.2629 6.5601 6.5601 6.7466 6.7466 7.2068 7.2068 7.2865 7.2865 7.6659 7.6659 7.7130 7.7130 7.8415 7.8415 7.8522 7.8522 8.0134 8.0134 8.0538 8.0538 8.0704 8.0704 8.1112 8.1112 8.6658 8.6658 8.7848 8.7848 9.3390 9.3390 9.5285 9.5285 9.6425 9.6425 9.7733 9.7733 9.9080 9.9080 9.9306 9.9306 10.0141 10.0141 10.0406 10.0406 10.0944 10.0944 10.3501 10.3501 10.3572 10.3572 10.7773 10.7773 k = 0.0625 0.1529 0.5401 ( 7402 PWs) bands (ev): 0.1175 0.1175 0.8868 0.8868 3.4047 3.4047 3.9395 3.9395 4.5098 4.5098 4.5736 4.5736 4.7156 4.7156 5.6145 5.6145 6.1608 6.1608 6.3599 6.3599 6.5758 6.5758 6.7150 6.7150 7.2572 7.2572 7.2892 7.2892 7.6843 7.6843 7.7387 7.7387 7.8413 7.8413 7.8912 7.8912 8.0207 8.0207 8.0613 8.0613 8.0761 8.0761 8.0813 8.0813 8.6881 8.6881 8.7568 8.7568 9.3417 9.3417 9.5049 9.5049 9.6392 9.6392 9.7292 9.7292 9.8960 9.8960 9.9221 9.9221 9.9973 9.9973 10.0490 10.0490 10.1211 10.1211 10.3728 10.3728 10.3791 10.3791 10.7520 10.7520 k = 0.0703 0.1721 0.5401 ( 7400 PWs) bands (ev): 0.1413 0.1413 0.9113 0.9113 3.4250 3.4250 3.8532 3.8532 4.5272 4.5272 4.5431 4.5431 4.6826 4.6826 5.5513 5.5513 6.1123 6.1123 6.4487 6.4487 6.5909 6.5909 6.6809 6.6809 7.2935 7.2935 7.3026 7.3026 7.7032 7.7032 7.7651 7.7651 7.8403 7.8403 7.9348 7.9348 8.0287 8.0287 8.0346 8.0346 8.0817 8.0817 8.0934 8.0934 8.7040 8.7040 8.7299 8.7299 9.3436 9.3436 9.4808 9.4808 9.6334 9.6334 9.6882 9.6882 9.8822 9.8822 9.9124 9.9124 9.9798 9.9798 10.0598 10.0598 10.1500 10.1500 10.3940 10.3940 10.4008 10.4008 10.7232 10.7232 k = 0.0781 0.1912 0.5401 ( 7392 PWs) bands (ev): 0.1680 0.1680 0.9387 0.9387 3.4476 3.4476 3.7569 3.7569 4.5000 4.5000 4.5491 4.5491 4.6618 4.6618 5.4999 5.4999 6.0595 6.0595 6.5275 6.5275 6.6055 6.6055 6.6451 6.6451 7.2997 7.2997 7.3425 7.3425 7.7204 7.7204 7.7919 7.7919 7.8403 7.8403 7.9783 7.9783 8.0080 8.0080 8.0378 8.0378 8.0947 8.0947 8.1103 8.1103 8.6873 8.6873 8.7305 8.7305 9.3443 9.3443 9.4567 9.4567 9.6184 9.6184 9.6577 9.6577 9.8668 9.8668 9.9018 9.9018 9.9625 9.9625 10.0725 10.0725 10.1805 10.1805 10.4137 10.4137 10.4230 10.4230 10.6911 10.6911 k = 0.0859 0.2103 0.5401 ( 7386 PWs) bands (ev): 0.1974 0.1974 0.9688 0.9688 3.4726 3.4726 3.6531 3.6531 4.4480 4.4480 4.5708 4.5708 4.6506 4.6506 5.4615 5.4615 6.0028 6.0028 6.5923 6.5923 6.6082 6.6082 6.6222 6.6222 7.3074 7.3074 7.3779 7.3779 7.7320 7.7320 7.8190 7.8190 7.8414 7.8414 7.9923 7.9923 8.0179 8.0179 8.0476 8.0476 8.1080 8.1080 8.1345 8.1345 8.6538 8.6538 8.7428 8.7428 9.3440 9.3440 9.4326 9.4326 9.5875 9.5875 9.6449 9.6449 9.8499 9.8499 9.8902 9.8902 9.9455 9.9455 10.0872 10.0872 10.2121 10.2121 10.4326 10.4326 10.4452 10.4452 10.6557 10.6557 k = 0.0938 0.2294 0.5401 ( 7388 PWs) bands (ev): 0.2296 0.2296 1.0016 1.0016 3.4999 3.4999 3.5443 3.5443 4.3852 4.3852 4.5943 4.5943 4.6470 4.6470 5.4364 5.4364 5.9426 5.9426 6.5661 6.5661 6.6354 6.6354 6.6524 6.6524 7.3165 7.3165 7.4095 7.4095 7.7345 7.7345 7.8424 7.8424 7.8474 7.8474 7.9927 7.9927 8.0486 8.0486 8.0580 8.0580 8.1210 8.1210 8.1680 8.1680 8.6177 8.6177 8.7528 8.7528 9.3425 9.3425 9.4089 9.4089 9.5514 9.5514 9.6395 9.6395 9.8319 9.8319 9.8778 9.8778 9.9288 9.9288 10.1036 10.1036 10.2447 10.2447 10.4516 10.4516 10.4670 10.4670 10.6175 10.6175 k = 0.1016 0.2485 0.5401 ( 7384 PWs) bands (ev): 0.2645 0.2645 1.0370 1.0370 3.4322 3.4322 3.5295 3.5295 4.3126 4.3126 4.6189 4.6189 4.6496 4.6496 5.4237 5.4237 5.8793 5.8793 6.5264 6.5264 6.6496 6.6496 6.6955 6.6955 7.3271 7.3271 7.4382 7.4382 7.7271 7.7271 7.8463 7.8463 7.8740 7.8740 8.0087 8.0087 8.0692 8.0692 8.0715 8.0715 8.1337 8.1337 8.2086 8.2086 8.5804 8.5804 8.7592 8.7592 9.3401 9.3401 9.3856 9.3856 9.5161 9.5161 9.6358 9.6358 9.8130 9.8130 9.8648 9.8648 9.9125 9.9125 10.1217 10.1217 10.2780 10.2780 10.4708 10.4708 10.4884 10.4884 10.5773 10.5773 k = 0.1094 0.2677 0.5401 ( 7392 PWs) bands (ev): 0.3023 0.3023 1.0750 1.0750 3.3181 3.3181 3.5613 3.5613 4.2320 4.2320 4.6431 4.6431 4.6585 4.6585 5.4221 5.4221 5.8133 5.8133 6.4861 6.4861 6.6632 6.6632 6.7262 6.7262 7.3388 7.3388 7.4647 7.4647 7.7132 7.7132 7.8508 7.8508 7.9013 7.9013 8.0366 8.0366 8.0811 8.0811 8.0891 8.0891 8.1462 8.1462 8.2516 8.2516 8.5428 8.5428 8.7618 8.7618 9.3369 9.3369 9.3631 9.3631 9.4832 9.4832 9.6328 9.6328 9.7936 9.7936 9.8513 9.8513 9.8965 9.8965 10.1415 10.1415 10.3119 10.3119 10.4885 10.4885 10.5091 10.5091 10.5379 10.5379 k = 0.1172 0.2868 0.5401 ( 7384 PWs) bands (ev): 0.3427 0.3427 1.1156 1.1156 3.2031 3.2031 3.5955 3.5955 4.1449 4.1449 4.6610 4.6610 4.6785 4.6785 5.4300 5.4300 5.7450 5.7450 6.4457 6.4457 6.6761 6.6761 6.7445 6.7445 7.3517 7.3517 7.4895 7.4895 7.6969 7.6969 7.8562 7.8562 7.9286 7.9286 8.0714 8.0714 8.0936 8.0936 8.1039 8.1039 8.1583 8.1583 8.2926 8.2926 8.5061 8.5061 8.7602 8.7602 9.3327 9.3327 9.3418 9.3418 9.4533 9.4533 9.6302 9.6302 9.7738 9.7738 9.8374 9.8374 9.8808 9.8808 10.1631 10.1631 10.3463 10.3463 10.4777 10.4777 10.5253 10.5253 10.5307 10.5307 k = 0.1250 0.3059 0.5401 ( 7380 PWs) bands (ev): 0.3860 0.3860 1.1585 1.1585 3.0879 3.0879 3.6318 3.6318 4.0531 4.0531 4.6756 4.6756 4.7059 4.7059 5.4459 5.4459 5.6747 5.6747 6.4057 6.4057 6.6879 6.6879 6.7510 6.7510 7.3656 7.3656 7.5133 7.5133 7.6809 7.6809 7.8625 7.8625 7.9556 7.9556 8.1043 8.1043 8.1113 8.1113 8.1170 8.1170 8.1702 8.1702 8.3269 8.3269 8.4731 8.4731 8.7546 8.7546 9.3193 9.3193 9.3306 9.3306 9.4264 9.4264 9.6278 9.6278 9.7538 9.7538 9.8232 9.8232 9.8654 9.8654 10.1864 10.1864 10.3811 10.3811 10.4353 10.4353 10.5472 10.5472 10.5497 10.5497 k = 0.1328 0.3250 0.5401 ( 7376 PWs) bands (ev): 0.4319 0.4319 1.2038 1.2038 2.9730 2.9730 3.6704 3.6704 3.9582 3.9582 4.6914 4.6914 4.7350 4.7350 5.4683 5.4683 5.6029 5.6029 6.3664 6.3664 6.6983 6.6983 6.7466 6.7466 7.3803 7.3803 7.5364 7.5364 7.6671 7.6671 7.8695 7.8695 7.9824 7.9824 8.1190 8.1190 8.1288 8.1288 8.1476 8.1476 8.1819 8.1819 8.3462 8.3462 8.4514 8.4514 8.7449 8.7449 9.2998 9.2998 9.3267 9.3267 9.4027 9.4027 9.6256 9.6256 9.7339 9.7339 9.8090 9.8090 9.8504 9.8504 10.2114 10.2114 10.3886 10.3886 10.4162 10.4162 10.5684 10.5684 10.5741 10.5741 k = 0.1406 0.3441 0.5401 ( 7380 PWs) bands (ev): 0.4806 0.4806 1.2513 1.2513 2.8588 2.8588 3.7112 3.7112 3.8612 3.8612 4.7090 4.7090 4.7649 4.7649 5.4960 5.4960 5.5297 5.5297 6.3284 6.3284 6.7068 6.7068 6.7326 6.7326 7.3957 7.3957 7.5591 7.5591 7.6561 7.6561 7.8771 7.8771 8.0089 8.0089 8.1328 8.1328 8.1392 8.1392 8.1813 8.1813 8.1950 8.1950 8.3402 8.3402 8.4511 8.4511 8.7314 8.7314 9.2812 9.2812 9.3238 9.3238 9.3819 9.3819 9.6236 9.6236 9.7143 9.7143 9.7947 9.7947 9.8356 9.8356 10.2376 10.2376 10.3416 10.3416 10.4514 10.4514 10.5864 10.5864 10.6035 10.6035 k = 0.1484 0.3633 0.5401 ( 7372 PWs) bands (ev): 0.5319 0.5319 1.3008 1.3008 2.7457 2.7457 3.7540 3.7540 3.7633 3.7633 4.7280 4.7280 4.7951 4.7951 5.4555 5.4555 5.5282 5.5282 6.2919 6.2919 6.7090 6.7090 6.7146 6.7146 7.4118 7.4118 7.5816 7.5816 7.6480 7.6480 7.8851 7.8851 8.0350 8.0350 8.1469 8.1469 8.1476 8.1476 8.1999 8.1999 8.2192 8.2192 8.3170 8.3170 8.4649 8.4649 8.7145 8.7145 9.2638 9.2638 9.3220 9.3220 9.3635 9.3635 9.6219 9.6219 9.6952 9.6952 9.7807 9.7807 9.8214 9.8214 10.2602 10.2602 10.3000 10.3000 10.4866 10.4866 10.6034 10.6034 10.6346 10.6346 k = 0.1562 0.3824 0.5401 ( 7364 PWs) bands (ev): 0.5860 0.5860 1.3522 1.3522 2.6339 2.6339 3.6654 3.6654 3.7991 3.7991 4.7484 4.7484 4.8250 4.8250 5.3806 5.3806 5.5637 5.5637 6.2575 6.2575 6.6806 6.6806 6.7178 6.7178 7.4283 7.4283 7.6041 7.6041 7.6426 7.6426 7.8935 7.8935 8.0605 8.0605 8.1522 8.1522 8.1614 8.1614 8.2105 8.2105 8.2459 8.2459 8.2916 8.2916 8.4801 8.4801 8.6949 8.6949 9.2479 9.2479 9.3217 9.3217 9.3472 9.3472 9.6205 9.6205 9.6768 9.6768 9.7669 9.7669 9.8076 9.8076 10.2374 10.2374 10.3061 10.3061 10.5216 10.5216 10.6196 10.6196 10.6667 10.6667 k = 0.1641 0.4015 0.5401 ( 7378 PWs) bands (ev): 0.6427 0.6427 1.4052 1.4052 2.5235 2.5235 3.5684 3.5684 3.8461 3.8461 4.7698 4.7698 4.8542 4.8542 5.3053 5.3053 5.6019 5.6019 6.2257 6.2257 6.6457 6.6457 6.7191 6.7191 7.4452 7.4452 7.6261 7.6261 7.6400 7.6400 7.9019 7.9019 8.0852 8.0852 8.1501 8.1501 8.1762 8.1762 8.2197 8.2197 8.2619 8.2619 8.2782 8.2782 8.4920 8.4920 8.6730 8.6730 9.2336 9.2336 9.3231 9.3231 9.3324 9.3324 9.6193 9.6193 9.6591 9.6591 9.7535 9.7535 9.7943 9.7943 10.1925 10.1925 10.3374 10.3374 10.5563 10.5563 10.6347 10.6347 10.6987 10.6987 k = 0.1719 0.4206 0.5401 ( 7382 PWs) bands (ev): 0.7022 0.7022 1.4594 1.4594 2.4148 2.4148 3.4728 3.4728 3.8952 3.8952 4.7921 4.7921 4.8823 4.8823 5.2298 5.2298 5.6420 5.6420 6.1970 6.1970 6.6065 6.6065 6.7176 6.7176 7.4623 7.4623 7.6355 7.6355 7.6518 7.6518 7.9104 7.9104 8.1083 8.1083 8.1389 8.1389 8.1915 8.1915 8.2280 8.2280 8.2567 8.2567 8.2917 8.2917 8.4990 8.4990 8.6494 8.6494 9.2210 9.2210 9.3185 9.3185 9.3263 9.3263 9.6184 9.6184 9.6424 9.6424 9.7406 9.7406 9.7818 9.7818 10.1470 10.1470 10.3727 10.3727 10.5903 10.5903 10.6488 10.6488 10.7298 10.7298 k = 0.1797 0.4397 0.5401 ( 7382 PWs) bands (ev): 0.7642 0.7642 1.5146 1.5146 2.3079 2.3079 3.3795 3.3795 3.9462 3.9462 4.8148 4.8148 4.9087 4.9087 5.1543 5.1543 5.6832 5.6832 6.1721 6.1721 6.5642 6.5642 6.7130 6.7130 7.4794 7.4794 7.6353 7.6353 7.6746 7.6746 7.9187 7.9187 8.1132 8.1132 8.1360 8.1360 8.2073 8.2073 8.2361 8.2361 8.2565 8.2565 8.3052 8.3052 8.5010 8.5010 8.6246 8.6246 9.2103 9.2103 9.3054 9.3054 9.3315 9.3315 9.6179 9.6179 9.6269 9.6269 9.7283 9.7283 9.7701 9.7701 10.1029 10.1029 10.4106 10.4106 10.6235 10.6235 10.6619 10.6619 10.7591 10.7591 k = 0.1875 0.4588 0.5401 ( 7368 PWs) bands (ev): 0.8289 0.8289 1.5701 1.5701 2.2028 2.2028 3.2893 3.2893 3.9992 3.9992 4.8379 4.8379 4.9327 4.9327 5.0791 5.0791 5.7248 5.7248 6.1514 6.1514 6.5198 6.5198 6.7054 6.7054 7.4963 7.4963 7.6350 7.6350 7.6982 7.6982 7.9266 7.9266 8.0892 8.0892 8.1559 8.1559 8.2238 8.2238 8.2442 8.2442 8.2618 8.2618 8.3145 8.3145 8.4981 8.4981 8.5993 8.5993 9.2016 9.2016 9.2927 9.2927 9.3385 9.3385 9.6122 9.6122 9.6181 9.6181 9.7167 9.7167 9.7592 9.7592 10.0606 10.0606 10.4509 10.4509 10.6553 10.6553 10.6742 10.6742 10.7857 10.7857 k = 0.1953 0.4780 0.5401 ( 7368 PWs) bands (ev): 0.8962 0.8962 1.6254 1.6254 2.0998 2.0998 3.2031 3.2031 4.0539 4.0539 4.8610 4.8610 4.9538 4.9538 5.0045 5.0045 5.7660 5.7660 6.1356 6.1356 6.4743 6.4743 6.6951 6.6951 7.5130 7.5130 7.6348 7.6348 7.7220 7.7220 7.9341 7.9341 8.0622 8.0622 8.1758 8.1758 8.2403 8.2403 8.2527 8.2527 8.2703 8.2703 8.3199 8.3199 8.4910 8.4910 8.5737 8.5737 9.1949 9.1949 9.2802 9.2802 9.3471 9.3471 9.5994 9.5994 9.6183 9.6183 9.7057 9.7057 9.7494 9.7494 10.0209 10.0209 10.4932 10.4932 10.6807 10.6807 10.6902 10.6902 10.8088 10.8088 k = 0.2031 0.4971 0.5401 ( 7386 PWs) bands (ev): 0.9661 0.9661 1.6793 1.6793 1.9988 1.9988 3.1220 3.1220 4.1104 4.1104 4.8837 4.8837 4.9305 4.9305 4.9715 4.9715 5.8057 5.8057 6.1251 6.1251 6.4286 6.4286 6.6827 6.6827 7.5292 7.5292 7.6341 7.6341 7.7461 7.7461 7.9409 7.9409 8.0350 8.0350 8.1940 8.1940 8.2531 8.2531 8.2651 8.2651 8.2811 8.2811 8.3217 8.3217 8.4802 8.4802 8.5481 8.5481 9.1902 9.1902 9.2679 9.2679 9.3568 9.3568 9.5880 9.5880 9.6189 9.6189 9.6956 9.6956 9.7406 9.7406 9.9842 9.9842 10.5375 10.5375 10.6920 10.6920 10.7175 10.7175 10.8279 10.8279 k = 0.2109 0.5162 0.5401 ( 7382 PWs) bands (ev): 1.0386 1.0386 1.7308 1.7308 1.8999 1.8999 3.0473 3.0473 4.1683 4.1683 4.8575 4.8575 4.9057 4.9057 4.9852 4.9852 5.8429 5.8429 6.1206 6.1206 6.3835 6.3835 6.6688 6.6688 7.5446 7.5446 7.6327 7.6327 7.7701 7.7701 7.9470 7.9470 8.0086 8.0086 8.2107 8.2107 8.2599 8.2599 8.2834 8.2834 8.2936 8.2936 8.3207 8.3207 8.4665 8.4665 8.5228 8.5228 9.1877 9.1877 9.2559 9.2559 9.3671 9.3671 9.5781 9.5781 9.6199 9.6199 9.6862 9.6862 9.7330 9.7330 9.9513 9.9513 10.5835 10.5835 10.7003 10.7003 10.7445 10.7445 10.8427 10.8427 k = 0.2188 0.5353 0.5401 ( 7386 PWs) bands (ev): 1.1137 1.1137 1.7778 1.7778 1.8035 1.8035 2.9809 2.9809 4.2275 4.2275 4.7859 4.7859 4.9266 4.9266 4.9946 4.9946 5.8764 5.8764 6.1222 6.1222 6.3398 6.3398 6.6545 6.6545 7.5593 7.5593 7.6303 7.6303 7.7941 7.7941 7.9521 7.9521 7.9832 7.9832 8.2258 8.2258 8.2644 8.2644 8.3024 8.3024 8.3069 8.3069 8.3190 8.3190 8.4508 8.4508 8.4978 8.4978 9.1872 9.1872 9.2443 9.2443 9.3773 9.3773 9.5699 9.5699 9.6213 9.6213 9.6779 9.6779 9.7266 9.7266 9.9227 9.9227 10.6307 10.6307 10.7071 10.7071 10.7693 10.7693 10.8529 10.8529 k = 0.2266 0.5544 0.5401 ( 7394 PWs) bands (ev): 1.1912 1.1912 1.7087 1.7087 1.8193 1.8193 2.9249 2.9249 4.2874 4.2874 4.7163 4.7163 4.9460 4.9460 4.9995 4.9995 5.9047 5.9047 6.1301 6.1301 6.2983 6.2983 6.6412 6.6412 7.5728 7.5728 7.6267 7.6267 7.8178 7.8178 7.9549 7.9549 7.9600 7.9600 8.2395 8.2395 8.2677 8.2677 8.3074 8.3074 8.3213 8.3213 8.3302 8.3302 8.4338 8.4338 8.4733 8.4733 9.1888 9.1888 9.2332 9.2332 9.3866 9.3866 9.5634 9.5634 9.6229 9.6229 9.6706 9.6706 9.7216 9.7216 9.8992 9.8992 10.6778 10.6778 10.7129 10.7129 10.7912 10.7912 10.8586 10.8586 k = 0.2344 0.5736 0.5401 ( 7406 PWs) bands (ev): 1.2713 1.2713 1.6166 1.6166 1.8515 1.8515 2.8820 2.8820 4.3466 4.3466 4.6501 4.6501 4.9633 4.9633 4.9999 4.9999 5.9263 5.9263 6.1441 6.1441 6.2599 6.2599 6.6301 6.6301 7.5852 7.5852 7.6217 7.6217 7.8411 7.8411 7.9347 7.9347 7.9596 7.9596 8.2518 8.2518 8.2699 8.2699 8.3011 8.3011 8.3371 8.3371 8.3507 8.3507 8.4166 8.4166 8.4493 8.4493 9.1922 9.1922 9.2228 9.2228 9.3941 9.3941 9.5587 9.5587 9.6245 9.6245 9.6648 9.6648 9.7180 9.7180 9.8818 9.8818 10.7123 10.7123 10.7287 10.7287 10.8095 10.8095 10.8602 10.8602 k = 0.2422 0.5927 0.5401 ( 7418 PWs) bands (ev): 1.3538 1.3538 1.5268 1.5268 1.8722 1.8722 2.8548 2.8548 4.4003 4.4003 4.5923 4.5923 4.9781 4.9781 4.9959 4.9959 5.9400 5.9400 6.1634 6.1634 6.2257 6.2257 6.6228 6.6228 7.5961 7.5961 7.6153 7.6153 7.8635 7.8635 7.9123 7.9123 7.9614 7.9614 8.2622 8.2622 8.2711 8.2711 8.2937 8.2937 8.3523 8.3523 8.3706 8.3706 8.4020 8.4020 8.4262 8.4262 9.1975 9.1975 9.2134 9.2134 9.3990 9.3990 9.5560 9.5560 9.6259 9.6259 9.6608 9.6608 9.7159 9.7159 9.8709 9.8709 10.7166 10.7166 10.7671 10.7671 10.8230 10.8230 10.8587 10.8587 k = 0.2500 0.6118 0.5401 ( 7416 PWs) bands (ev): 1.4370 1.4370 1.4412 1.4412 1.8793 1.8793 2.8455 2.8455 4.4277 4.4277 4.5635 4.5635 4.9874 4.9874 4.9903 4.9903 5.9448 5.9448 6.1805 6.1805 6.2036 6.2036 6.6201 6.6201 7.6043 7.6043 7.6087 7.6087 7.8784 7.8784 7.8974 7.8974 7.9620 7.9620 8.2678 8.2678 8.2712 8.2712 8.2893 8.2893 8.3613 8.3613 8.3782 8.3782 8.4018 8.4018 8.4089 8.4089 9.2043 9.2043 9.2052 9.2052 9.4007 9.4007 9.5550 9.5550 9.6266 9.6266 9.6592 9.6592 9.7152 9.7152 9.8673 9.8673 10.7176 10.7176 10.7862 10.7862 10.8287 10.8287 10.8568 10.8568 Writing output data file ZrxAl2Fex4.save init_run : 0.36s CPU 0.50s WALL ( 1 calls) electrons : 468.51s CPU 472.81s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 468.50s CPU 472.80s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.15s CPU 0.17s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.15s CPU 0.23s WALL ( 264 calls) cegterg : 412.70s CPU 415.97s WALL ( 451 calls) Called by sum_band: Called by *egterg: h_psi : 280.61s CPU 283.18s WALL ( 7827 calls) s_psi : 37.45s CPU 37.57s WALL ( 7827 calls) g_psi : 0.75s CPU 0.67s WALL ( 7112 calls) cdiaghg : 89.78s CPU 90.87s WALL ( 7376 calls) cegterg:over : 18.09s CPU 18.08s WALL ( 7112 calls) cegterg:upda : 16.41s CPU 16.33s WALL ( 7112 calls) cegterg:last : 9.81s CPU 9.78s WALL ( 1413 calls) cdiaghg:chol : 5.40s CPU 5.35s WALL ( 7376 calls) cdiaghg:inve : 3.60s CPU 3.82s WALL ( 7376 calls) cdiaghg:para : 6.47s CPU 6.54s WALL ( 14752 calls) Called by h_psi: h_psi:vloc : 208.85s CPU 211.30s WALL ( 7827 calls) h_psi:vnl : 70.96s CPU 71.16s WALL ( 7827 calls) add_vuspsi : 39.80s CPU 39.64s WALL ( 7827 calls) General routines calbec : 31.09s CPU 31.49s WALL ( 7827 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 195.76s CPU 198.43s WALL ( 1266420 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.42s WALL ( 528 calls) Parallel routines fft_scatter : 52.51s CPU 53.70s WALL ( 1266443 calls) PWSCF : 8m13.32s CPU 8m33.41s WALL This run was terminated on: 18:51:12 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=