Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19:31:28 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: ./HfxSiNix2.save/ file Ni.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 53 38 11 925 565 93 Max 54 39 12 927 575 95 Sum 1915 1387 417 33331 20481 3373 bravais-lattice index = 14 lattice parameter (alat) = 10.3977 a.u. unit-cell volume = 455.4461 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 266.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.397688 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.768987 celldm(5)= -0.768987 celldm(6)= 0.537973 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.537973 0.842962 0.000000 ) a(3) = ( -0.768987 -0.421481 0.480639 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.638194 1.040283 ) b(2) = ( 0.000000 1.186293 1.040283 ) b(3) = ( 0.000000 0.000000 2.080565 ) PseudoPot. # 1 for Hf read from file: /users/gautes/Pseudo/Hf.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: fb4a78a955dff820df95c575f14a6778 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1271 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 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 Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Hf 12.00 178.49000 Hf( 1.00) Ni 10.00 58.69340 Ni( 1.00) Si 4.00 28.08550 Si( 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= 381 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 2) = ( 0.0000000 0.0000000 0.0173380), wk = 0.0026247 k( 3) = ( 0.0000000 0.0000000 0.0346761), wk = 0.0026247 k( 4) = ( 0.0000000 0.0000000 0.0520141), wk = 0.0026247 k( 5) = ( 0.0000000 0.0000000 0.0693522), wk = 0.0026247 k( 6) = ( 0.0000000 0.0000000 0.0866902), wk = 0.0026247 k( 7) = ( 0.0000000 0.0000000 0.1040283), wk = 0.0026247 k( 8) = ( 0.0000000 0.0000000 0.1213663), wk = 0.0026247 k( 9) = ( 0.0000000 0.0000000 0.1387044), wk = 0.0026247 k( 10) = ( 0.0000000 0.0000000 0.1560424), wk = 0.0026247 k( 11) = ( 0.0000000 0.0000000 0.1733804), wk = 0.0026247 k( 12) = ( 0.0000000 0.0000000 0.1907185), wk = 0.0026247 k( 13) = ( 0.0000000 0.0000000 0.2080565), wk = 0.0026247 k( 14) = ( 0.0000000 0.0000000 0.2253946), wk = 0.0026247 k( 15) = ( 0.0000000 0.0000000 0.2427326), wk = 0.0026247 k( 16) = ( 0.0000000 0.0000000 0.2600707), wk = 0.0026247 k( 17) = ( 0.0000000 0.0000000 0.2774087), wk = 0.0026247 k( 18) = ( 0.0000000 0.0000000 0.2947468), wk = 0.0026247 k( 19) = ( 0.0000000 0.0000000 0.3120848), wk = 0.0026247 k( 20) = ( 0.0000000 0.0000000 0.3294228), wk = 0.0026247 k( 21) = ( 0.0000000 0.0000000 0.3467609), wk = 0.0026247 k( 22) = ( 0.0000000 0.0000000 0.3640989), wk = 0.0026247 k( 23) = ( 0.0000000 0.0000000 0.3814370), wk = 0.0026247 k( 24) = ( 0.0000000 0.0000000 0.3987750), wk = 0.0026247 k( 25) = ( 0.0000000 0.0000000 0.4161131), wk = 0.0026247 k( 26) = ( 0.0000000 0.0000000 0.4334511), wk = 0.0026247 k( 27) = ( 0.0000000 0.0000000 0.4507892), wk = 0.0026247 k( 28) = ( 0.0000000 0.0000000 0.4681272), wk = 0.0026247 k( 29) = ( 0.0000000 0.0000000 0.4854652), wk = 0.0026247 k( 30) = ( 0.0000000 0.0000000 0.5028033), wk = 0.0026247 k( 31) = ( 0.0000000 0.0000000 0.5201413), wk = 0.0026247 k( 32) = ( 0.0000000 0.0000000 0.5374794), wk = 0.0026247 k( 33) = ( 0.0000000 0.0000000 0.5548174), wk = 0.0026247 k( 34) = ( 0.0000000 0.0000000 0.5721555), wk = 0.0026247 k( 35) = ( 0.0000000 0.0000000 0.5894935), wk = 0.0026247 k( 36) = ( 0.0000000 0.0000000 0.6068315), wk = 0.0026247 k( 37) = ( 0.0000000 0.0000000 0.6241696), wk = 0.0026247 k( 38) = ( 0.0000000 0.0000000 0.6415076), wk = 0.0026247 k( 39) = ( 0.0000000 0.0000000 0.6588457), wk = 0.0026247 k( 40) = ( 0.0000000 0.0000000 0.6761837), wk = 0.0026247 k( 41) = ( 0.0000000 0.0000000 0.6935218), wk = 0.0026247 k( 42) = ( 0.0000000 0.0000000 0.7108598), wk = 0.0026247 k( 43) = ( 0.0000000 0.0000000 0.7281978), wk = 0.0026247 k( 44) = ( 0.0000000 0.0000000 0.7455359), wk = 0.0026247 k( 45) = ( 0.0000000 0.0000000 0.7628739), wk = 0.0026247 k( 46) = ( 0.0000000 0.0000000 0.7802120), wk = 0.0026247 k( 47) = ( 0.0000000 0.0000000 0.7975500), wk = 0.0026247 k( 48) = ( 0.0000000 0.0000000 0.8148881), wk = 0.0026247 k( 49) = ( 0.0000000 0.0000000 0.8322261), wk = 0.0026247 k( 50) = ( 0.0000000 0.0000000 0.8495642), wk = 0.0026247 k( 51) = ( 0.0000000 0.0000000 0.8669022), wk = 0.0026247 k( 52) = ( 0.0000000 0.0000000 0.8842402), wk = 0.0026247 k( 53) = ( 0.0000000 0.0000000 0.9015783), wk = 0.0026247 k( 54) = ( 0.0000000 0.0000000 0.9189163), wk = 0.0026247 k( 55) = ( 0.0000000 0.0000000 0.9362544), wk = 0.0026247 k( 56) = ( 0.0000000 0.0000000 0.9535924), wk = 0.0026247 k( 57) = ( 0.0000000 0.0000000 0.9709305), wk = 0.0026247 k( 58) = ( 0.0000000 0.0000000 0.9882685), wk = 0.0026247 k( 59) = ( 0.0000000 0.0000000 1.0056065), wk = 0.0026247 k( 60) = ( 0.0000000 0.0000000 1.0229446), wk = 0.0026247 k( 61) = ( 0.0000000 0.0000000 1.0402826), wk = 0.0026247 k( 62) = ( 0.0000000 0.0000000 1.0402826), wk = 0.0026247 k( 63) = ( -0.0083448 0.0152250 1.0402826), wk = 0.0026247 k( 64) = ( -0.0166896 0.0304500 1.0402826), wk = 0.0026247 k( 65) = ( -0.0250344 0.0456749 1.0402826), wk = 0.0026247 k( 66) = ( -0.0333792 0.0608999 1.0402826), wk = 0.0026247 k( 67) = ( -0.0417240 0.0761249 1.0402826), wk = 0.0026247 k( 68) = ( -0.0500688 0.0913499 1.0402826), wk = 0.0026247 k( 69) = ( -0.0584136 0.1065749 1.0402826), wk = 0.0026247 k( 70) = ( -0.0667584 0.1217999 1.0402826), wk = 0.0026247 k( 71) = ( -0.0751032 0.1370248 1.0402826), wk = 0.0026247 k( 72) = ( -0.0751032 0.1370248 1.0402826), wk = 0.0026247 k( 73) = ( -0.0810046 0.1477918 1.0280045), wk = 0.0026247 k( 74) = ( -0.0869059 0.1585587 1.0157264), wk = 0.0026247 k( 75) = ( -0.0928073 0.1693256 1.0034483), wk = 0.0026247 k( 76) = ( -0.0987086 0.1800925 0.9911701), wk = 0.0026247 k( 77) = ( -0.1046099 0.1908594 0.9788920), wk = 0.0026247 k( 78) = ( -0.1105113 0.2016264 0.9666139), wk = 0.0026247 k( 79) = ( -0.1164126 0.2123933 0.9543357), wk = 0.0026247 k( 80) = ( -0.1223140 0.2231602 0.9420576), wk = 0.0026247 k( 81) = ( -0.1282153 0.2339272 0.9297794), wk = 0.0026247 k( 82) = ( -0.1341167 0.2446941 0.9175013), wk = 0.0026247 k( 83) = ( -0.1400180 0.2554610 0.9052232), wk = 0.0026247 k( 84) = ( -0.1459194 0.2662279 0.8929451), wk = 0.0026247 k( 85) = ( -0.1518207 0.2769949 0.8806669), wk = 0.0026247 k( 86) = ( -0.1577220 0.2877618 0.8683888), wk = 0.0026247 k( 87) = ( -0.1636234 0.2985287 0.8561107), wk = 0.0026247 k( 88) = ( -0.1695247 0.3092956 0.8438325), wk = 0.0026247 k( 89) = ( -0.1754261 0.3200625 0.8315544), wk = 0.0026247 k( 90) = ( -0.1813274 0.3308295 0.8192763), wk = 0.0026247 k( 91) = ( -0.1872288 0.3415964 0.8069981), wk = 0.0026247 k( 92) = ( -0.1931301 0.3523633 0.7947200), wk = 0.0026247 k( 93) = ( -0.1990314 0.3631302 0.7824419), wk = 0.0026247 k( 94) = ( -0.2049328 0.3738972 0.7701637), wk = 0.0026247 k( 95) = ( -0.2108341 0.3846641 0.7578856), wk = 0.0026247 k( 96) = ( -0.2167355 0.3954310 0.7456075), wk = 0.0026247 k( 97) = ( -0.2226368 0.4061979 0.7333294), wk = 0.0026247 k( 98) = ( -0.2285382 0.4169649 0.7210512), wk = 0.0026247 k( 99) = ( -0.2344395 0.4277318 0.7087731), wk = 0.0026247 k( 100) = ( -0.2403409 0.4384987 0.6964949), wk = 0.0026247 k( 101) = ( -0.2462422 0.4492656 0.6842168), wk = 0.0026247 k( 102) = ( -0.2521435 0.4600326 0.6719387), wk = 0.0026247 k( 103) = ( -0.2580449 0.4707995 0.6596606), wk = 0.0026247 k( 104) = ( -0.2639462 0.4815664 0.6473824), wk = 0.0026247 k( 105) = ( -0.2698476 0.4923333 0.6351043), wk = 0.0026247 k( 106) = ( -0.2757489 0.5031003 0.6228262), wk = 0.0026247 k( 107) = ( -0.2816503 0.5138672 0.6105480), wk = 0.0026247 k( 108) = ( -0.2875516 0.5246341 0.5982699), wk = 0.0026247 k( 109) = ( -0.2875516 0.5246341 0.5982699), wk = 0.0026247 k( 110) = ( -0.2816832 0.5139273 0.5860603), wk = 0.0026247 k( 111) = ( -0.2758148 0.5032205 0.5738507), wk = 0.0026247 k( 112) = ( -0.2699464 0.4925136 0.5616411), wk = 0.0026247 k( 113) = ( -0.2640780 0.4818068 0.5494315), wk = 0.0026247 k( 114) = ( -0.2582096 0.4711000 0.5372220), wk = 0.0026247 k( 115) = ( -0.2523412 0.4603932 0.5250124), wk = 0.0026247 k( 116) = ( -0.2464728 0.4496864 0.5128028), wk = 0.0026247 k( 117) = ( -0.2406044 0.4389796 0.5005932), wk = 0.0026247 k( 118) = ( -0.2347360 0.4282727 0.4883836), wk = 0.0026247 k( 119) = ( -0.2288676 0.4175659 0.4761740), wk = 0.0026247 k( 120) = ( -0.2229992 0.4068591 0.4639644), wk = 0.0026247 k( 121) = ( -0.2171308 0.3961523 0.4517548), wk = 0.0026247 k( 122) = ( -0.2112624 0.3854455 0.4395452), wk = 0.0026247 k( 123) = ( -0.2053940 0.3747386 0.4273356), wk = 0.0026247 k( 124) = ( -0.1995256 0.3640318 0.4151261), wk = 0.0026247 k( 125) = ( -0.1936572 0.3533250 0.4029165), wk = 0.0026247 k( 126) = ( -0.1877888 0.3426182 0.3907069), wk = 0.0026247 k( 127) = ( -0.1819204 0.3319114 0.3784973), wk = 0.0026247 k( 128) = ( -0.1760520 0.3212046 0.3662877), wk = 0.0026247 k( 129) = ( -0.1701836 0.3104977 0.3540781), wk = 0.0026247 k( 130) = ( -0.1643152 0.2997909 0.3418685), wk = 0.0026247 k( 131) = ( -0.1584468 0.2890841 0.3296589), wk = 0.0026247 k( 132) = ( -0.1525784 0.2783773 0.3174493), wk = 0.0026247 k( 133) = ( -0.1467100 0.2676705 0.3052398), wk = 0.0026247 k( 134) = ( -0.1408416 0.2569637 0.2930302), wk = 0.0026247 k( 135) = ( -0.1349732 0.2462568 0.2808206), wk = 0.0026247 k( 136) = ( -0.1291048 0.2355500 0.2686110), wk = 0.0026247 k( 137) = ( -0.1232364 0.2248432 0.2564014), wk = 0.0026247 k( 138) = ( -0.1173680 0.2141364 0.2441918), wk = 0.0026247 k( 139) = ( -0.1114996 0.2034295 0.2319822), wk = 0.0026247 k( 140) = ( -0.1056312 0.1927227 0.2197726), wk = 0.0026247 k( 141) = ( -0.0997628 0.1820159 0.2075630), wk = 0.0026247 k( 142) = ( -0.0938944 0.1713091 0.1953534), wk = 0.0026247 k( 143) = ( -0.0880260 0.1606023 0.1831438), wk = 0.0026247 k( 144) = ( -0.0821576 0.1498955 0.1709343), wk = 0.0026247 k( 145) = ( -0.0762892 0.1391886 0.1587247), wk = 0.0026247 k( 146) = ( -0.0704208 0.1284818 0.1465151), wk = 0.0026247 k( 147) = ( -0.0645524 0.1177750 0.1343055), wk = 0.0026247 k( 148) = ( -0.0586840 0.1070682 0.1220959), wk = 0.0026247 k( 149) = ( -0.0528156 0.0963614 0.1098863), wk = 0.0026247 k( 150) = ( -0.0469472 0.0856545 0.0976767), wk = 0.0026247 k( 151) = ( -0.0410788 0.0749477 0.0854671), wk = 0.0026247 k( 152) = ( -0.0352104 0.0642409 0.0732575), wk = 0.0026247 k( 153) = ( -0.0293420 0.0535341 0.0610479), wk = 0.0026247 k( 154) = ( -0.0234736 0.0428273 0.0488384), wk = 0.0026247 k( 155) = ( -0.0176052 0.0321205 0.0366288), wk = 0.0026247 k( 156) = ( -0.0117368 0.0214136 0.0244192), wk = 0.0026247 k( 157) = ( -0.0058684 0.0107068 0.0122096), wk = 0.0026247 k( 158) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 160) = ( 0.0151515 0.0083045 -0.0000000), wk = 0.0026247 k( 161) = ( 0.0303030 0.0166091 -0.0000000), wk = 0.0026247 k( 162) = ( 0.0454546 0.0249136 -0.0000000), wk = 0.0026247 k( 163) = ( 0.0606061 0.0332181 -0.0000000), wk = 0.0026247 k( 164) = ( 0.0757576 0.0415227 -0.0000000), wk = 0.0026247 k( 165) = ( 0.0909091 0.0498272 -0.0000000), wk = 0.0026247 k( 166) = ( 0.1060606 0.0581318 -0.0000000), wk = 0.0026247 k( 167) = ( 0.1212121 0.0664363 -0.0000000), wk = 0.0026247 k( 168) = ( 0.1363636 0.0747408 -0.0000000), wk = 0.0026247 k( 169) = ( 0.1515151 0.0830454 -0.0000000), wk = 0.0026247 k( 170) = ( 0.1666667 0.0913499 -0.0000000), wk = 0.0026247 k( 171) = ( 0.1818182 0.0996544 -0.0000000), wk = 0.0026247 k( 172) = ( 0.1969697 0.1079590 -0.0000000), wk = 0.0026247 k( 173) = ( 0.2121212 0.1162635 -0.0000000), wk = 0.0026247 k( 174) = ( 0.2272727 0.1245680 -0.0000000), wk = 0.0026247 k( 175) = ( 0.2424242 0.1328726 -0.0000000), wk = 0.0026247 k( 176) = ( 0.2575758 0.1411771 -0.0000000), wk = 0.0026247 k( 177) = ( 0.2727273 0.1494816 -0.0000000), wk = 0.0026247 k( 178) = ( 0.2878788 0.1577862 -0.0000000), wk = 0.0026247 k( 179) = ( 0.3030303 0.1660907 -0.0000000), wk = 0.0026247 k( 180) = ( 0.3181818 0.1743952 -0.0000000), wk = 0.0026247 k( 181) = ( 0.3333333 0.1826998 -0.0000000), wk = 0.0026247 k( 182) = ( 0.3484849 0.1910043 -0.0000000), wk = 0.0026247 k( 183) = ( 0.3636364 0.1993089 -0.0000000), wk = 0.0026247 k( 184) = ( 0.3787879 0.2076134 -0.0000000), wk = 0.0026247 k( 185) = ( 0.3939394 0.2159179 -0.0000000), wk = 0.0026247 k( 186) = ( 0.4090909 0.2242225 -0.0000000), wk = 0.0026247 k( 187) = ( 0.4242424 0.2325270 -0.0000000), wk = 0.0026247 k( 188) = ( 0.4393939 0.2408315 -0.0000000), wk = 0.0026247 k( 189) = ( 0.4545455 0.2491361 -0.0000000), wk = 0.0026247 k( 190) = ( 0.4696970 0.2574406 -0.0000000), wk = 0.0026247 k( 191) = ( 0.4848485 0.2657451 -0.0000000), wk = 0.0026247 k( 192) = ( 0.5000000 0.2740497 -0.0000000), wk = 0.0026247 k( 193) = ( 0.5000000 0.2740497 -0.0000000), wk = 0.0026247 k( 194) = ( 0.4940987 0.2848166 0.0122781), wk = 0.0026247 k( 195) = ( 0.4881973 0.2955835 0.0245563), wk = 0.0026247 k( 196) = ( 0.4822960 0.3063504 0.0368344), wk = 0.0026247 k( 197) = ( 0.4763946 0.3171174 0.0491125), wk = 0.0026247 k( 198) = ( 0.4704933 0.3278843 0.0613907), wk = 0.0026247 k( 199) = ( 0.4645919 0.3386512 0.0736688), wk = 0.0026247 k( 200) = ( 0.4586906 0.3494181 0.0859469), wk = 0.0026247 k( 201) = ( 0.4527892 0.3601851 0.0982250), wk = 0.0026247 k( 202) = ( 0.4468879 0.3709520 0.1105032), wk = 0.0026247 k( 203) = ( 0.4409866 0.3817189 0.1227813), wk = 0.0026247 k( 204) = ( 0.4350852 0.3924858 0.1350595), wk = 0.0026247 k( 205) = ( 0.4291839 0.4032528 0.1473376), wk = 0.0026247 k( 206) = ( 0.4232825 0.4140197 0.1596157), wk = 0.0026247 k( 207) = ( 0.4173812 0.4247866 0.1718938), wk = 0.0026247 k( 208) = ( 0.4114798 0.4355535 0.1841720), wk = 0.0026247 k( 209) = ( 0.4055785 0.4463205 0.1964501), wk = 0.0026247 k( 210) = ( 0.3996771 0.4570874 0.2087282), wk = 0.0026247 k( 211) = ( 0.3937758 0.4678543 0.2210064), wk = 0.0026247 k( 212) = ( 0.3878745 0.4786212 0.2332845), wk = 0.0026247 k( 213) = ( 0.3819731 0.4893882 0.2455626), wk = 0.0026247 k( 214) = ( 0.3760718 0.5001551 0.2578408), wk = 0.0026247 k( 215) = ( 0.3701704 0.5109220 0.2701189), wk = 0.0026247 k( 216) = ( 0.3642691 0.5216889 0.2823970), wk = 0.0026247 k( 217) = ( 0.3583677 0.5324559 0.2946752), wk = 0.0026247 k( 218) = ( 0.3524664 0.5432228 0.3069533), wk = 0.0026247 k( 219) = ( 0.3465650 0.5539897 0.3192314), wk = 0.0026247 k( 220) = ( 0.3406637 0.5647566 0.3315096), wk = 0.0026247 k( 221) = ( 0.3347624 0.5755236 0.3437877), wk = 0.0026247 k( 222) = ( 0.3288610 0.5862905 0.3560658), wk = 0.0026247 k( 223) = ( 0.3229597 0.5970574 0.3683439), wk = 0.0026247 k( 224) = ( 0.3170583 0.6078243 0.3806221), wk = 0.0026247 k( 225) = ( 0.3111570 0.6185912 0.3929002), wk = 0.0026247 k( 226) = ( 0.3052556 0.6293582 0.4051784), wk = 0.0026247 k( 227) = ( 0.2993543 0.6401251 0.4174565), wk = 0.0026247 k( 228) = ( 0.2934530 0.6508920 0.4297346), wk = 0.0026247 k( 229) = ( 0.2875516 0.6616589 0.4420127), wk = 0.0026247 k( 230) = ( 0.2875516 0.6616589 0.4420127), wk = 0.0026247 k( 231) = ( 0.2715765 0.6578527 0.4463532), wk = 0.0026247 k( 232) = ( 0.2556014 0.6540465 0.4506937), wk = 0.0026247 k( 233) = ( 0.2396263 0.6502402 0.4550342), wk = 0.0026247 k( 234) = ( 0.2236512 0.6464340 0.4593747), wk = 0.0026247 k( 235) = ( 0.2076762 0.6426277 0.4637151), wk = 0.0026247 k( 236) = ( 0.1917011 0.6388215 0.4680556), wk = 0.0026247 k( 237) = ( 0.1757260 0.6350152 0.4723961), wk = 0.0026247 k( 238) = ( 0.1597509 0.6312090 0.4767365), wk = 0.0026247 k( 239) = ( 0.1437758 0.6274027 0.4810770), wk = 0.0026247 k( 240) = ( 0.1278007 0.6235965 0.4854175), wk = 0.0026247 k( 241) = ( 0.1118256 0.6197902 0.4897580), wk = 0.0026247 k( 242) = ( 0.0958505 0.6159840 0.4940985), wk = 0.0026247 k( 243) = ( 0.0798755 0.6121777 0.4984389), wk = 0.0026247 k( 244) = ( 0.0639004 0.6083715 0.5027794), wk = 0.0026247 k( 245) = ( 0.0479253 0.6045653 0.5071199), wk = 0.0026247 k( 246) = ( 0.0319502 0.6007590 0.5114604), wk = 0.0026247 k( 247) = ( 0.0159751 0.5969528 0.5158008), wk = 0.0026247 k( 248) = ( 0.0000000 0.5931465 0.5201413), wk = 0.0026247 k( 249) = ( 0.0000000 0.5931465 0.5201413), wk = 0.0026247 k( 250) = ( 0.0059524 0.5822865 0.5325256), wk = 0.0026247 k( 251) = ( 0.0119048 0.5714264 0.5449100), wk = 0.0026247 k( 252) = ( 0.0178571 0.5605664 0.5572943), wk = 0.0026247 k( 253) = ( 0.0238095 0.5497064 0.5696786), wk = 0.0026247 k( 254) = ( 0.0297619 0.5388463 0.5820629), wk = 0.0026247 k( 255) = ( 0.0357143 0.5279863 0.5944472), wk = 0.0026247 k( 256) = ( 0.0416667 0.5171262 0.6068315), wk = 0.0026247 k( 257) = ( 0.0476191 0.5062662 0.6192159), wk = 0.0026247 k( 258) = ( 0.0535714 0.4954062 0.6316002), wk = 0.0026247 k( 259) = ( 0.0595238 0.4845461 0.6439845), wk = 0.0026247 k( 260) = ( 0.0654762 0.4736861 0.6563688), wk = 0.0026247 k( 261) = ( 0.0714286 0.4628260 0.6687531), wk = 0.0026247 k( 262) = ( 0.0773810 0.4519660 0.6811374), wk = 0.0026247 k( 263) = ( 0.0833333 0.4411060 0.6935218), wk = 0.0026247 k( 264) = ( 0.0892857 0.4302459 0.7059061), wk = 0.0026247 k( 265) = ( 0.0952381 0.4193859 0.7182904), wk = 0.0026247 k( 266) = ( 0.1011905 0.4085258 0.7306747), wk = 0.0026247 k( 267) = ( 0.1071429 0.3976658 0.7430590), wk = 0.0026247 k( 268) = ( 0.1130952 0.3868058 0.7554434), wk = 0.0026247 k( 269) = ( 0.1190476 0.3759457 0.7678277), wk = 0.0026247 k( 270) = ( 0.1250000 0.3650857 0.7802120), wk = 0.0026247 k( 271) = ( 0.1309524 0.3542256 0.7925963), wk = 0.0026247 k( 272) = ( 0.1369048 0.3433656 0.8049806), wk = 0.0026247 k( 273) = ( 0.1428571 0.3325056 0.8173649), wk = 0.0026247 k( 274) = ( 0.1488095 0.3216455 0.8297492), wk = 0.0026247 k( 275) = ( 0.1547619 0.3107855 0.8421336), wk = 0.0026247 k( 276) = ( 0.1607143 0.2999254 0.8545179), wk = 0.0026247 k( 277) = ( 0.1666667 0.2890654 0.8669022), wk = 0.0026247 k( 278) = ( 0.1726190 0.2782054 0.8792865), wk = 0.0026247 k( 279) = ( 0.1785714 0.2673453 0.8916708), wk = 0.0026247 k( 280) = ( 0.1845238 0.2564853 0.9040552), wk = 0.0026247 k( 281) = ( 0.1904762 0.2456252 0.9164395), wk = 0.0026247 k( 282) = ( 0.1964286 0.2347652 0.9288238), wk = 0.0026247 k( 283) = ( 0.2023810 0.2239052 0.9412081), wk = 0.0026247 k( 284) = ( 0.2083333 0.2130451 0.9535924), wk = 0.0026247 k( 285) = ( 0.2142857 0.2021851 0.9659767), wk = 0.0026247 k( 286) = ( 0.2202381 0.1913250 0.9783611), wk = 0.0026247 k( 287) = ( 0.2261905 0.1804650 0.9907454), wk = 0.0026247 k( 288) = ( 0.2321429 0.1696050 1.0031297), wk = 0.0026247 k( 289) = ( 0.2380952 0.1587449 1.0155140), wk = 0.0026247 k( 290) = ( 0.2440476 0.1478849 1.0278983), wk = 0.0026247 k( 291) = ( 0.2500000 0.1370248 1.0402826), wk = 0.0026247 k( 292) = ( 0.2500000 0.1370248 1.0402826), wk = 0.0026247 k( 293) = ( 0.2631579 0.1442367 1.0320586), wk = 0.0026247 k( 294) = ( 0.2763158 0.1514485 1.0238345), wk = 0.0026247 k( 295) = ( 0.2894737 0.1586603 1.0156104), wk = 0.0026247 k( 296) = ( 0.3026316 0.1658722 1.0073864), wk = 0.0026247 k( 297) = ( 0.3157895 0.1730840 0.9991623), wk = 0.0026247 k( 298) = ( 0.3289474 0.1802958 0.9909383), wk = 0.0026247 k( 299) = ( 0.3421053 0.1875077 0.9827142), wk = 0.0026247 k( 300) = ( 0.3552632 0.1947195 0.9744902), wk = 0.0026247 k( 301) = ( 0.3684211 0.2019313 0.9662661), wk = 0.0026247 k( 302) = ( 0.3815789 0.2091432 0.9580420), wk = 0.0026247 k( 303) = ( 0.3947368 0.2163550 0.9498180), wk = 0.0026247 k( 304) = ( 0.4078947 0.2235668 0.9415939), wk = 0.0026247 k( 305) = ( 0.4210526 0.2307787 0.9333698), wk = 0.0026247 k( 306) = ( 0.4342105 0.2379905 0.9251458), wk = 0.0026247 k( 307) = ( 0.4473684 0.2452023 0.9169217), wk = 0.0026247 k( 308) = ( 0.4605263 0.2524142 0.9086977), wk = 0.0026247 k( 309) = ( 0.4736842 0.2596260 0.9004736), wk = 0.0026247 k( 310) = ( 0.4868421 0.2668378 0.8922495), wk = 0.0026247 k( 311) = ( 0.5000000 0.2740497 0.8840255), wk = 0.0026247 k( 312) = ( 0.5000000 0.2740497 0.8840255), wk = 0.0026247 k( 313) = ( 0.5000000 0.2740497 0.8666917), wk = 0.0026247 k( 314) = ( 0.5000000 0.2740497 0.8493578), wk = 0.0026247 k( 315) = ( 0.5000000 0.2740497 0.8320240), wk = 0.0026247 k( 316) = ( 0.5000000 0.2740497 0.8146902), wk = 0.0026247 k( 317) = ( 0.5000000 0.2740497 0.7973563), wk = 0.0026247 k( 318) = ( 0.5000000 0.2740497 0.7800225), wk = 0.0026247 k( 319) = ( 0.5000000 0.2740497 0.7626886), wk = 0.0026247 k( 320) = ( 0.5000000 0.2740497 0.7453548), wk = 0.0026247 k( 321) = ( 0.5000000 0.2740497 0.7280210), wk = 0.0026247 k( 322) = ( 0.5000000 0.2740497 0.7106871), wk = 0.0026247 k( 323) = ( 0.5000000 0.2740497 0.6933533), wk = 0.0026247 k( 324) = ( 0.5000000 0.2740497 0.6760195), wk = 0.0026247 k( 325) = ( 0.5000000 0.2740497 0.6586856), wk = 0.0026247 k( 326) = ( 0.5000000 0.2740497 0.6413518), wk = 0.0026247 k( 327) = ( 0.5000000 0.2740497 0.6240180), wk = 0.0026247 k( 328) = ( 0.5000000 0.2740497 0.6066842), wk = 0.0026247 k( 329) = ( 0.5000000 0.2740497 0.5893503), wk = 0.0026247 k( 330) = ( 0.5000000 0.2740497 0.5720165), wk = 0.0026247 k( 331) = ( 0.5000000 0.2740497 0.5546827), wk = 0.0026247 k( 332) = ( 0.5000000 0.2740497 0.5373488), wk = 0.0026247 k( 333) = ( 0.5000000 0.2740497 0.5200150), wk = 0.0026247 k( 334) = ( 0.5000000 0.2740497 0.5026812), wk = 0.0026247 k( 335) = ( 0.5000000 0.2740497 0.4853473), wk = 0.0026247 k( 336) = ( 0.5000000 0.2740497 0.4680135), wk = 0.0026247 k( 337) = ( 0.5000000 0.2740497 0.4506797), wk = 0.0026247 k( 338) = ( 0.5000000 0.2740497 0.4333458), wk = 0.0026247 k( 339) = ( 0.5000000 0.2740497 0.4160120), wk = 0.0026247 k( 340) = ( 0.5000000 0.2740497 0.3986781), wk = 0.0026247 k( 341) = ( 0.5000000 0.2740497 0.3813443), wk = 0.0026247 k( 342) = ( 0.5000000 0.2740497 0.3640105), wk = 0.0026247 k( 343) = ( 0.5000000 0.2740497 0.3466767), wk = 0.0026247 k( 344) = ( 0.5000000 0.2740497 0.3293428), wk = 0.0026247 k( 345) = ( 0.5000000 0.2740497 0.3120090), wk = 0.0026247 k( 346) = ( 0.5000000 0.2740497 0.2946752), wk = 0.0026247 k( 347) = ( 0.5000000 0.2740497 0.2773413), wk = 0.0026247 k( 348) = ( 0.5000000 0.2740497 0.2600075), wk = 0.0026247 k( 349) = ( 0.5000000 0.2740497 0.2426737), wk = 0.0026247 k( 350) = ( 0.5000000 0.2740497 0.2253398), wk = 0.0026247 k( 351) = ( 0.5000000 0.2740497 0.2080060), wk = 0.0026247 k( 352) = ( 0.5000000 0.2740497 0.1906722), wk = 0.0026247 k( 353) = ( 0.5000000 0.2740497 0.1733383), wk = 0.0026247 k( 354) = ( 0.5000000 0.2740497 0.1560045), wk = 0.0026247 k( 355) = ( 0.5000000 0.2740497 0.1386707), wk = 0.0026247 k( 356) = ( 0.5000000 0.2740497 0.1213368), wk = 0.0026247 k( 357) = ( 0.5000000 0.2740497 0.1040030), wk = 0.0026247 k( 358) = ( 0.5000000 0.2740497 0.0866692), wk = 0.0026247 k( 359) = ( 0.5000000 0.2740497 0.0693353), wk = 0.0026247 k( 360) = ( 0.5000000 0.2740497 0.0520015), wk = 0.0026247 k( 361) = ( 0.5000000 0.2740497 0.0346677), wk = 0.0026247 k( 362) = ( 0.5000000 0.2740497 0.0173338), wk = 0.0026247 k( 363) = ( 0.5000000 0.2740497 -0.0000000), wk = 0.0026247 k( 364) = ( 0.0000000 0.0000000 1.0402826), wk = 0.0026247 k( 365) = ( 0.0147059 0.0080603 1.0402826), wk = 0.0026247 k( 366) = ( 0.0294118 0.0161206 1.0402826), wk = 0.0026247 k( 367) = ( 0.0441177 0.0241809 1.0402826), wk = 0.0026247 k( 368) = ( 0.0588235 0.0322411 1.0402826), wk = 0.0026247 k( 369) = ( 0.0735294 0.0403014 1.0402826), wk = 0.0026247 k( 370) = ( 0.0882353 0.0483617 1.0402826), wk = 0.0026247 k( 371) = ( 0.1029412 0.0564220 1.0402826), wk = 0.0026247 k( 372) = ( 0.1176471 0.0644823 1.0402826), wk = 0.0026247 k( 373) = ( 0.1323529 0.0725426 1.0402826), wk = 0.0026247 k( 374) = ( 0.1470588 0.0806028 1.0402826), wk = 0.0026247 k( 375) = ( 0.1617647 0.0886631 1.0402826), wk = 0.0026247 k( 376) = ( 0.1764706 0.0967234 1.0402826), wk = 0.0026247 k( 377) = ( 0.1911765 0.1047837 1.0402826), wk = 0.0026247 k( 378) = ( 0.2058823 0.1128440 1.0402826), wk = 0.0026247 k( 379) = ( 0.2205882 0.1209043 1.0402826), wk = 0.0026247 k( 380) = ( 0.2352941 0.1289646 1.0402826), wk = 0.0026247 k( 381) = ( 0.2500000 0.1370248 1.0402826), wk = 0.0026247 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 2) = ( 0.0000000 0.0000000 0.0083333), wk = 0.0026247 k( 3) = ( 0.0000000 0.0000000 0.0166667), wk = 0.0026247 k( 4) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0026247 k( 5) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0026247 k( 6) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0026247 k( 7) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0026247 k( 8) = ( 0.0000000 0.0000000 0.0583333), wk = 0.0026247 k( 9) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0026247 k( 10) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0026247 k( 11) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0026247 k( 12) = ( 0.0000000 0.0000000 0.0916667), wk = 0.0026247 k( 13) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0026247 k( 14) = ( 0.0000000 0.0000000 0.1083333), wk = 0.0026247 k( 15) = ( 0.0000000 0.0000000 0.1166667), wk = 0.0026247 k( 16) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0026247 k( 17) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0026247 k( 18) = ( 0.0000000 0.0000000 0.1416667), wk = 0.0026247 k( 19) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0026247 k( 20) = ( 0.0000000 0.0000000 0.1583333), wk = 0.0026247 k( 21) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0026247 k( 22) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0026247 k( 23) = ( 0.0000000 0.0000000 0.1833333), wk = 0.0026247 k( 24) = ( 0.0000000 0.0000000 0.1916667), wk = 0.0026247 k( 25) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0026247 k( 26) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0026247 k( 27) = ( 0.0000000 0.0000000 0.2166667), wk = 0.0026247 k( 28) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0026247 k( 29) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0026247 k( 30) = ( 0.0000000 0.0000000 0.2416667), wk = 0.0026247 k( 31) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0026247 k( 32) = ( 0.0000000 0.0000000 0.2583333), wk = 0.0026247 k( 33) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0026247 k( 34) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0026247 k( 35) = ( 0.0000000 0.0000000 0.2833333), wk = 0.0026247 k( 36) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0026247 k( 37) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0026247 k( 38) = ( 0.0000000 0.0000000 0.3083333), wk = 0.0026247 k( 39) = ( 0.0000000 0.0000000 0.3166667), wk = 0.0026247 k( 40) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0026247 k( 41) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0026247 k( 42) = ( 0.0000000 0.0000000 0.3416667), wk = 0.0026247 k( 43) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0026247 k( 44) = ( 0.0000000 0.0000000 0.3583333), wk = 0.0026247 k( 45) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0026247 k( 46) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0026247 k( 47) = ( 0.0000000 0.0000000 0.3833333), wk = 0.0026247 k( 48) = ( 0.0000000 0.0000000 0.3916667), wk = 0.0026247 k( 49) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0026247 k( 50) = ( 0.0000000 0.0000000 0.4083333), wk = 0.0026247 k( 51) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0026247 k( 52) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0026247 k( 53) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0026247 k( 54) = ( 0.0000000 0.0000000 0.4416667), wk = 0.0026247 k( 55) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0026247 k( 56) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0026247 k( 57) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0026247 k( 58) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0026247 k( 59) = ( 0.0000000 0.0000000 0.4833333), wk = 0.0026247 k( 60) = ( 0.0000000 0.0000000 0.4916667), wk = 0.0026247 k( 61) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026247 k( 62) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026247 k( 63) = ( -0.0083448 0.0083448 0.5000000), wk = 0.0026247 k( 64) = ( -0.0166896 0.0166896 0.5000000), wk = 0.0026247 k( 65) = ( -0.0250344 0.0250344 0.5000000), wk = 0.0026247 k( 66) = ( -0.0333792 0.0333792 0.5000000), wk = 0.0026247 k( 67) = ( -0.0417240 0.0417240 0.5000000), wk = 0.0026247 k( 68) = ( -0.0500688 0.0500688 0.5000000), wk = 0.0026247 k( 69) = ( -0.0584136 0.0584136 0.5000000), wk = 0.0026247 k( 70) = ( -0.0667584 0.0667584 0.5000000), wk = 0.0026247 k( 71) = ( -0.0751032 0.0751032 0.5000000), wk = 0.0026247 k( 72) = ( -0.0751032 0.0751032 0.5000000), wk = 0.0026247 k( 73) = ( -0.0810046 0.0810046 0.4940987), wk = 0.0026247 k( 74) = ( -0.0869059 0.0869059 0.4881973), wk = 0.0026247 k( 75) = ( -0.0928073 0.0928073 0.4822960), wk = 0.0026247 k( 76) = ( -0.0987086 0.0987086 0.4763946), wk = 0.0026247 k( 77) = ( -0.1046099 0.1046099 0.4704933), wk = 0.0026247 k( 78) = ( -0.1105113 0.1105113 0.4645919), wk = 0.0026247 k( 79) = ( -0.1164126 0.1164126 0.4586906), wk = 0.0026247 k( 80) = ( -0.1223140 0.1223140 0.4527893), wk = 0.0026247 k( 81) = ( -0.1282153 0.1282153 0.4468879), wk = 0.0026247 k( 82) = ( -0.1341167 0.1341167 0.4409866), wk = 0.0026247 k( 83) = ( -0.1400180 0.1400180 0.4350852), wk = 0.0026247 k( 84) = ( -0.1459194 0.1459194 0.4291839), wk = 0.0026247 k( 85) = ( -0.1518207 0.1518207 0.4232825), wk = 0.0026247 k( 86) = ( -0.1577220 0.1577220 0.4173812), wk = 0.0026247 k( 87) = ( -0.1636234 0.1636234 0.4114798), wk = 0.0026247 k( 88) = ( -0.1695247 0.1695247 0.4055785), wk = 0.0026247 k( 89) = ( -0.1754261 0.1754261 0.3996771), wk = 0.0026247 k( 90) = ( -0.1813274 0.1813274 0.3937758), wk = 0.0026247 k( 91) = ( -0.1872288 0.1872288 0.3878745), wk = 0.0026247 k( 92) = ( -0.1931301 0.1931301 0.3819731), wk = 0.0026247 k( 93) = ( -0.1990314 0.1990314 0.3760718), wk = 0.0026247 k( 94) = ( -0.2049328 0.2049328 0.3701704), wk = 0.0026247 k( 95) = ( -0.2108341 0.2108341 0.3642691), wk = 0.0026247 k( 96) = ( -0.2167355 0.2167355 0.3583677), wk = 0.0026247 k( 97) = ( -0.2226368 0.2226368 0.3524664), wk = 0.0026247 k( 98) = ( -0.2285382 0.2285382 0.3465650), wk = 0.0026247 k( 99) = ( -0.2344395 0.2344395 0.3406637), wk = 0.0026247 k( 100) = ( -0.2403409 0.2403409 0.3347624), wk = 0.0026247 k( 101) = ( -0.2462422 0.2462422 0.3288610), wk = 0.0026247 k( 102) = ( -0.2521435 0.2521436 0.3229597), wk = 0.0026247 k( 103) = ( -0.2580449 0.2580449 0.3170583), wk = 0.0026247 k( 104) = ( -0.2639462 0.2639462 0.3111570), wk = 0.0026247 k( 105) = ( -0.2698476 0.2698476 0.3052556), wk = 0.0026247 k( 106) = ( -0.2757489 0.2757489 0.2993543), wk = 0.0026247 k( 107) = ( -0.2816503 0.2816503 0.2934530), wk = 0.0026247 k( 108) = ( -0.2875516 0.2875516 0.2875516), wk = 0.0026247 k( 109) = ( -0.2875516 0.2875516 0.2875516), wk = 0.0026247 k( 110) = ( -0.2816832 0.2816832 0.2816832), wk = 0.0026247 k( 111) = ( -0.2758148 0.2758148 0.2758148), wk = 0.0026247 k( 112) = ( -0.2699464 0.2699464 0.2699464), wk = 0.0026247 k( 113) = ( -0.2640780 0.2640780 0.2640780), wk = 0.0026247 k( 114) = ( -0.2582096 0.2582096 0.2582096), wk = 0.0026247 k( 115) = ( -0.2523412 0.2523412 0.2523412), wk = 0.0026247 k( 116) = ( -0.2464728 0.2464728 0.2464728), wk = 0.0026247 k( 117) = ( -0.2406044 0.2406044 0.2406044), wk = 0.0026247 k( 118) = ( -0.2347360 0.2347360 0.2347360), wk = 0.0026247 k( 119) = ( -0.2288676 0.2288676 0.2288676), wk = 0.0026247 k( 120) = ( -0.2229992 0.2229992 0.2229992), wk = 0.0026247 k( 121) = ( -0.2171308 0.2171308 0.2171308), wk = 0.0026247 k( 122) = ( -0.2112624 0.2112624 0.2112624), wk = 0.0026247 k( 123) = ( -0.2053940 0.2053940 0.2053940), wk = 0.0026247 k( 124) = ( -0.1995256 0.1995256 0.1995256), wk = 0.0026247 k( 125) = ( -0.1936572 0.1936572 0.1936572), wk = 0.0026247 k( 126) = ( -0.1877888 0.1877888 0.1877888), wk = 0.0026247 k( 127) = ( -0.1819204 0.1819204 0.1819204), wk = 0.0026247 k( 128) = ( -0.1760520 0.1760520 0.1760520), wk = 0.0026247 k( 129) = ( -0.1701836 0.1701836 0.1701836), wk = 0.0026247 k( 130) = ( -0.1643152 0.1643152 0.1643152), wk = 0.0026247 k( 131) = ( -0.1584468 0.1584468 0.1584468), wk = 0.0026247 k( 132) = ( -0.1525784 0.1525784 0.1525784), wk = 0.0026247 k( 133) = ( -0.1467100 0.1467100 0.1467100), wk = 0.0026247 k( 134) = ( -0.1408416 0.1408416 0.1408416), wk = 0.0026247 k( 135) = ( -0.1349732 0.1349732 0.1349732), wk = 0.0026247 k( 136) = ( -0.1291048 0.1291048 0.1291048), wk = 0.0026247 k( 137) = ( -0.1232364 0.1232364 0.1232364), wk = 0.0026247 k( 138) = ( -0.1173680 0.1173680 0.1173680), wk = 0.0026247 k( 139) = ( -0.1114996 0.1114996 0.1114996), wk = 0.0026247 k( 140) = ( -0.1056312 0.1056312 0.1056312), wk = 0.0026247 k( 141) = ( -0.0997628 0.0997628 0.0997628), wk = 0.0026247 k( 142) = ( -0.0938944 0.0938944 0.0938944), wk = 0.0026247 k( 143) = ( -0.0880260 0.0880260 0.0880260), wk = 0.0026247 k( 144) = ( -0.0821576 0.0821576 0.0821576), wk = 0.0026247 k( 145) = ( -0.0762892 0.0762892 0.0762892), wk = 0.0026247 k( 146) = ( -0.0704208 0.0704208 0.0704208), wk = 0.0026247 k( 147) = ( -0.0645524 0.0645524 0.0645524), wk = 0.0026247 k( 148) = ( -0.0586840 0.0586840 0.0586840), wk = 0.0026247 k( 149) = ( -0.0528156 0.0528156 0.0528156), wk = 0.0026247 k( 150) = ( -0.0469472 0.0469472 0.0469472), wk = 0.0026247 k( 151) = ( -0.0410788 0.0410788 0.0410788), wk = 0.0026247 k( 152) = ( -0.0352104 0.0352104 0.0352104), wk = 0.0026247 k( 153) = ( -0.0293420 0.0293420 0.0293420), wk = 0.0026247 k( 154) = ( -0.0234736 0.0234736 0.0234736), wk = 0.0026247 k( 155) = ( -0.0176052 0.0176052 0.0176052), wk = 0.0026247 k( 156) = ( -0.0117368 0.0117368 0.0117368), wk = 0.0026247 k( 157) = ( -0.0058684 0.0058684 0.0058684), wk = 0.0026247 k( 158) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026247 k( 160) = ( 0.0151515 0.0151515 -0.0151515), wk = 0.0026247 k( 161) = ( 0.0303030 0.0303030 -0.0303030), wk = 0.0026247 k( 162) = ( 0.0454546 0.0454545 -0.0454546), wk = 0.0026247 k( 163) = ( 0.0606061 0.0606061 -0.0606061), wk = 0.0026247 k( 164) = ( 0.0757576 0.0757576 -0.0757576), wk = 0.0026247 k( 165) = ( 0.0909091 0.0909091 -0.0909091), wk = 0.0026247 k( 166) = ( 0.1060606 0.1060606 -0.1060606), wk = 0.0026247 k( 167) = ( 0.1212121 0.1212121 -0.1212121), wk = 0.0026247 k( 168) = ( 0.1363636 0.1363636 -0.1363636), wk = 0.0026247 k( 169) = ( 0.1515151 0.1515151 -0.1515151), wk = 0.0026247 k( 170) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0026247 k( 171) = ( 0.1818182 0.1818182 -0.1818182), wk = 0.0026247 k( 172) = ( 0.1969697 0.1969697 -0.1969697), wk = 0.0026247 k( 173) = ( 0.2121212 0.2121212 -0.2121212), wk = 0.0026247 k( 174) = ( 0.2272727 0.2272727 -0.2272727), wk = 0.0026247 k( 175) = ( 0.2424242 0.2424242 -0.2424242), wk = 0.0026247 k( 176) = ( 0.2575758 0.2575758 -0.2575758), wk = 0.0026247 k( 177) = ( 0.2727273 0.2727273 -0.2727273), wk = 0.0026247 k( 178) = ( 0.2878788 0.2878788 -0.2878788), wk = 0.0026247 k( 179) = ( 0.3030303 0.3030303 -0.3030303), wk = 0.0026247 k( 180) = ( 0.3181818 0.3181818 -0.3181818), wk = 0.0026247 k( 181) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0026247 k( 182) = ( 0.3484849 0.3484848 -0.3484849), wk = 0.0026247 k( 183) = ( 0.3636364 0.3636364 -0.3636364), wk = 0.0026247 k( 184) = ( 0.3787879 0.3787879 -0.3787879), wk = 0.0026247 k( 185) = ( 0.3939394 0.3939394 -0.3939394), wk = 0.0026247 k( 186) = ( 0.4090909 0.4090909 -0.4090909), wk = 0.0026247 k( 187) = ( 0.4242424 0.4242424 -0.4242424), wk = 0.0026247 k( 188) = ( 0.4393939 0.4393939 -0.4393939), wk = 0.0026247 k( 189) = ( 0.4545455 0.4545454 -0.4545455), wk = 0.0026247 k( 190) = ( 0.4696970 0.4696970 -0.4696970), wk = 0.0026247 k( 191) = ( 0.4848485 0.4848485 -0.4848485), wk = 0.0026247 k( 192) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0026247 k( 193) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0026247 k( 194) = ( 0.4940987 0.5059013 -0.4940987), wk = 0.0026247 k( 195) = ( 0.4881973 0.5118027 -0.4881973), wk = 0.0026247 k( 196) = ( 0.4822960 0.5177040 -0.4822960), wk = 0.0026247 k( 197) = ( 0.4763946 0.5236054 -0.4763946), wk = 0.0026247 k( 198) = ( 0.4704933 0.5295067 -0.4704933), wk = 0.0026247 k( 199) = ( 0.4645919 0.5354081 -0.4645919), wk = 0.0026247 k( 200) = ( 0.4586906 0.5413094 -0.4586906), wk = 0.0026247 k( 201) = ( 0.4527892 0.5472107 -0.4527892), wk = 0.0026247 k( 202) = ( 0.4468879 0.5531121 -0.4468879), wk = 0.0026247 k( 203) = ( 0.4409866 0.5590134 -0.4409866), wk = 0.0026247 k( 204) = ( 0.4350852 0.5649148 -0.4350852), wk = 0.0026247 k( 205) = ( 0.4291839 0.5708161 -0.4291839), wk = 0.0026247 k( 206) = ( 0.4232825 0.5767175 -0.4232825), wk = 0.0026247 k( 207) = ( 0.4173812 0.5826188 -0.4173812), wk = 0.0026247 k( 208) = ( 0.4114798 0.5885202 -0.4114798), wk = 0.0026247 k( 209) = ( 0.4055785 0.5944215 -0.4055785), wk = 0.0026247 k( 210) = ( 0.3996771 0.6003228 -0.3996771), wk = 0.0026247 k( 211) = ( 0.3937758 0.6062242 -0.3937758), wk = 0.0026247 k( 212) = ( 0.3878745 0.6121255 -0.3878745), wk = 0.0026247 k( 213) = ( 0.3819731 0.6180269 -0.3819731), wk = 0.0026247 k( 214) = ( 0.3760718 0.6239282 -0.3760718), wk = 0.0026247 k( 215) = ( 0.3701704 0.6298296 -0.3701704), wk = 0.0026247 k( 216) = ( 0.3642691 0.6357309 -0.3642691), wk = 0.0026247 k( 217) = ( 0.3583677 0.6416323 -0.3583677), wk = 0.0026247 k( 218) = ( 0.3524664 0.6475336 -0.3524664), wk = 0.0026247 k( 219) = ( 0.3465650 0.6534349 -0.3465650), wk = 0.0026247 k( 220) = ( 0.3406637 0.6593363 -0.3406637), wk = 0.0026247 k( 221) = ( 0.3347624 0.6652376 -0.3347624), wk = 0.0026247 k( 222) = ( 0.3288610 0.6711390 -0.3288610), wk = 0.0026247 k( 223) = ( 0.3229597 0.6770403 -0.3229597), wk = 0.0026247 k( 224) = ( 0.3170583 0.6829417 -0.3170583), wk = 0.0026247 k( 225) = ( 0.3111570 0.6888430 -0.3111570), wk = 0.0026247 k( 226) = ( 0.3052556 0.6947444 -0.3052556), wk = 0.0026247 k( 227) = ( 0.2993543 0.7006457 -0.2993543), wk = 0.0026247 k( 228) = ( 0.2934530 0.7065470 -0.2934530), wk = 0.0026247 k( 229) = ( 0.2875516 0.7124484 -0.2875516), wk = 0.0026247 k( 230) = ( 0.2875516 0.7124484 -0.2875516), wk = 0.0026247 k( 231) = ( 0.2715765 0.7006457 -0.2715765), wk = 0.0026247 k( 232) = ( 0.2556014 0.6888430 -0.2556014), wk = 0.0026247 k( 233) = ( 0.2396263 0.6770403 -0.2396263), wk = 0.0026247 k( 234) = ( 0.2236512 0.6652376 -0.2236512), wk = 0.0026247 k( 235) = ( 0.2076762 0.6534349 -0.2076762), wk = 0.0026247 k( 236) = ( 0.1917011 0.6416323 -0.1917011), wk = 0.0026247 k( 237) = ( 0.1757260 0.6298296 -0.1757260), wk = 0.0026247 k( 238) = ( 0.1597509 0.6180269 -0.1597509), wk = 0.0026247 k( 239) = ( 0.1437758 0.6062242 -0.1437758), wk = 0.0026247 k( 240) = ( 0.1278007 0.5944215 -0.1278007), wk = 0.0026247 k( 241) = ( 0.1118256 0.5826188 -0.1118256), wk = 0.0026247 k( 242) = ( 0.0958505 0.5708161 -0.0958505), wk = 0.0026247 k( 243) = ( 0.0798755 0.5590134 -0.0798755), wk = 0.0026247 k( 244) = ( 0.0639004 0.5472107 -0.0639004), wk = 0.0026247 k( 245) = ( 0.0479253 0.5354081 -0.0479253), wk = 0.0026247 k( 246) = ( 0.0319502 0.5236054 -0.0319502), wk = 0.0026247 k( 247) = ( 0.0159751 0.5118027 -0.0159751), wk = 0.0026247 k( 248) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026247 k( 249) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026247 k( 250) = ( 0.0059524 0.4940476 0.0059524), wk = 0.0026247 k( 251) = ( 0.0119048 0.4880952 0.0119048), wk = 0.0026247 k( 252) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0026247 k( 253) = ( 0.0238095 0.4761905 0.0238095), wk = 0.0026247 k( 254) = ( 0.0297619 0.4702381 0.0297619), wk = 0.0026247 k( 255) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0026247 k( 256) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0026247 k( 257) = ( 0.0476191 0.4523810 0.0476190), wk = 0.0026247 k( 258) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0026247 k( 259) = ( 0.0595238 0.4404762 0.0595238), wk = 0.0026247 k( 260) = ( 0.0654762 0.4345238 0.0654762), wk = 0.0026247 k( 261) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0026247 k( 262) = ( 0.0773810 0.4226190 0.0773810), wk = 0.0026247 k( 263) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0026247 k( 264) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0026247 k( 265) = ( 0.0952381 0.4047619 0.0952381), wk = 0.0026247 k( 266) = ( 0.1011905 0.3988095 0.1011905), wk = 0.0026247 k( 267) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0026247 k( 268) = ( 0.1130952 0.3869048 0.1130952), wk = 0.0026247 k( 269) = ( 0.1190476 0.3809524 0.1190476), wk = 0.0026247 k( 270) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0026247 k( 271) = ( 0.1309524 0.3690476 0.1309524), wk = 0.0026247 k( 272) = ( 0.1369048 0.3630952 0.1369048), wk = 0.0026247 k( 273) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0026247 k( 274) = ( 0.1488095 0.3511905 0.1488095), wk = 0.0026247 k( 275) = ( 0.1547619 0.3452381 0.1547619), wk = 0.0026247 k( 276) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0026247 k( 277) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0026247 k( 278) = ( 0.1726190 0.3273809 0.1726191), wk = 0.0026247 k( 279) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0026247 k( 280) = ( 0.1845238 0.3154762 0.1845238), wk = 0.0026247 k( 281) = ( 0.1904762 0.3095238 0.1904762), wk = 0.0026247 k( 282) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0026247 k( 283) = ( 0.2023810 0.2976190 0.2023810), wk = 0.0026247 k( 284) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0026247 k( 285) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0026247 k( 286) = ( 0.2202381 0.2797619 0.2202381), wk = 0.0026247 k( 287) = ( 0.2261905 0.2738095 0.2261905), wk = 0.0026247 k( 288) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0026247 k( 289) = ( 0.2380952 0.2619048 0.2380952), wk = 0.0026247 k( 290) = ( 0.2440476 0.2559524 0.2440476), wk = 0.0026247 k( 291) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026247 k( 292) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026247 k( 293) = ( 0.2631579 0.2631579 0.2328893), wk = 0.0026247 k( 294) = ( 0.2763158 0.2763158 0.2157786), wk = 0.0026247 k( 295) = ( 0.2894737 0.2894737 0.1986679), wk = 0.0026247 k( 296) = ( 0.3026316 0.3026316 0.1815572), wk = 0.0026247 k( 297) = ( 0.3157895 0.3157895 0.1644465), wk = 0.0026247 k( 298) = ( 0.3289474 0.3289474 0.1473358), wk = 0.0026247 k( 299) = ( 0.3421053 0.3421053 0.1302251), wk = 0.0026247 k( 300) = ( 0.3552632 0.3552632 0.1131144), wk = 0.0026247 k( 301) = ( 0.3684211 0.3684210 0.0960037), wk = 0.0026247 k( 302) = ( 0.3815789 0.3815789 0.0788930), wk = 0.0026247 k( 303) = ( 0.3947368 0.3947368 0.0617823), wk = 0.0026247 k( 304) = ( 0.4078947 0.4078947 0.0446717), wk = 0.0026247 k( 305) = ( 0.4210526 0.4210526 0.0275610), wk = 0.0026247 k( 306) = ( 0.4342105 0.4342105 0.0104503), wk = 0.0026247 k( 307) = ( 0.4473684 0.4473684 -0.0066604), wk = 0.0026247 k( 308) = ( 0.4605263 0.4605263 -0.0237711), wk = 0.0026247 k( 309) = ( 0.4736842 0.4736842 -0.0408818), wk = 0.0026247 k( 310) = ( 0.4868421 0.4868421 -0.0579925), wk = 0.0026247 k( 311) = ( 0.5000000 0.5000000 -0.0751032), wk = 0.0026247 k( 312) = ( 0.5000000 0.5000000 -0.0751032), wk = 0.0026247 k( 313) = ( 0.5000000 0.5000000 -0.0834345), wk = 0.0026247 k( 314) = ( 0.5000000 0.5000000 -0.0917658), wk = 0.0026247 k( 315) = ( 0.5000000 0.5000000 -0.1000971), wk = 0.0026247 k( 316) = ( 0.5000000 0.5000000 -0.1084285), wk = 0.0026247 k( 317) = ( 0.5000000 0.5000000 -0.1167598), wk = 0.0026247 k( 318) = ( 0.5000000 0.5000000 -0.1250911), wk = 0.0026247 k( 319) = ( 0.5000000 0.5000000 -0.1334224), wk = 0.0026247 k( 320) = ( 0.5000000 0.5000000 -0.1417537), wk = 0.0026247 k( 321) = ( 0.5000000 0.5000000 -0.1500850), wk = 0.0026247 k( 322) = ( 0.5000000 0.5000000 -0.1584163), wk = 0.0026247 k( 323) = ( 0.5000000 0.5000000 -0.1667476), wk = 0.0026247 k( 324) = ( 0.5000000 0.5000000 -0.1750789), wk = 0.0026247 k( 325) = ( 0.5000000 0.5000000 -0.1834103), wk = 0.0026247 k( 326) = ( 0.5000000 0.5000000 -0.1917416), wk = 0.0026247 k( 327) = ( 0.5000000 0.5000000 -0.2000729), wk = 0.0026247 k( 328) = ( 0.5000000 0.5000000 -0.2084042), wk = 0.0026247 k( 329) = ( 0.5000000 0.5000000 -0.2167355), wk = 0.0026247 k( 330) = ( 0.5000000 0.5000000 -0.2250668), wk = 0.0026247 k( 331) = ( 0.5000000 0.5000000 -0.2333981), wk = 0.0026247 k( 332) = ( 0.5000000 0.5000000 -0.2417294), wk = 0.0026247 k( 333) = ( 0.5000000 0.5000000 -0.2500607), wk = 0.0026247 k( 334) = ( 0.5000000 0.5000000 -0.2583920), wk = 0.0026247 k( 335) = ( 0.5000000 0.5000000 -0.2667233), wk = 0.0026247 k( 336) = ( 0.5000000 0.5000000 -0.2750547), wk = 0.0026247 k( 337) = ( 0.5000000 0.5000000 -0.2833860), wk = 0.0026247 k( 338) = ( 0.5000000 0.5000000 -0.2917173), wk = 0.0026247 k( 339) = ( 0.5000000 0.5000000 -0.3000486), wk = 0.0026247 k( 340) = ( 0.5000000 0.5000000 -0.3083799), wk = 0.0026247 k( 341) = ( 0.5000000 0.5000000 -0.3167112), wk = 0.0026247 k( 342) = ( 0.5000000 0.5000000 -0.3250425), wk = 0.0026247 k( 343) = ( 0.5000000 0.5000000 -0.3333738), wk = 0.0026247 k( 344) = ( 0.5000000 0.5000000 -0.3417051), wk = 0.0026247 k( 345) = ( 0.5000000 0.5000000 -0.3500364), wk = 0.0026247 k( 346) = ( 0.5000000 0.5000000 -0.3583677), wk = 0.0026247 k( 347) = ( 0.5000000 0.5000000 -0.3666991), wk = 0.0026247 k( 348) = ( 0.5000000 0.5000000 -0.3750304), wk = 0.0026247 k( 349) = ( 0.5000000 0.5000000 -0.3833617), wk = 0.0026247 k( 350) = ( 0.5000000 0.5000000 -0.3916930), wk = 0.0026247 k( 351) = ( 0.5000000 0.5000000 -0.4000243), wk = 0.0026247 k( 352) = ( 0.5000000 0.5000000 -0.4083556), wk = 0.0026247 k( 353) = ( 0.5000000 0.5000000 -0.4166869), wk = 0.0026247 k( 354) = ( 0.5000000 0.5000000 -0.4250182), wk = 0.0026247 k( 355) = ( 0.5000000 0.5000000 -0.4333495), wk = 0.0026247 k( 356) = ( 0.5000000 0.5000000 -0.4416808), wk = 0.0026247 k( 357) = ( 0.5000000 0.5000000 -0.4500121), wk = 0.0026247 k( 358) = ( 0.5000000 0.5000000 -0.4583435), wk = 0.0026247 k( 359) = ( 0.5000000 0.5000000 -0.4666748), wk = 0.0026247 k( 360) = ( 0.5000000 0.5000000 -0.4750061), wk = 0.0026247 k( 361) = ( 0.5000000 0.5000000 -0.4833374), wk = 0.0026247 k( 362) = ( 0.5000000 0.5000000 -0.4916687), wk = 0.0026247 k( 363) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0026247 k( 364) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026247 k( 365) = ( 0.0147059 0.0147059 0.4852941), wk = 0.0026247 k( 366) = ( 0.0294118 0.0294118 0.4705882), wk = 0.0026247 k( 367) = ( 0.0441177 0.0441176 0.4558824), wk = 0.0026247 k( 368) = ( 0.0588235 0.0588235 0.4411765), wk = 0.0026247 k( 369) = ( 0.0735294 0.0735294 0.4264706), wk = 0.0026247 k( 370) = ( 0.0882353 0.0882353 0.4117647), wk = 0.0026247 k( 371) = ( 0.1029412 0.1029412 0.3970588), wk = 0.0026247 k( 372) = ( 0.1176471 0.1176471 0.3823529), wk = 0.0026247 k( 373) = ( 0.1323529 0.1323529 0.3676471), wk = 0.0026247 k( 374) = ( 0.1470588 0.1470588 0.3529412), wk = 0.0026247 k( 375) = ( 0.1617647 0.1617647 0.3382353), wk = 0.0026247 k( 376) = ( 0.1764706 0.1764706 0.3235294), wk = 0.0026247 k( 377) = ( 0.1911765 0.1911765 0.3088235), wk = 0.0026247 k( 378) = ( 0.2058823 0.2058823 0.2941177), wk = 0.0026247 k( 379) = ( 0.2205882 0.2205882 0.2794118), wk = 0.0026247 k( 380) = ( 0.2352941 0.2352941 0.2647059), wk = 0.0026247 k( 381) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026247 Dense grid: 33331 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 20481 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.11 Mb ( 146, 48) NL pseudopotentials 0.19 Mb ( 73, 170) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 927) G-vector shells 0.00 Mb ( 435) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.43 Mb ( 146, 192) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.25 Mb ( 170, 2, 48) The potential is recalculated from file : ./HfxSiNix2.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.8 secs Computing kpt #: 2 total cpu time spent up to now is 4.3 secs Computing kpt #: 3 total cpu time spent up to now is 4.7 secs Computing kpt #: 4 total cpu time spent up to now is 5.2 secs Computing kpt #: 5 total cpu time spent up to now is 5.7 secs Computing kpt #: 6 total cpu time spent up to now is 6.1 secs Computing kpt #: 7 total cpu time spent up to now is 6.6 secs Computing kpt #: 8 total cpu time spent up to now is 7.1 secs Computing kpt #: 9 total cpu time spent up to now is 7.6 secs Computing kpt #: 10 total cpu time spent up to now is 8.0 secs Computing kpt #: 11 total cpu time spent up to now is 8.5 secs Computing kpt #: 12 total cpu time spent up to now is 9.0 secs Computing kpt #: 13 total cpu time spent up to now is 9.5 secs Computing kpt #: 14 total cpu time spent up to now is 10.0 secs Computing kpt #: 15 total cpu time spent up to now is 10.5 secs Computing kpt #: 16 total cpu time spent up to now is 11.0 secs Computing kpt #: 17 total cpu time spent up to now is 11.5 secs Computing kpt #: 18 total cpu time spent up to now is 12.0 secs Computing kpt #: 19 total cpu time spent up to now is 12.5 secs Computing kpt #: 20 total cpu time spent up to now is 13.0 secs Computing kpt #: 21 total cpu time spent up to now is 13.5 secs Computing kpt #: 22 total cpu time spent up to now is 14.1 secs Computing kpt #: 23 total cpu time spent up to now is 14.6 secs Computing kpt #: 24 total cpu time spent up to now is 15.2 secs Computing kpt #: 25 total cpu time spent up to now is 15.7 secs Computing kpt #: 26 total cpu time spent up to now is 16.3 secs Computing kpt #: 27 total cpu time spent up to now is 16.8 secs Computing kpt #: 28 total cpu time spent up to now is 17.5 secs Computing kpt #: 29 total cpu time spent up to now is 18.0 secs Computing kpt #: 30 total cpu time spent up to now is 18.5 secs Computing kpt #: 31 total cpu time spent up to now is 19.0 secs Computing kpt #: 32 total cpu time spent up to now is 19.5 secs Computing kpt #: 33 total cpu time spent up to now is 20.0 secs Computing kpt #: 34 total cpu time spent up to now is 20.4 secs Computing kpt #: 35 total cpu time spent up to now is 21.1 secs Computing kpt #: 36 total cpu time spent up to now is 21.5 secs Computing kpt #: 37 total cpu time spent up to now is 22.1 secs Computing kpt #: 38 total cpu time spent up to now is 22.7 secs Computing kpt #: 39 total cpu time spent up to now is 23.4 secs Computing kpt #: 40 total cpu time spent up to now is 24.0 secs Computing kpt #: 41 total cpu time spent up to now is 24.6 secs Computing kpt #: 42 total cpu time spent up to now is 25.2 secs Computing kpt #: 43 total cpu time spent up to now is 25.8 secs Computing kpt #: 44 total cpu time spent up to now is 26.6 secs Computing kpt #: 45 total cpu time spent up to now is 27.5 secs Computing kpt #: 46 total cpu time spent up to now is 28.0 secs Computing kpt #: 47 total cpu time spent up to now is 28.5 secs Computing kpt #: 48 total cpu time spent up to now is 29.1 secs Computing kpt #: 49 total cpu time spent up to now is 29.6 secs Computing kpt #: 50 total cpu time spent up to now is 30.1 secs Computing kpt #: 51 total cpu time spent up to now is 30.6 secs Computing kpt #: 52 total cpu time spent up to now is 31.1 secs Computing kpt #: 53 total cpu time spent up to now is 31.6 secs Computing kpt #: 54 total cpu time spent up to now is 32.1 secs Computing kpt #: 55 total cpu time spent up to now is 32.6 secs Computing kpt #: 56 total cpu time spent up to now is 33.1 secs Computing kpt #: 57 total cpu time spent up to now is 33.6 secs Computing kpt #: 58 total cpu time spent up to now is 34.1 secs Computing kpt #: 59 total cpu time spent up to now is 34.6 secs Computing kpt #: 60 total cpu time spent up to now is 35.1 secs Computing kpt #: 61 total cpu time spent up to now is 35.6 secs Computing kpt #: 62 total cpu time spent up to now is 36.1 secs Computing kpt #: 63 total cpu time spent up to now is 36.6 secs Computing kpt #: 64 total cpu time spent up to now is 37.1 secs Computing kpt #: 65 total cpu time spent up to now is 37.6 secs Computing kpt #: 66 total cpu time spent up to now is 38.0 secs Computing kpt #: 67 total cpu time spent up to now is 38.5 secs Computing kpt #: 68 total cpu time spent up to now is 39.0 secs Computing kpt #: 69 total cpu time spent up to now is 39.6 secs Computing kpt #: 70 total cpu time spent up to now is 40.1 secs Computing kpt #: 71 total cpu time spent up to now is 40.6 secs Computing kpt #: 72 total cpu time spent up to now is 41.1 secs Computing kpt #: 73 total cpu time spent up to now is 41.6 secs Computing kpt #: 74 total cpu time spent up to now is 42.1 secs Computing kpt #: 75 total cpu time spent up to now is 42.5 secs Computing kpt #: 76 total cpu time spent up to now is 43.0 secs Computing kpt #: 77 total cpu time spent up to now is 43.5 secs Computing kpt #: 78 total cpu time spent up to now is 44.0 secs Computing kpt #: 79 total cpu time spent up to now is 44.5 secs Computing kpt #: 80 total cpu time spent up to now is 45.0 secs Computing kpt #: 81 total cpu time spent up to now is 45.5 secs Computing kpt #: 82 total cpu time spent up to now is 45.9 secs Computing kpt #: 83 total cpu time spent up to now is 46.4 secs Computing kpt #: 84 total cpu time spent up to now is 46.9 secs Computing kpt #: 85 total cpu time spent up to now is 47.4 secs Computing kpt #: 86 total cpu time spent up to now is 47.9 secs Computing kpt #: 87 total cpu time spent up to now is 48.3 secs Computing kpt #: 88 total cpu time spent up to now is 48.8 secs Computing kpt #: 89 total cpu time spent up to now is 49.3 secs Computing kpt #: 90 total cpu time spent up to now is 49.7 secs Computing kpt #: 91 total cpu time spent up to now is 50.3 secs Computing kpt #: 92 total cpu time spent up to now is 50.8 secs Computing kpt #: 93 total cpu time spent up to now is 51.4 secs Computing kpt #: 94 total cpu time spent up to now is 52.0 secs Computing kpt #: 95 total cpu time spent up to now is 52.6 secs Computing kpt #: 96 total cpu time spent up to now is 53.3 secs Computing kpt #: 97 total cpu time spent up to now is 53.9 secs Computing kpt #: 98 total cpu time spent up to now is 54.5 secs Computing kpt #: 99 total cpu time spent up to now is 55.2 secs Computing kpt #: 100 total cpu time spent up to now is 55.7 secs Computing kpt #: 101 total cpu time spent up to now is 56.1 secs Computing kpt #: 102 total cpu time spent up to now is 56.6 secs Computing kpt #: 103 total cpu time spent up to now is 57.1 secs Computing kpt #: 104 total cpu time spent up to now is 57.6 secs Computing kpt #: 105 total cpu time spent up to now is 58.0 secs Computing kpt #: 106 total cpu time spent up to now is 58.5 secs Computing kpt #: 107 total cpu time spent up to now is 59.0 secs Computing kpt #: 108 total cpu time spent up to now is 59.4 secs Computing kpt #: 109 total cpu time spent up to now is 59.9 secs Computing kpt #: 110 total cpu time spent up to now is 60.3 secs Computing kpt #: 111 total cpu time spent up to now is 60.8 secs Computing kpt #: 112 total cpu time spent up to now is 61.3 secs Computing kpt #: 113 total cpu time spent up to now is 61.7 secs Computing kpt #: 114 total cpu time spent up to now is 62.2 secs Computing kpt #: 115 total cpu time spent up to now is 62.6 secs Computing kpt #: 116 total cpu time spent up to now is 63.1 secs Computing kpt #: 117 total cpu time spent up to now is 63.6 secs Computing kpt #: 118 total cpu time spent up to now is 64.0 secs Computing kpt #: 119 total cpu time spent up to now is 64.5 secs Computing kpt #: 120 total cpu time spent up to now is 64.9 secs Computing kpt #: 121 total cpu time spent up to now is 65.3 secs Computing kpt #: 122 total cpu time spent up to now is 65.8 secs Computing kpt #: 123 total cpu time spent up to now is 66.2 secs Computing kpt #: 124 total cpu time spent up to now is 66.6 secs Computing kpt #: 125 total cpu time spent up to now is 67.1 secs Computing kpt #: 126 total cpu time spent up to now is 67.5 secs Computing kpt #: 127 total cpu time spent up to now is 67.9 secs Computing kpt #: 128 total cpu time spent up to now is 68.3 secs Computing kpt #: 129 total cpu time spent up to now is 68.7 secs Computing kpt #: 130 total cpu time spent up to now is 69.1 secs Computing kpt #: 131 total cpu time spent up to now is 69.5 secs Computing kpt #: 132 total cpu time spent up to now is 70.0 secs Computing kpt #: 133 total cpu time spent up to now is 70.4 secs Computing kpt #: 134 total cpu time spent up to now is 70.8 secs Computing kpt #: 135 total cpu time spent up to now is 71.2 secs Computing kpt #: 136 total cpu time spent up to now is 71.7 secs Computing kpt #: 137 total cpu time spent up to now is 72.1 secs Computing kpt #: 138 total cpu time spent up to now is 72.5 secs Computing kpt #: 139 total cpu time spent up to now is 73.0 secs Computing kpt #: 140 total cpu time spent up to now is 73.4 secs Computing kpt #: 141 total cpu time spent up to now is 73.9 secs Computing kpt #: 142 total cpu time spent up to now is 74.3 secs Computing kpt #: 143 total cpu time spent up to now is 74.8 secs Computing kpt #: 144 total cpu time spent up to now is 75.3 secs Computing kpt #: 145 total cpu time spent up to now is 75.9 secs Computing kpt #: 146 total cpu time spent up to now is 76.4 secs Computing kpt #: 147 total cpu time spent up to now is 76.8 secs Computing kpt #: 148 total cpu time spent up to now is 77.3 secs Computing kpt #: 149 total cpu time spent up to now is 77.8 secs Computing kpt #: 150 total cpu time spent up to now is 78.4 secs Computing kpt #: 151 total cpu time spent up to now is 78.9 secs Computing kpt #: 152 total cpu time spent up to now is 79.4 secs Computing kpt #: 153 total cpu time spent up to now is 79.8 secs Computing kpt #: 154 total cpu time spent up to now is 80.3 secs Computing kpt #: 155 total cpu time spent up to now is 80.8 secs Computing kpt #: 156 total cpu time spent up to now is 81.2 secs Computing kpt #: 157 total cpu time spent up to now is 81.7 secs Computing kpt #: 158 total cpu time spent up to now is 82.2 secs Computing kpt #: 159 total cpu time spent up to now is 82.7 secs Computing kpt #: 160 total cpu time spent up to now is 83.1 secs Computing kpt #: 161 total cpu time spent up to now is 83.6 secs Computing kpt #: 162 total cpu time spent up to now is 84.1 secs Computing kpt #: 163 total cpu time spent up to now is 84.5 secs Computing kpt #: 164 total cpu time spent up to now is 85.0 secs Computing kpt #: 165 total cpu time spent up to now is 85.5 secs Computing kpt #: 166 total cpu time spent up to now is 85.9 secs Computing kpt #: 167 total cpu time spent up to now is 86.4 secs Computing kpt #: 168 total cpu time spent up to now is 86.9 secs Computing kpt #: 169 total cpu time spent up to now is 87.4 secs Computing kpt #: 170 total cpu time spent up to now is 87.8 secs Computing kpt #: 171 total cpu time spent up to now is 88.3 secs Computing kpt #: 172 total cpu time spent up to now is 88.8 secs Computing kpt #: 173 total cpu time spent up to now is 89.2 secs Computing kpt #: 174 total cpu time spent up to now is 89.7 secs Computing kpt #: 175 total cpu time spent up to now is 90.2 secs Computing kpt #: 176 total cpu time spent up to now is 90.6 secs Computing kpt #: 177 total cpu time spent up to now is 91.1 secs Computing kpt #: 178 total cpu time spent up to now is 91.5 secs Computing kpt #: 179 total cpu time spent up to now is 92.0 secs Computing kpt #: 180 total cpu time spent up to now is 92.5 secs Computing kpt #: 181 total cpu time spent up to now is 93.0 secs Computing kpt #: 182 total cpu time spent up to now is 93.4 secs Computing kpt #: 183 total cpu time spent up to now is 93.9 secs Computing kpt #: 184 total cpu time spent up to now is 94.4 secs Computing kpt #: 185 total cpu time spent up to now is 94.8 secs Computing kpt #: 186 total cpu time spent up to now is 95.3 secs Computing kpt #: 187 total cpu time spent up to now is 95.8 secs Computing kpt #: 188 total cpu time spent up to now is 96.3 secs Computing kpt #: 189 total cpu time spent up to now is 96.8 secs Computing kpt #: 190 total cpu time spent up to now is 97.3 secs Computing kpt #: 191 total cpu time spent up to now is 97.8 secs Computing kpt #: 192 total cpu time spent up to now is 98.3 secs Computing kpt #: 193 total cpu time spent up to now is 98.8 secs Computing kpt #: 194 total cpu time spent up to now is 99.4 secs Computing kpt #: 195 total cpu time spent up to now is 99.9 secs Computing kpt #: 196 total cpu time spent up to now is 100.4 secs Computing kpt #: 197 total cpu time spent up to now is 101.0 secs Computing kpt #: 198 total cpu time spent up to now is 101.6 secs Computing kpt #: 199 total cpu time spent up to now is 102.2 secs Computing kpt #: 200 total cpu time spent up to now is 102.6 secs Computing kpt #: 201 total cpu time spent up to now is 103.1 secs Computing kpt #: 202 total cpu time spent up to now is 103.6 secs Computing kpt #: 203 total cpu time spent up to now is 104.1 secs Computing kpt #: 204 total cpu time spent up to now is 104.6 secs Computing kpt #: 205 total cpu time spent up to now is 105.0 secs Computing kpt #: 206 total cpu time spent up to now is 105.5 secs Computing kpt #: 207 total cpu time spent up to now is 105.9 secs Computing kpt #: 208 total cpu time spent up to now is 106.3 secs Computing kpt #: 209 total cpu time spent up to now is 106.8 secs Computing kpt #: 210 total cpu time spent up to now is 107.2 secs Computing kpt #: 211 total cpu time spent up to now is 107.7 secs Computing kpt #: 212 total cpu time spent up to now is 108.1 secs Computing kpt #: 213 total cpu time spent up to now is 108.6 secs Computing kpt #: 214 total cpu time spent up to now is 109.0 secs Computing kpt #: 215 total cpu time spent up to now is 109.4 secs Computing kpt #: 216 total cpu time spent up to now is 109.9 secs Computing kpt #: 217 total cpu time spent up to now is 110.3 secs Computing kpt #: 218 total cpu time spent up to now is 110.8 secs Computing kpt #: 219 total cpu time spent up to now is 111.2 secs Computing kpt #: 220 total cpu time spent up to now is 111.7 secs Computing kpt #: 221 total cpu time spent up to now is 112.1 secs Computing kpt #: 222 total cpu time spent up to now is 112.6 secs Computing kpt #: 223 total cpu time spent up to now is 113.1 secs Computing kpt #: 224 total cpu time spent up to now is 113.6 secs Computing kpt #: 225 total cpu time spent up to now is 114.1 secs Computing kpt #: 226 total cpu time spent up to now is 114.6 secs Computing kpt #: 227 total cpu time spent up to now is 115.1 secs Computing kpt #: 228 total cpu time spent up to now is 115.6 secs Computing kpt #: 229 total cpu time spent up to now is 116.0 secs Computing kpt #: 230 total cpu time spent up to now is 116.5 secs Computing kpt #: 231 total cpu time spent up to now is 116.9 secs Computing kpt #: 232 total cpu time spent up to now is 117.4 secs Computing kpt #: 233 total cpu time spent up to now is 117.9 secs Computing kpt #: 234 total cpu time spent up to now is 118.3 secs Computing kpt #: 235 total cpu time spent up to now is 118.8 secs Computing kpt #: 236 total cpu time spent up to now is 119.3 secs Computing kpt #: 237 total cpu time spent up to now is 119.8 secs Computing kpt #: 238 total cpu time spent up to now is 120.3 secs Computing kpt #: 239 total cpu time spent up to now is 120.8 secs Computing kpt #: 240 total cpu time spent up to now is 121.3 secs Computing kpt #: 241 total cpu time spent up to now is 121.7 secs Computing kpt #: 242 total cpu time spent up to now is 122.2 secs Computing kpt #: 243 total cpu time spent up to now is 122.7 secs Computing kpt #: 244 total cpu time spent up to now is 123.2 secs Computing kpt #: 245 total cpu time spent up to now is 123.6 secs Computing kpt #: 246 total cpu time spent up to now is 124.1 secs Computing kpt #: 247 total cpu time spent up to now is 124.6 secs Computing kpt #: 248 total cpu time spent up to now is 125.1 secs Computing kpt #: 249 total cpu time spent up to now is 125.6 secs Computing kpt #: 250 total cpu time spent up to now is 126.0 secs Computing kpt #: 251 total cpu time spent up to now is 126.5 secs Computing kpt #: 252 total cpu time spent up to now is 127.0 secs Computing kpt #: 253 total cpu time spent up to now is 127.4 secs Computing kpt #: 254 total cpu time spent up to now is 127.9 secs Computing kpt #: 255 total cpu time spent up to now is 128.4 secs Computing kpt #: 256 total cpu time spent up to now is 128.9 secs Computing kpt #: 257 total cpu time spent up to now is 129.4 secs Computing kpt #: 258 total cpu time spent up to now is 129.9 secs Computing kpt #: 259 total cpu time spent up to now is 130.4 secs Computing kpt #: 260 total cpu time spent up to now is 130.9 secs Computing kpt #: 261 total cpu time spent up to now is 131.5 secs Computing kpt #: 262 total cpu time spent up to now is 131.9 secs Computing kpt #: 263 total cpu time spent up to now is 132.4 secs Computing kpt #: 264 total cpu time spent up to now is 133.0 secs Computing kpt #: 265 total cpu time spent up to now is 133.6 secs Computing kpt #: 266 total cpu time spent up to now is 134.1 secs Computing kpt #: 267 total cpu time spent up to now is 134.6 secs Computing kpt #: 268 total cpu time spent up to now is 135.1 secs Computing kpt #: 269 total cpu time spent up to now is 135.6 secs Computing kpt #: 270 total cpu time spent up to now is 136.1 secs Computing kpt #: 271 total cpu time spent up to now is 136.6 secs Computing kpt #: 272 total cpu time spent up to now is 137.1 secs Computing kpt #: 273 total cpu time spent up to now is 137.6 secs Computing kpt #: 274 total cpu time spent up to now is 138.1 secs Computing kpt #: 275 total cpu time spent up to now is 138.6 secs Computing kpt #: 276 total cpu time spent up to now is 139.1 secs Computing kpt #: 277 total cpu time spent up to now is 139.6 secs Computing kpt #: 278 total cpu time spent up to now is 140.1 secs Computing kpt #: 279 total cpu time spent up to now is 140.6 secs Computing kpt #: 280 total cpu time spent up to now is 141.1 secs Computing kpt #: 281 total cpu time spent up to now is 141.6 secs Computing kpt #: 282 total cpu time spent up to now is 142.1 secs Computing kpt #: 283 total cpu time spent up to now is 142.6 secs Computing kpt #: 284 total cpu time spent up to now is 143.2 secs Computing kpt #: 285 total cpu time spent up to now is 143.7 secs Computing kpt #: 286 total cpu time spent up to now is 144.2 secs Computing kpt #: 287 total cpu time spent up to now is 144.7 secs Computing kpt #: 288 total cpu time spent up to now is 145.2 secs Computing kpt #: 289 total cpu time spent up to now is 145.7 secs Computing kpt #: 290 total cpu time spent up to now is 146.3 secs Computing kpt #: 291 total cpu time spent up to now is 146.8 secs Computing kpt #: 292 total cpu time spent up to now is 147.4 secs Computing kpt #: 293 total cpu time spent up to now is 147.9 secs Computing kpt #: 294 total cpu time spent up to now is 148.3 secs Computing kpt #: 295 total cpu time spent up to now is 148.8 secs Computing kpt #: 296 total cpu time spent up to now is 149.3 secs Computing kpt #: 297 total cpu time spent up to now is 149.9 secs Computing kpt #: 298 total cpu time spent up to now is 150.4 secs Computing kpt #: 299 total cpu time spent up to now is 150.9 secs Computing kpt #: 300 total cpu time spent up to now is 151.4 secs Computing kpt #: 301 total cpu time spent up to now is 151.9 secs Computing kpt #: 302 total cpu time spent up to now is 152.4 secs Computing kpt #: 303 total cpu time spent up to now is 152.9 secs Computing kpt #: 304 total cpu time spent up to now is 153.4 secs Computing kpt #: 305 total cpu time spent up to now is 153.9 secs Computing kpt #: 306 total cpu time spent up to now is 154.4 secs Computing kpt #: 307 total cpu time spent up to now is 154.9 secs Computing kpt #: 308 total cpu time spent up to now is 155.4 secs Computing kpt #: 309 total cpu time spent up to now is 155.9 secs Computing kpt #: 310 total cpu time spent up to now is 156.4 secs Computing kpt #: 311 total cpu time spent up to now is 156.8 secs Computing kpt #: 312 total cpu time spent up to now is 157.3 secs Computing kpt #: 313 total cpu time spent up to now is 157.8 secs Computing kpt #: 314 total cpu time spent up to now is 158.3 secs Computing kpt #: 315 total cpu time spent up to now is 158.7 secs Computing kpt #: 316 total cpu time spent up to now is 159.2 secs Computing kpt #: 317 total cpu time spent up to now is 159.7 secs Computing kpt #: 318 total cpu time spent up to now is 160.1 secs Computing kpt #: 319 total cpu time spent up to now is 160.6 secs Computing kpt #: 320 total cpu time spent up to now is 161.0 secs Computing kpt #: 321 total cpu time spent up to now is 161.5 secs Computing kpt #: 322 total cpu time spent up to now is 161.9 secs Computing kpt #: 323 total cpu time spent up to now is 162.4 secs Computing kpt #: 324 total cpu time spent up to now is 162.8 secs Computing kpt #: 325 total cpu time spent up to now is 163.3 secs Computing kpt #: 326 total cpu time spent up to now is 163.7 secs Computing kpt #: 327 total cpu time spent up to now is 164.1 secs Computing kpt #: 328 total cpu time spent up to now is 164.6 secs Computing kpt #: 329 total cpu time spent up to now is 165.0 secs Computing kpt #: 330 total cpu time spent up to now is 165.4 secs Computing kpt #: 331 total cpu time spent up to now is 165.9 secs Computing kpt #: 332 total cpu time spent up to now is 166.3 secs Computing kpt #: 333 total cpu time spent up to now is 166.7 secs Computing kpt #: 334 total cpu time spent up to now is 167.2 secs Computing kpt #: 335 total cpu time spent up to now is 167.6 secs Computing kpt #: 336 total cpu time spent up to now is 168.1 secs Computing kpt #: 337 total cpu time spent up to now is 168.5 secs Computing kpt #: 338 total cpu time spent up to now is 169.0 secs Computing kpt #: 339 total cpu time spent up to now is 169.4 secs Computing kpt #: 340 total cpu time spent up to now is 169.9 secs Computing kpt #: 341 total cpu time spent up to now is 170.4 secs Computing kpt #: 342 total cpu time spent up to now is 170.9 secs Computing kpt #: 343 total cpu time spent up to now is 171.4 secs Computing kpt #: 344 total cpu time spent up to now is 171.8 secs Computing kpt #: 345 total cpu time spent up to now is 172.3 secs Computing kpt #: 346 total cpu time spent up to now is 172.7 secs Computing kpt #: 347 total cpu time spent up to now is 173.2 secs Computing kpt #: 348 total cpu time spent up to now is 173.6 secs Computing kpt #: 349 total cpu time spent up to now is 174.1 secs Computing kpt #: 350 total cpu time spent up to now is 174.5 secs Computing kpt #: 351 total cpu time spent up to now is 175.0 secs Computing kpt #: 352 total cpu time spent up to now is 175.4 secs Computing kpt #: 353 total cpu time spent up to now is 175.9 secs Computing kpt #: 354 total cpu time spent up to now is 176.4 secs Computing kpt #: 355 total cpu time spent up to now is 176.9 secs Computing kpt #: 356 total cpu time spent up to now is 177.4 secs Computing kpt #: 357 total cpu time spent up to now is 178.0 secs Computing kpt #: 358 total cpu time spent up to now is 178.7 secs Computing kpt #: 359 total cpu time spent up to now is 179.2 secs Computing kpt #: 360 total cpu time spent up to now is 179.8 secs Computing kpt #: 361 total cpu time spent up to now is 180.5 secs Computing kpt #: 362 total cpu time spent up to now is 181.1 secs Computing kpt #: 363 total cpu time spent up to now is 181.6 secs Computing kpt #: 364 total cpu time spent up to now is 182.0 secs Computing kpt #: 365 total cpu time spent up to now is 182.5 secs Computing kpt #: 366 total cpu time spent up to now is 183.1 secs Computing kpt #: 367 total cpu time spent up to now is 183.7 secs Computing kpt #: 368 total cpu time spent up to now is 184.2 secs Computing kpt #: 369 total cpu time spent up to now is 184.8 secs Computing kpt #: 370 total cpu time spent up to now is 185.3 secs Computing kpt #: 371 total cpu time spent up to now is 185.9 secs Computing kpt #: 372 total cpu time spent up to now is 186.5 secs Computing kpt #: 373 total cpu time spent up to now is 187.0 secs Computing kpt #: 374 total cpu time spent up to now is 187.5 secs Computing kpt #: 375 total cpu time spent up to now is 188.0 secs Computing kpt #: 376 total cpu time spent up to now is 188.5 secs Computing kpt #: 377 total cpu time spent up to now is 189.0 secs Computing kpt #: 378 total cpu time spent up to now is 189.6 secs Computing kpt #: 379 total cpu time spent up to now is 190.1 secs Computing kpt #: 380 total cpu time spent up to now is 190.6 secs Computing kpt #: 381 total cpu time spent up to now is 191.1 secs ethr = 2.50E-08, avg # of iterations = 18.6 total cpu time spent up to now is 191.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9147 -14.9147 -14.8607 -14.8607 1.8660 1.8660 6.7124 6.7124 7.3055 7.3055 9.9675 9.9675 9.9835 9.9835 10.2701 10.2701 10.3218 10.3218 11.3573 11.3573 11.3966 11.3966 11.8057 11.8057 11.8611 11.8611 12.2356 12.2356 12.3665 12.3665 12.3887 12.3887 12.5585 12.5585 13.1076 13.1076 15.6473 15.6473 15.8083 15.8083 15.8732 15.8732 17.3936 17.3936 k = 0.0000 0.0000 0.0173 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9147 -14.9147 -14.8607 -14.8607 1.8675 1.8675 6.7121 6.7121 7.3069 7.3069 9.9664 9.9664 9.9821 9.9821 10.2702 10.2702 10.3229 10.3229 11.3558 11.3558 11.3949 11.3949 11.8042 11.8042 11.8625 11.8625 12.2351 12.2351 12.3655 12.3655 12.3875 12.3875 12.5578 12.5578 13.1102 13.1102 15.6100 15.6100 15.7684 15.7684 15.9464 15.9464 17.3938 17.3938 k = 0.0000 0.0000 0.0347 ( 2561 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9148 -14.9148 -14.8609 -14.8609 1.8721 1.8721 6.7113 6.7113 7.3113 7.3113 9.9617 9.9617 9.9790 9.9790 10.2705 10.2705 10.3261 10.3261 11.3492 11.3492 11.3920 11.3920 11.8003 11.8003 11.8662 11.8662 12.2338 12.2338 12.3624 12.3624 12.3844 12.3844 12.5559 12.5559 13.1176 13.1176 15.5111 15.5111 15.7542 15.7542 16.0474 16.0474 17.3944 17.3944 k = 0.0000 0.0000 0.0520 ( 2561 PWs) bands (ev): -48.3537 -48.3537 -22.6385 -22.6385 -14.9148 -14.9148 -14.8613 -14.8613 1.8799 1.8799 6.7099 6.7099 7.3185 7.3185 9.9511 9.9511 9.9769 9.9769 10.2712 10.2712 10.3310 10.3310 11.3330 11.3330 11.3922 11.3922 11.7950 11.7950 11.8712 11.8712 12.2315 12.2315 12.3569 12.3569 12.3798 12.3798 12.5529 12.5529 13.1294 13.1294 15.3876 15.3876 15.7606 15.7606 16.1447 16.1447 17.3950 17.3950 k = 0.0000 0.0000 0.0694 ( 2561 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9149 -14.9149 -14.8618 -14.8618 1.8907 1.8907 6.7080 6.7080 7.3286 7.3286 9.9345 9.9345 9.9761 9.9761 10.2720 10.2720 10.3375 10.3375 11.3060 11.3060 11.3969 11.3969 11.7895 11.7895 11.8768 11.8768 12.2282 12.2282 12.3487 12.3487 12.3745 12.3745 12.5488 12.5488 13.1450 13.1450 15.2559 15.2559 15.7762 15.7762 16.2342 16.2342 17.3954 17.3954 k = 0.0000 0.0000 0.0867 ( 2553 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9150 -14.9150 -14.8624 -14.8624 1.9046 1.9046 6.7056 6.7056 7.3415 7.3415 9.9130 9.9130 9.9760 9.9760 10.2734 10.2734 10.3453 10.3453 11.2694 11.2694 11.4050 11.4050 11.7841 11.7841 11.8825 11.8825 12.2239 12.2239 12.3380 12.3380 12.3689 12.3689 12.5440 12.5440 13.1635 13.1635 15.1212 15.1212 15.7980 15.7980 16.3148 16.3148 17.3951 17.3951 k = 0.0000 0.0000 0.1040 ( 2559 PWs) bands (ev): -48.3536 -48.3536 -22.6389 -22.6389 -14.9152 -14.9152 -14.8633 -14.8633 1.9215 1.9215 6.7026 6.7026 7.3572 7.3572 9.8870 9.8870 9.9762 9.9762 10.2752 10.2752 10.3539 10.3539 11.2243 11.2243 11.4154 11.4154 11.7793 11.7793 11.8879 11.8879 12.2186 12.2186 12.3255 12.3255 12.3628 12.3628 12.5384 12.5384 13.1839 13.1839 14.9857 14.9857 15.8253 15.8253 16.3863 16.3863 17.3938 17.3938 k = 0.0000 0.0000 0.1214 ( 2557 PWs) bands (ev): -48.3535 -48.3535 -22.6391 -22.6391 -14.9153 -14.9153 -14.8643 -14.8643 1.9415 1.9415 6.6993 6.6993 7.3756 7.3756 9.8572 9.8572 9.9767 9.9767 10.2776 10.2776 10.3634 10.3634 11.1716 11.1716 11.4277 11.4277 11.7752 11.7752 11.8932 11.8932 12.2122 12.2122 12.3118 12.3118 12.3562 12.3562 12.5322 12.5322 13.2057 13.2057 14.8510 14.8510 15.8574 15.8574 16.4495 16.4495 17.3914 17.3914 k = 0.0000 0.0000 0.1387 ( 2557 PWs) bands (ev): -48.3535 -48.3535 -22.6393 -22.6393 -14.9155 -14.9155 -14.8654 -14.8654 1.9644 1.9644 6.6955 6.6955 7.3967 7.3967 9.8237 9.8237 9.9773 9.9773 10.2805 10.2805 10.3734 10.3734 11.1121 11.1121 11.4415 11.4415 11.7716 11.7716 11.8980 11.8980 12.2046 12.2046 12.2974 12.2974 12.3492 12.3492 12.5255 12.5255 13.2280 13.2280 14.7183 14.7183 15.8942 15.8942 16.5054 16.5054 17.3875 17.3875 k = 0.0000 0.0000 0.1560 ( 2557 PWs) bands (ev): -48.3535 -48.3535 -22.6396 -22.6396 -14.9158 -14.9158 -14.8666 -14.8666 1.9903 1.9903 6.6915 6.6915 7.4204 7.4204 9.7869 9.7869 9.9781 9.9781 10.2840 10.2840 10.3839 10.3839 11.0467 11.0467 11.4564 11.4564 11.7687 11.7687 11.9023 11.9023 12.1959 12.1959 12.2828 12.2828 12.3415 12.3415 12.5184 12.5184 13.2503 13.2503 14.5884 14.5884 15.9353 15.9353 16.5551 16.5551 17.3818 17.3818 k = 0.0000 0.0000 0.1734 ( 2557 PWs) bands (ev): -48.3534 -48.3534 -22.6399 -22.6399 -14.9160 -14.9160 -14.8679 -14.8679 2.0192 2.0192 6.6871 6.6871 7.4466 7.4466 9.7470 9.7470 9.9791 9.9791 10.2883 10.2883 10.3947 10.3947 10.9761 10.9761 11.4720 11.4720 11.7661 11.7661 11.9060 11.9060 12.1859 12.1859 12.2684 12.2684 12.3332 12.3332 12.5108 12.5108 13.2724 13.2724 14.4622 14.4622 15.9803 15.9803 16.5997 16.5997 17.3741 17.3741 k = 0.0000 0.0000 0.1907 ( 2553 PWs) bands (ev): -48.3533 -48.3533 -22.6402 -22.6402 -14.9163 -14.9163 -14.8694 -14.8694 2.0509 2.0509 6.6825 6.6825 7.4751 7.4751 9.7042 9.7042 9.9804 9.9804 10.2932 10.2932 10.4058 10.4058 10.9010 10.9010 11.4880 11.4880 11.7638 11.7638 11.9091 11.9091 12.1747 12.1747 12.2544 12.2544 12.3244 12.3244 12.5028 12.5028 13.2939 13.2939 14.3403 14.3403 16.0292 16.0292 16.6403 16.6403 17.3636 17.3636 k = 0.0000 0.0000 0.2081 ( 2549 PWs) bands (ev): -48.3533 -48.3533 -22.6405 -22.6405 -14.9165 -14.9165 -14.8710 -14.8710 2.0854 2.0854 6.6777 6.6777 7.5060 7.5060 9.6588 9.6588 9.9818 9.9818 10.2989 10.2989 10.4171 10.4171 10.8222 10.8222 11.5041 11.5041 11.7616 11.7616 11.9113 11.9113 12.1623 12.1623 12.2409 12.2409 12.3149 12.3149 12.4947 12.4947 13.3144 13.3144 14.2233 14.2233 16.0814 16.0814 16.6778 16.6778 17.3496 17.3496 k = 0.0000 0.0000 0.2254 ( 2545 PWs) bands (ev): -48.3532 -48.3532 -22.6408 -22.6408 -14.9168 -14.9168 -14.8727 -14.8727 2.1228 2.1228 6.6728 6.6728 7.5389 7.5389 9.6111 9.6111 9.9834 9.9834 10.3053 10.3053 10.4286 10.4286 10.7402 10.7402 11.5198 11.5198 11.7592 11.7592 11.9126 11.9126 12.1490 12.1490 12.2280 12.2280 12.3050 12.3050 12.4862 12.4862 13.3339 13.3339 14.1118 14.1118 16.1367 16.1367 16.7127 16.7127 17.3312 17.3312 k = 0.0000 0.0000 0.2427 ( 2549 PWs) bands (ev): -48.3531 -48.3531 -22.6412 -22.6412 -14.9172 -14.9172 -14.8745 -14.8745 2.1629 2.1629 6.6679 6.6679 7.5738 7.5738 9.5613 9.5613 9.9853 9.9853 10.3126 10.3126 10.4398 10.4398 10.6559 10.6559 11.5350 11.5350 11.7564 11.7564 11.9126 11.9126 12.1349 12.1349 12.2155 12.2155 12.2945 12.2945 12.4776 12.4776 13.3521 13.3521 14.0062 14.0062 16.1946 16.1946 16.7459 16.7459 17.3076 17.3076 k = 0.0000 0.0000 0.2601 ( 2553 PWs) bands (ev): -48.3531 -48.3531 -22.6417 -22.6417 -14.9176 -14.9176 -14.8765 -14.8765 2.2056 2.2056 6.6629 6.6629 7.6103 7.6103 9.5099 9.5099 9.9873 9.9873 10.3206 10.3206 10.4504 10.4504 10.5703 10.5703 11.5491 11.5491 11.7532 11.7532 11.9111 11.9111 12.1204 12.1204 12.2035 12.2035 12.2836 12.2836 12.4688 12.4688 13.3691 13.3691 13.9071 13.9071 16.2549 16.2549 16.7775 16.7775 17.2788 17.2788 k = 0.0000 0.0000 0.2774 ( 2553 PWs) bands (ev): -48.3530 -48.3530 -22.6422 -22.6422 -14.9180 -14.9180 -14.8785 -14.8785 2.2509 2.2509 6.6581 6.6581 7.6483 7.6483 9.4573 9.4573 9.9897 9.9897 10.3292 10.3292 10.4526 10.4526 10.4918 10.4918 11.5621 11.5621 11.7492 11.7492 11.9080 11.9080 12.1057 12.1057 12.1918 12.1918 12.2723 12.2723 12.4600 12.4600 13.3847 13.3847 13.8149 13.8149 16.3171 16.3171 16.8081 16.8081 17.2460 17.2460 k = 0.0000 0.0000 0.2947 ( 2555 PWs) bands (ev): -48.3529 -48.3529 -22.6426 -22.6426 -14.9184 -14.9184 -14.8807 -14.8807 2.2988 2.2988 6.6534 6.6534 7.6874 7.6874 9.4038 9.4038 9.9923 9.9923 10.3376 10.3376 10.3870 10.3870 10.4810 10.4810 11.5734 11.5734 11.7442 11.7442 11.9029 11.9029 12.0911 12.0911 12.1804 12.1804 12.2606 12.2606 12.4512 12.4512 13.3988 13.3988 13.7300 13.7300 16.3808 16.3808 16.8377 16.8377 17.2114 17.2114 k = 0.0000 0.0000 0.3121 ( 2555 PWs) bands (ev): -48.3528 -48.3528 -22.6431 -22.6431 -14.9188 -14.9188 -14.8829 -14.8829 2.3491 2.3491 6.6489 6.6489 7.7271 7.7271 9.3502 9.3502 9.9953 9.9953 10.2944 10.2944 10.3522 10.3522 10.4910 10.4910 11.5831 11.5831 11.7380 11.7380 11.8956 11.8956 12.0769 12.0769 12.1691 12.1691 12.2486 12.2486 12.4425 12.4425 13.4112 13.4112 13.6532 13.6532 16.4453 16.4453 16.8664 16.8664 17.1775 17.1775 k = 0.0000 0.0000 0.3294 ( 2559 PWs) bands (ev): -48.3528 -48.3528 -22.6437 -22.6437 -14.9193 -14.9193 -14.8852 -14.8852 2.4018 2.4018 6.6447 6.6447 7.7671 7.7671 9.2970 9.2970 9.9985 9.9985 10.2050 10.2050 10.3625 10.3625 10.5023 10.5023 11.5907 11.5907 11.7305 11.7305 11.8859 11.8859 12.0632 12.0632 12.1578 12.1578 12.2363 12.2363 12.4340 12.4340 13.4210 13.4210 13.5853 13.5853 16.5102 16.5102 16.8940 16.8940 17.1467 17.1467 k = 0.0000 0.0000 0.3468 ( 2555 PWs) bands (ev): -48.3527 -48.3527 -22.6442 -22.6442 -14.9197 -14.9197 -14.8875 -14.8875 2.4567 2.4567 6.6408 6.6408 7.8067 7.8067 9.2450 9.2450 10.0021 10.0021 10.1142 10.1142 10.3745 10.3745 10.5138 10.5138 11.5962 11.5962 11.7215 11.7215 11.8736 11.8736 12.0502 12.0502 12.1467 12.1467 12.2237 12.2237 12.4256 12.4256 13.4262 13.4262 13.5288 13.5288 16.5748 16.5748 16.9201 16.9201 17.1210 17.1210 k = 0.0000 0.0000 0.3641 ( 2563 PWs) bands (ev): -48.3526 -48.3526 -22.6448 -22.6448 -14.9202 -14.9202 -14.8899 -14.8899 2.5137 2.5137 6.6372 6.6372 7.8452 7.8452 9.1951 9.1951 10.0060 10.0060 10.0233 10.0233 10.3874 10.3874 10.5251 10.5251 11.5993 11.5993 11.7108 11.7108 11.8586 11.8586 12.0381 12.0381 12.1356 12.1356 12.2107 12.2107 12.4173 12.4173 13.4190 13.4190 13.4917 13.4917 16.6383 16.6383 16.9441 16.9441 17.1024 17.1024 k = 0.0000 0.0000 0.3814 ( 2563 PWs) bands (ev): -48.3525 -48.3525 -22.6453 -22.6453 -14.9207 -14.9207 -14.8924 -14.8924 2.5729 2.5729 6.6341 6.6341 7.8818 7.8818 9.1485 9.1485 9.9324 9.9324 10.0105 10.0105 10.4011 10.4011 10.5362 10.5362 11.6001 11.6001 11.6984 11.6984 11.8408 11.8408 12.0267 12.0267 12.1245 12.1245 12.1975 12.1975 12.4093 12.4093 13.3925 13.3925 13.4806 13.4806 16.6996 16.6996 16.9649 16.9649 17.0930 17.0930 k = 0.0000 0.0000 0.3988 ( 2559 PWs) bands (ev): -48.3524 -48.3524 -22.6459 -22.6459 -14.9211 -14.9211 -14.8949 -14.8949 2.6339 2.6339 6.6315 6.6315 7.9152 7.9152 9.1063 9.1063 9.8422 9.8422 10.0152 10.0152 10.4155 10.4155 10.5470 10.5470 11.5985 11.5985 11.6843 11.6843 11.8203 11.8203 12.0161 12.0161 12.1137 12.1137 12.1840 12.1840 12.4015 12.4015 13.3601 13.3601 13.4824 13.4824 16.7573 16.7573 16.9823 16.9823 17.0942 17.0942 k = 0.0000 0.0000 0.4161 ( 2555 PWs) bands (ev): -48.3523 -48.3523 -22.6464 -22.6464 -14.9216 -14.9216 -14.8974 -14.8974 2.6968 2.6968 6.6293 6.6293 7.9444 7.9444 9.0700 9.0700 9.7528 9.7528 10.0203 10.0203 10.4306 10.4306 10.5573 10.5573 11.5942 11.5942 11.6689 11.6689 11.7972 11.7972 12.0062 12.0062 12.1030 12.1030 12.1701 12.1701 12.3939 12.3939 13.3311 13.3311 13.4875 13.4875 16.8096 16.8096 16.9984 16.9984 17.1051 17.1051 k = 0.0000 0.0000 0.4335 ( 2559 PWs) bands (ev): -48.3522 -48.3522 -22.6470 -22.6470 -14.9221 -14.9221 -14.9000 -14.9000 2.7613 2.7613 6.6277 6.6277 7.9680 7.9680 9.0411 9.0411 9.6643 9.6643 10.0258 10.0258 10.4463 10.4463 10.5671 10.5671 11.5870 11.5870 11.6522 11.6522 11.7717 11.7717 11.9967 11.9967 12.0926 12.0926 12.1559 12.1559 12.3865 12.3865 13.3079 13.3079 13.4933 13.4933 16.8538 16.8538 17.0177 17.0177 17.1226 17.1226 k = 0.0000 0.0000 0.4508 ( 2557 PWs) bands (ev): -48.3521 -48.3521 -22.6476 -22.6476 -14.9226 -14.9226 -14.9026 -14.9026 2.8273 2.8273 6.6267 6.6267 7.9848 7.9848 9.0209 9.0209 9.5769 9.5769 10.0318 10.0318 10.4626 10.4626 10.5762 10.5762 11.5770 11.5770 11.6347 11.6347 11.7441 11.7441 11.9873 11.9873 12.0825 12.0825 12.1414 12.1414 12.3793 12.3793 13.2908 13.2908 13.4990 13.4990 16.8885 16.8885 17.0439 17.0439 17.1433 17.1433 k = 0.0000 0.0000 0.4681 ( 2559 PWs) bands (ev): -48.3520 -48.3520 -22.6482 -22.6482 -14.9231 -14.9231 -14.9052 -14.9052 2.8947 2.8947 6.6263 6.6263 7.9938 7.9938 9.0107 9.0107 9.4909 9.4909 10.0381 10.0381 10.4792 10.4792 10.5844 10.5844 11.5637 11.5637 11.6168 11.6168 11.7148 11.7148 11.9781 11.9781 12.0727 12.0727 12.1269 12.1269 12.3723 12.3723 13.2796 13.2796 13.5044 13.5044 16.9143 16.9143 17.0770 17.0770 17.1650 17.1650 k = 0.0000 0.0000 0.4855 ( 2555 PWs) bands (ev): -48.3519 -48.3519 -22.6488 -22.6488 -14.9236 -14.9236 -14.9077 -14.9077 2.9633 2.9633 6.6265 6.6265 7.9945 7.9945 9.0111 9.0111 9.4063 9.4063 10.0448 10.0448 10.4963 10.4963 10.5917 10.5917 11.5472 11.5472 11.5988 11.5988 11.6842 11.6842 11.9685 11.9685 12.0628 12.0628 12.1128 12.1128 12.3655 12.3655 13.2741 13.2741 13.5095 13.5095 16.9339 16.9339 17.1138 17.1138 17.1862 17.1862 k = 0.0000 0.0000 0.5028 ( 2555 PWs) bands (ev): -48.3518 -48.3518 -22.6494 -22.6494 -14.9241 -14.9241 -14.9103 -14.9103 3.0329 3.0329 6.6273 6.6273 7.9870 7.9870 9.0222 9.0222 9.3234 9.3234 10.0519 10.0519 10.5137 10.5137 10.5980 10.5980 11.5277 11.5277 11.5805 11.5805 11.6527 11.6527 11.9586 11.9586 12.0524 12.0524 12.0999 12.0999 12.3588 12.3588 13.2737 13.2737 13.5141 13.5141 16.9496 16.9496 17.1511 17.1511 17.2062 17.2062 k = 0.0000 0.0000 0.5201 ( 2551 PWs) bands (ev): -48.3517 -48.3517 -22.6499 -22.6499 -14.9246 -14.9246 -14.9129 -14.9129 3.1033 3.1033 6.6288 6.6288 7.9720 7.9720 9.0432 9.0432 9.2423 9.2423 10.0594 10.0594 10.5312 10.5312 10.6030 10.6030 11.5055 11.5055 11.5617 11.5617 11.6210 11.6210 11.9480 11.9480 12.0407 12.0407 12.0892 12.0892 12.3522 12.3522 13.2780 13.2780 13.5184 13.5184 16.9614 16.9614 17.1854 17.1854 17.2260 17.2260 k = 0.0000 0.0000 0.5375 ( 2559 PWs) bands (ev): -48.3516 -48.3516 -22.6506 -22.6506 -14.9252 -14.9252 -14.9154 -14.9154 3.1742 3.1742 6.6309 6.6309 7.9509 7.9509 9.0725 9.0725 9.1636 9.1636 10.0673 10.0673 10.5487 10.5487 10.6067 10.6067 11.4811 11.4811 11.5418 11.5418 11.5894 11.5894 11.9370 11.9370 12.0271 12.0271 12.0810 12.0810 12.3456 12.3456 13.2863 13.2863 13.5222 13.5222 16.9677 16.9677 17.2122 17.2122 17.2494 17.2494 k = 0.0000 0.0000 0.5548 ( 2561 PWs) bands (ev): -48.3515 -48.3515 -22.6512 -22.6512 -14.9259 -14.9259 -14.9179 -14.9179 3.2456 3.2456 6.6337 6.6337 7.9250 7.9250 9.0798 9.0798 9.1166 9.1166 10.0755 10.0755 10.5662 10.5662 10.6090 10.6090 11.4549 11.4549 11.5206 11.5206 11.5584 11.5584 11.9254 11.9254 12.0119 12.0119 12.0756 12.0756 12.3391 12.3391 13.2982 13.2982 13.5257 13.5257 16.9655 16.9655 17.2288 17.2288 17.2788 17.2788 k = 0.0000 0.0000 0.5722 ( 2561 PWs) bands (ev): -48.3514 -48.3514 -22.6518 -22.6518 -14.9266 -14.9266 -14.9202 -14.9202 3.3171 3.3171 6.6371 6.6371 7.8960 7.8960 9.0078 9.0078 9.1571 9.1571 10.0841 10.0841 10.5831 10.5831 10.6100 10.6100 11.4275 11.4275 11.4977 11.4977 11.5286 11.5286 11.9133 11.9133 11.9958 11.9958 12.0723 12.0723 12.3324 12.3324 13.3131 13.3131 13.5289 13.5289 16.9504 16.9504 17.2387 17.2387 17.3109 17.3109 k = 0.0000 0.0000 0.5895 ( 2565 PWs) bands (ev): -48.3513 -48.3513 -22.6524 -22.6524 -14.9276 -14.9276 -14.9223 -14.9223 3.3884 3.3884 6.6411 6.6411 7.8651 7.8651 8.9348 8.9348 9.2056 9.2056 10.0930 10.0930 10.5968 10.5968 10.6122 10.6122 11.3989 11.3989 11.4733 11.4733 11.5000 11.5000 11.9008 11.9008 11.9795 11.9795 12.0706 12.0706 12.3257 12.3257 13.3306 13.3306 13.5318 13.5318 16.9178 16.9178 17.2445 17.2445 17.3433 17.3433 k = 0.0000 0.0000 0.6068 ( 2565 PWs) bands (ev): -48.3512 -48.3512 -22.6530 -22.6530 -14.9288 -14.9288 -14.9240 -14.9240 3.4594 3.4594 6.6458 6.6458 7.8337 7.8337 8.8636 8.8636 9.2581 9.2581 10.1022 10.1022 10.5992 10.5992 10.6233 10.6233 11.3697 11.3697 11.4476 11.4476 11.4721 11.4721 11.8881 11.8881 11.9635 11.9635 12.0701 12.0701 12.3188 12.3188 13.3499 13.3499 13.5344 13.5344 16.8653 16.8653 17.2472 17.2472 17.3747 17.3747 k = 0.0000 0.0000 0.6242 ( 2565 PWs) bands (ev): -48.3511 -48.3511 -22.6536 -22.6536 -14.9304 -14.9304 -14.9253 -14.9253 3.5297 3.5297 6.6510 6.6510 7.8028 7.8028 8.7947 8.7947 9.3133 9.3133 10.1117 10.1117 10.5941 10.5941 10.6391 10.6391 11.3400 11.3400 11.4214 11.4214 11.4444 11.4444 11.8755 11.8755 11.9484 11.9484 12.0706 12.0706 12.3116 12.3116 13.3706 13.3706 13.5367 13.5367 16.7945 16.7945 17.2474 17.2474 17.4045 17.4045 k = 0.0000 0.0000 0.6415 ( 2557 PWs) bands (ev): -48.3510 -48.3510 -22.6540 -22.6540 -14.9322 -14.9322 -14.9262 -14.9262 3.5991 3.5991 6.6568 6.6568 7.7735 7.7735 8.7281 8.7281 9.3704 9.3704 10.1214 10.1214 10.5858 10.5858 10.6554 10.6554 11.3102 11.3102 11.3951 11.3951 11.4164 11.4164 11.8630 11.8630 11.9344 11.9344 12.0717 12.0717 12.3042 12.3042 13.3921 13.3921 13.5389 13.5389 16.7109 16.7109 17.2458 17.2458 17.4323 17.4323 k = 0.0000 0.0000 0.6588 ( 2555 PWs) bands (ev): -48.3509 -48.3509 -22.6546 -22.6546 -14.9342 -14.9342 -14.9269 -14.9269 3.6673 3.6673 6.6630 6.6630 7.7463 7.7463 8.6639 8.6639 9.4284 9.4284 10.1313 10.1313 10.5745 10.5745 10.6714 10.6714 11.2806 11.2806 11.3690 11.3690 11.3882 11.3882 11.8509 11.8509 11.9215 11.9215 12.0733 12.0733 12.2964 12.2964 13.4137 13.4137 13.5411 13.5411 16.6213 16.6213 17.2430 17.2430 17.4577 17.4577 k = 0.0000 0.0000 0.6762 ( 2559 PWs) bands (ev): -48.3508 -48.3508 -22.6551 -22.6551 -14.9363 -14.9363 -14.9275 -14.9275 3.7338 3.7338 6.6698 6.6698 7.7221 7.7221 8.6022 8.6022 9.4867 9.4867 10.1414 10.1414 10.5602 10.5602 10.6867 10.6867 11.2515 11.2515 11.3425 11.3425 11.3599 11.3599 11.8396 11.8396 11.9099 11.9099 12.0754 12.0754 12.2883 12.2883 13.4347 13.4347 13.5432 13.5432 16.5316 16.5316 17.2393 17.2393 17.4801 17.4801 k = 0.0000 0.0000 0.6935 ( 2571 PWs) bands (ev): -48.3507 -48.3507 -22.6558 -22.6558 -14.9385 -14.9385 -14.9281 -14.9281 3.7986 3.7986 6.6769 6.6769 7.7013 7.7013 8.5429 8.5429 9.5446 9.5446 10.1516 10.1516 10.5430 10.5430 10.7014 10.7014 11.2230 11.2230 11.3151 11.3151 11.3326 11.3326 11.8290 11.8290 11.8995 11.8995 12.0776 12.0776 12.2796 12.2796 13.4546 13.4546 13.5452 13.5452 16.4462 16.4462 17.2348 17.2348 17.4952 17.4952 k = 0.0000 0.0000 0.7109 ( 2565 PWs) bands (ev): -48.3506 -48.3506 -22.6562 -22.6562 -14.9405 -14.9405 -14.9285 -14.9285 3.8612 3.8612 6.6843 6.6843 7.6844 7.6844 8.4863 8.4863 9.6016 9.6016 10.1619 10.1619 10.5229 10.5229 10.7155 10.7155 11.1953 11.1953 11.2861 11.2861 11.3073 11.3073 11.8197 11.8197 11.8905 11.8905 12.0802 12.0802 12.2706 12.2706 13.4726 13.4726 13.5473 13.5473 16.3685 16.3685 17.2295 17.2295 17.4844 17.4844 k = 0.0000 0.0000 0.7282 ( 2561 PWs) bands (ev): -48.3505 -48.3505 -22.6567 -22.6567 -14.9425 -14.9425 -14.9289 -14.9289 3.9214 3.9214 6.6921 6.6921 7.6718 7.6718 8.4323 8.4323 9.6569 9.6569 10.1723 10.1723 10.5001 10.5001 10.7287 10.7287 11.1686 11.1686 11.2554 11.2554 11.2839 11.2839 11.8117 11.8117 11.8828 11.8828 12.0829 12.0829 12.2611 12.2611 13.4881 13.4881 13.5495 13.5495 16.3008 16.3008 17.2231 17.2231 17.4600 17.4600 k = 0.0000 0.0000 0.7455 ( 2565 PWs) bands (ev): -48.3504 -48.3504 -22.6572 -22.6572 -14.9444 -14.9444 -14.9293 -14.9293 3.9789 3.9789 6.7001 6.7001 7.6637 7.6637 8.3809 8.3809 9.7101 9.7101 10.1827 10.1827 10.4747 10.4747 10.7409 10.7409 11.1427 11.1427 11.2240 11.2240 11.2622 11.2622 11.8051 11.8051 11.8762 11.8762 12.0856 12.0856 12.2512 12.2512 13.5007 13.5007 13.5518 13.5518 16.2451 16.2451 17.2151 17.2151 17.4301 17.4301 k = 0.0000 0.0000 0.7629 ( 2569 PWs) bands (ev): -48.3504 -48.3504 -22.6576 -22.6576 -14.9463 -14.9463 -14.9297 -14.9297 4.0334 4.0334 6.7082 6.7082 7.6602 7.6602 8.3323 8.3323 9.7603 9.7603 10.1932 10.1932 10.4471 10.4471 10.7522 10.7522 11.1178 11.1178 11.1924 11.1924 11.2416 11.2416 11.7999 11.7999 11.8707 11.8707 12.0884 12.0884 12.2407 12.2407 13.5101 13.5101 13.5538 13.5538 16.2024 16.2024 17.2049 17.2049 17.3974 17.3974 k = 0.0000 0.0000 0.7802 ( 2573 PWs) bands (ev): -48.3503 -48.3503 -22.6581 -22.6581 -14.9481 -14.9481 -14.9301 -14.9301 4.0848 4.0848 6.7164 6.7164 7.6614 7.6614 8.2865 8.2865 9.8068 9.8068 10.2037 10.2037 10.4180 10.4180 10.7626 10.7626 11.0938 11.0938 11.1611 11.1611 11.2223 11.2223 11.7960 11.7960 11.8662 11.8662 12.0911 12.0911 12.2299 12.2299 13.5166 13.5166 13.5553 13.5553 16.1738 16.1738 17.1912 17.1912 17.3646 17.3646 k = 0.0000 0.0000 0.7976 ( 2579 PWs) bands (ev): -48.3502 -48.3502 -22.6586 -22.6586 -14.9498 -14.9498 -14.9304 -14.9304 4.1329 4.1329 6.7246 6.7246 7.6673 7.6673 8.2434 8.2434 9.8485 9.8485 10.2143 10.2143 10.3882 10.3882 10.7719 10.7719 11.0707 11.0707 11.1305 11.1305 11.2041 11.2041 11.7936 11.7936 11.8628 11.8628 12.0938 12.0938 12.2187 12.2187 13.5205 13.5205 13.5556 13.5556 16.1596 16.1596 17.1725 17.1725 17.3346 17.3346 k = 0.0000 0.0000 0.8149 ( 2575 PWs) bands (ev): -48.3502 -48.3502 -22.6589 -22.6589 -14.9513 -14.9513 -14.9307 -14.9307 4.1774 4.1774 6.7327 6.7327 7.6778 7.6778 8.2032 8.2032 9.8841 9.8841 10.2251 10.2251 10.3593 10.3593 10.7801 10.7801 11.0484 11.0484 11.1010 11.1010 11.1871 11.1871 11.7925 11.7925 11.8603 11.8603 12.0965 12.0965 12.2072 12.2072 13.5222 13.5222 13.5548 13.5548 16.1600 16.1600 17.1479 17.1479 17.3099 17.3099 k = 0.0000 0.0000 0.8322 ( 2579 PWs) bands (ev): -48.3501 -48.3501 -22.6593 -22.6593 -14.9528 -14.9528 -14.9310 -14.9310 4.2184 4.2184 6.7407 6.7407 7.6925 7.6925 8.1658 8.1658 9.9118 9.9118 10.2358 10.2358 10.3328 10.3328 10.7873 10.7873 11.0268 11.0268 11.0730 11.0730 11.1712 11.1712 11.7927 11.7927 11.8587 11.8587 12.0990 12.0990 12.1954 12.1954 13.5216 13.5216 13.5529 13.5529 16.1746 16.1746 17.1177 17.1177 17.2912 17.2912 k = 0.0000 0.0000 0.8496 ( 2565 PWs) bands (ev): -48.3500 -48.3500 -22.6595 -22.6595 -14.9540 -14.9540 -14.9312 -14.9312 4.2558 4.2558 6.7484 6.7484 7.7110 7.7110 8.1313 8.1313 9.9298 9.9298 10.2462 10.2462 10.3118 10.3118 10.7935 10.7935 11.0058 11.0058 11.0469 11.0469 11.1566 11.1566 11.7939 11.7939 11.8580 11.8580 12.1015 12.1015 12.1837 12.1837 13.5187 13.5187 13.5508 13.5508 16.2029 16.2029 17.0835 17.0835 17.2778 17.2778 k = 0.0000 0.0000 0.8669 ( 2561 PWs) bands (ev): -48.3500 -48.3500 -22.6598 -22.6598 -14.9553 -14.9553 -14.9314 -14.9314 4.2895 4.2895 6.7557 6.7557 7.7329 7.7329 8.0998 8.0998 9.9362 9.9362 10.2546 10.2546 10.2997 10.2997 10.7987 10.7987 10.9855 10.9855 11.0230 11.0230 11.1431 11.1431 11.7961 11.7961 11.8579 11.8579 12.1038 12.1038 12.1718 12.1718 13.5132 13.5132 13.5489 13.5489 16.2439 16.2439 17.0478 17.0478 17.2682 17.2682 k = 0.0000 0.0000 0.8842 ( 2561 PWs) bands (ev): -48.3499 -48.3499 -22.6600 -22.6600 -14.9564 -14.9564 -14.9316 -14.9316 4.3196 4.3196 6.7627 6.7627 7.7574 7.7574 8.0712 8.0712 9.9308 9.9308 10.2583 10.2583 10.3001 10.3001 10.8027 10.8027 10.9659 10.9659 11.0016 11.0016 11.1308 11.1308 11.7990 11.7990 11.8584 11.8584 12.1057 12.1057 12.1600 12.1600 13.5056 13.5056 13.5476 13.5476 16.2964 16.2964 17.0122 17.0122 17.2614 17.2614 k = 0.0000 0.0000 0.9016 ( 2559 PWs) bands (ev): -48.3499 -48.3499 -22.6603 -22.6603 -14.9574 -14.9574 -14.9317 -14.9317 4.3462 4.3462 6.7691 6.7691 7.7837 7.7837 8.0455 8.0455 9.9150 9.9150 10.2591 10.2591 10.3104 10.3104 10.8056 10.8056 10.9475 10.9475 10.9826 10.9826 11.1197 11.1197 11.8024 11.8024 11.8595 11.8595 12.1076 12.1076 12.1487 12.1487 13.4965 13.4965 13.5468 13.5468 16.3591 16.3591 16.9782 16.9782 17.2566 17.2566 k = 0.0000 0.0000 0.9189 ( 2559 PWs) bands (ev): -48.3498 -48.3498 -22.6605 -22.6605 -14.9584 -14.9584 -14.9319 -14.9319 4.3692 4.3692 6.7750 6.7750 7.8109 7.8109 8.0228 8.0228 9.8918 9.8918 10.2602 10.2602 10.3252 10.3252 10.8075 10.8075 10.9305 10.9305 10.9659 10.9659 11.1098 11.1098 11.8063 11.8063 11.8609 11.8609 12.1090 12.1090 12.1378 12.1378 13.4868 13.4868 13.5463 13.5463 16.4302 16.4302 16.9467 16.9467 17.2533 17.2533 k = 0.0000 0.0000 0.9363 ( 2555 PWs) bands (ev): -48.3498 -48.3498 -22.6607 -22.6607 -14.9591 -14.9591 -14.9320 -14.9320 4.3889 4.3889 6.7803 6.7803 7.8379 7.8379 8.0031 8.0031 9.8647 9.8647 10.2622 10.2622 10.3412 10.3412 10.8083 10.8083 10.9155 10.9155 10.9515 10.9515 11.1013 11.1013 11.8103 11.8103 11.8626 11.8626 12.1098 12.1098 12.1280 12.1280 13.4772 13.4772 13.5461 13.5461 16.5077 16.5077 16.9184 16.9184 17.2514 17.2514 k = 0.0000 0.0000 0.9536 ( 2553 PWs) bands (ev): -48.3498 -48.3498 -22.6608 -22.6608 -14.9598 -14.9598 -14.9321 -14.9321 4.4053 4.4053 6.7848 6.7848 7.8637 7.8637 7.9865 7.9865 9.8366 9.8366 10.2648 10.2648 10.3569 10.3569 10.8083 10.8083 10.9027 10.9027 10.9394 10.9394 11.0940 11.0940 11.8142 11.8142 11.8644 11.8644 12.1091 12.1091 12.1205 12.1205 13.4682 13.4682 13.5459 13.5459 16.5889 16.5889 16.8939 16.8939 17.2508 17.2508 k = 0.0000 0.0000 0.9709 ( 2549 PWs) bands (ev): -48.3497 -48.3497 -22.6609 -22.6609 -14.9603 -14.9603 -14.9322 -14.9322 4.4185 4.4185 6.7887 6.7887 7.8869 7.8869 7.9728 7.9728 9.8101 9.8101 10.2673 10.2673 10.3710 10.3710 10.8075 10.8075 10.8923 10.8923 10.9296 10.9296 11.0880 11.0880 11.8177 11.8177 11.8663 11.8663 12.1050 12.1050 12.1174 12.1174 13.4603 13.4603 13.5458 13.5458 16.6702 16.6702 16.8737 16.8737 17.2519 17.2519 k = 0.0000 0.0000 0.9883 ( 2553 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9608 -14.9608 -14.9323 -14.9323 4.4287 4.4287 6.7917 6.7917 7.9065 7.9065 7.9621 7.9621 9.7872 9.7872 10.2696 10.2696 10.3828 10.3828 10.8062 10.8062 10.8843 10.8843 10.9219 10.9219 11.0833 11.0833 11.8207 11.8207 11.8680 11.8680 12.0993 12.0993 12.1169 12.1169 13.4538 13.4538 13.5458 13.5458 16.7463 16.7463 16.8582 16.8582 17.2548 17.2548 k = 0.0000 0.0000 1.0056 ( 2551 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9611 -14.9611 -14.9323 -14.9323 4.4359 4.4359 6.7939 6.7939 7.9213 7.9213 7.9545 7.9545 9.7697 9.7697 10.2713 10.2713 10.3916 10.3916 10.8049 10.8049 10.8786 10.8786 10.9165 10.9165 11.0799 11.0799 11.8229 11.8229 11.8693 11.8693 12.0945 12.0945 12.1171 12.1171 13.4490 13.4490 13.5458 13.5458 16.8078 16.8078 16.8504 16.8504 17.2596 17.2596 k = 0.0000 0.0000 1.0229 ( 2552 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4402 4.4402 6.7952 6.7952 7.9306 7.9306 7.9500 7.9500 9.7587 9.7587 10.2723 10.2723 10.3970 10.3970 10.8039 10.8039 10.8753 10.8753 10.9134 10.9134 11.0779 11.0779 11.8244 11.8244 11.8703 11.8703 12.0915 12.0915 12.1173 12.1173 13.4461 13.4461 13.5457 13.5457 16.8299 16.8299 16.8661 16.8661 17.2649 17.2649 k = 0.0000 0.0000 1.0403 ( 2564 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9614 -14.9614 -14.9325 -14.9325 4.4416 4.4416 6.7956 6.7956 7.9338 7.9338 7.9484 7.9484 9.7549 9.7549 10.2727 10.2727 10.3987 10.3987 10.8035 10.8035 10.8741 10.8741 10.9123 10.9123 11.0771 11.0771 11.8248 11.8248 11.8707 11.8707 12.0903 12.0903 12.1173 12.1173 13.4451 13.4451 13.5456 13.5456 16.8302 16.8302 16.8796 16.8796 17.2674 17.2674 k = 0.0000 0.0000 1.0403 ( 2564 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9614 -14.9614 -14.9325 -14.9325 4.4416 4.4416 6.7956 6.7956 7.9338 7.9338 7.9484 7.9484 9.7549 9.7549 10.2727 10.2727 10.3987 10.3987 10.8035 10.8035 10.8741 10.8741 10.9123 10.9123 11.0771 11.0771 11.8248 11.8248 11.8707 11.8707 12.0903 12.0903 12.1173 12.1173 13.4451 13.4451 13.5456 13.5456 16.8302 16.8302 16.8796 16.8796 17.2674 17.2674 k =-0.0083 0.0152 1.0403 ( 2546 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9612 -14.9612 -14.9323 -14.9323 4.4419 4.4419 6.7860 6.7860 7.9350 7.9350 7.9577 7.9577 9.7506 9.7506 10.2714 10.2714 10.4012 10.4012 10.8026 10.8026 10.8741 10.8741 10.9122 10.9122 11.0770 11.0770 11.8225 11.8225 11.8734 11.8734 12.0902 12.0902 12.1217 12.1217 13.4450 13.4450 13.5477 13.5477 16.8267 16.8267 16.8849 16.8849 17.2648 17.2648 k =-0.0167 0.0304 1.0403 ( 2550 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9611 -14.9611 -14.9323 -14.9323 4.4428 4.4428 6.7582 6.7582 7.9387 7.9387 7.9846 7.9846 9.7378 9.7378 10.2676 10.2676 10.4076 10.4076 10.7998 10.7998 10.8737 10.8737 10.9122 10.9122 11.0764 11.0764 11.8163 11.8163 11.8809 11.8809 12.0896 12.0896 12.1343 12.1343 13.4446 13.4446 13.5534 13.5534 16.8163 16.8163 16.9003 16.9003 17.2569 17.2569 k =-0.0250 0.0457 1.0403 ( 2554 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9608 -14.9608 -14.9323 -14.9323 4.4442 4.4442 6.7146 6.7146 7.9450 7.9450 8.0265 8.0265 9.7171 9.7171 10.2618 10.2618 10.4175 10.4175 10.7952 10.7952 10.8728 10.8728 10.9125 10.9125 11.0753 11.0753 11.8074 11.8074 11.8931 11.8931 12.0890 12.0890 12.1539 12.1539 13.4441 13.4441 13.5629 13.5629 16.7996 16.7996 16.9251 16.9251 17.2442 17.2442 k =-0.0334 0.0609 1.0403 ( 2546 PWs) bands (ev): -48.3497 -48.3497 -22.6609 -22.6609 -14.9603 -14.9603 -14.9322 -14.9322 4.4461 4.4461 6.6581 6.6581 7.9537 7.9537 8.0805 8.0805 9.6889 9.6889 10.2546 10.2546 10.4300 10.4300 10.7889 10.7889 10.8708 10.8708 10.9137 10.9137 11.0738 11.0738 11.7974 11.7974 11.9095 11.9095 12.0883 12.0883 12.1795 12.1795 13.4436 13.4436 13.5762 13.5762 16.7775 16.7775 16.9577 16.9577 17.2280 17.2280 k =-0.0417 0.0761 1.0403 ( 2538 PWs) bands (ev): -48.3497 -48.3497 -22.6607 -22.6607 -14.9597 -14.9597 -14.9321 -14.9321 4.4484 4.4484 6.5917 6.5917 7.9650 7.9650 8.1435 8.1435 9.6543 9.6543 10.2464 10.2464 10.4444 10.4444 10.7809 10.7809 10.8673 10.8673 10.9162 10.9162 11.0719 11.0719 11.7871 11.7871 11.9301 11.9301 12.0876 12.0876 12.2099 12.2099 13.4429 13.4429 13.5933 13.5933 16.7507 16.7507 16.9938 16.9938 17.2116 17.2116 k =-0.0501 0.0913 1.0403 ( 2534 PWs) bands (ev): -48.3498 -48.3498 -22.6605 -22.6605 -14.9589 -14.9589 -14.9320 -14.9320 4.4510 4.4510 6.5180 6.5180 7.9787 7.9787 8.2130 8.2130 9.6140 9.6140 10.2373 10.2373 10.4602 10.4602 10.7714 10.7714 10.8622 10.8622 10.9200 10.9200 11.0693 11.0693 11.7772 11.7772 11.9548 11.9548 12.0868 12.0868 12.2444 12.2444 13.4422 13.4422 13.6144 13.6144 16.7204 16.7204 17.0237 17.0237 17.2040 17.2040 k =-0.0584 0.1066 1.0403 ( 2540 PWs) bands (ev): -48.3498 -48.3498 -22.6603 -22.6603 -14.9581 -14.9581 -14.9320 -14.9320 4.4539 4.4539 6.4389 6.4389 7.9949 7.9949 8.2868 8.2868 9.5689 9.5689 10.2276 10.2276 10.4770 10.4770 10.7603 10.7603 10.8557 10.8557 10.9252 10.9252 11.0663 11.0663 11.7682 11.7682 11.9835 11.9835 12.0859 12.0859 12.2824 12.2824 13.4414 13.4414 13.6393 13.6393 16.6873 16.6873 17.0300 17.0300 17.2179 17.2179 k =-0.0668 0.1218 1.0403 ( 2536 PWs) bands (ev): -48.3498 -48.3498 -22.6601 -22.6601 -14.9572 -14.9572 -14.9318 -14.9318 4.4569 4.4569 6.3559 6.3559 8.0135 8.0135 8.3634 8.3634 9.5198 9.5198 10.2173 10.2173 10.4945 10.4945 10.7477 10.7477 10.8478 10.8478 10.9317 10.9317 11.0627 11.0627 11.7605 11.7605 12.0161 12.0161 12.0849 12.0849 12.3235 12.3235 13.4405 13.4405 13.6684 13.6684 16.6523 16.6523 17.0072 17.0072 17.1816 17.1816 k =-0.0751 0.1370 1.0403 ( 2536 PWs) bands (ev): -48.3499 -48.3499 -22.6598 -22.6598 -14.9562 -14.9562 -14.9317 -14.9317 4.4598 4.4598 6.2702 6.2702 8.0345 8.0345 8.4415 8.4415 9.4677 9.4677 10.2067 10.2067 10.5126 10.5126 10.7338 10.7338 10.8389 10.8389 10.9394 10.9394 11.0585 11.0585 11.7543 11.7543 12.0524 12.0524 12.0839 12.0839 12.3672 12.3672 13.4397 13.4397 13.7018 13.7018 16.6160 16.6160 16.9659 16.9659 17.1232 17.1232 k =-0.0751 0.1370 1.0403 ( 2536 PWs) bands (ev): -48.3499 -48.3499 -22.6598 -22.6598 -14.9562 -14.9562 -14.9317 -14.9317 4.4598 4.4598 6.2702 6.2702 8.0345 8.0345 8.4415 8.4415 9.4677 9.4677 10.2067 10.2067 10.5126 10.5126 10.7338 10.7338 10.8389 10.8389 10.9394 10.9394 11.0585 11.0585 11.7543 11.7543 12.0524 12.0524 12.0839 12.0839 12.3672 12.3672 13.4397 13.4397 13.7018 13.7018 16.6160 16.6160 16.9659 16.9659 17.1232 17.1232 k =-0.0810 0.1478 1.0280 ( 2540 PWs) bands (ev): -48.3499 -48.3499 -22.6597 -22.6597 -14.9554 -14.9554 -14.9316 -14.9316 4.4612 4.4612 6.2086 6.2086 8.0484 8.0484 8.4974 8.4974 9.4320 9.4320 10.1982 10.1982 10.5256 10.5256 10.7236 10.7236 10.8320 10.8320 10.9461 10.9461 11.0555 11.0555 11.7509 11.7509 12.0714 12.0714 12.0918 12.0918 12.3994 12.3994 13.4397 13.4397 13.7281 13.7281 16.5907 16.5907 16.9225 16.9225 17.0831 17.0831 k =-0.0869 0.1586 1.0157 ( 2544 PWs) bands (ev): -48.3500 -48.3500 -22.6595 -22.6595 -14.9545 -14.9545 -14.9314 -14.9314 4.4615 4.4615 6.1467 6.1467 8.0580 8.0580 8.5540 8.5540 9.4012 9.4012 10.1879 10.1879 10.5387 10.5387 10.7140 10.7140 10.8245 10.8245 10.9545 10.9545 11.0528 11.0528 11.7483 11.7483 12.0715 12.0715 12.1195 12.1195 12.4325 12.4325 13.4412 13.4412 13.7569 13.7569 16.5666 16.5666 16.8659 16.8659 17.0460 17.0460 k =-0.0928 0.1693 1.0034 ( 2548 PWs) bands (ev): -48.3500 -48.3500 -22.6593 -22.6593 -14.9537 -14.9537 -14.9311 -14.9311 4.4605 4.4605 6.0847 6.0847 8.0627 8.0627 8.6108 8.6108 9.3761 9.3761 10.1760 10.1760 10.5522 10.5522 10.7050 10.7050 10.8166 10.8166 10.9645 10.9645 11.0504 11.0504 11.7466 11.7466 12.0684 12.0684 12.1511 12.1511 12.4663 12.4663 13.4442 13.4442 13.7884 13.7884 16.5435 16.5435 16.8038 16.8038 17.0098 17.0098 k =-0.0987 0.1801 0.9912 ( 2546 PWs) bands (ev): -48.3501 -48.3501 -22.6590 -22.6590 -14.9528 -14.9528 -14.9307 -14.9307 4.4585 4.4585 6.0231 6.0231 8.0619 8.0619 8.6675 8.6675 9.3576 9.3576 10.1625 10.1625 10.5661 10.5661 10.6965 10.6965 10.8081 10.8081 10.9760 10.9760 11.0483 11.0483 11.7456 11.7456 12.0647 12.0647 12.1834 12.1834 12.5008 12.5008 13.4490 13.4490 13.8229 13.8229 16.5211 16.5211 16.7411 16.7411 16.9728 16.9728 k =-0.1046 0.1909 0.9789 ( 2547 PWs) bands (ev): -48.3501 -48.3501 -22.6587 -22.6587 -14.9519 -14.9519 -14.9302 -14.9302 4.4555 4.4555 5.9621 5.9621 8.0550 8.0550 8.7239 8.7239 9.3461 9.3461 10.1476 10.1476 10.5807 10.5807 10.6884 10.6884 10.7991 10.7991 10.9889 10.9889 11.0464 11.0464 11.7453 11.7453 12.0606 12.0606 12.2157 12.2157 12.5359 12.5359 13.4558 13.4558 13.8605 13.8605 16.4983 16.4983 16.6812 16.6812 16.9341 16.9341 k =-0.1105 0.2016 0.9666 ( 2553 PWs) bands (ev): -48.3502 -48.3502 -22.6585 -22.6585 -14.9512 -14.9512 -14.9295 -14.9295 4.4516 4.4516 5.9017 5.9017 8.0420 8.0420 8.7798 8.7798 9.3419 9.3419 10.1312 10.1312 10.5959 10.5959 10.6807 10.6807 10.7899 10.7899 11.0031 11.0031 11.0450 11.0450 11.7456 11.7456 12.0560 12.0560 12.2473 12.2473 12.5714 12.5714 13.4646 13.4646 13.9012 13.9012 16.4737 16.4737 16.6272 16.6272 16.8931 16.8931 k =-0.1164 0.2124 0.9543 ( 2553 PWs) bands (ev): -48.3502 -48.3502 -22.6582 -22.6582 -14.9505 -14.9505 -14.9285 -14.9285 4.4469 4.4469 5.8423 5.8423 8.0228 8.0228 8.8348 8.8348 9.3448 9.3448 10.1138 10.1138 10.6120 10.6120 10.6733 10.6733 10.7807 10.7807 11.0180 11.0180 11.0443 11.0443 11.7463 11.7463 12.0510 12.0510 12.2779 12.2779 12.6074 12.6074 13.4755 13.4755 13.9453 13.9453 16.4450 16.4450 16.5822 16.5822 16.8499 16.8499 k =-0.1223 0.2232 0.9421 ( 2556 PWs) bands (ev): -48.3503 -48.3503 -22.6578 -22.6578 -14.9500 -14.9500 -14.9274 -14.9274 4.4414 4.4414 5.7840 5.7840 7.9980 7.9980 8.8888 8.8888 9.3546 9.3546 10.0955 10.0955 10.6287 10.6287 10.6661 10.6661 10.7718 10.7718 11.0309 11.0309 11.0470 11.0470 11.7474 11.7474 12.0455 12.0455 12.3072 12.3072 12.6438 12.6438 13.4885 13.4885 13.9928 13.9928 16.4107 16.4107 16.5486 16.5486 16.8045 16.8045 k =-0.1282 0.2339 0.9298 ( 2556 PWs) bands (ev): -48.3504 -48.3504 -22.6575 -22.6575 -14.9496 -14.9496 -14.9261 -14.9261 4.4353 4.4353 5.7268 5.7268 7.9680 7.9680 8.9418 8.9418 9.3707 9.3707 10.0764 10.0764 10.6444 10.6444 10.6604 10.6604 10.7636 10.7636 11.0354 11.0354 11.0595 11.0595 11.7487 11.7487 12.0394 12.0394 12.3347 12.3347 12.6804 12.6804 13.5035 13.5035 14.0438 14.0438 16.3720 16.3720 16.5253 16.5253 16.7572 16.7572 k =-0.1341 0.2447 0.9175 ( 2557 PWs) bands (ev): -48.3504 -48.3504 -22.6571 -22.6571 -14.9494 -14.9494 -14.9245 -14.9245 4.4285 4.4285 5.6710 5.6710 7.9335 7.9335 8.9934 8.9934 9.3923 9.3923 10.0568 10.0568 10.6461 10.6461 10.6691 10.6691 10.7565 10.7565 11.0353 11.0353 11.0776 11.0776 11.7502 11.7502 12.0328 12.0328 12.3603 12.3603 12.7172 12.7172 13.5203 13.5203 14.0983 14.0983 16.3319 16.3319 16.5095 16.5095 16.7087 16.7087 k =-0.1400 0.2555 0.9052 ( 2551 PWs) bands (ev): -48.3505 -48.3505 -22.6567 -22.6567 -14.9492 -14.9492 -14.9227 -14.9227 4.4213 4.4213 5.6167 5.6167 7.8953 7.8953 9.0437 9.0437 9.4186 9.4186 10.0368 10.0368 10.6380 10.6380 10.6873 10.6873 10.7513 10.7513 11.0343 11.0343 11.0977 11.0977 11.7516 11.7516 12.0255 12.0255 12.3838 12.3838 12.7541 12.7541 13.5388 13.5388 14.1565 14.1565 16.2928 16.2928 16.4982 16.4982 16.6601 16.6601 k =-0.1459 0.2662 0.8929 ( 2551 PWs) bands (ev): -48.3506 -48.3506 -22.6563 -22.6563 -14.9492 -14.9492 -14.9208 -14.9208 4.4136 4.4136 5.5639 5.5639 7.8543 7.8543 9.0925 9.0925 9.4486 9.4486 10.0169 10.0169 10.6282 10.6282 10.7058 10.7058 10.7491 10.7491 11.0330 11.0330 11.1189 11.1189 11.7528 11.7528 12.0176 12.0176 12.4051 12.4051 12.7911 12.7911 13.5583 13.5583 14.2181 14.2181 16.2559 16.2559 16.4881 16.4881 16.6143 16.6143 k =-0.1518 0.2770 0.8807 ( 2551 PWs) bands (ev): -48.3506 -48.3506 -22.6559 -22.6559 -14.9493 -14.9493 -14.9187 -14.9187 4.4056 4.4056 5.5127 5.5127 7.8110 7.8110 9.1398 9.1398 9.4816 9.4816 9.9970 9.9970 10.6172 10.6172 10.7202 10.7202 10.7538 10.7538 11.0315 11.0315 11.1411 11.1411 11.7538 11.7538 12.0090 12.0090 12.4245 12.4245 12.8279 12.8279 13.5785 13.5785 14.2832 14.2832 16.2212 16.2212 16.4749 16.4749 16.5764 16.5764 k =-0.1577 0.2878 0.8684 ( 2557 PWs) bands (ev): -48.3507 -48.3507 -22.6555 -22.6555 -14.9495 -14.9495 -14.9166 -14.9166 4.3974 4.3974 5.4633 5.4633 7.7663 7.7663 9.1855 9.1855 9.5166 9.5166 9.9776 9.9776 10.6054 10.6054 10.7264 10.7264 10.7694 10.7694 11.0297 11.0297 11.1639 11.1639 11.7544 11.7544 11.9995 11.9995 12.4419 12.4419 12.8647 12.8647 13.5986 13.5986 14.3515 14.3515 16.1875 16.1875 16.4530 16.4530 16.5539 16.5539 k =-0.1636 0.2985 0.8561 ( 2561 PWs) bands (ev): -48.3508 -48.3508 -22.6552 -22.6552 -14.9498 -14.9498 -14.9144 -14.9144 4.3889 4.3889 5.4156 5.4156 7.7207 7.7207 9.2294 9.2294 9.5529 9.5529 9.9590 9.9590 10.5930 10.5930 10.7285 10.7285 10.7916 10.7916 11.0278 11.0278 11.1873 11.1873 11.7547 11.7547 11.9894 11.9894 12.4579 12.4579 12.9012 12.9012 13.6181 13.6181 14.4228 14.4228 16.1524 16.1524 16.4250 16.4250 16.5475 16.5475 k =-0.1695 0.3093 0.8438 ( 2563 PWs) bands (ev): -48.3509 -48.3509 -22.6548 -22.6548 -14.9501 -14.9501 -14.9122 -14.9122 4.3803 4.3803 5.3698 5.3698 7.6747 7.6747 9.2717 9.2717 9.5894 9.5894 9.9414 9.9414 10.5801 10.5801 10.7299 10.7299 10.8168 10.8168 11.0259 11.0259 11.2110 11.2110 11.7546 11.7546 11.9785 11.9785 12.4727 12.4727 12.9373 12.9373 13.6363 13.6363 14.4969 14.4969 16.1128 16.1128 16.4003 16.4003 16.5515 16.5515 k =-0.1754 0.3201 0.8316 ( 2562 PWs) bands (ev): -48.3510 -48.3510 -22.6544 -22.6544 -14.9504 -14.9504 -14.9098 -14.9098 4.3717 4.3717 5.3259 5.3259 7.6289 7.6289 9.3121 9.3121 9.6254 9.6254 9.9256 9.9256 10.5671 10.5671 10.7318 10.7318 10.8436 10.8436 11.0237 11.0237 11.2349 11.2349 11.7541 11.7541 11.9668 11.9668 12.4869 12.4869 12.9730 12.9730 13.6524 13.6524 14.5735 14.5735 16.0663 16.0663 16.3861 16.3861 16.5620 16.5620 k =-0.1813 0.3308 0.8193 ( 2564 PWs) bands (ev): -48.3510 -48.3510 -22.6540 -22.6540 -14.9508 -14.9508 -14.9075 -14.9075 4.3630 4.3630 5.2840 5.2840 7.5836 7.5836 9.3507 9.3507 9.6594 9.6594 9.9122 9.9122 10.5541 10.5541 10.7343 10.7343 10.8715 10.8715 11.0215 11.0215 11.2586 11.2586 11.7532 11.7532 11.9543 11.9543 12.5009 12.5009 13.0081 13.0081 13.6658 13.6658 14.6521 14.6521 16.0123 16.0123 16.3851 16.3851 16.5775 16.5775 k =-0.1872 0.3416 0.8070 ( 2560 PWs) bands (ev): -48.3511 -48.3511 -22.6536 -22.6536 -14.9512 -14.9512 -14.9052 -14.9052 4.3545 4.3545 5.2441 5.2441 7.5393 7.5393 9.3874 9.3874 9.6900 9.6900 9.9026 9.9026 10.5412 10.5412 10.7375 10.7375 10.9001 10.9001 11.0194 11.0194 11.2821 11.2821 11.7520 11.7520 11.9410 11.9410 12.5154 12.5154 13.0426 13.0426 13.6760 13.6760 14.7322 14.7322 15.9520 15.9520 16.3972 16.3972 16.5974 16.5974 k =-0.1931 0.3524 0.7947 ( 2560 PWs) bands (ev): -48.3512 -48.3512 -22.6532 -22.6532 -14.9516 -14.9516 -14.9029 -14.9029 4.3461 4.3461 5.2063 5.2063 7.4961 7.4961 9.4220 9.4220 9.7149 9.7149 9.8987 9.8987 10.5287 10.5287 10.7413 10.7413 10.9288 10.9288 11.0179 11.0179 11.3050 11.3050 11.7504 11.7504 11.9268 11.9268 12.5309 12.5309 13.0762 13.0762 13.6823 13.6823 14.8132 14.8132 15.8875 15.8875 16.4209 16.4209 16.6215 16.6215 k =-0.1990 0.3631 0.7824 ( 2561 PWs) bands (ev): -48.3512 -48.3512 -22.6528 -22.6528 -14.9520 -14.9520 -14.9006 -14.9006 4.3379 4.3379 5.1705 5.1705 7.4545 7.4545 9.4547 9.4547 9.7320 9.7320 9.9025 9.9025 10.5166 10.5166 10.7457 10.7457 10.9559 10.9559 11.0183 11.0183 11.3270 11.3270 11.7485 11.7485 11.9118 11.9118 12.5481 12.5481 13.1089 13.1089 13.6845 13.6845 14.8945 14.8945 15.8206 15.8206 16.4544 16.4544 16.6498 16.6498 k =-0.2049 0.3739 0.7702 ( 2559 PWs) bands (ev): -48.3513 -48.3513 -22.6525 -22.6525 -14.9524 -14.9524 -14.8984 -14.8984 4.3299 4.3299 5.1370 5.1370 7.4145 7.4145 9.4852 9.4852 9.7402 9.7402 9.9146 9.9146 10.5052 10.5052 10.7507 10.7507 10.9769 10.9769 11.0251 11.0251 11.3480 11.3480 11.7463 11.7463 11.8959 11.8959 12.5675 12.5675 13.1406 13.1406 13.6823 13.6823 14.9751 14.9751 15.7530 15.7530 16.4957 16.4957 16.6825 16.6825 k =-0.2108 0.3847 0.7579 ( 2559 PWs) bands (ev): -48.3513 -48.3513 -22.6521 -22.6521 -14.9528 -14.9528 -14.8963 -14.8963 4.3223 4.3223 5.1056 5.1056 7.3766 7.3766 9.5135 9.5135 9.7412 9.7412 9.9335 9.9335 10.4944 10.4944 10.7561 10.7561 10.9856 10.9856 11.0442 11.0442 11.3676 11.3676 11.7440 11.7440 11.8790 11.8790 12.5897 12.5897 13.1709 13.1709 13.6754 13.6754 15.0542 15.0542 15.6863 15.6863 16.5424 16.5424 16.7197 16.7197 k =-0.2167 0.3954 0.7456 ( 2557 PWs) bands (ev): -48.3514 -48.3514 -22.6518 -22.6518 -14.9532 -14.9532 -14.8943 -14.8943 4.3150 4.3150 5.0764 5.0764 7.3408 7.3408 9.5395 9.5395 9.7376 9.7376 9.9564 9.9564 10.4844 10.4844 10.7619 10.7619 10.9860 10.9860 11.0716 11.0716 11.3858 11.3858 11.7416 11.7416 11.8612 11.8612 12.6151 12.6151 13.1999 13.1999 13.6637 13.6637 15.1303 15.1303 15.6222 15.6222 16.5917 16.5917 16.7611 16.7611 k =-0.2226 0.4062 0.7333 ( 2563 PWs) bands (ev): -48.3515 -48.3515 -22.6515 -22.6515 -14.9536 -14.9536 -14.8925 -14.8925 4.3082 4.3082 5.0494 5.0494 7.3073 7.3073 9.5631 9.5631 9.7317 9.7317 9.9807 9.9807 10.4751 10.4751 10.7680 10.7680 10.9831 10.9831 11.1018 11.1018 11.4023 11.4023 11.7391 11.7391 11.8425 11.8425 12.6441 12.6441 13.2273 13.2273 13.6472 13.6472 15.2009 15.2009 15.5634 15.5634 16.6400 16.6400 16.8062 16.8062 k =-0.2285 0.4170 0.7211 ( 2561 PWs) bands (ev): -48.3515 -48.3515 -22.6512 -22.6512 -14.9540 -14.9540 -14.8907 -14.8907 4.3018 4.3018 5.0248 5.0248 7.2763 7.2763 9.5841 9.5841 9.7251 9.7251 10.0051 10.0051 10.4667 10.4667 10.7744 10.7744 10.9790 10.9790 11.1328 11.1328 11.4173 11.4173 11.7366 11.7366 11.8229 11.8229 12.6770 12.6770 13.2530 13.2530 13.6258 13.6258 15.2612 15.2612 15.5148 15.5148 16.6833 16.6833 16.8532 16.8532 k =-0.2344 0.4277 0.7088 ( 2565 PWs) bands (ev): -48.3516 -48.3516 -22.6510 -22.6510 -14.9543 -14.9543 -14.8891 -14.8891 4.2958 4.2958 5.0024 5.0024 7.2479 7.2479 9.6023 9.6023 9.7189 9.7189 10.0285 10.0285 10.4592 10.4592 10.7809 10.7809 10.9741 10.9741 11.1637 11.1637 11.4309 11.4309 11.7342 11.7342 11.8024 11.8024 12.7138 12.7138 13.2767 13.2767 13.5997 13.5997 15.2987 15.2987 15.4887 15.4887 16.7179 16.7179 16.9006 16.9006 k =-0.2403 0.4385 0.6965 ( 2567 PWs) bands (ev): -48.3516 -48.3516 -22.6508 -22.6508 -14.9546 -14.9546 -14.8876 -14.8876 4.2904 4.2904 4.9823 4.9823 7.2222 7.2222 9.6173 9.6173 9.7140 9.7140 10.0503 10.0503 10.4525 10.4525 10.7876 10.7876 10.9689 10.9689 11.1938 11.1938 11.4432 11.4432 11.7317 11.7317 11.7812 11.7812 12.7545 12.7545 13.2983 13.2983 13.5691 13.5691 15.2987 15.2987 15.5000 15.5000 16.7420 16.7420 16.9480 16.9480 k =-0.2462 0.4493 0.6842 ( 2569 PWs) bands (ev): -48.3517 -48.3517 -22.6506 -22.6506 -14.9549 -14.9549 -14.8863 -14.8863 4.2856 4.2856 4.9645 4.9645 7.1993 7.1993 9.6288 9.6288 9.7109 9.7109 10.0702 10.0702 10.4467 10.4467 10.7942 10.7942 10.9635 10.9635 11.2227 11.2227 11.4547 11.4547 11.7289 11.7289 11.7597 11.7597 12.7990 12.7990 13.3176 13.3176 13.5342 13.5342 15.2721 15.2721 15.5374 15.5374 16.7563 16.7563 16.9965 16.9965 k =-0.2521 0.4600 0.6719 ( 2568 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9552 -14.9552 -14.8851 -14.8851 4.2813 4.2813 4.9491 4.9491 7.1792 7.1792 9.6367 9.6367 9.7101 9.7101 10.0878 10.0878 10.4417 10.4417 10.8006 10.8006 10.9581 10.9581 11.2496 11.2496 11.4658 11.4658 11.7244 11.7244 11.7398 11.7398 12.8468 12.8468 13.3340 13.3340 13.4956 13.4956 15.2381 15.2381 15.5817 15.5817 16.7634 16.7634 17.0461 17.0461 k =-0.2580 0.4708 0.6597 ( 2568 PWs) bands (ev): -48.3517 -48.3517 -22.6502 -22.6502 -14.9554 -14.9554 -14.8840 -14.8840 4.2777 4.2777 4.9360 4.9360 7.1622 7.1622 9.6411 9.6411 9.7114 9.7114 10.1030 10.1030 10.4375 10.4375 10.8067 10.8067 10.9529 10.9529 11.2739 11.2739 11.4769 11.4769 11.7099 11.7099 11.7299 11.7299 12.8975 12.8975 13.3466 13.3466 13.4544 13.4544 15.2051 15.2051 15.6241 15.6241 16.7660 16.7660 17.0955 17.0955 k =-0.2639 0.4816 0.6474 ( 2568 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9556 -14.9556 -14.8832 -14.8832 4.2747 4.2747 4.9253 4.9253 7.1481 7.1481 9.6430 9.6430 9.7141 9.7141 10.1155 10.1155 10.4341 10.4341 10.8123 10.8123 10.9482 10.9482 11.2948 11.2948 11.4885 11.4885 11.6888 11.6888 11.7269 11.7269 12.9506 12.9506 13.3516 13.3516 13.4148 13.4148 15.1763 15.1763 15.6611 15.6611 16.7661 16.7661 17.1429 17.1429 k =-0.2698 0.4923 0.6351 ( 2566 PWs) bands (ev): -48.3518 -48.3518 -22.6500 -22.6500 -14.9557 -14.9557 -14.8825 -14.8825 4.2723 4.2723 4.9170 4.9170 7.1372 7.1372 9.6435 9.6435 9.7173 9.7173 10.1254 10.1254 10.4315 10.4315 10.8169 10.8169 10.9442 10.9442 11.3117 11.3117 11.5007 11.5007 11.6678 11.6678 11.7254 11.7254 13.0053 13.0053 13.3335 13.3335 13.3929 13.3929 15.1531 15.1531 15.6912 15.6912 16.7651 16.7651 17.1855 17.1855 k =-0.2757 0.5031 0.6228 ( 2564 PWs) bands (ev): -48.3518 -48.3518 -22.6499 -22.6499 -14.9557 -14.9557 -14.8820 -14.8820 4.2706 4.2706 4.9110 4.9110 7.1293 7.1293 9.6432 9.6432 9.7200 9.7200 10.1324 10.1324 10.4296 10.4296 10.8205 10.8205 10.9411 10.9411 11.3240 11.3240 11.5128 11.5128 11.6491 11.6491 11.7243 11.7243 13.0605 13.0605 13.2905 13.2905 13.3913 13.3913 15.1361 15.1361 15.7133 15.7133 16.7640 16.7640 17.2204 17.2204 k =-0.2817 0.5139 0.6105 ( 2562 PWs) bands (ev): -48.3518 -48.3518 -22.6498 -22.6498 -14.9558 -14.9558 -14.8817 -14.8817 4.2696 4.2696 4.9074 4.9074 7.1246 7.1246 9.6429 9.6429 9.7219 9.7219 10.1367 10.1367 10.4285 10.4285 10.8226 10.8226 10.9394 10.9394 11.3313 11.3313 11.5224 11.5224 11.6354 11.6354 11.7237 11.7237 13.1135 13.1135 13.2421 13.2421 13.3932 13.3932 15.1258 15.1258 15.7267 15.7267 16.7631 16.7631 17.2438 17.2438 k =-0.2876 0.5246 0.5983 ( 2560 PWs) bands (ev): -48.3518 -48.3518 -22.6498 -22.6498 -14.9558 -14.9558 -14.8816 -14.8816 4.2693 4.2693 4.9063 4.9063 7.1230 7.1230 9.6428 9.6428 9.7226 9.7226 10.1381 10.1381 10.4280 10.4280 10.8232 10.8232 10.9390 10.9390 11.3336 11.3336 11.5259 11.5259 11.6306 11.6306 11.7234 11.7234 13.1459 13.1459 13.2111 13.2111 13.3940 13.3940 15.1223 15.1223 15.7312 15.7312 16.7629 16.7629 17.2521 17.2521 k =-0.2876 0.5246 0.5983 ( 2560 PWs) bands (ev): -48.3518 -48.3518 -22.6498 -22.6498 -14.9558 -14.9558 -14.8816 -14.8816 4.2693 4.2693 4.9063 4.9063 7.1230 7.1230 9.6428 9.6428 9.7226 9.7226 10.1381 10.1381 10.4280 10.4280 10.8232 10.8232 10.9390 10.9390 11.3336 11.3336 11.5259 11.5259 11.6306 11.6306 11.7234 11.7234 13.1459 13.1459 13.2111 13.2111 13.3940 13.3940 15.1223 15.1223 15.7312 15.7312 16.7629 16.7629 17.2521 17.2521 k =-0.2817 0.5139 0.5861 ( 2564 PWs) bands (ev): -48.3517 -48.3517 -22.6500 -22.6500 -14.9568 -14.9568 -14.8815 -14.8815 4.2531 4.2531 4.9742 4.9742 7.1082 7.1082 9.6288 9.6288 9.7218 9.7218 10.1136 10.1136 10.4506 10.4506 10.8192 10.8192 10.9709 10.9709 11.3328 11.3328 11.5070 11.5070 11.6023 11.6023 11.7047 11.7047 13.1021 13.1021 13.1850 13.1850 13.3336 13.3336 15.2037 15.2037 15.6840 15.6840 16.8518 16.8518 17.2244 17.2244 k =-0.2758 0.5032 0.5739 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9576 -14.9576 -14.8815 -14.8815 4.2291 4.2291 5.0427 5.0427 7.1037 7.1037 9.6086 9.6086 9.7234 9.7234 10.0903 10.0903 10.4734 10.4734 10.8132 10.8132 11.0034 11.0034 11.3328 11.3328 11.4860 11.4860 11.5795 11.5795 11.6885 11.6885 13.0501 13.0501 13.1720 13.1720 13.2756 13.2756 15.2806 15.2806 15.6381 15.6381 16.9266 16.9266 17.2088 17.2088 k =-0.2699 0.4925 0.5616 ( 2564 PWs) bands (ev): -48.3517 -48.3517 -22.6503 -22.6503 -14.9583 -14.9583 -14.8814 -14.8814 4.1975 4.1975 5.1116 5.1116 7.1093 7.1093 9.5823 9.5823 9.7275 9.7275 10.0683 10.0683 10.4964 10.4964 10.8051 10.8051 11.0364 11.0364 11.3333 11.3333 11.4619 11.4619 11.5637 11.5637 11.6749 11.6749 12.9982 12.9982 13.1609 13.1609 13.2228 13.2228 15.3445 15.3445 15.6020 15.6020 16.9768 16.9768 17.2130 17.2130 k =-0.2641 0.4818 0.5494 ( 2564 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9587 -14.9587 -14.8814 -14.8814 4.1587 4.1587 5.1808 5.1808 7.1246 7.1246 9.5500 9.5500 9.7338 9.7338 10.0476 10.0476 10.5195 10.5195 10.7950 10.7950 11.0698 11.0698 11.3337 11.3337 11.4357 11.4357 11.5551 11.5551 11.6641 11.6641 12.9487 12.9487 13.1367 13.1367 13.1876 13.1876 15.3745 15.3745 15.5969 15.5969 16.9963 16.9963 17.2394 17.2394 k =-0.2582 0.4711 0.5372 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9590 -14.9590 -14.8813 -14.8813 4.1132 4.1132 5.2502 5.2502 7.1491 7.1491 9.5123 9.5123 9.7421 9.7421 10.0281 10.0281 10.5426 10.5426 10.7831 10.7831 11.1035 11.1035 11.3319 11.3319 11.4102 11.4102 11.5531 11.5531 11.6562 11.6562 12.9020 12.9020 13.0914 13.0914 13.1777 13.1777 15.3556 15.3556 15.6379 15.6379 16.9941 16.9941 17.2742 17.2742 k =-0.2523 0.4604 0.5250 ( 2566 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9591 -14.9591 -14.8813 -14.8813 4.0616 4.0616 5.3195 5.3195 7.1822 7.1822 9.4696 9.4696 9.7523 9.7523 10.0100 10.0100 10.5657 10.5657 10.7694 10.7694 11.1372 11.1372 11.3236 11.3236 11.3910 11.3910 11.5565 11.5565 11.6510 11.6510 12.8579 12.8579 13.0405 13.0405 13.1773 13.1773 15.3075 15.3075 15.7052 15.7052 16.9821 16.9821 17.3000 17.3000 k =-0.2465 0.4497 0.5128 ( 2570 PWs) bands (ev): -48.3517 -48.3517 -22.6505 -22.6505 -14.9591 -14.9591 -14.8813 -14.8813 4.0046 4.0046 5.3886 5.3886 7.2231 7.2231 9.4225 9.4225 9.7641 9.7641 9.9931 9.9931 10.5887 10.5887 10.7542 10.7542 11.1707 11.1707 11.3046 11.3046 11.3835 11.3835 11.5644 11.5644 11.6487 11.6487 12.8164 12.8164 12.9894 12.9894 13.1807 13.1807 15.2474 15.2474 15.7816 15.7816 16.9668 16.9668 17.3058 17.3058 k =-0.2406 0.4390 0.5006 ( 2566 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9589 -14.9589 -14.8812 -14.8812 3.9429 3.9429 5.4573 5.4573 7.2709 7.2709 9.3717 9.3717 9.7778 9.7778 9.9776 9.9776 10.6112 10.6112 10.7382 10.7382 11.2029 11.2029 11.2788 11.2788 11.3853 11.3853 11.5762 11.5762 11.6491 11.6491 12.7773 12.7773 12.9394 12.9394 13.1870 13.1870 15.1820 15.1820 15.8603 15.8603 16.9510 16.9510 17.2877 17.2877 k =-0.2347 0.4283 0.4884 ( 2564 PWs) bands (ev): -48.3517 -48.3517 -22.6503 -22.6503 -14.9585 -14.9585 -14.8812 -14.8812 3.8773 3.8773 5.5255 5.5255 7.3249 7.3249 9.3176 9.3176 9.7931 9.7931 9.9635 9.9635 10.6323 10.6323 10.7223 10.7223 11.2239 11.2239 11.2605 11.2605 11.3922 11.3922 11.5912 11.5912 11.6523 11.6523 12.7402 12.7402 12.8909 12.8909 13.1959 13.1959 15.1136 15.1136 15.9382 15.9382 16.9357 16.9357 17.2474 17.2474 k =-0.2289 0.4176 0.4762 ( 2566 PWs) bands (ev): -48.3517 -48.3517 -22.6502 -22.6502 -14.9579 -14.9579 -14.8812 -14.8812 3.8084 3.8084 5.5929 5.5929 7.3842 7.3842 9.2610 9.2610 9.8100 9.8100 9.9508 9.9508 10.6488 10.6488 10.7101 10.7101 11.2048 11.2048 11.2805 11.2805 11.4024 11.4024 11.6088 11.6088 11.6581 11.6581 12.7049 12.7049 12.8440 12.8440 13.2071 13.2071 15.0436 15.0436 16.0135 16.0135 16.9212 16.9212 17.1904 17.1904 k =-0.2230 0.4069 0.4640 ( 2568 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9571 -14.9571 -14.8812 -14.8812 3.7368 3.7368 5.6594 5.6594 7.4479 7.4479 9.2026 9.2026 9.8284 9.8284 9.9397 9.9397 10.6521 10.6521 10.7103 10.7103 11.1735 11.1735 11.3117 11.3117 11.4153 11.4153 11.6280 11.6280 11.6670 11.6670 12.6710 12.6710 12.7991 12.7991 13.2208 13.2208 14.9726 14.9726 16.0840 16.0840 16.9069 16.9069 17.1240 17.1240 k =-0.2171 0.3962 0.4518 ( 2568 PWs) bands (ev): -48.3518 -48.3518 -22.6499 -22.6499 -14.9563 -14.9563 -14.8812 -14.8812 3.6633 3.6633 5.7249 5.7249 7.5151 7.5151 9.1431 9.1431 9.8479 9.8479 9.9306 9.9306 10.6402 10.6402 10.7252 10.7252 11.1407 11.1407 11.3433 11.3433 11.4310 11.4310 11.6475 11.6475 11.6794 11.6794 12.6384 12.6384 12.7562 12.7562 13.2370 13.2370 14.9012 14.9012 16.1472 16.1472 16.8907 16.8907 17.0574 17.0574 k =-0.2113 0.3854 0.4395 ( 2570 PWs) bands (ev): -48.3518 -48.3518 -22.6498 -22.6498 -14.9552 -14.9552 -14.8813 -14.8813 3.5883 3.5883 5.7890 5.7890 7.5848 7.5848 9.0832 9.0832 9.8672 9.8672 9.9249 9.9249 10.6220 10.6220 10.7461 10.7461 11.1077 11.1077 11.3740 11.3740 11.4497 11.4497 11.6660 11.6660 11.6964 11.6964 12.6068 12.6068 12.7155 12.7155 13.2556 13.2556 14.8296 14.8296 16.1991 16.1991 16.8684 16.8684 17.0021 17.0021 k =-0.2054 0.3747 0.4273 ( 2562 PWs) bands (ev): -48.3518 -48.3518 -22.6494 -22.6494 -14.9539 -14.9539 -14.8812 -14.8812 3.5122 3.5122 5.8517 5.8517 7.6560 7.6560 9.0240 9.0240 9.8818 9.8818 9.9270 9.9270 10.6018 10.6018 10.7689 10.7689 11.0749 11.0749 11.4029 11.4029 11.4719 11.4719 11.6829 11.6829 11.7179 11.7179 12.5758 12.5758 12.6773 12.6773 13.2768 13.2768 14.7582 14.7582 16.2339 16.2339 16.8381 16.8381 16.9686 16.9686 k =-0.1995 0.3640 0.4151 ( 2560 PWs) bands (ev): -48.3519 -48.3519 -22.6492 -22.6492 -14.9525 -14.9525 -14.8812 -14.8812 3.4356 3.4356 5.9127 5.9127 7.7276 7.7276 8.9665 8.9665 9.8863 9.8863 9.9425 9.9425 10.5809 10.5809 10.7923 10.7923 11.0425 11.0425 11.4296 11.4296 11.4975 11.4975 11.6990 11.6990 11.7424 11.7424 12.5453 12.5453 12.6419 12.6419 13.3005 13.3005 14.6870 14.6870 16.2445 16.2445 16.8103 16.8103 16.9552 16.9552 k =-0.1937 0.3533 0.4029 ( 2564 PWs) bands (ev): -48.3519 -48.3519 -22.6489 -22.6489 -14.9510 -14.9510 -14.8813 -14.8813 3.3589 3.3589 5.9719 5.9719 7.7979 7.7979 8.9120 8.9120 9.8843 9.8843 9.9676 9.9676 10.5600 10.5600 10.8156 10.8156 11.0108 11.0108 11.4546 11.4546 11.5261 11.5261 11.7152 11.7152 11.7685 11.7685 12.5151 12.5151 12.6092 12.6092 13.3267 13.3267 14.6165 14.6165 16.2262 16.2262 16.7984 16.7984 16.9546 16.9546 k =-0.1878 0.3426 0.3907 ( 2560 PWs) bands (ev): -48.3520 -48.3520 -22.6486 -22.6486 -14.9494 -14.9494 -14.8813 -14.8813 3.2822 3.2822 6.0291 6.0291 7.8653 7.8653 8.8622 8.8622 9.8808 9.8808 9.9975 9.9975 10.5392 10.5392 10.8384 10.8384 10.9805 10.9805 11.4786 11.4786 11.5569 11.5569 11.7319 11.7319 11.7955 11.7955 12.4853 12.4853 12.5794 12.5794 13.3557 13.3557 14.5465 14.5465 16.1811 16.1811 16.8054 16.8054 16.9629 16.9629 k =-0.1819 0.3319 0.3785 ( 2564 PWs) bands (ev): -48.3520 -48.3520 -22.6483 -22.6483 -14.9477 -14.9477 -14.8813 -14.8813 3.2061 3.2061 6.0841 6.0841 7.9273 7.9273 8.8194 8.8194 9.8773 9.8773 10.0307 10.0307 10.5189 10.5189 10.8590 10.8590 10.9527 10.9527 11.5021 11.5021 11.5889 11.5889 11.7490 11.7490 11.8226 11.8226 12.4560 12.4560 12.5524 12.5524 13.3873 13.3873 14.4774 14.4774 16.1168 16.1168 16.8253 16.8253 16.9791 16.9791 k =-0.1761 0.3212 0.3663 ( 2558 PWs) bands (ev): -48.3521 -48.3521 -22.6479 -22.6479 -14.9458 -14.9458 -14.8812 -14.8812 3.1307 3.1307 6.1369 6.1369 7.9807 7.9807 8.7866 8.7866 9.8744 9.8744 10.0667 10.0667 10.4993 10.4993 10.8719 10.8719 10.9333 10.9333 11.5257 11.5257 11.6218 11.6218 11.7666 11.7666 11.8497 11.8497 12.4274 12.4274 12.5280 12.5280 13.4216 13.4216 14.4091 14.4091 16.0415 16.0415 16.8510 16.8510 17.0029 17.0029 k =-0.1702 0.3105 0.3541 ( 2558 PWs) bands (ev): -48.3521 -48.3521 -22.6475 -22.6475 -14.9439 -14.9439 -14.8811 -14.8811 3.0562 3.0562 6.1873 6.1873 8.0220 8.0220 8.7671 8.7671 9.8720 9.8720 10.1052 10.1052 10.4804 10.4804 10.8643 10.8643 10.9350 10.9350 11.5495 11.5495 11.6550 11.6550 11.7843 11.7843 11.8763 11.8763 12.4001 12.4001 12.5062 12.5062 13.4587 13.4587 14.3419 14.3419 15.9610 15.9610 16.8777 16.8777 17.0337 17.0337 k =-0.1643 0.2998 0.3419 ( 2562 PWs) bands (ev): -48.3522 -48.3522 -22.6472 -22.6472 -14.9420 -14.9420 -14.8811 -14.8811 2.9830 2.9830 6.2352 6.2352 8.0478 8.0478 8.7643 8.7643 9.8704 9.8704 10.1461 10.1461 10.4623 10.4623 10.8415 10.8415 10.9522 10.9522 11.5735 11.5735 11.6884 11.6884 11.8019 11.8019 11.9020 11.9020 12.3744 12.3744 12.4866 12.4866 13.4986 13.4986 14.2757 14.2757 15.8792 15.8792 16.9038 16.9038 17.0700 17.0700 k =-0.1584 0.2891 0.3297 ( 2558 PWs) bands (ev): -48.3523 -48.3523 -22.6467 -22.6467 -14.9400 -14.9400 -14.8809 -14.8809 2.9111 2.9111 6.2805 6.2805 8.0564 8.0564 8.7797 8.7797 9.8696 9.8696 10.1894 10.1894 10.4451 10.4451 10.8148 10.8148 10.9738 10.9738 11.5978 11.5978 11.7218 11.7218 11.8192 11.8192 11.9267 11.9267 12.3507 12.3507 12.4693 12.4693 13.5413 13.5413 14.2107 14.2107 15.7984 15.7984 16.9294 16.9294 17.1095 17.1095 k =-0.1526 0.2784 0.3174 ( 2560 PWs) bands (ev): -48.3523 -48.3523 -22.6463 -22.6463 -14.9380 -14.9380 -14.8807 -14.8807 2.8408 2.8408 6.3231 6.3231 8.0485 8.0485 8.8123 8.8123 9.8694 9.8694 10.2350 10.2350 10.4288 10.4288 10.7873 10.7873 10.9966 10.9966 11.6221 11.6221 11.7549 11.7549 11.8359 11.8359 11.9500 11.9500 12.3295 12.3295 12.4543 12.4543 13.5868 13.5868 14.1468 14.1468 15.7205 15.7205 16.9552 16.9552 17.1505 17.1505 k =-0.1467 0.2677 0.3052 ( 2560 PWs) bands (ev): -48.3524 -48.3524 -22.6459 -22.6459 -14.9360 -14.9360 -14.8805 -14.8805 2.7722 2.7722 6.3631 6.3631 8.0272 8.0272 8.8589 8.8589 9.8699 9.8699 10.2826 10.2826 10.4137 10.4137 10.7599 10.7599 11.0197 11.0197 11.6463 11.6463 11.7878 11.7878 11.8517 11.8517 11.9717 11.9717 12.3112 12.3112 12.4417 12.4417 13.6352 13.6352 14.0842 14.0842 15.6465 15.6465 16.9818 16.9818 17.1916 17.1916 k =-0.1408 0.2570 0.2930 ( 2564 PWs) bands (ev): -48.3525 -48.3525 -22.6455 -22.6455 -14.9340 -14.9340 -14.8802 -14.8802 2.7054 2.7054 6.4004 6.4004 7.9962 7.9962 8.9156 8.9156 9.8711 9.8711 10.3317 10.3317 10.3999 10.3999 10.7330 10.7330 11.0428 11.0428 11.6700 11.6700 11.8200 11.8200 11.8664 11.8664 11.9917 11.9917 12.2960 12.2960 12.4315 12.4315 13.6865 13.6865 14.0229 14.0229 15.5774 15.5774 17.0095 17.0095 17.2321 17.2321 k =-0.1350 0.2463 0.2808 ( 2568 PWs) bands (ev): -48.3526 -48.3526 -22.6451 -22.6451 -14.9321 -14.9321 -14.8798 -14.8798 2.6406 2.6406 6.4350 6.4350 7.9587 7.9587 8.9790 8.9790 9.8729 9.8729 10.3749 10.3749 10.3949 10.3949 10.7067 10.7067 11.0658 11.0658 11.6929 11.6929 11.8507 11.8507 11.8805 11.8805 12.0100 12.0100 12.2841 12.2841 12.4239 12.4239 13.7406 13.7406 13.9630 13.9630 15.5139 15.5139 17.0387 17.0387 17.2714 17.2714 k =-0.1291 0.2356 0.2686 ( 2568 PWs) bands (ev): -48.3526 -48.3526 -22.6447 -22.6447 -14.9303 -14.9303 -14.8793 -14.8793 2.5779 2.5779 6.4670 6.4670 7.9171 7.9171 9.0464 9.0464 9.8754 9.8754 10.3709 10.3709 10.4392 10.4392 10.6816 10.6816 11.0884 11.0884 11.7145 11.7145 11.8762 11.8762 11.8977 11.8977 12.0266 12.0266 12.2758 12.2758 12.4190 12.4190 13.7972 13.7972 13.9050 13.9050 15.4567 15.4567 17.0691 17.0691 17.3096 17.3096 k =-0.1232 0.2248 0.2564 ( 2570 PWs) bands (ev): -48.3527 -48.3527 -22.6443 -22.6443 -14.9285 -14.9285 -14.8787 -14.8787 2.5174 2.5174 6.4964 6.4964 7.8734 7.8734 9.1158 9.1158 9.8784 9.8784 10.3600 10.3600 10.4917 10.4917 10.6583 10.6583 11.1106 11.1106 11.7342 11.7342 11.8906 11.8906 11.9235 11.9235 12.0418 12.0418 12.2709 12.2709 12.4169 12.4169 13.8392 13.8392 13.8659 13.8659 15.4063 15.4063 17.1007 17.1007 17.3469 17.3469 k =-0.1174 0.2141 0.2442 ( 2568 PWs) bands (ev): -48.3528 -48.3528 -22.6438 -22.6438 -14.9268 -14.9268 -14.8780 -14.8780 2.4592 2.4592 6.5233 6.5233 7.8287 7.8287 9.1858 9.1858 9.8819 9.8819 10.3495 10.3495 10.5418 10.5418 10.6400 10.6400 11.1324 11.1324 11.7514 11.7514 11.8988 11.8988 11.9534 11.9534 12.0561 12.0561 12.2691 12.2691 12.4175 12.4175 13.7894 13.7894 13.9230 13.9230 15.3632 15.3632 17.1331 17.1331 17.3837 17.3837 k =-0.1115 0.2034 0.2320 ( 2568 PWs) bands (ev): -48.3528 -48.3528 -22.6434 -22.6434 -14.9252 -14.9252 -14.8772 -14.8772 2.4033 2.4033 6.5477 6.5477 7.7839 7.7839 9.2553 9.2553 9.8859 9.8859 10.3398 10.3398 10.5721 10.5721 10.6433 10.6433 11.1536 11.1536 11.7655 11.7655 11.9047 11.9047 11.9838 11.9838 12.0695 12.0695 12.2701 12.2701 12.4206 12.4206 13.7354 13.7354 13.9887 13.9887 15.3276 15.3276 17.1657 17.1657 17.4205 17.4205 k =-0.1056 0.1927 0.2198 ( 2568 PWs) bands (ev): -48.3529 -48.3529 -22.6429 -22.6429 -14.9237 -14.9237 -14.8764 -14.8764 2.3499 2.3499 6.5699 6.5699 7.7397 7.7397 9.3235 9.3235 9.8904 9.8904 10.3309 10.3309 10.5657 10.5657 10.6848 10.6848 11.1741 11.1741 11.7761 11.7761 11.9092 11.9092 12.0139 12.0139 12.0826 12.0826 12.2735 12.2735 12.4260 12.4260 13.6827 13.6827 14.0576 14.0576 15.3001 15.3001 17.1978 17.1978 17.4584 17.4584 k =-0.0998 0.1820 0.2076 ( 2559 PWs) bands (ev): -48.3530 -48.3530 -22.6424 -22.6424 -14.9223 -14.9223 -14.8754 -14.8754 2.2991 2.2991 6.5899 6.5899 7.6966 7.6966 9.3898 9.3898 9.8952 9.8952 10.3227 10.3227 10.5473 10.5473 10.7395 10.7395 11.1940 11.1940 11.7831 11.7831 11.9130 11.9130 12.0437 12.0437 12.0957 12.0957 12.2787 12.2787 12.4333 12.4333 13.6315 13.6315 14.1296 14.1296 15.2808 15.2808 17.2287 17.2287 17.4980 17.4980 k =-0.0939 0.1713 0.1954 ( 2563 PWs) bands (ev): -48.3531 -48.3531 -22.6420 -22.6420 -14.9212 -14.9212 -14.8743 -14.8743 2.2508 2.2508 6.6078 6.6078 7.6549 7.6549 9.4536 9.4536 9.9004 9.9004 10.3153 10.3153 10.5269 10.5269 10.7970 10.7970 11.2132 11.2132 11.7867 11.7867 11.9159 11.9159 12.0727 12.0727 12.1089 12.1089 12.2855 12.2855 12.4420 12.4420 13.5817 13.5817 14.2046 14.2046 15.2699 15.2699 17.2575 17.2575 17.5400 17.5400 k =-0.0880 0.1606 0.1831 ( 2563 PWs) bands (ev): -48.3531 -48.3531 -22.6416 -22.6416 -14.9201 -14.9201 -14.8732 -14.8732 2.2051 2.2051 6.6237 6.6237 7.6149 7.6149 9.5146 9.5146 9.9059 9.9059 10.3086 10.3086 10.5063 10.5063 10.8551 10.8551 11.2315 11.2315 11.7876 11.7876 11.9179 11.9179 12.1006 12.1006 12.1228 12.1228 12.2933 12.2933 12.4517 12.4517 13.5336 13.5336 14.2826 14.2826 15.2674 15.2674 17.2836 17.2836 17.5837 17.5837 k =-0.0822 0.1499 0.1709 ( 2559 PWs) bands (ev): -48.3532 -48.3532 -22.6412 -22.6412 -14.9191 -14.9191 -14.8720 -14.8720 2.1622 2.1622 6.6379 6.6379 7.5768 7.5768 9.5724 9.5724 9.9117 9.9117 10.3026 10.3026 10.4862 10.4862 10.9128 10.9128 11.2490 11.2490 11.7865 11.7865 11.9188 11.9188 12.1257 12.1257 12.1390 12.1390 12.3019 12.3019 12.4621 12.4621 13.4873 13.4873 14.3634 14.3634 15.2732 15.2732 17.3065 17.3065 17.6115 17.6115 k =-0.0763 0.1392 0.1587 ( 2563 PWs) bands (ev): -48.3533 -48.3533 -22.6409 -22.6409 -14.9183 -14.9183 -14.8709 -14.8709 2.1220 2.1220 6.6504 6.6504 7.5408 7.5408 9.6268 9.6268 9.9177 9.9177 10.2972 10.2972 10.4667 10.4667 10.9693 10.9693 11.2656 11.2656 11.7843 11.7843 11.9185 11.9185 12.1441 12.1441 12.1612 12.1612 12.3109 12.3109 12.4727 12.4727 13.4426 13.4426 14.4472 14.4472 15.2872 15.2872 17.3262 17.3262 17.5150 17.5150 k =-0.0704 0.1285 0.1465 ( 2571 PWs) bands (ev): -48.3533 -48.3533 -22.6406 -22.6406 -14.9177 -14.9177 -14.8697 -14.8697 2.0846 2.0846 6.6613 6.6613 7.5070 7.5070 9.6777 9.6777 9.9237 9.9237 10.2924 10.2924 10.4479 10.4479 11.0242 11.0242 11.2812 11.2812 11.7815 11.7815 11.9169 11.9169 12.1582 12.1582 12.1863 12.1863 12.3199 12.3199 12.4833 12.4833 13.3999 13.3999 14.5338 14.5338 15.3090 15.3090 17.3427 17.3427 17.3784 17.3784 k =-0.0646 0.1178 0.1343 ( 2563 PWs) bands (ev): -48.3534 -48.3534 -22.6402 -22.6402 -14.9171 -14.9171 -14.8684 -14.8684 2.0500 2.0500 6.6709 6.6709 7.4756 7.4756 9.7248 9.7248 9.9299 9.9299 10.2882 10.2882 10.4301 10.4301 11.0768 11.0768 11.2959 11.2959 11.7789 11.7789 11.9142 11.9142 12.1710 12.1710 12.2114 12.2114 12.3288 12.3288 12.4937 12.4937 13.3593 13.3593 14.6232 14.6232 15.3380 15.3380 17.2396 17.2396 17.3564 17.3564 k =-0.0587 0.1071 0.1221 ( 2563 PWs) bands (ev): -48.3534 -48.3534 -22.6399 -22.6399 -14.9166 -14.9166 -14.8673 -14.8673 2.0184 2.0184 6.6792 6.6792 7.4466 7.4466 9.7680 9.7680 9.9362 9.9362 10.2846 10.2846 10.4132 10.4132 11.1265 11.1265 11.3095 11.3095 11.7768 11.7768 11.9105 11.9105 12.1827 12.1827 12.2357 12.2357 12.3373 12.3373 12.5037 12.5037 13.3207 13.3207 14.7154 14.7154 15.3734 15.3734 17.1014 17.1014 17.3675 17.3675 k =-0.0528 0.0964 0.1099 ( 2563 PWs) bands (ev): -48.3535 -48.3535 -22.6396 -22.6396 -14.9161 -14.9161 -14.8661 -14.8661 1.9896 1.9896 6.6863 6.6863 7.4202 7.4202 9.8072 9.8072 9.9424 9.9424 10.2814 10.2814 10.3974 10.3974 11.1726 11.1726 11.3221 11.3221 11.7757 11.7757 11.9060 11.9060 12.1934 12.1934 12.2588 12.2588 12.3452 12.3452 12.5131 12.5131 13.2845 13.2845 14.8103 14.8103 15.4143 15.4143 16.9644 16.9644 17.3764 17.3764 k =-0.0469 0.0857 0.0977 ( 2563 PWs) bands (ev): -48.3535 -48.3535 -22.6393 -22.6393 -14.9158 -14.9158 -14.8651 -14.8651 1.9638 1.9638 6.6923 6.6923 7.3964 7.3964 9.8423 9.8423 9.9484 9.9484 10.2787 10.2787 10.3828 10.3828 11.2146 11.2146 11.3337 11.3337 11.7757 11.7757 11.9008 11.9008 12.2028 12.2028 12.2805 12.2805 12.3525 12.3525 12.5218 12.5218 13.2507 13.2507 14.9078 14.9078 15.4593 15.4593 16.8288 16.8288 17.3832 17.3832 k =-0.0411 0.0749 0.0855 ( 2563 PWs) bands (ev): -48.3535 -48.3535 -22.6391 -22.6391 -14.9155 -14.9155 -14.8641 -14.8641 1.9410 1.9410 6.6974 6.6974 7.3753 7.3753 9.8732 9.8732 9.9542 9.9542 10.2763 10.2763 10.3695 10.3695 11.2520 11.2520 11.3445 11.3445 11.7772 11.7772 11.8953 11.8953 12.2110 12.2110 12.3005 12.3005 12.3592 12.3592 12.5298 12.5298 13.2197 13.2197 15.0078 15.0078 15.5072 15.5072 16.6948 16.6948 17.3883 17.3883 k =-0.0352 0.0642 0.0733 ( 2559 PWs) bands (ev): -48.3536 -48.3536 -22.6389 -22.6389 -14.9152 -14.9152 -14.8632 -14.8632 1.9211 1.9211 6.7016 6.7016 7.3569 7.3569 9.9000 9.9000 9.9597 9.9597 10.2745 10.2745 10.3576 10.3576 11.2840 11.2840 11.3545 11.3545 11.7801 11.7801 11.8894 11.8894 12.2179 12.2179 12.3185 12.3185 12.3652 12.3652 12.5369 12.5369 13.1917 13.1917 15.1101 15.1101 15.5560 15.5560 16.5628 16.5628 17.3918 17.3918 k =-0.0293 0.0535 0.0610 ( 2559 PWs) bands (ev): -48.3536 -48.3536 -22.6387 -22.6387 -14.9150 -14.9150 -14.8624 -14.8624 1.9043 1.9043 6.7051 6.7051 7.3412 7.3412 9.9224 9.9224 9.9649 9.9649 10.2730 10.2730 10.3472 10.3472 11.3100 11.3100 11.3640 11.3640 11.7842 11.7842 11.8833 11.8833 12.2236 12.2236 12.3341 12.3341 12.3707 12.3707 12.5432 12.5432 13.1672 13.1672 15.2144 15.2144 15.6039 15.6039 16.4329 16.4329 17.3939 17.3939 k =-0.0235 0.0428 0.0488 ( 2563 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9149 -14.9149 -14.8618 -14.8618 1.8905 1.8905 6.7078 6.7078 7.3284 7.3284 9.9403 9.9403 9.9698 9.9698 10.2719 10.2719 10.3383 10.3383 11.3297 11.3297 11.3733 11.3733 11.7893 11.7893 11.8772 11.8772 12.2280 12.2280 12.3467 12.3467 12.3757 12.3757 12.5485 12.5485 13.1463 13.1463 15.3201 15.3201 15.6488 15.6488 16.3054 16.3054 17.3948 17.3948 k =-0.0176 0.0321 0.0366 ( 2563 PWs) bands (ev): -48.3537 -48.3537 -22.6385 -22.6385 -14.9148 -14.9148 -14.8613 -14.8613 1.8798 1.8798 6.7099 6.7099 7.3184 7.3184 9.9534 9.9534 9.9744 9.9744 10.2711 10.2711 10.3312 10.3312 11.3432 11.3432 11.3823 11.3823 11.7949 11.7949 11.8713 11.8713 12.2314 12.2314 12.3561 12.3561 12.3805 12.3805 12.5528 12.5528 13.1298 13.1298 15.4258 15.4258 15.6890 15.6890 16.1809 16.1809 17.3948 17.3948 k =-0.0117 0.0214 0.0244 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9148 -14.9148 -14.8610 -14.8610 1.8721 1.8721 6.7113 6.7113 7.3112 7.3112 9.9619 9.9619 9.9788 9.9788 10.2705 10.2705 10.3260 10.3260 11.3515 11.3515 11.3898 11.3898 11.8003 11.8003 11.8662 11.8662 12.2338 12.2338 12.3622 12.3622 12.3846 12.3846 12.5559 12.5559 13.1176 13.1176 15.5279 15.5279 15.7248 15.7248 16.0606 16.0606 17.3943 17.3943 k =-0.0059 0.0107 0.0122 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9147 -14.9147 -14.8607 -14.8607 1.8675 1.8675 6.7121 6.7121 7.3069 7.3069 9.9662 9.9662 9.9822 9.9822 10.2702 10.2702 10.3229 10.3229 11.3559 11.3559 11.3949 11.3949 11.8042 11.8042 11.8625 11.8625 12.2351 12.2351 12.3655 12.3655 12.3876 12.3876 12.5578 12.5578 13.1101 13.1101 15.6126 15.6126 15.7639 15.7639 15.9482 15.9482 17.3938 17.3938 k = 0.0000 0.0000 0.0000 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9147 -14.9147 -14.8607 -14.8607 1.8660 1.8660 6.7124 6.7124 7.3055 7.3055 9.9675 9.9675 9.9835 9.9835 10.2701 10.2701 10.3218 10.3218 11.3573 11.3573 11.3966 11.3966 11.8057 11.8057 11.8611 11.8611 12.2356 12.2356 12.3665 12.3665 12.3887 12.3887 12.5585 12.5585 13.1076 13.1076 15.6473 15.6473 15.8083 15.8083 15.8732 15.8732 17.3936 17.3936 k = 0.0000 0.0000 0.0000 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9147 -14.9147 -14.8607 -14.8607 1.8660 1.8660 6.7124 6.7124 7.3055 7.3055 9.9675 9.9675 9.9835 9.9835 10.2701 10.2701 10.3218 10.3218 11.3573 11.3573 11.3966 11.3966 11.8057 11.8057 11.8611 11.8611 12.2356 12.2356 12.3665 12.3665 12.3887 12.3887 12.5585 12.5585 13.1076 13.1076 15.6473 15.6473 15.8083 15.8083 15.8732 15.8732 17.3936 17.3936 k = 0.0152 0.0083-0.0000 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9147 -14.9147 -14.8607 -14.8607 1.8675 1.8675 6.6915 6.6915 7.3251 7.3251 9.9674 9.9674 9.9833 9.9833 10.2696 10.2696 10.3219 10.3219 11.3568 11.3568 11.3963 11.3963 11.7962 11.7962 11.8624 11.8624 12.2434 12.2434 12.3675 12.3675 12.3902 12.3902 12.5607 12.5607 13.1076 13.1076 15.6484 15.6484 15.8090 15.8090 15.8731 15.8731 17.3932 17.3932 k = 0.0303 0.0166-0.0000 ( 2565 PWs) bands (ev): -48.3537 -48.3537 -22.6384 -22.6384 -14.9148 -14.9148 -14.8607 -14.8607 1.8721 1.8721 6.6353 6.6353 7.3771 7.3771 9.9670 9.9670 9.9825 9.9825 10.2682 10.2682 10.3222 10.3222 11.3553 11.3553 11.3951 11.3951 11.7698 11.7698 11.8661 11.8661 12.2642 12.2642 12.3703 12.3703 12.3950 12.3950 12.5678 12.5678 13.1076 13.1076 15.6514 15.6514 15.8110 15.8110 15.8730 15.8730 17.3920 17.3920 k = 0.0455 0.0249-0.0000 ( 2557 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9147 -14.9147 -14.8606 -14.8606 1.8798 1.8798 6.5565 6.5565 7.4490 7.4490 9.9664 9.9664 9.9812 9.9812 10.2659 10.2659 10.3227 10.3227 11.3529 11.3529 11.3932 11.3932 11.7315 11.7315 11.8724 11.8724 12.2915 12.2915 12.3751 12.3751 12.4037 12.4037 12.5807 12.5807 13.1076 13.1076 15.6565 15.6565 15.8142 15.8142 15.8730 15.8730 17.3900 17.3900 k = 0.0606 0.0332-0.0000 ( 2556 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9148 -14.9148 -14.8606 -14.8606 1.8905 1.8905 6.4643 6.4643 7.5313 7.5313 9.9656 9.9656 9.9794 9.9794 10.2629 10.2629 10.3233 10.3233 11.3496 11.3496 11.3905 11.3905 11.6855 11.6855 11.8812 11.8812 12.3185 12.3185 12.3817 12.3817 12.4170 12.4170 12.6010 12.6010 13.1076 13.1076 15.6635 15.6635 15.8179 15.8179 15.8735 15.8735 17.3875 17.3875 k = 0.0758 0.0415-0.0000 ( 2556 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9148 -14.9148 -14.8606 -14.8606 1.9042 1.9042 6.3644 6.3644 7.6182 7.6182 9.9645 9.9645 9.9770 9.9770 10.2595 10.2595 10.3242 10.3242 11.3453 11.3453 11.3871 11.3871 11.6352 11.6352 11.8926 11.8926 12.3406 12.3406 12.3901 12.3901 12.4345 12.4345 12.6302 12.6302 13.1075 13.1075 15.6722 15.6722 15.8214 15.8214 15.8752 15.8752 17.3844 17.3844 k = 0.0909 0.0498-0.0000 ( 2556 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9150 -14.9150 -14.8606 -14.8606 1.9211 1.9211 6.2598 6.2598 7.7064 7.7064 9.9631 9.9631 9.9742 9.9742 10.2561 10.2561 10.3252 10.3252 11.3402 11.3402 11.3829 11.3829 11.5826 11.5826 11.9064 11.9064 12.3569 12.3569 12.4002 12.4002 12.4541 12.4541 12.6692 12.6692 13.1076 13.1076 15.6826 15.6826 15.8238 15.8238 15.8790 15.8790 17.3810 17.3810 k = 0.1061 0.0581-0.0000 ( 2556 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9151 -14.9151 -14.8606 -14.8606 1.9409 1.9409 6.1521 6.1521 7.7940 7.7940 9.9616 9.9616 9.9710 9.9710 10.2529 10.2529 10.3264 10.3264 11.3343 11.3343 11.3782 11.3782 11.5290 11.5290 11.9228 11.9228 12.3690 12.3690 12.4121 12.4121 12.4739 12.4739 12.7169 12.7169 13.1076 13.1076 15.6943 15.6943 15.8243 15.8243 15.8854 15.8854 17.3774 17.3774 k = 0.1212 0.0664-0.0000 ( 2560 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9153 -14.9153 -14.8606 -14.8606 1.9637 1.9637 6.0425 6.0425 7.8794 7.8794 9.9599 9.9599 9.9675 9.9675 10.2504 10.2504 10.3277 10.3277 11.3276 11.3276 11.3727 11.3727 11.4754 11.4754 11.9417 11.9417 12.3785 12.3785 12.4255 12.4255 12.4930 12.4930 12.7714 12.7714 13.1075 13.1075 15.7072 15.7072 15.8228 15.8228 15.8944 15.8944 17.3738 17.3738 k = 0.1364 0.0747-0.0000 ( 2552 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9153 -14.9153 -14.8606 -14.8606 1.9896 1.9896 5.9317 5.9317 7.9618 7.9618 9.9581 9.9581 9.9637 9.9637 10.2490 10.2490 10.3293 10.3293 11.3202 11.3202 11.3666 11.3666 11.4226 11.4226 11.9634 11.9634 12.3862 12.3862 12.4404 12.4404 12.5120 12.5120 12.8308 12.8308 13.1075 13.1075 15.7210 15.7210 15.8195 15.8195 15.9055 15.9055 17.3703 17.3703 k = 0.1515 0.0830-0.0000 ( 2552 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9155 -14.9155 -14.8606 -14.8606 2.0184 2.0184 5.8201 5.8201 8.0403 8.0403 9.9558 9.9558 9.9597 9.9597 10.2491 10.2491 10.3309 10.3309 11.3123 11.3123 11.3580 11.3580 11.3724 11.3724 11.9876 11.9876 12.3925 12.3925 12.4567 12.4567 12.5314 12.5314 12.8931 12.8931 13.1074 13.1074 15.7355 15.7355 15.8149 15.8149 15.9181 15.9181 17.3671 17.3671 k = 0.1667 0.0913-0.0000 ( 2552 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9156 -14.9156 -14.8606 -14.8606 2.0502 2.0502 5.7081 5.7081 8.1141 8.1141 9.9530 9.9530 9.9560 9.9560 10.2511 10.2511 10.3326 10.3326 11.3038 11.3038 11.3177 11.3177 11.3549 11.3549 12.0146 12.0146 12.3978 12.3978 12.4744 12.4744 12.5515 12.5515 12.9572 12.9572 13.1074 13.1074 15.7503 15.7503 15.8092 15.8092 15.9317 15.9317 17.3643 17.3643 k = 0.1818 0.0997-0.0000 ( 2552 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9158 -14.9158 -14.8606 -14.8606 2.0849 2.0849 5.5960 5.5960 8.1828 8.1828 9.9491 9.9491 9.9531 9.9531 10.2554 10.2554 10.3344 10.3344 11.2684 11.2684 11.2949 11.2949 11.3473 11.3473 12.0443 12.0443 12.4023 12.4023 12.4931 12.4931 12.5727 12.5727 13.0221 13.0221 13.1074 13.1074 15.7652 15.7652 15.8027 15.8027 15.9457 15.9457 17.3621 17.3621 k = 0.1970 0.1080-0.0000 ( 2552 PWs) bands (ev): -48.3537 -48.3537 -22.6383 -22.6383 -14.9159 -14.9159 -14.8606 -14.8606 2.1225 2.1225 5.4840 5.4840 8.2458 8.2458 9.9445 9.9445 9.9505 9.9505 10.2623 10.2623 10.3362 10.3362 11.2204 11.2204 11.2857 11.2857 11.3397 11.3397 12.0769 12.0769 12.4060 12.4060 12.5129 12.5129 12.5948 12.5948 13.0870 13.0870 13.1074 13.1074 15.7798 15.7798 15.7956 15.7956 15.9597 15.9597 17.3605 17.3605 k = 0.2121 0.1163-0.0000 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6382 -22.6382 -14.9160 -14.9160 -14.8605 -14.8605 2.1629 2.1629 5.3722 5.3722 8.3029 8.3029 9.9398 9.9398 9.9483 9.9483 10.2718 10.2718 10.3382 10.3382 11.1742 11.1742 11.2762 11.2762 11.3320 11.3320 12.1121 12.1121 12.4091 12.4091 12.5336 12.5336 12.6181 12.6181 13.1072 13.1072 13.1519 13.1519 15.7881 15.7881 15.7938 15.7938 15.9734 15.9734 17.3597 17.3597 k = 0.2273 0.1246-0.0000 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6382 -22.6382 -14.9163 -14.9163 -14.8605 -14.8605 2.2062 2.2062 5.2608 5.2608 8.3538 8.3538 9.9348 9.9348 9.9457 9.9457 10.2841 10.2841 10.3403 10.3403 11.1297 11.1297 11.2665 11.2665 11.3243 11.3243 12.1500 12.1500 12.4119 12.4119 12.5551 12.5551 12.6422 12.6422 13.1072 13.1072 13.2155 13.2155 15.7801 15.7801 15.8069 15.8069 15.9863 15.9863 17.3597 17.3597 k = 0.2424 0.1329-0.0000 ( 2532 PWs) bands (ev): -48.3536 -48.3536 -22.6382 -22.6382 -14.9164 -14.9164 -14.8605 -14.8605 2.2524 2.2524 5.1500 5.1500 8.3986 8.3986 9.9298 9.9298 9.9433 9.9433 10.2991 10.2991 10.3425 10.3425 11.0872 11.0872 11.2569 11.2569 11.3165 11.3165 12.1906 12.1906 12.4141 12.4141 12.5770 12.5770 12.6671 12.6671 13.1073 13.1073 13.2778 13.2778 15.7719 15.7719 15.8189 15.8189 15.9981 15.9981 17.3607 17.3607 k = 0.2576 0.1412-0.0000 ( 2532 PWs) bands (ev): -48.3536 -48.3536 -22.6382 -22.6382 -14.9166 -14.9166 -14.8605 -14.8605 2.3012 2.3012 5.0398 5.0398 8.4373 8.4373 9.9248 9.9248 9.9408 9.9408 10.3164 10.3164 10.3446 10.3446 11.0469 11.0469 11.2471 11.2471 11.3086 11.3086 12.2337 12.2337 12.4160 12.4160 12.5993 12.5993 12.6924 12.6924 13.1072 13.1072 13.3384 13.3384 15.7635 15.7635 15.8295 15.8295 16.0087 16.0087 17.3627 17.3627 k = 0.2727 0.1495-0.0000 ( 2532 PWs) bands (ev): -48.3536 -48.3536 -22.6382 -22.6382 -14.9168 -14.9168 -14.8605 -14.8605 2.3528 2.3528 4.9303 4.9303 8.4702 8.4702 9.9199 9.9199 9.9384 9.9384 10.3357 10.3357 10.3469 10.3469 11.0087 11.0087 11.2375 11.2375 11.3008 11.3008 12.2792 12.2792 12.4175 12.4175 12.6217 12.6217 12.7180 12.7180 13.1072 13.1072 13.3971 13.3971 15.7551 15.7551 15.8386 15.8386 16.0178 16.0178 17.3659 17.3659 k = 0.2879 0.1578-0.0000 ( 2536 PWs) bands (ev): -48.3536 -48.3536 -22.6383 -22.6383 -14.9170 -14.9170 -14.8605 -14.8605 2.4071 2.4071 4.8217 4.8217 8.4976 8.4976 9.9151 9.9151 9.9360 9.9360 10.3481 10.3481 10.3574 10.3574 10.9727 10.9727 11.2280 11.2280 11.2931 11.2931 12.3267 12.3267 12.4189 12.4189 12.6441 12.6441 12.7436 12.7436 13.1071 13.1071 13.4534 13.4534 15.7466 15.7466 15.8460 15.8460 16.0252 16.0252 17.3704 17.3704 k = 0.3030 0.1661-0.0000 ( 2536 PWs) bands (ev): -48.3536 -48.3536 -22.6383 -22.6383 -14.9172 -14.9172 -14.8605 -14.8605 2.4641 2.4641 4.7140 4.7140 8.5201 8.5201 9.9105 9.9105 9.9337 9.9337 10.3504 10.3504 10.3794 10.3794 10.9389 10.9389 11.2188 11.2188 11.2856 11.2856 12.3760 12.3760 12.4200 12.4200 12.6663 12.6663 12.7690 12.7690 13.1071 13.1071 13.5070 13.5070 15.7382 15.7382 15.8518 15.8518 16.0310 16.0310 17.3764 17.3764 k = 0.3182 0.1744-0.0000 ( 2536 PWs) bands (ev): -48.3536 -48.3536 -22.6383 -22.6383 -14.9174 -14.9174 -14.8605 -14.8605 2.5236 2.5236 4.6074 4.6074 8.5381 8.5381 9.9060 9.9060 9.9315 9.9315 10.3524 10.3524 10.4021 10.4021 10.9075 10.9075 11.2100 11.2100 11.2784 11.2784 12.4210 12.4210 12.4266 12.4266 12.6880 12.6880 12.7940 12.7940 13.1070 13.1070 13.5579 13.5579 15.7299 15.7299 15.8560 15.8560 16.0350 16.0350 17.3840 17.3840 k = 0.3333 0.1827-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6384 -22.6384 -14.9177 -14.9177 -14.8605 -14.8605 2.5857 2.5857 4.5019 4.5019 8.5522 8.5522 9.9019 9.9019 9.9294 9.9294 10.3542 10.3542 10.4249 10.4249 10.8785 10.8785 11.2015 11.2015 11.2715 11.2715 12.4218 12.4218 12.4779 12.4779 12.7091 12.7091 12.8182 12.8182 13.1070 13.1070 13.6055 13.6055 15.7219 15.7219 15.8586 15.8586 16.0374 16.0374 17.3935 17.3935 k = 0.3485 0.1910-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9178 -14.9178 -14.8605 -14.8605 2.6503 2.6503 4.3976 4.3976 8.5630 8.5630 9.8979 9.8979 9.9274 9.9274 10.3560 10.3560 10.4472 10.4472 10.8519 10.8519 11.1936 11.1936 11.2651 11.2651 12.4225 12.4225 12.5291 12.5291 12.7293 12.7293 12.8416 12.8416 13.1069 13.1069 13.6499 13.6499 15.7142 15.7142 15.8597 15.8597 16.0383 16.0383 17.4051 17.4051 k = 0.3636 0.1993-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9180 -14.9180 -14.8605 -14.8605 2.7173 2.7173 4.2945 4.2945 8.5710 8.5710 9.8943 9.8943 9.9255 9.9255 10.3576 10.3576 10.4686 10.4686 10.8277 10.8277 11.1863 11.1863 11.2590 11.2590 12.4232 12.4232 12.5796 12.5796 12.7486 12.7486 12.8637 12.8637 13.1069 13.1069 13.6906 13.6906 15.7068 15.7068 15.8597 15.8597 16.0380 16.0380 17.4192 17.4192 k = 0.3788 0.2076-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9181 -14.9181 -14.8605 -14.8605 2.7866 2.7866 4.1929 4.1929 8.5767 8.5767 9.8910 9.8910 9.9238 9.9238 10.3592 10.3592 10.4887 10.4887 10.8060 10.8060 11.1795 11.1795 11.2535 11.2535 12.4237 12.4237 12.6284 12.6284 12.7666 12.7666 12.8843 12.8843 13.1069 13.1069 13.7276 13.7276 15.7000 15.7000 15.8587 15.8587 16.0367 16.0367 17.4362 17.4362 k = 0.3939 0.2159-0.0000 ( 2552 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9183 -14.9183 -14.8606 -14.8606 2.8583 2.8583 4.0927 4.0927 8.5806 8.5806 9.8879 9.8879 9.9222 9.9222 10.3606 10.3606 10.5070 10.5070 10.7867 10.7867 11.1735 11.1735 11.2485 11.2485 12.4241 12.4241 12.6745 12.6745 12.7832 12.7832 12.9032 12.9032 13.1067 13.1067 13.7606 13.7606 15.6937 15.6937 15.8570 15.8570 16.0346 16.0346 17.4564 17.4564 k = 0.4091 0.2242-0.0000 ( 2560 PWs) bands (ev): -48.3537 -48.3537 -22.6387 -22.6387 -14.9185 -14.9185 -14.8606 -14.8606 2.9321 2.9321 3.9941 3.9941 8.5832 8.5832 9.8853 9.8853 9.9209 9.9209 10.3618 10.3618 10.5233 10.5233 10.7701 10.7701 11.1681 11.1681 11.2441 11.2441 12.4244 12.4244 12.7168 12.7168 12.7984 12.7984 12.9200 12.9200 13.1067 13.1067 13.7896 13.7896 15.6880 15.6880 15.8549 15.8549 16.0321 16.0321 17.4803 17.4803 k = 0.4242 0.2325-0.0000 ( 2548 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9185 -14.9185 -14.8606 -14.8606 3.0079 3.0079 3.8973 3.8973 8.5847 8.5847 9.8831 9.8831 9.9199 9.9199 10.3628 10.3628 10.5374 10.5374 10.7560 10.7560 11.1635 11.1635 11.2403 11.2403 12.4248 12.4248 12.7540 12.7540 12.8124 12.8124 12.9348 12.9348 13.1067 13.1067 13.8144 13.8144 15.6831 15.6831 15.8526 15.8526 16.0294 16.0294 17.5084 17.5084 k = 0.4394 0.2408-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9185 -14.9185 -14.8605 -14.8605 3.0855 3.0855 3.8025 3.8025 8.5856 8.5856 9.8812 9.8812 9.9189 9.9189 10.3637 10.3637 10.5492 10.5492 10.7444 10.7444 11.1598 11.1598 11.2372 11.2372 12.4250 12.4250 12.7846 12.7846 12.8255 12.8255 12.9472 12.9472 13.1067 13.1067 13.8348 13.8348 15.6789 15.6789 15.8504 15.8504 16.0268 16.0268 17.5411 17.5411 k = 0.4545 0.2491-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8605 -14.8605 3.1644 3.1644 3.7102 3.7102 8.5860 8.5860 9.8798 9.8798 9.9182 9.9182 10.3644 10.3644 10.5585 10.5585 10.7353 10.7353 11.1568 11.1568 11.2348 11.2348 12.4252 12.4252 12.8067 12.8067 12.8386 12.8386 12.9570 12.9570 13.1066 13.1066 13.8508 13.8508 15.6756 15.6756 15.8484 15.8484 16.0245 16.0245 17.5786 17.5786 k = 0.4697 0.2574-0.0000 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9186 -14.9186 -14.8605 -14.8605 3.2435 3.2435 3.6216 3.6216 8.5862 8.5862 9.8787 9.8787 9.9177 9.9177 10.3649 10.3649 10.5652 10.5652 10.7289 10.7289 11.1546 11.1546 11.2330 11.2330 12.4253 12.4253 12.8199 12.8199 12.8510 12.8510 12.9641 12.9641 13.1066 13.1066 13.8622 13.8622 15.6732 15.6732 15.8468 15.8468 16.0227 16.0227 17.6203 17.6203 k = 0.4848 0.2657-0.0000 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8605 -14.8605 3.3181 3.3181 3.5412 3.5412 8.5862 8.5862 9.8781 9.8781 9.9173 9.9173 10.3652 10.3652 10.5692 10.5692 10.7251 10.7251 11.1534 11.1534 11.2319 11.2319 12.4254 12.4254 12.8266 12.8266 12.8601 12.8601 12.9684 12.9684 13.1066 13.1066 13.8692 13.8692 15.6717 15.6717 15.8459 15.8459 16.0215 16.0215 17.6628 17.6628 k = 0.5000 0.2740-0.0000 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8605 -14.8605 3.3603 3.3603 3.4971 3.4971 8.5863 8.5863 9.8779 9.8779 9.9172 9.9172 10.3653 10.3653 10.5705 10.5705 10.7238 10.7238 11.1529 11.1529 11.2316 11.2316 12.4254 12.4254 12.8286 12.8286 12.8634 12.8634 12.9698 12.9698 13.1066 13.1066 13.8715 13.8715 15.6712 15.6712 15.8455 15.8455 16.0212 16.0212 17.6873 17.6873 k = 0.5000 0.2740-0.0000 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8605 -14.8605 3.3603 3.3603 3.4971 3.4971 8.5863 8.5863 9.8779 9.8779 9.9172 9.9172 10.3653 10.3653 10.5705 10.5705 10.7238 10.7238 11.1529 11.1529 11.2316 11.2316 12.4254 12.4254 12.8286 12.8286 12.8634 12.8634 12.9698 12.9698 13.1066 13.1066 13.8715 13.8715 15.6712 15.6712 15.8455 15.8455 16.0212 16.0212 17.6873 17.6873 k = 0.4941 0.2848 0.0123 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8606 -14.8606 3.3616 3.3616 3.4984 3.4984 8.5863 8.5863 9.8779 9.8779 9.9172 9.9172 10.3657 10.3657 10.5711 10.5711 10.7171 10.7171 11.1543 11.1543 11.2324 11.2324 12.4246 12.4246 12.7878 12.7878 12.8788 12.8788 12.9817 12.9817 13.1173 13.1173 13.8754 13.8754 15.6702 15.6702 15.8427 15.8427 16.0183 16.0183 17.6907 17.6907 k = 0.4882 0.2956 0.0246 ( 2542 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9187 -14.9187 -14.8609 -14.8609 3.3655 3.3655 3.5021 3.5021 8.5864 8.5864 9.8777 9.8777 9.9173 9.9173 10.3668 10.3668 10.5728 10.5728 10.6977 10.6977 11.1569 11.1569 11.2357 11.2357 12.4222 12.4222 12.7251 12.7251 12.8687 12.8687 13.0195 13.0195 13.1439 13.1439 13.8868 13.8868 15.6673 15.6673 15.8340 15.8340 16.0106 16.0106 17.6993 17.6993 k = 0.4823 0.3064 0.0368 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6387 -22.6387 -14.9187 -14.9187 -14.8613 -14.8613 3.3720 3.3720 3.5082 3.5082 8.5864 8.5864 9.8772 9.8772 9.9177 9.9177 10.3687 10.3687 10.5756 10.5756 10.6671 10.6671 11.1573 11.1573 11.2435 11.2435 12.4181 12.4181 12.6575 12.6575 12.8397 12.8397 13.0683 13.0683 13.1783 13.1783 13.9056 13.9056 15.6624 15.6624 15.8181 15.8181 16.0001 16.0001 17.7054 17.7054 k = 0.4764 0.3171 0.0491 ( 2544 PWs) bands (ev): -48.3536 -48.3536 -22.6388 -22.6388 -14.9188 -14.9188 -14.8618 -14.8618 3.3811 3.3811 3.5168 3.5168 8.5863 8.5863 9.8760 9.8760 9.9188 9.9188 10.3714 10.3714 10.5795 10.5795 10.6273 10.6273 11.1527 11.1527 11.2568 11.2568 12.4121 12.4121 12.5882 12.5882 12.8041 12.8041 13.1183 13.1183 13.2156 13.2156 13.9314 13.9314 15.6551 15.6551 15.7944 15.7944 15.9893 15.9893 17.6777 17.6777 k = 0.4705 0.3279 0.0614 ( 2546 PWs) bands (ev): -48.3536 -48.3536 -22.6390 -22.6390 -14.9189 -14.9189 -14.8624 -14.8624 3.3928 3.3928 3.5278 3.5278 8.5859 8.5859 9.8737 9.8737 9.9211 9.9211 10.3748 10.3748 10.5797 10.5797 10.5845 10.5845 11.1426 11.1426 11.2748 11.2748 12.4036 12.4036 12.5192 12.5192 12.7661 12.7661 13.1669 13.1669 13.2533 13.2533 13.9634 13.9634 15.6442 15.6442 15.7636 15.7636 15.9803 15.9803 17.5792 17.5792 k = 0.4646 0.3387 0.0737 ( 2542 PWs) bands (ev): -48.3535 -48.3535 -22.6391 -22.6391 -14.9191 -14.9191 -14.8632 -14.8632 3.4070 3.4070 3.5413 3.5413 8.5850 8.5850 9.8702 9.8702 9.9248 9.9248 10.3788 10.3788 10.5263 10.5263 10.5903 10.5903 11.1278 11.1278 11.2957 11.2957 12.3895 12.3895 12.4546 12.4546 12.7273 12.7273 13.2137 13.2137 13.2901 13.2901 14.0010 14.0010 15.6257 15.6257 15.7309 15.7309 15.9741 15.9741 17.4430 17.4430 k = 0.4587 0.3494 0.0859 ( 2550 PWs) bands (ev): -48.3535 -48.3535 -22.6394 -22.6394 -14.9193 -14.9193 -14.8642 -14.8642 3.4237 3.4237 3.5572 3.5572 8.5831 8.5831 9.8653 9.8653 9.9299 9.9299 10.3832 10.3832 10.4681 10.4681 10.5970 10.5970 11.1091 11.1091 11.3178 11.3178 12.3556 12.3556 12.4095 12.4095 12.6884 12.6884 13.2584 13.2584 13.3251 13.3251 14.0433 14.0433 15.5924 15.5924 15.7053 15.7053 15.9707 15.9707 17.2935 17.2935 k = 0.4528 0.3602 0.0982 ( 2550 PWs) bands (ev): -48.3535 -48.3535 -22.6396 -22.6396 -14.9195 -14.9195 -14.8652 -14.8652 3.4428 3.4428 3.5755 3.5755 8.5800 8.5800 9.8593 9.8593 9.9363 9.9363 10.3841 10.3841 10.4103 10.4103 10.6045 10.6045 11.0871 11.0871 11.3403 11.3403 12.2978 12.2978 12.3889 12.3889 12.6499 12.6499 13.3008 13.3008 13.3585 13.3585 14.0897 14.0897 15.5415 15.5415 15.6921 15.6921 15.9696 15.9696 17.1383 17.1383 k = 0.4469 0.3710 0.1105 ( 2550 PWs) bands (ev): -48.3534 -48.3534 -22.6399 -22.6399 -14.9198 -14.9198 -14.8662 -14.8662 3.4643 3.4643 3.5962 3.5962 8.5751 8.5751 9.8523 9.8523 9.9440 9.9440 10.3358 10.3358 10.3996 10.3996 10.6127 10.6127 11.0622 11.0622 11.3623 11.3623 12.2354 12.2354 12.3738 12.3738 12.6119 12.6119 13.3402 13.3402 13.3910 13.3910 14.1392 14.1392 15.4781 15.4781 15.6887 15.6887 15.9702 15.9702 16.9808 16.9808 k = 0.4410 0.3817 0.1228 ( 2546 PWs) bands (ev): -48.3534 -48.3534 -22.6401 -22.6401 -14.9201 -14.9201 -14.8673 -14.8673 3.4881 3.4881 3.6193 3.6193 8.5680 8.5680 9.8446 9.8446 9.9528 9.9528 10.2693 10.2693 10.4060 10.4060 10.6214 10.6214 11.0349 11.0349 11.3834 11.3834 12.1745 12.1745 12.3589 12.3589 12.5745 12.5745 13.3749 13.3749 13.4243 13.4243 14.1911 14.1911 15.4069 15.4069 15.6922 15.6922 15.9722 15.9722 16.8229 16.8229 k = 0.4351 0.3925 0.1351 ( 2546 PWs) bands (ev): -48.3533 -48.3533 -22.6404 -22.6404 -14.9206 -14.9206 -14.8685 -14.8685 3.5141 3.5141 3.6447 3.6447 8.5579 8.5579 9.8362 9.8362 9.9624 9.9624 10.2013 10.2013 10.4141 10.4141 10.6307 10.6307 11.0054 11.0054 11.4031 11.4031 12.1165 12.1165 12.3431 12.3431 12.5377 12.5377 13.4026 13.4026 13.4606 13.4606 14.2447 14.2447 15.3306 15.3306 15.7016 15.7016 15.9751 15.9751 16.6665 16.6665 k = 0.4292 0.4033 0.1473 ( 2546 PWs) bands (ev): -48.3533 -48.3533 -22.6407 -22.6407 -14.9211 -14.9211 -14.8698 -14.8698 3.5423 3.5423 3.6724 3.6724 8.5440 8.5440 9.8273 9.8273 9.9725 9.9725 10.1340 10.1340 10.4233 10.4233 10.6404 10.6404 10.9740 10.9740 11.4213 11.4213 12.0620 12.0620 12.3262 12.3262 12.5015 12.5015 13.4232 13.4232 13.5004 13.5004 14.2991 14.2991 15.2509 15.2509 15.7166 15.7166 15.9785 15.9785 16.5131 16.5131 k = 0.4233 0.4140 0.1596 ( 2548 PWs) bands (ev): -48.3532 -48.3532 -22.6411 -22.6411 -14.9217 -14.9217 -14.8710 -14.8710 3.5726 3.5726 3.7025 3.7025 8.5257 8.5257 9.8180 9.8180 9.9815 9.9815 10.0703 10.0703 10.4332 10.4332 10.6504 10.6504 10.9410 10.9410 11.4374 11.4374 12.0113 12.0113 12.3081 12.3081 12.4658 12.4658 13.4376 13.4376 13.5429 13.5429 14.3534 14.3534 15.1690 15.1690 15.7372 15.7372 15.9813 15.9813 16.3652 16.3652 k = 0.4174 0.4248 0.1719 ( 2546 PWs) bands (ev): -48.3531 -48.3531 -22.6414 -22.6414 -14.9224 -14.9224 -14.8722 -14.8722 3.6048 3.6048 3.7348 3.7348 8.5020 8.5020 9.8082 9.8082 9.9770 9.9770 10.0238 10.0238 10.4442 10.4442 10.6606 10.6606 10.9067 10.9067 11.4512 11.4512 11.9648 11.9648 12.2886 12.2886 12.4305 12.4305 13.4467 13.4467 13.5873 13.5873 14.4065 14.4065 15.0855 15.0855 15.7630 15.7630 15.9809 15.9809 16.2274 16.2274 k = 0.4115 0.4356 0.1842 ( 2542 PWs) bands (ev): -48.3531 -48.3531 -22.6418 -22.6418 -14.9232 -14.9232 -14.8734 -14.8734 3.6388 3.6388 3.7693 3.7693 8.4721 8.4721 9.7982 9.7982 9.9335 9.9335 10.0218 10.0218 10.4561 10.4561 10.6709 10.6709 10.8714 10.8714 11.4624 11.4624 11.9226 11.9226 12.2679 12.2679 12.3955 12.3955 13.4512 13.4512 13.6334 13.6334 14.4568 14.4568 15.0011 15.0011 15.7927 15.7927 15.9655 15.9655 16.1144 16.1144 k = 0.4056 0.4463 0.1965 ( 2538 PWs) bands (ev): -48.3530 -48.3530 -22.6421 -22.6421 -14.9241 -14.9241 -14.8745 -14.8745 3.6746 3.6746 3.8060 3.8060 8.4352 8.4352 9.7875 9.7875 9.8829 9.8829 10.0336 10.0336 10.4689 10.4689 10.6810 10.6810 10.8356 10.8356 11.4706 11.4706 11.8849 11.8849 12.2460 12.2460 12.3608 12.3608 13.4514 13.4514 13.6812 13.6812 14.5022 14.5022 14.9163 14.9163 15.8193 15.8193 15.9084 15.9084 16.0624 16.0624 k = 0.3997 0.4571 0.2087 ( 2544 PWs) bands (ev): -48.3529 -48.3529 -22.6426 -22.6426 -14.9253 -14.9253 -14.8757 -14.8757 3.7119 3.7119 3.8448 3.8448 8.3908 8.3908 9.7754 9.7754 9.8381 9.8381 10.0479 10.0479 10.4826 10.4826 10.6904 10.6904 10.7997 10.7997 11.4757 11.4757 11.8517 11.8517 12.2228 12.2228 12.3262 12.3262 13.4478 13.4478 13.7305 13.7305 14.5395 14.5395 14.8315 14.8315 15.7814 15.7814 15.8866 15.8866 16.0591 16.0591 k = 0.3938 0.4679 0.2210 ( 2540 PWs) bands (ev): -48.3529 -48.3529 -22.6430 -22.6430 -14.9264 -14.9264 -14.8766 -14.8766 3.7505 3.7505 3.8856 3.8856 8.3388 8.3388 9.7601 9.7601 9.8032 9.8032 10.0635 10.0635 10.4972 10.4972 10.6975 10.6975 10.7658 10.7658 11.4775 11.4775 11.8229 11.8229 12.1985 12.1985 12.2918 12.2918 13.4409 13.4409 13.7813 13.7813 14.5646 14.5646 14.7472 14.7472 15.6956 15.6956 15.9177 15.9177 16.0743 16.0743 k = 0.3879 0.4786 0.2333 ( 2530 PWs) bands (ev): -48.3528 -48.3528 -22.6433 -22.6433 -14.9277 -14.9277 -14.8775 -14.8775 3.7904 3.7904 3.9285 3.9285 8.2794 8.2794 9.7397 9.7397 9.7807 9.7807 10.0800 10.0800 10.5126 10.5126 10.6953 10.6953 10.7412 10.7412 11.4759 11.4759 11.7984 11.7984 12.1730 12.1730 12.2574 12.2574 13.4311 13.4311 13.8334 13.8334 14.5720 14.5720 14.6644 14.6644 15.6237 15.6237 15.9492 15.9492 16.1037 16.1037 k = 0.3820 0.4894 0.2456 ( 2534 PWs) bands (ev): -48.3527 -48.3527 -22.6438 -22.6438 -14.9292 -14.9292 -14.8783 -14.8783 3.8313 3.8313 3.9733 3.9733 8.2130 8.2130 9.7178 9.7178 9.7670 9.7670 10.0972 10.0972 10.5286 10.5286 10.6720 10.6720 10.7375 10.7375 11.4711 11.4711 11.7776 11.7776 12.1465 12.1465 12.2229 12.2229 13.4187 13.4187 13.8864 13.8864 14.5521 14.5521 14.5887 14.5887 15.5771 15.5771 15.9729 15.9729 16.1484 16.1484 k = 0.3761 0.5002 0.2578 ( 2536 PWs) bands (ev): -48.3526 -48.3526 -22.6443 -22.6443 -14.9307 -14.9307 -14.8791 -14.8791 3.8728 3.8728 4.0200 4.0200 8.1405 8.1405 9.6992 9.6992 9.7570 9.7570 10.1150 10.1150 10.5445 10.5445 10.6394 10.6394 10.7441 10.7441 11.4637 11.4637 11.7599 11.7599 12.1190 12.1190 12.1883 12.1883 13.4043 13.4043 13.9394 13.9394 14.4875 14.4875 14.5366 14.5366 15.5594 15.5594 15.9887 15.9887 16.2066 16.2066 k = 0.3702 0.5109 0.2701 ( 2540 PWs) bands (ev): -48.3526 -48.3526 -22.6447 -22.6447 -14.9324 -14.9324 -14.8797 -14.8797 3.9149 3.9149 4.0685 4.0685 8.0629 8.0629 9.6851 9.6851 9.7489 9.7489 10.1333 10.1333 10.5569 10.5569 10.6092 10.6092 10.7529 10.7529 11.4540 11.4540 11.7446 11.7446 12.0905 12.0905 12.1536 12.1536 13.3883 13.3883 13.9906 13.9906 14.4077 14.4077 14.4825 14.4825 15.5693 15.5693 15.9986 15.9986 16.2751 16.2751 k = 0.3643 0.5217 0.2824 ( 2542 PWs) bands (ev): -48.3525 -48.3525 -22.6452 -22.6452 -14.9342 -14.9342 -14.8803 -14.8803 3.9570 3.9570 4.1188 4.1188 7.9814 7.9814 9.6754 9.6754 9.7422 9.7422 10.1522 10.1522 10.5481 10.5481 10.6006 10.6006 10.7622 10.7622 11.4429 11.4429 11.7309 11.7309 12.0612 12.0612 12.1188 12.1188 13.3712 13.3712 14.0356 14.0356 14.3266 14.3266 14.4223 14.4223 15.6024 15.6024 16.0045 16.0045 16.3514 16.3514 k = 0.3584 0.5325 0.2947 ( 2548 PWs) bands (ev): -48.3524 -48.3524 -22.6457 -22.6457 -14.9360 -14.9360 -14.8807 -14.8807 3.9989 3.9989 4.1707 4.1707 7.8974 7.8974 9.6693 9.6693 9.7367 9.7367 10.1716 10.1716 10.5175 10.5175 10.6149 10.6149 10.7714 10.7714 11.4309 11.4309 11.7180 11.7180 12.0311 12.0311 12.0839 12.0839 13.3533 13.3533 14.0632 14.0632 14.2453 14.2453 14.3715 14.3715 15.6533 15.6533 16.0071 16.0071 16.4338 16.4338 k = 0.3525 0.5432 0.3070 ( 2554 PWs) bands (ev): -48.3524 -48.3524 -22.6462 -22.6462 -14.9379 -14.9379 -14.8811 -14.8811 4.0400 4.0400 4.2243 4.2243 7.8121 7.8121 9.6659 9.6659 9.7326 9.7326 10.1913 10.1913 10.4827 10.4827 10.6349 10.6349 10.7804 10.7804 11.4184 11.4184 11.7053 11.7053 12.0002 12.0002 12.0490 12.0490 13.3349 13.3349 14.0538 14.0538 14.1646 14.1646 14.3539 14.3539 15.7174 15.7174 16.0070 16.0070 16.5214 16.5214 k = 0.3466 0.5540 0.3192 ( 2554 PWs) bands (ev): -48.3523 -48.3523 -22.6466 -22.6466 -14.9398 -14.9398 -14.8814 -14.8814 4.0800 4.0800 4.2795 4.2795 7.7267 7.7267 9.6644 9.6644 9.7299 9.7299 10.2114 10.2114 10.4474 10.4474 10.6569 10.6569 10.7891 10.7891 11.4062 11.4062 11.6923 11.6923 11.9688 11.9688 12.0142 12.0142 13.3164 13.3164 14.0007 14.0007 14.0863 14.0863 14.3779 14.3779 15.7909 15.7909 16.0044 16.0044 16.6135 16.6135 k = 0.3407 0.5648 0.3315 ( 2560 PWs) bands (ev): -48.3522 -48.3522 -22.6470 -22.6470 -14.9417 -14.9417 -14.8816 -14.8816 4.1181 4.1181 4.3363 4.3363 7.6425 7.6425 9.6638 9.6638 9.7286 9.7286 10.2319 10.2319 10.4124 10.4124 10.6804 10.6804 10.7972 10.7972 11.3943 11.3943 11.6785 11.6785 11.9366 11.9366 11.9798 11.9798 13.2981 13.2981 13.9216 13.9216 14.0108 14.0108 14.4278 14.4278 15.8695 15.8695 16.0009 16.0009 16.7095 16.7095 k = 0.3348 0.5755 0.3438 ( 2556 PWs) bands (ev): -48.3522 -48.3522 -22.6474 -22.6474 -14.9436 -14.9436 -14.8817 -14.8817 4.1539 4.1539 4.3945 4.3945 7.5608 7.5608 9.6637 9.6637 9.7286 9.7286 10.2527 10.2527 10.3780 10.3780 10.7051 10.7051 10.8047 10.8047 11.3832 11.3832 11.6639 11.6639 11.9038 11.9038 11.9459 11.9459 13.2801 13.2801 13.8327 13.8327 13.9371 13.9371 14.4906 14.4906 15.9389 15.9389 16.0088 16.0088 16.8092 16.8092 k = 0.3289 0.5863 0.3561 ( 2560 PWs) bands (ev): -48.3521 -48.3521 -22.6478 -22.6478 -14.9454 -14.9454 -14.8818 -14.8818 4.1866 4.1866 4.4542 4.4542 7.4826 7.4826 9.6635 9.6635 9.7294 9.7294 10.2736 10.2736 10.3445 10.3445 10.7306 10.7306 10.8116 10.8116 11.3729 11.3729 11.6484 11.6484 11.8703 11.8703 11.9128 11.9128 13.2628 13.2628 13.7414 13.7414 13.8644 13.8644 14.5603 14.5603 15.9537 15.9537 16.0721 16.0721 16.9122 16.9122 k = 0.3230 0.5971 0.3683 ( 2564 PWs) bands (ev): -48.3521 -48.3521 -22.6482 -22.6482 -14.9472 -14.9472 -14.8819 -14.8819 4.2155 4.2155 4.5153 4.5153 7.4090 7.4090 9.6631 9.6631 9.7305 9.7305 10.2940 10.2940 10.3127 10.3127 10.7569 10.7569 10.8178 10.8178 11.3636 11.3636 11.6321 11.6321 11.8361 11.8361 11.8808 11.8808 13.2461 13.2461 13.6512 13.6512 13.7931 13.7931 14.6343 14.6343 15.9397 15.9397 16.1634 16.1634 17.0182 17.0182 k = 0.3171 0.6078 0.3806 ( 2572 PWs) bands (ev): -48.3520 -48.3520 -22.6486 -22.6486 -14.9490 -14.9490 -14.8820 -14.8820 4.2399 4.2399 4.5776 4.5776 7.3413 7.3413 9.6624 9.6624 9.7314 9.7314 10.2792 10.2792 10.3173 10.3173 10.7836 10.7836 10.8237 10.8237 11.3556 11.3556 11.6149 11.6149 11.8013 11.8013 11.8501 11.8501 13.2303 13.2303 13.5637 13.5637 13.7229 13.7229 14.7116 14.7116 15.9175 15.9175 16.2610 16.2610 17.1270 17.1270 k = 0.3112 0.6186 0.3929 ( 2568 PWs) bands (ev): -48.3520 -48.3520 -22.6489 -22.6489 -14.9506 -14.9506 -14.8819 -14.8819 4.2591 4.2591 4.6413 4.6413 7.2804 7.2804 9.6613 9.6613 9.7315 9.7315 10.2489 10.2489 10.3388 10.3388 10.8082 10.8082 10.8313 10.8313 11.3487 11.3487 11.5973 11.5973 11.7663 11.7663 11.8210 11.8210 13.2154 13.2154 13.4800 13.4800 13.6542 13.6542 14.7912 14.7912 15.8896 15.8896 16.3616 16.3616 17.2383 17.2383 k = 0.3053 0.6294 0.4052 ( 2568 PWs) bands (ev): -48.3519 -48.3519 -22.6492 -22.6492 -14.9521 -14.9521 -14.8819 -14.8819 4.2722 4.2722 4.7060 4.7060 7.2274 7.2274 9.6597 9.6597 9.7303 9.7303 10.2195 10.2195 10.3607 10.3607 10.8216 10.8216 10.8497 10.8497 11.3431 11.3431 11.5795 11.5795 11.7311 11.7311 11.7936 11.7936 13.2012 13.2012 13.4009 13.4009 13.5868 13.5868 14.8727 14.8727 15.8565 15.8565 16.4635 16.4635 17.3519 17.3519 k = 0.2994 0.6401 0.4175 ( 2564 PWs) bands (ev): -48.3519 -48.3519 -22.6494 -22.6494 -14.9535 -14.9535 -14.8818 -14.8818 4.2786 4.2786 4.7719 4.7719 7.1830 7.1830 9.6568 9.6568 9.7280 9.7280 10.1912 10.1912 10.3829 10.3829 10.8251 10.8251 10.8774 10.8774 11.3387 11.3387 11.5616 11.5616 11.6964 11.6964 11.7681 11.7681 13.1872 13.1872 13.3274 13.3274 13.5210 13.5210 14.9554 14.9554 15.8187 15.8187 16.5655 16.5655 17.3278 17.3278 k = 0.2935 0.6509 0.4297 ( 2556 PWs) bands (ev): -48.3518 -48.3518 -22.6495 -22.6495 -14.9547 -14.9547 -14.8817 -14.8817 4.2777 4.2777 4.8386 4.8386 7.1480 7.1480 9.6517 9.6517 9.7251 9.7251 10.1641 10.1641 10.4054 10.4054 10.8253 10.8253 10.9078 10.9078 11.3356 11.3356 11.5438 11.5438 11.6625 11.6625 11.7447 11.7447 13.1713 13.1713 13.2615 13.2615 13.4567 13.4567 15.0389 15.0389 15.7767 15.7767 16.6660 16.6660 17.2874 17.2874 k = 0.2876 0.6617 0.4420 ( 2560 PWs) bands (ev): -48.3518 -48.3518 -22.6498 -22.6498 -14.9558 -14.9558 -14.8816 -14.8816 4.2693 4.2693 4.9063 4.9063 7.1230 7.1230 9.6428 9.6428 9.7226 9.7226 10.1381 10.1381 10.4280 10.4280 10.8232 10.8232 10.9390 10.9390 11.3336 11.3336 11.5259 11.5259 11.6306 11.6306 11.7234 11.7234 13.1459 13.1459 13.2111 13.2111 13.3940 13.3940 15.1223 15.1223 15.7312 15.7312 16.7629 16.7629 17.2521 17.2521 k = 0.2876 0.6617 0.4420 ( 2560 PWs) bands (ev): -48.3518 -48.3518 -22.6498 -22.6498 -14.9558 -14.9558 -14.8816 -14.8816 4.2693 4.2693 4.9063 4.9063 7.1230 7.1230 9.6428 9.6428 9.7226 9.7226 10.1381 10.1381 10.4280 10.4280 10.8232 10.8232 10.9390 10.9390 11.3336 11.3336 11.5259 11.5259 11.6306 11.6306 11.7234 11.7234 13.1459 13.1459 13.2111 13.2111 13.3940 13.3940 15.1223 15.1223 15.7312 15.7312 16.7629 16.7629 17.2521 17.2521 k = 0.2716 0.6579 0.4464 ( 2562 PWs) bands (ev): -48.3518 -48.3518 -22.6499 -22.6499 -14.9562 -14.9562 -14.8816 -14.8816 4.2625 4.2625 4.9319 4.9319 7.1194 7.1194 9.6186 9.6186 9.7401 9.7401 10.1285 10.1285 10.4369 10.4369 10.8201 10.8201 10.9505 10.9505 11.3349 11.3349 11.5195 11.5195 11.6199 11.6199 11.7165 11.7165 13.1081 13.1081 13.1902 13.1902 13.4075 13.4075 15.1488 15.1488 15.7151 15.7151 16.7953 16.7953 17.2424 17.2424 k = 0.2556 0.6540 0.4507 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6499 -22.6499 -14.9565 -14.9565 -14.8816 -14.8816 4.2518 4.2518 4.9594 4.9594 7.1228 7.1228 9.5739 9.5739 9.7739 9.7739 10.1179 10.1179 10.4473 10.4473 10.8129 10.8129 10.9625 10.9625 11.3396 11.3396 11.5133 11.5133 11.6096 11.6096 11.7099 11.7099 13.0270 13.0270 13.1792 13.1792 13.4594 13.4594 15.1697 15.1697 15.7002 15.7002 16.8260 16.8260 17.2359 17.2359 k = 0.2396 0.6502 0.4550 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6500 -22.6500 -14.9568 -14.9568 -14.8815 -14.8815 4.2386 4.2386 4.9874 4.9874 7.1334 7.1334 9.5217 9.5217 9.8109 9.8109 10.1066 10.1066 10.4586 10.4586 10.8018 10.8018 10.9750 10.9750 11.3474 11.3474 11.5074 11.5074 11.5997 11.5997 11.7037 11.7037 12.9333 12.9333 13.1735 13.1735 13.5236 13.5236 15.1852 15.1852 15.6867 15.6867 16.8552 16.8552 17.2325 17.2325 k = 0.2237 0.6464 0.4594 ( 2565 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9572 -14.9572 -14.8815 -14.8815 4.2239 4.2239 5.0145 5.0145 7.1512 7.1512 9.4646 9.4646 9.8487 9.8487 10.0953 10.0953 10.4704 10.4704 10.7871 10.7871 10.9880 10.9880 11.3575 11.3575 11.5018 11.5018 11.5905 11.5905 11.6980 11.6980 12.8388 12.8388 13.1688 13.1688 13.5927 13.5927 15.1955 15.1955 15.6749 15.6749 16.8829 16.8829 17.2314 17.2314 k = 0.2077 0.6426 0.4637 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9574 -14.9574 -14.8815 -14.8815 4.2085 4.2085 5.0400 5.0400 7.1761 7.1761 9.4035 9.4035 9.8865 9.8865 10.0840 10.0840 10.4825 10.4825 10.7694 10.7694 11.0014 11.0014 11.3691 11.3691 11.4969 11.4969 11.5822 11.5822 11.6930 11.6930 12.7467 12.7467 13.1641 13.1641 13.6643 13.6643 15.2007 15.2007 15.6648 15.6648 16.9094 16.9094 17.2299 17.2299 k = 0.1917 0.6388 0.4681 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9577 -14.9577 -14.8815 -14.8815 4.1930 4.1930 5.0632 5.0632 7.2078 7.2078 9.3391 9.3391 9.9241 9.9241 10.0731 10.0731 10.4943 10.4943 10.7490 10.7490 11.0152 11.0152 11.3807 11.3807 11.4935 11.4935 11.5749 11.5749 11.6888 11.6888 12.6581 12.6581 13.1592 13.1592 13.7370 13.7370 15.2011 15.2011 15.6563 15.6563 16.9347 16.9347 17.2136 17.2136 k = 0.1757 0.6350 0.4724 ( 2559 PWs) bands (ev): -48.3517 -48.3517 -22.6502 -22.6502 -14.9579 -14.9579 -14.8814 -14.8814 4.1778 4.1778 5.0839 5.0839 7.2458 7.2458 9.2716 9.2716 9.9612 9.9612 10.0628 10.0628 10.5057 10.5057 10.7265 10.7265 11.0292 11.0292 11.3905 11.3905 11.4928 11.4928 11.5687 11.5687 11.6858 11.6858 12.5736 12.5736 13.1542 13.1542 13.8103 13.8103 15.1968 15.1968 15.6496 15.6496 16.9587 16.9587 17.1674 17.1674 k = 0.1598 0.6312 0.4767 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6502 -22.6502 -14.9581 -14.9581 -14.8814 -14.8814 4.1633 4.1633 5.1019 5.1019 7.2897 7.2897 9.2017 9.2017 9.9976 9.9976 10.0534 10.0534 10.5164 10.5164 10.7023 10.7023 11.0434 11.0434 11.3964 11.3964 11.4958 11.4958 11.5636 11.5636 11.6843 11.6843 12.4934 12.4934 13.1491 13.1491 13.8833 13.8833 15.1880 15.1880 15.6445 15.6445 16.9806 16.9806 17.1146 17.1146 k = 0.1438 0.6274 0.4811 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6503 -22.6503 -14.9583 -14.9583 -14.8814 -14.8814 4.1496 4.1496 5.1173 5.1173 7.3385 7.3385 9.1299 9.1299 10.0299 10.0299 10.0484 10.0484 10.5261 10.5261 10.6770 10.6770 11.0576 11.0576 11.3975 11.3975 11.5032 11.5032 11.5596 11.5596 11.6851 11.6851 12.4176 12.4176 13.1439 13.1439 13.9556 13.9556 15.1750 15.1750 15.6411 15.6411 16.9950 16.9950 17.0700 17.0700 k = 0.1278 0.6236 0.4854 ( 2559 PWs) bands (ev): -48.3517 -48.3517 -22.6503 -22.6503 -14.9585 -14.9585 -14.8813 -14.8813 4.1371 4.1371 5.1301 5.1301 7.3914 7.3914 9.0571 9.0571 10.0326 10.0326 10.0734 10.0734 10.5345 10.5345 10.6511 10.6511 11.0717 11.0717 11.3942 11.3942 11.5134 11.5134 11.5568 11.5568 11.6887 11.6887 12.3460 12.3460 13.1389 13.1389 14.0263 14.0263 15.1582 15.1582 15.6392 15.6392 16.9814 16.9814 17.0563 17.0563 k = 0.1118 0.6198 0.4898 ( 2561 PWs) bands (ev): -48.3517 -48.3517 -22.6503 -22.6503 -14.9586 -14.9586 -14.8813 -14.8813 4.1258 4.1258 5.1407 5.1407 7.4472 7.4472 8.9843 8.9843 10.0260 10.0260 10.1079 10.1079 10.5407 10.5407 10.6256 10.6256 11.0855 11.0855 11.3879 11.3879 11.5241 11.5241 11.5552 11.5552 11.6963 11.6963 12.2787 12.2787 13.1341 13.1341 14.0946 14.0946 15.1379 15.1379 15.6387 15.6387 16.9438 16.9438 17.0697 17.0697 k = 0.0959 0.6160 0.4941 ( 2564 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9588 -14.9588 -14.8813 -14.8813 4.1158 4.1158 5.1492 5.1492 7.5043 7.5043 8.9128 8.9128 10.0196 10.0196 10.1424 10.1424 10.5425 10.5425 10.6030 10.6030 11.0987 11.0987 11.3799 11.3799 11.5330 11.5330 11.5550 11.5550 11.7084 11.7084 12.2157 12.2157 13.1296 13.1296 14.1597 14.1597 15.1150 15.1150 15.6394 15.6394 16.9046 16.9046 17.0881 17.0881 k = 0.0799 0.6122 0.4984 ( 2564 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9589 -14.9589 -14.8813 -14.8813 4.1072 4.1072 5.1559 5.1559 7.5610 7.5610 8.8442 8.8442 10.0141 10.0141 10.1760 10.1760 10.5353 10.5353 10.5882 10.5882 11.1110 11.1110 11.3713 11.3713 11.5389 11.5389 11.5562 11.5562 11.7257 11.7257 12.1568 12.1568 13.1255 13.1255 14.2202 14.2202 15.0904 15.0904 15.6409 15.6409 16.8691 16.8691 17.1060 17.1060 k = 0.0639 0.6084 0.5028 ( 2559 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9590 -14.9590 -14.8813 -14.8813 4.1002 4.1002 5.1610 5.1610 7.6150 7.6150 8.7807 8.7807 10.0095 10.0095 10.2082 10.2082 10.5173 10.5173 10.5835 10.5835 11.1222 11.1222 11.3629 11.3629 11.5420 11.5420 11.5582 11.5582 11.7476 11.7476 12.1021 12.1021 13.1221 13.1221 14.2747 14.2747 15.0656 15.0656 15.6429 15.6429 16.8388 16.8388 17.1218 17.1218 k = 0.0479 0.6046 0.5071 ( 2556 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9590 -14.9590 -14.8812 -14.8812 4.0946 4.0946 5.1648 5.1648 7.6631 7.6631 8.7253 8.7253 10.0059 10.0059 10.2383 10.2383 10.4944 10.4944 10.5837 10.5837 11.1317 11.1317 11.3553 11.3553 11.5435 11.5435 11.5600 11.5600 11.7732 11.7732 12.0522 12.0522 13.1193 13.1193 14.3211 14.3211 15.0423 15.0423 15.6449 15.6449 16.8146 16.8146 17.1346 17.1346 k = 0.0320 0.6008 0.5115 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9591 -14.9591 -14.8812 -14.8812 4.0906 4.0906 5.1674 5.1674 7.7018 7.7018 8.6814 8.6814 10.0033 10.0033 10.2645 10.2645 10.4721 10.4721 10.5850 10.5850 11.1391 11.1391 11.3493 11.3493 11.5443 11.5443 11.5610 11.5610 11.8003 11.8003 12.0081 12.0081 13.1172 13.1172 14.3571 14.3571 15.0229 15.0229 15.6467 15.6467 16.7969 16.7969 17.1440 17.1440 k = 0.0160 0.5970 0.5158 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9591 -14.9591 -14.8812 -14.8812 4.0882 4.0882 5.1688 5.1688 7.7273 7.7273 8.6529 8.6529 10.0017 10.0017 10.2837 10.2837 10.4550 10.4550 10.5861 10.5861 11.1438 11.1438 11.3454 11.3454 11.5448 11.5448 11.5615 11.5615 11.8248 11.8248 11.9738 11.9738 13.1159 13.1159 14.3802 14.3802 15.0098 15.0098 15.6479 15.6479 16.7861 16.7861 17.1497 17.1497 k = 0.0000 0.5931 0.5201 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9592 -14.9592 -14.8812 -14.8812 4.0874 4.0874 5.1693 5.1693 7.7362 7.7362 8.6430 8.6430 10.0012 10.0012 10.2911 10.2911 10.4483 10.4483 10.5865 10.5865 11.1453 11.1453 11.3440 11.3440 11.5449 11.5449 11.5617 11.5617 11.8360 11.8360 11.9593 11.9593 13.1155 13.1155 14.3881 14.3881 15.0052 15.0052 15.6483 15.6483 16.7825 16.7825 17.1517 17.1517 k = 0.0000 0.5931 0.5201 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6504 -22.6504 -14.9592 -14.9592 -14.8812 -14.8812 4.0874 4.0874 5.1693 5.1693 7.7362 7.7362 8.6430 8.6430 10.0012 10.0012 10.2911 10.2911 10.4483 10.4483 10.5865 10.5865 11.1453 11.1453 11.3440 11.3440 11.5449 11.5449 11.5617 11.5617 11.8360 11.8360 11.9593 11.9593 13.1155 13.1155 14.3881 14.3881 15.0052 15.0052 15.6483 15.6483 16.7825 16.7825 17.1517 17.1517 k = 0.0060 0.5823 0.5325 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6505 -22.6505 -14.9591 -14.9591 -14.8813 -14.8813 4.0879 4.0879 5.1707 5.1707 7.7375 7.7375 8.6423 8.6423 9.9993 9.9993 10.2929 10.2929 10.4487 10.4487 10.5853 10.5853 11.1440 11.1440 11.3418 11.3418 11.5453 11.5453 11.5650 11.5650 11.8342 11.8342 11.9601 11.9601 13.1148 13.1148 14.3879 14.3879 14.9934 14.9934 15.6630 15.6630 16.7607 16.7607 17.1593 17.1593 k = 0.0119 0.5714 0.5449 ( 2562 PWs) bands (ev): -48.3517 -48.3517 -22.6505 -22.6505 -14.9591 -14.9591 -14.8816 -14.8816 4.0893 4.0893 5.1748 5.1748 7.7414 7.7414 8.6402 8.6402 9.9940 9.9940 10.2983 10.2983 10.4498 10.4498 10.5817 10.5817 11.1400 11.1400 11.3354 11.3354 11.5473 11.5473 11.5737 11.5737 11.8289 11.8289 11.9624 11.9624 13.1127 13.1127 14.3871 14.3871 14.9610 14.9610 15.7042 15.7042 16.7028 16.7028 17.1761 17.1761 k = 0.0179 0.5606 0.5573 ( 2562 PWs) bands (ev): -48.3516 -48.3516 -22.6506 -22.6506 -14.9590 -14.9590 -14.8821 -14.8821 4.0915 4.0915 5.1815 5.1815 7.7478 7.7478 8.6368 8.6368 9.9857 9.9857 10.3066 10.3066 10.4516 10.4516 10.5757 10.5757 11.1337 11.1337 11.3256 11.3256 11.5519 11.5519 11.5858 11.5858 11.8204 11.8204 11.9660 11.9660 13.1091 13.1091 14.3857 14.3857 14.9142 14.9142 15.7656 15.7656 16.6221 16.6221 17.1933 17.1933 k = 0.0238 0.5497 0.5697 ( 2560 PWs) bands (ev): -48.3516 -48.3516 -22.6507 -22.6507 -14.9588 -14.9588 -14.8828 -14.8828 4.0947 4.0947 5.1910 5.1910 7.7568 7.7568 8.6319 8.6319 9.9752 9.9752 10.3172 10.3172 10.4541 10.4541 10.5673 10.5673 11.1253 11.1253 11.3131 11.3131 11.5589 11.5589 11.6002 11.6002 11.8091 11.8091 11.9709 11.9709 13.1037 13.1037 14.3835 14.3835 14.8590 14.8590 15.8412 15.8412 16.5287 16.5287 17.2074 17.2074 k = 0.0298 0.5388 0.5821 ( 2560 PWs) bands (ev): -48.3516 -48.3516 -22.6508 -22.6508 -14.9587 -14.9587 -14.8836 -14.8836 4.0987 4.0987 5.2032 5.2032 7.7682 7.7682 8.6256 8.6256 9.9632 9.9632 10.3294 10.3294 10.4573 10.4573 10.5568 10.5568 11.1153 11.1153 11.2987 11.2987 11.5676 11.5676 11.6160 11.6160 11.7954 11.7954 11.9769 11.9769 13.0966 13.0966 14.3802 14.3802 14.7996 14.7996 15.9265 15.9265 16.4285 16.4285 17.2185 17.2185 k = 0.0357 0.5280 0.5944 ( 2566 PWs) bands (ev): -48.3516 -48.3516 -22.6510 -22.6510 -14.9585 -14.9585 -14.8847 -14.8847 4.1037 4.1037 5.2181 5.2181 7.7820 7.7820 8.6178 8.6178 9.9503 9.9503 10.3423 10.3423 10.4612 10.4612 10.5442 10.5442 11.1041 11.1041 11.2830 11.2830 11.5771 11.5771 11.6327 11.6327 11.7802 11.7802 11.9838 11.9838 13.0873 13.0873 14.3756 14.3756 14.7387 14.7387 16.0187 16.0187 16.3256 16.3256 17.2277 17.2277 k = 0.0417 0.5171 0.6068 ( 2564 PWs) bands (ev): -48.3515 -48.3515 -22.6512 -22.6512 -14.9582 -14.9582 -14.8858 -14.8858 4.1094 4.1094 5.2356 5.2356 7.7981 7.7981 8.6085 8.6085 9.9372 9.9372 10.3555 10.3555 10.4655 10.4655 10.5299 10.5299 11.0920 11.0920 11.2667 11.2667 11.5863 11.5863 11.6497 11.6497 11.7644 11.7644 11.9916 11.9916 13.0758 13.0758 14.3691 14.3691 14.6780 14.6780 16.1158 16.1158 16.2231 16.2231 17.2357 17.2357 k = 0.0476 0.5063 0.6192 ( 2566 PWs) bands (ev): -48.3515 -48.3515 -22.6514 -22.6514 -14.9580 -14.9580 -14.8872 -14.8872 4.1160 4.1160 5.2557 5.2557 7.8163 7.8163 8.5976 8.5976 9.9245 9.9245 10.3681 10.3681 10.4701 10.4701 10.5145 10.5145 11.0794 11.0794 11.2501 11.2501 11.5934 11.5934 11.6667 11.6667 11.7499 11.7499 12.0000 12.0000 13.0619 13.0619 14.3603 14.3603 14.6186 14.6186 16.1221 16.1221 16.2172 16.2172 17.2432 17.2432 k = 0.0536 0.4954 0.6316 ( 2568 PWs) bands (ev): -48.3515 -48.3515 -22.6517 -22.6517 -14.9577 -14.9577 -14.8887 -14.8887 4.1234 4.1234 5.2785 5.2785 7.8367 7.8367 8.5851 8.5851 9.9124 9.9124 10.3793 10.3793 10.4735 10.4735 10.4997 10.4997 11.0667 11.0667 11.2334 11.2334 11.5960 11.5960 11.6831 11.6831 11.7389 11.7389 12.0091 12.0091 13.0454 13.0454 14.3485 14.3485 14.5611 14.5611 16.0264 16.0264 16.3204 16.3204 17.2505 17.2505 k = 0.0595 0.4845 0.6440 ( 2566 PWs) bands (ev): -48.3514 -48.3514 -22.6519 -22.6519 -14.9573 -14.9573 -14.8904 -14.8904 4.1315 4.1315 5.3038 5.3038 7.8589 7.8589 8.5711 8.5711 9.9015 9.9015 10.3879 10.3879 10.4699 10.4699 10.4927 10.4927 11.0541 11.0541 11.2170 11.2170 11.5918 11.5918 11.6982 11.6982 11.7345 11.7345 12.0187 12.0187 13.0262 13.0262 14.3331 14.3331 14.5060 14.5060 15.9364 15.9364 16.4254 16.4254 17.2580 17.2580 k = 0.0655 0.4737 0.6564 ( 2564 PWs) bands (ev): -48.3514 -48.3514 -22.6522 -22.6522 -14.9570 -14.9570 -14.8921 -14.8921 4.1403 4.1403 5.3317 5.3317 7.8828 7.8828 8.5554 8.5554 9.8919 9.8919 10.3912 10.3912 10.4591 10.4591 10.4959 10.4959 11.0418 11.0418 11.2009 11.2009 11.5798 11.5798 11.7115 11.7115 11.7380 11.7380 12.0287 12.0287 13.0044 13.0044 14.3132 14.3132 14.4535 14.4535 15.8540 15.8540 16.5311 16.5311 17.2660 17.2660 k = 0.0714 0.4628 0.6688 ( 2562 PWs) bands (ev): -48.3513 -48.3513 -22.6525 -22.6525 -14.9566 -14.9566 -14.8940 -14.8940 4.1498 4.1498 5.3621 5.3621 7.9082 7.9082 8.5382 8.5382 9.8839 9.8839 10.3851 10.3851 10.4523 10.4523 10.5022 10.5022 11.0299 11.0299 11.1855 11.1855 11.5611 11.5611 11.7232 11.7232 11.7479 11.7479 12.0389 12.0389 12.9800 12.9800 14.2883 14.2883 14.4038 14.4038 15.7804 15.7804 16.6364 16.6364 17.2747 17.2747 k = 0.0774 0.4520 0.6811 ( 2564 PWs) bands (ev): -48.3512 -48.3512 -22.6528 -22.6528 -14.9562 -14.9562 -14.8960 -14.8960 4.1600 4.1600 5.3949 5.3949 7.9349 7.9349 8.5194 8.5194 9.8777 9.8777 10.3687 10.3687 10.4524 10.4524 10.5092 10.5092 11.0186 11.0186 11.1706 11.1706 11.5378 11.5378 11.7344 11.7344 11.7609 11.7609 12.0492 12.0492 12.9530 12.9530 14.2582 14.2582 14.3566 14.3566 15.7166 15.7166 16.7400 16.7400 17.2846 17.2846 k = 0.0833 0.4411 0.6935 ( 2566 PWs) bands (ev): -48.3512 -48.3512 -22.6532 -22.6532 -14.9559 -14.9559 -14.8981 -14.8981 4.1708 4.1708 5.4302 5.4302 7.9626 7.9626 8.4992 8.4992 9.8734 9.8734 10.3458 10.3458 10.4565 10.4565 10.5164 10.5164 11.0081 11.0081 11.1566 11.1566 11.5116 11.5116 11.7455 11.7455 11.7749 11.7749 12.0595 12.0595 12.9237 12.9237 14.2232 14.2232 14.3111 14.3111 15.6635 15.6635 16.8400 16.8400 17.2965 17.2965 k = 0.0893 0.4302 0.7059 ( 2562 PWs) bands (ev): -48.3511 -48.3511 -22.6535 -22.6535 -14.9555 -14.9555 -14.9003 -14.9003 4.1821 4.1821 5.4678 5.4678 7.9910 7.9910 8.4776 8.4776 9.8711 9.8711 10.3193 10.3193 10.4619 10.4619 10.5233 10.5233 10.9983 10.9983 11.1434 11.1434 11.4838 11.4838 11.7562 11.7562 11.7889 11.7889 12.0698 12.0698 12.8924 12.8924 14.1844 14.1844 14.2664 14.2664 15.6214 15.6214 16.9338 16.9338 17.3113 17.3113 k = 0.0952 0.4194 0.7183 ( 2556 PWs) bands (ev): -48.3510 -48.3510 -22.6538 -22.6538 -14.9550 -14.9550 -14.9025 -14.9025 4.1939 4.1939 5.5078 5.5078 8.0198 8.0198 8.4547 8.4547 9.8709 9.8709 10.2907 10.2907 10.4675 10.4675 10.5297 10.5297 10.9895 10.9895 11.1311 11.1311 11.4551 11.4551 11.7662 11.7662 11.8026 11.8026 12.0798 12.0798 12.8592 12.8592 14.1429 14.1429 14.2214 14.2214 15.5902 15.5902 17.0177 17.0177 17.3304 17.3304 k = 0.1012 0.4085 0.7307 ( 2554 PWs) bands (ev): -48.3510 -48.3510 -22.6542 -22.6542 -14.9546 -14.9546 -14.9047 -14.9047 4.2061 4.2061 5.5499 5.5499 8.0486 8.0486 8.4308 8.4308 9.8728 9.8728 10.2607 10.2607 10.4727 10.4727 10.5354 10.5354 10.9815 10.9815 11.1197 11.1197 11.4261 11.4261 11.7753 11.7753 11.8158 11.8158 12.0894 12.0894 12.8243 12.8243 14.0999 14.0999 14.1757 14.1757 15.5698 15.5698 17.0873 17.0873 17.3544 17.3544 k = 0.1071 0.3977 0.7431 ( 2550 PWs) bands (ev): -48.3509 -48.3509 -22.6545 -22.6545 -14.9543 -14.9543 -14.9070 -14.9070 4.2187 4.2187 5.5943 5.5943 8.0769 8.0769 8.4059 8.4059 9.8768 9.8768 10.2299 10.2299 10.4775 10.4775 10.5403 10.5403 10.9744 10.9744 11.1093 11.1093 11.3971 11.3971 11.7832 11.7832 11.8282 11.8282 12.0987 12.0987 12.7882 12.7882 14.0559 14.0559 14.1293 14.1293 15.5593 15.5593 17.1397 17.1397 17.3810 17.3810 k = 0.1131 0.3868 0.7554 ( 2548 PWs) bands (ev): -48.3508 -48.3508 -22.6549 -22.6549 -14.9539 -14.9539 -14.9093 -14.9093 4.2316 4.2316 5.6407 5.6407 8.1043 8.1043 8.3804 8.3804 9.8828 9.8828 10.1986 10.1986 10.4816 10.4816 10.5443 10.5443 10.9681 10.9681 11.0997 11.0997 11.3685 11.3685 11.7898 11.7898 11.8397 11.8397 12.1073 12.1073 12.7510 12.7510 14.0116 14.0116 14.0827 14.0827 15.5581 15.5581 17.1754 17.1754 17.4026 17.4026 k = 0.1190 0.3759 0.7678 ( 2552 PWs) bands (ev): -48.3507 -48.3507 -22.6553 -22.6553 -14.9536 -14.9536 -14.9116 -14.9116 4.2447 4.2447 5.6892 5.6892 8.1302 8.1302 8.3544 8.3544 9.8908 9.8908 10.1674 10.1674 10.4851 10.4851 10.5473 10.5473 10.9624 10.9624 11.0911 11.0911 11.3405 11.3405 11.7952 11.7952 11.8502 11.8502 12.1152 12.1152 12.7130 12.7130 13.9672 13.9672 14.0364 14.0364 15.5652 15.5652 17.1966 17.1966 17.4092 17.4092 k = 0.1250 0.3651 0.7802 ( 2558 PWs) bands (ev): -48.3507 -48.3507 -22.6558 -22.6558 -14.9534 -14.9534 -14.9139 -14.9139 4.2580 4.2580 5.7396 5.7396 8.1537 8.1537 8.3285 8.3285 9.9006 9.9006 10.1366 10.1366 10.4878 10.4878 10.5495 10.5495 10.9574 10.9574 11.0834 11.0834 11.3134 11.3134 11.7995 11.7995 11.8595 11.8595 12.1224 12.1224 12.6745 12.6745 13.9231 13.9231 13.9910 13.9910 15.5797 15.5797 17.2042 17.2042 17.3985 17.3985 k = 0.1310 0.3542 0.7926 ( 2554 PWs) bands (ev): -48.3506 -48.3506 -22.6562 -22.6562 -14.9532 -14.9532 -14.9161 -14.9161 4.2714 4.2714 5.7918 5.7918 8.1740 8.1740 8.3032 8.3032 9.9121 9.9121 10.1068 10.1068 10.4897 10.4897 10.5510 10.5510 10.9529 10.9529 11.0766 11.0766 11.2875 11.2875 11.8027 11.8027 11.8678 11.8678 12.1288 12.1288 12.6356 12.6356 13.8800 13.8800 13.9470 13.9470 15.6007 15.6007 17.1947 17.1947 17.3817 17.3817 k = 0.1369 0.3434 0.8050 ( 2560 PWs) bands (ev): -48.3505 -48.3505 -22.6566 -22.6566 -14.9531 -14.9531 -14.9182 -14.9182 4.2848 4.2848 5.8457 5.8457 8.1892 8.1892 8.2800 8.2800 9.9250 9.9250 10.0784 10.0784 10.4909 10.4909 10.5517 10.5517 10.9486 10.9486 11.0705 11.0705 11.2627 11.2627 11.8049 11.8049 11.8747 11.8747 12.1342 12.1342 12.5967 12.5967 13.8383 13.8383 13.9045 13.9045 15.6271 15.6271 17.1642 17.1642 17.3724 17.3724 k = 0.1429 0.3325 0.8174 ( 2562 PWs) bands (ev): -48.3505 -48.3505 -22.6570 -22.6570 -14.9531 -14.9531 -14.9203 -14.9203 4.2982 4.2982 5.9011 5.9011 8.1956 8.1956 8.2624 8.2624 9.9391 9.9391 10.0522 10.0522 10.4912 10.4912 10.5520 10.5520 10.9444 10.9444 11.0652 11.0652 11.2394 11.2394 11.8063 11.8063 11.8804 11.8804 12.1387 12.1387 12.5579 12.5579 13.7984 13.7984 13.8638 13.8638 15.6581 15.6581 17.1157 17.1157 17.3746 17.3746 k = 0.1488 0.3216 0.8297 ( 2558 PWs) bands (ev): -48.3504 -48.3504 -22.6574 -22.6574 -14.9531 -14.9531 -14.9221 -14.9221 4.3114 4.3114 5.9579 5.9579 8.1883 8.1883 8.2546 8.2546 9.9536 9.9536 10.0292 10.0292 10.4907 10.4907 10.5519 10.5519 10.9403 10.9403 11.0606 11.0606 11.2176 11.2176 11.8071 11.8071 11.8848 11.8848 12.1421 12.1421 12.5193 12.5193 13.7608 13.7608 13.8251 13.8251 15.6927 15.6927 17.0568 17.0568 17.3849 17.3849 k = 0.1548 0.3108 0.8421 ( 2560 PWs) bands (ev): -48.3503 -48.3503 -22.6578 -22.6578 -14.9532 -14.9532 -14.9239 -14.9239 4.3245 4.3245 6.0160 6.0160 8.1703 8.1703 8.2536 8.2536 9.9659 9.9659 10.0122 10.0122 10.4893 10.4893 10.5517 10.5517 10.9360 10.9360 11.0565 11.0565 11.1974 11.1974 11.8075 11.8075 11.8881 11.8881 12.1445 12.1445 12.4813 12.4813 13.7257 13.7257 13.7882 13.7882 15.7298 15.7298 16.9941 16.9941 17.4001 17.4001 k = 0.1607 0.2999 0.8545 ( 2560 PWs) bands (ev): -48.3503 -48.3503 -22.6582 -22.6582 -14.9535 -14.9535 -14.9254 -14.9254 4.3372 4.3372 6.0751 6.0751 8.1480 8.1480 8.2526 8.2526 9.9679 9.9679 10.0096 10.0096 10.4870 10.4870 10.5514 10.5514 10.9315 10.9315 11.0530 11.0530 11.1789 11.1789 11.8077 11.8077 11.8901 11.8901 12.1458 12.1458 12.4439 12.4439 13.6933 13.6933 13.7535 13.7535 15.7682 15.7682 16.9320 16.9320 17.4182 17.4182 k = 0.1667 0.2891 0.8669 ( 2558 PWs) bands (ev): -48.3502 -48.3502 -22.6585 -22.6585 -14.9538 -14.9538 -14.9268 -14.9268 4.3496 4.3496 6.1350 6.1350 8.1244 8.1244 8.2486 8.2486 9.9588 9.9588 10.0221 10.0221 10.4839 10.4839 10.5511 10.5511 10.9268 10.9268 11.0499 11.0499 11.1619 11.1619 11.8078 11.8078 11.8910 11.8910 12.1460 12.1460 12.4074 12.4074 13.6637 13.6637 13.7210 13.7210 15.8065 15.8065 16.8740 16.8740 17.4383 17.4383 k = 0.1726 0.2782 0.8793 ( 2560 PWs) bands (ev): -48.3501 -48.3501 -22.6589 -22.6589 -14.9543 -14.9543 -14.9280 -14.9280 4.3616 4.3616 6.1955 6.1955 8.1009 8.1009 8.2401 8.2401 9.9486 9.9486 10.0399 10.0399 10.4800 10.4800 10.5510 10.5510 10.9220 10.9220 11.0471 11.0471 11.1464 11.1464 11.8079 11.8079 11.8909 11.8909 12.1451 12.1451 12.3719 12.3719 13.6370 13.6370 13.6908 13.6908 15.8430 15.8430 16.8227 16.8227 17.4594 17.4594 k = 0.1786 0.2673 0.8917 ( 2562 PWs) bands (ev): -48.3501 -48.3501 -22.6592 -22.6592 -14.9549 -14.9549 -14.9291 -14.9291 4.3730 4.3730 6.2561 6.2561 8.0779 8.0779 8.2270 8.2270 9.9404 9.9404 10.0595 10.0595 10.4754 10.4754 10.5510 10.5510 10.9171 10.9171 11.0446 11.0446 11.1323 11.1323 11.8082 11.8082 11.8899 11.8899 12.1432 12.1432 12.3377 12.3377 13.6131 13.6131 13.6629 13.6629 15.8757 15.8757 16.7810 16.7810 17.4812 17.4812 k = 0.1845 0.2565 0.9041 ( 2556 PWs) bands (ev): -48.3500 -48.3500 -22.6595 -22.6595 -14.9555 -14.9555 -14.9299 -14.9299 4.3838 4.3838 6.3167 6.3167 8.0559 8.0559 8.2094 8.2094 9.9350 9.9350 10.0797 10.0797 10.4702 10.4702 10.5511 10.5511 10.9124 10.9124 11.0423 11.0423 11.1196 11.1196 11.8090 11.8090 11.8881 11.8881 12.1403 12.1403 12.3051 12.3051 13.5919 13.5919 13.6374 13.6374 15.9026 15.9026 16.7512 16.7512 17.5032 17.5032 k = 0.1905 0.2456 0.9164 ( 2560 PWs) bands (ev): -48.3500 -48.3500 -22.6598 -22.6598 -14.9563 -14.9563 -14.9306 -14.9306 4.3940 4.3940 6.3766 6.3766 8.0348 8.0348 8.1876 8.1876 9.9324 9.9324 10.1001 10.1001 10.4645 10.4645 10.5514 10.5514 10.9081 10.9081 11.0402 11.0402 11.1079 11.1079 11.8101 11.8101 11.8856 11.8856 12.1366 12.1366 12.2741 12.2741 13.5732 13.5732 13.6143 13.6143 15.9219 15.9219 16.7352 16.7352 17.5251 17.5251 k = 0.1964 0.2348 0.9288 ( 2558 PWs) bands (ev): -48.3499 -48.3499 -22.6601 -22.6601 -14.9570 -14.9570 -14.9311 -14.9311 4.4035 4.4035 6.4354 6.4354 8.0150 8.0150 8.1624 8.1624 9.9323 9.9323 10.1203 10.1203 10.4584 10.4584 10.5518 10.5518 10.9042 10.9042 11.0382 11.0382 11.0971 11.0971 11.8116 11.8116 11.8828 11.8828 12.1322 12.1322 12.2452 12.2452 13.5569 13.5569 13.5935 13.5935 15.9326 15.9326 16.7337 16.7337 17.5469 17.5469 k = 0.2024 0.2239 0.9412 ( 2558 PWs) bands (ev): -48.3499 -48.3499 -22.6603 -22.6603 -14.9578 -14.9578 -14.9315 -14.9315 4.4121 4.4121 6.4925 6.4925 7.9963 7.9963 8.1347 8.1347 9.9342 9.9342 10.1400 10.1400 10.4519 10.4519 10.5523 10.5523 10.9011 10.9011 11.0362 11.0362 11.0873 11.0873 11.8136 11.8136 11.8795 11.8795 12.1273 12.1273 12.2186 12.2186 13.5429 13.5429 13.5752 13.5752 15.9351 15.9351 16.7461 16.7461 17.5684 17.5684 k = 0.2083 0.2130 0.9536 ( 2562 PWs) bands (ev): -48.3498 -48.3498 -22.6606 -22.6606 -14.9585 -14.9585 -14.9318 -14.9318 4.4199 4.4199 6.5470 6.5470 7.9788 7.9788 8.1058 8.1058 9.9376 9.9376 10.1588 10.1588 10.4453 10.4453 10.5528 10.5528 10.8989 10.8989 11.0340 11.0340 11.0783 11.0783 11.8158 11.8158 11.8761 11.8761 12.1220 12.1220 12.1943 12.1943 13.5309 13.5309 13.5591 13.5591 15.9306 15.9306 16.7703 16.7703 17.5899 17.5899 k = 0.2143 0.2022 0.9660 ( 2566 PWs) bands (ev): -48.3498 -48.3498 -22.6608 -22.6608 -14.9592 -14.9592 -14.9321 -14.9321 4.4268 4.4268 6.5981 6.5981 7.9624 7.9624 8.0771 8.0771 9.9420 9.9420 10.1764 10.1764 10.4387 10.4387 10.5533 10.5533 10.8975 10.8975 11.0316 11.0316 11.0703 11.0703 11.8183 11.8183 11.8727 11.8727 12.1166 12.1166 12.1728 12.1728 13.5209 13.5209 13.5454 13.5454 15.9214 15.9214 16.8029 16.8029 17.6115 17.6115 k = 0.2202 0.1913 0.9784 ( 2564 PWs) bands (ev): -48.3498 -48.3498 -22.6609 -22.6609 -14.9598 -14.9598 -14.9323 -14.9323 4.4327 4.4327 6.6447 6.6447 7.9469 7.9469 8.0502 8.0502 9.9468 9.9468 10.1925 10.1925 10.4323 10.4323 10.5539 10.5539 10.8970 10.8970 11.0289 11.0289 11.0634 11.0634 11.8210 11.8210 11.8695 11.8695 12.1115 12.1115 12.1542 12.1542 13.5127 13.5127 13.5339 13.5339 15.9097 15.9097 16.8402 16.8402 17.6335 17.6335 k = 0.2262 0.1805 0.9907 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6610 -22.6610 -14.9603 -14.9603 -14.9324 -14.9324 4.4375 4.4375 6.6856 6.6856 7.9324 7.9324 8.0268 8.0268 9.9515 9.9515 10.2066 10.2066 10.4263 10.4263 10.5543 10.5543 10.8972 10.8972 11.0259 11.0259 11.0580 11.0580 11.8235 11.8235 11.8666 11.8666 12.1068 12.1068 12.1386 12.1386 13.5062 13.5062 13.5246 13.5246 15.8976 15.8976 16.8782 16.8782 17.6558 17.6558 k = 0.2321 0.1696 1.0031 ( 2562 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9607 -14.9607 -14.9325 -14.9325 4.4414 4.4414 6.7193 6.7193 7.9190 7.9190 8.0082 8.0082 9.9557 9.9557 10.2183 10.2183 10.4211 10.4211 10.5547 10.5547 10.8979 10.8979 11.0226 11.0226 11.0540 11.0540 11.8258 11.8258 11.8642 11.8642 12.1030 12.1030 12.1262 12.1262 13.5012 13.5012 13.5174 13.5174 15.8867 15.8867 16.9131 16.9131 17.6781 17.6781 k = 0.2381 0.1587 1.0155 ( 2564 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9611 -14.9611 -14.9326 -14.9326 4.4441 4.4441 6.7447 6.7447 7.9080 7.9080 7.9950 7.9950 9.9589 9.9589 10.2271 10.2271 10.4170 10.4170 10.5550 10.5550 10.8988 10.8988 11.0197 11.0197 11.0514 11.0514 11.8275 11.8275 11.8624 11.8624 12.1002 12.1002 12.1171 12.1171 13.4977 13.4977 13.5123 13.5123 15.8781 15.8781 16.9411 16.9411 17.6986 17.6986 k = 0.2440 0.1479 1.0279 ( 2564 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9612 -14.9612 -14.9326 -14.9326 4.4458 4.4458 6.7605 6.7605 7.9005 7.9005 7.9873 7.9873 9.9609 9.9609 10.2327 10.2327 10.4143 10.4143 10.5552 10.5552 10.8995 10.8995 11.0176 11.0176 11.0499 11.0499 11.8287 11.8287 11.8614 11.8614 12.0987 12.0987 12.1115 12.1115 13.4956 13.4956 13.5092 13.5092 15.8726 15.8726 16.9593 16.9593 17.7139 17.7139 k = 0.2500 0.1370 1.0403 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4464 4.4464 6.7659 6.7659 7.8979 7.8979 7.9847 7.9847 9.9616 9.9616 10.2345 10.2345 10.4133 10.4133 10.5552 10.5552 10.8997 10.8997 11.0169 11.0169 11.0495 11.0495 11.8291 11.8291 11.8610 11.8610 12.0982 12.0982 12.1095 12.1095 13.4949 13.4949 13.5083 13.5083 15.8708 15.8708 16.9656 16.9656 17.7198 17.7198 k = 0.2500 0.1370 1.0403 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4464 4.4464 6.7659 6.7659 7.8979 7.8979 7.9847 7.9847 9.9616 9.9616 10.2345 10.2345 10.4133 10.4133 10.5552 10.5552 10.8997 10.8997 11.0169 11.0169 11.0495 11.0495 11.8291 11.8291 11.8610 11.8610 12.0982 12.0982 12.1095 12.1095 13.4949 13.4949 13.5083 13.5083 15.8708 15.8708 16.9656 16.9656 17.7198 17.7198 k = 0.2632 0.1442 1.0321 ( 2562 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4462 4.4462 6.7648 6.7648 7.8987 7.8987 7.9852 7.9852 9.9592 9.9592 10.2359 10.2359 10.4115 10.4115 10.5576 10.5576 10.8997 10.8997 11.0156 11.0156 11.0508 11.0508 11.8289 11.8289 11.8612 11.8612 12.0987 12.0987 12.1096 12.1096 13.4955 13.4955 13.5080 13.5080 15.8745 15.8745 16.9644 16.9644 17.7181 17.7181 k = 0.2763 0.1514 1.0238 ( 2557 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9612 -14.9612 -14.9325 -14.9325 4.4459 4.4459 6.7613 6.7613 7.9012 7.9012 7.9869 7.9869 9.9515 9.9515 10.2406 10.2406 10.4066 10.4066 10.5643 10.5643 10.8996 10.8996 11.0130 11.0130 11.0531 11.0531 11.8283 11.8283 11.8620 11.8620 12.0991 12.0991 12.1110 12.1110 13.4937 13.4937 13.5107 13.5107 15.8855 15.8855 16.9612 16.9612 17.7121 17.7121 k = 0.2895 0.1587 1.0156 ( 2558 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9611 -14.9611 -14.9325 -14.9325 4.4454 4.4454 6.7549 6.7549 7.9054 7.9054 7.9902 7.9902 9.9383 9.9383 10.2483 10.2483 10.3996 10.3996 10.5744 10.5744 10.8991 10.8991 11.0094 11.0094 11.0561 11.0561 11.8270 11.8270 11.8637 11.8637 12.0992 12.0992 12.1141 12.1141 13.4907 13.4907 13.5154 13.5154 15.9036 15.9036 16.9572 16.9572 17.6999 17.6999 k = 0.3026 0.1659 1.0074 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9611 -14.9611 -14.9325 -14.9325 4.4449 4.4449 6.7454 6.7454 7.9114 7.9114 7.9957 7.9957 9.9201 9.9201 10.2586 10.2586 10.3914 10.3914 10.5866 10.5866 10.8984 10.8984 11.0050 11.0050 11.0592 11.0592 11.8247 11.8247 11.8666 11.8666 12.0988 12.0988 12.1192 12.1192 13.4871 13.4871 13.5212 13.5212 15.9286 15.9286 16.9530 16.9530 17.6805 17.6805 k = 0.3158 0.1731 0.9992 ( 2563 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9610 -14.9610 -14.9325 -14.9325 4.4444 4.4444 6.7324 6.7324 7.9187 7.9187 8.0040 8.0040 9.8977 9.8977 10.2702 10.2702 10.3831 10.3831 10.6004 10.6004 10.8974 10.8974 11.0000 11.0000 11.0623 11.0623 11.8216 11.8216 11.8708 11.8708 12.0982 12.0982 12.1261 12.1261 13.4833 13.4833 13.5280 13.5280 15.9601 15.9601 16.9494 16.9494 17.6535 17.6535 k = 0.3289 0.1803 0.9909 ( 2555 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9608 -14.9608 -14.9324 -14.9324 4.4441 4.4441 6.7159 6.7159 7.9268 7.9268 8.0157 8.0157 9.8719 9.8719 10.2817 10.2817 10.3759 10.3759 10.6150 10.6150 10.8960 10.8960 10.9945 10.9945 11.0653 11.0653 11.8177 11.8177 11.8765 11.8765 12.0975 12.0975 12.1348 12.1348 13.4795 13.4795 13.5357 13.5357 15.9979 15.9979 16.9471 16.9471 17.6201 17.6201 k = 0.3421 0.1875 0.9827 ( 2552 PWs) bands (ev): -48.3497 -48.3497 -22.6610 -22.6610 -14.9606 -14.9606 -14.9324 -14.9324 4.4439 4.4439 6.6959 6.6959 7.9350 7.9350 8.0316 8.0316 9.8434 9.8434 10.2910 10.2910 10.3715 10.3715 10.6301 10.6301 10.8943 10.8943 10.9886 10.9886 11.0678 11.0678 11.8130 11.8130 11.8835 11.8835 12.0967 12.0967 12.1453 12.1453 13.4757 13.4757 13.5441 13.5441 16.0413 16.0413 16.9466 16.9466 17.5820 17.5820 k = 0.3553 0.1947 0.9745 ( 2552 PWs) bands (ev): -48.3497 -48.3497 -22.6610 -22.6610 -14.9603 -14.9603 -14.9324 -14.9324 4.4440 4.4440 6.6725 6.6725 7.9430 7.9430 8.0519 8.0519 9.8129 9.8129 10.2955 10.2955 10.3723 10.3723 10.6453 10.6453 10.8922 10.8922 10.9823 10.9823 11.0698 11.0698 11.8078 11.8078 11.8919 11.8919 12.0959 12.0959 12.1573 12.1573 13.4719 13.4719 13.5531 13.5531 16.0899 16.0899 16.9484 16.9484 17.5407 17.5407 k = 0.3684 0.2019 0.9663 ( 2550 PWs) bands (ev): -48.3497 -48.3497 -22.6609 -22.6609 -14.9601 -14.9601 -14.9323 -14.9323 4.4443 4.4443 6.6458 6.6458 7.9507 7.9507 8.0765 8.0765 9.7810 9.7810 10.2940 10.2940 10.3791 10.3791 10.6604 10.6604 10.8895 10.8895 10.9758 10.9758 11.0714 11.0714 11.8022 11.8022 11.9015 11.9015 12.0950 12.0950 12.1709 12.1709 13.4682 13.4682 13.5629 13.5629 16.1429 16.1429 16.9530 16.9530 17.4978 17.4978 k = 0.3816 0.2091 0.9580 ( 2548 PWs) bands (ev): -48.3497 -48.3497 -22.6608 -22.6608 -14.9598 -14.9598 -14.9323 -14.9323 4.4450 4.4450 6.6162 6.6162 7.9580 7.9580 8.1049 8.1049 9.7482 9.7482 10.2878 10.2878 10.3904 10.3904 10.6751 10.6751 10.8863 10.8863 10.9689 10.9689 11.0725 11.0725 11.7964 11.7964 11.9123 11.9123 12.0943 12.0943 12.1859 12.1859 13.4647 13.4647 13.5734 13.5734 16.1997 16.1997 16.9607 16.9607 17.4541 17.4541 k = 0.3947 0.2164 0.9498 ( 2549 PWs) bands (ev): -48.3498 -48.3498 -22.6608 -22.6608 -14.9596 -14.9596 -14.9322 -14.9322 4.4459 4.4459 6.5839 6.5839 7.9653 7.9653 8.1367 8.1367 9.7149 9.7149 10.2790 10.2790 10.4042 10.4042 10.6891 10.6891 10.8825 10.8825 10.9619 10.9619 11.0730 11.0730 11.7904 11.7904 11.9244 11.9244 12.0936 12.0936 12.2024 12.2024 13.4613 13.4613 13.5845 13.5845 16.2591 16.2591 16.9716 16.9716 17.4106 17.4106 k = 0.4079 0.2236 0.9416 ( 2547 PWs) bands (ev): -48.3498 -48.3498 -22.6607 -22.6607 -14.9592 -14.9592 -14.9322 -14.9322 4.4471 4.4471 6.5493 6.5493 7.9726 7.9726 8.1712 8.1712 9.6814 9.6814 10.2689 10.2689 10.4191 10.4191 10.7022 10.7022 10.8783 10.8783 10.9549 10.9549 11.0730 11.0730 11.7846 11.7846 11.9376 11.9376 12.0928 12.0928 12.2200 12.2200 13.4581 13.4581 13.5963 13.5963 16.3202 16.3202 16.9859 16.9859 17.3677 17.3677 k = 0.4211 0.2308 0.9334 ( 2539 PWs) bands (ev): -48.3498 -48.3498 -22.6605 -22.6605 -14.9588 -14.9588 -14.9320 -14.9320 4.4487 4.4487 6.5126 6.5126 7.9801 7.9801 8.2079 8.2079 9.6482 9.6482 10.2584 10.2584 10.4341 10.4341 10.7141 10.7141 10.8734 10.8734 10.9483 10.9483 11.0726 11.0726 11.7789 11.7789 11.9518 11.9518 12.0920 12.0920 12.2389 12.2389 13.4553 13.4553 13.6087 13.6087 16.3816 16.3816 17.0032 17.0032 17.3259 17.3259 k = 0.4342 0.2380 0.9251 ( 2535 PWs) bands (ev): -48.3498 -48.3498 -22.6604 -22.6604 -14.9584 -14.9584 -14.9320 -14.9320 4.4504 4.4504 6.4743 6.4743 7.9880 7.9880 8.2462 8.2462 9.6154 9.6154 10.2478 10.2478 10.4490 10.4490 10.7243 10.7243 10.8680 10.8680 10.9423 10.9423 11.0717 11.0717 11.7736 11.7736 11.9669 11.9669 12.0913 12.0913 12.2585 12.2585 13.4527 13.4527 13.6218 13.6218 16.4417 16.4417 17.0221 17.0221 17.2856 17.2856 k = 0.4474 0.2452 0.9169 ( 2536 PWs) bands (ev): -48.3498 -48.3498 -22.6603 -22.6603 -14.9580 -14.9580 -14.9319 -14.9319 4.4524 4.4524 6.4347 6.4347 7.9962 7.9962 8.2856 8.2856 9.5834 9.5834 10.2376 10.2376 10.4632 10.4632 10.7324 10.7324 10.8622 10.8622 10.9373 10.9373 11.0705 11.0705 11.7685 11.7685 11.9829 11.9829 12.0907 12.0907 12.2789 12.2789 13.4504 13.4504 13.6354 13.6354 16.4987 16.4987 17.0391 17.0391 17.2475 17.2475 k = 0.4605 0.2524 0.9087 ( 2534 PWs) bands (ev): -48.3498 -48.3498 -22.6602 -22.6602 -14.9576 -14.9576 -14.9319 -14.9319 4.4544 4.4544 6.3941 6.3941 8.0048 8.0048 8.3254 8.3254 9.5524 9.5524 10.2282 10.2282 10.4767 10.4767 10.7378 10.7378 10.8562 10.8562 10.9337 10.9337 11.0689 11.0689 11.7640 11.7640 11.9996 11.9996 12.0900 12.0900 12.2998 12.2998 13.4484 13.4484 13.6498 13.6498 16.5501 16.5501 17.0465 17.0465 17.2126 17.2126 k = 0.4737 0.2596 0.9005 ( 2534 PWs) bands (ev): -48.3498 -48.3498 -22.6601 -22.6601 -14.9571 -14.9571 -14.9318 -14.9318 4.4564 4.4564 6.3529 6.3529 8.0140 8.0140 8.3653 8.3653 9.5227 9.5227 10.2196 10.2196 10.4890 10.4890 10.7400 10.7400 10.8503 10.8503 10.9320 10.9320 11.0671 11.0671 11.7599 11.7599 12.0168 12.0168 12.0894 12.0894 12.3212 12.3212 13.4469 13.4469 13.6649 13.6649 16.5919 16.5919 17.0322 17.0322 17.1815 17.1815 k = 0.4868 0.2668 0.8922 ( 2536 PWs) bands (ev): -48.3499 -48.3499 -22.6600 -22.6600 -14.9567 -14.9567 -14.9317 -14.9317 4.4583 4.4583 6.3115 6.3115 8.0236 8.0236 8.4045 8.4045 9.4946 9.4946 10.2123 10.2123 10.5001 10.5001 10.7386 10.7386 10.8448 10.8448 10.9324 10.9324 11.0651 11.0651 11.7564 11.7564 12.0345 12.0345 12.0889 12.0889 12.3427 12.3427 13.4458 13.4458 13.6806 13.6806 16.6175 16.6175 16.9978 16.9978 17.1515 17.1515 k = 0.5000 0.2740 0.8840 ( 2536 PWs) bands (ev): -48.3499 -48.3499 -22.6598 -22.6598 -14.9561 -14.9561 -14.9317 -14.9317 4.4599 4.4599 6.2703 6.2703 8.0339 8.0339 8.4425 8.4425 9.4682 9.4682 10.2064 10.2064 10.5097 10.5097 10.7334 10.7334 10.8399 10.8399 10.9351 10.9351 11.0630 11.0630 11.7536 11.7536 12.0525 12.0525 12.0883 12.0883 12.3642 12.3642 13.4451 13.4451 13.6971 13.6971 16.6166 16.6166 16.9660 16.9660 17.1226 17.1226 k = 0.5000 0.2740 0.8840 ( 2536 PWs) bands (ev): -48.3499 -48.3499 -22.6598 -22.6598 -14.9561 -14.9561 -14.9317 -14.9317 4.4599 4.4599 6.2703 6.2703 8.0339 8.0339 8.4425 8.4425 9.4682 9.4682 10.2064 10.2064 10.5097 10.5097 10.7334 10.7334 10.8399 10.8399 10.9351 10.9351 11.0630 11.0630 11.7536 11.7536 12.0525 12.0525 12.0883 12.0883 12.3642 12.3642 13.4451 13.4451 13.6971 13.6971 16.6166 16.6166 16.9660 16.9660 17.1226 17.1226 k = 0.5000 0.2740 0.8667 ( 2540 PWs) bands (ev): -48.3499 -48.3499 -22.6596 -22.6596 -14.9550 -14.9550 -14.9316 -14.9316 4.4627 4.4627 6.1829 6.1829 8.0573 8.0573 8.5209 8.5209 9.4137 9.4137 10.1955 10.1955 10.5283 10.5283 10.7181 10.7181 10.8299 10.8299 10.9438 10.9438 11.0583 11.0583 11.7491 11.7491 12.0862 12.0862 12.0934 12.0934 12.4103 12.4103 13.4441 13.4441 13.7348 13.7348 16.5797 16.5797 16.9140 16.9140 17.0639 17.0639 k = 0.5000 0.2740 0.8494 ( 2550 PWs) bands (ev): -48.3500 -48.3500 -22.6594 -22.6594 -14.9539 -14.9539 -14.9314 -14.9314 4.4650 4.4650 6.0943 6.0943 8.0830 8.0830 8.5990 8.5990 9.3576 9.3576 10.1844 10.1844 10.5473 10.5473 10.7015 10.7015 10.8191 10.8191 10.9537 10.9537 11.0529 11.0529 11.7463 11.7463 12.0856 12.0856 12.1362 12.1362 12.4588 12.4588 13.4432 13.4432 13.7768 13.7768 16.5425 16.5425 16.8546 16.8546 17.0054 17.0054 k = 0.5000 0.2740 0.8320 ( 2550 PWs) bands (ev): -48.3501 -48.3501 -22.6591 -22.6591 -14.9525 -14.9525 -14.9313 -14.9313 4.4669 4.4669 6.0051 6.0051 8.1110 8.1110 8.6762 8.6762 9.3006 9.3006 10.1734 10.1734 10.5669 10.5669 10.6838 10.6838 10.8078 10.8078 10.9646 10.9646 11.0470 11.0470 11.7454 11.7454 12.0842 12.0842 12.1830 12.1830 12.5095 12.5095 13.4422 13.4422 13.8235 13.8235 16.5052 16.5052 16.7896 16.7896 16.9475 16.9475 k = 0.5000 0.2740 0.8147 ( 2550 PWs) bands (ev): -48.3501 -48.3501 -22.6588 -22.6588 -14.9510 -14.9510 -14.9311 -14.9311 4.4680 4.4680 5.9157 5.9157 8.1413 8.1413 8.7518 8.7518 9.2434 9.2434 10.1625 10.1625 10.5870 10.5870 10.6651 10.6651 10.7960 10.7960 10.9765 10.9765 11.0405 11.0405 11.7463 11.7463 12.0828 12.0828 12.2330 12.2330 12.5621 12.5621 13.4412 13.4412 13.8749 13.8749 16.4678 16.4678 16.7203 16.7203 16.8901 16.8901 k = 0.5000 0.2740 0.7974 ( 2540 PWs) bands (ev): -48.3502 -48.3502 -22.6583 -22.6583 -14.9493 -14.9493 -14.9308 -14.9308 4.4682 4.4682 5.8264 5.8264 8.1739 8.1739 8.8253 8.8253 9.1866 9.1866 10.1519 10.1519 10.6076 10.6076 10.6455 10.6455 10.7840 10.7840 10.9895 10.9895 11.0335 11.0335 11.7490 11.7490 12.0812 12.0812 12.2863 12.2863 12.6167 12.6167 13.4402 13.4402 13.9312 13.9312 16.4302 16.4302 16.6481 16.6481 16.8331 16.8331 k = 0.5000 0.2740 0.7800 ( 2544 PWs) bands (ev): -48.3503 -48.3503 -22.6579 -22.6579 -14.9477 -14.9477 -14.9306 -14.9306 4.4673 4.4673 5.7374 5.7374 8.2087 8.2087 8.8961 8.8961 9.1311 9.1311 10.1417 10.1417 10.6232 10.6232 10.6305 10.6305 10.7718 10.7718 11.0032 11.0032 11.0260 11.0260 11.7534 11.7534 12.0797 12.0797 12.3424 12.3424 12.6731 12.6731 13.4391 13.4391 13.9922 13.9922 16.3913 16.3913 16.5745 16.5745 16.7766 16.7766 k = 0.5000 0.2740 0.7627 ( 2540 PWs) bands (ev): -48.3503 -48.3503 -22.6575 -22.6575 -14.9459 -14.9459 -14.9303 -14.9303 4.4650 4.4650 5.6491 5.6491 8.2456 8.2456 8.9627 8.9627 9.0786 9.0786 10.1323 10.1323 10.6033 10.6033 10.6506 10.6506 10.7598 10.7598 11.0153 11.0153 11.0207 11.0207 11.7594 11.7594 12.0781 12.0781 12.4015 12.4015 12.7313 12.7313 13.4381 13.4381 14.0582 14.0582 16.3492 16.3492 16.5026 16.5026 16.7205 16.7205 k = 0.5000 0.2740 0.7454 ( 2540 PWs) bands (ev): -48.3504 -48.3504 -22.6570 -22.6570 -14.9440 -14.9440 -14.9300 -14.9300 4.4611 4.4611 5.5615 5.5615 8.2846 8.2846 9.0038 9.0038 9.0507 9.0507 10.1236 10.1236 10.5815 10.5815 10.6720 10.6720 10.7483 10.7483 11.0087 11.0087 11.0346 11.0346 11.7669 11.7669 12.0765 12.0765 12.4634 12.4634 12.7914 12.7914 13.4370 13.4370 14.1290 14.1290 16.2995 16.2995 16.4371 16.4371 16.6646 16.6646 k = 0.5000 0.2740 0.7280 ( 2544 PWs) bands (ev): -48.3505 -48.3505 -22.6566 -22.6566 -14.9422 -14.9422 -14.9297 -14.9297 4.4555 4.4555 5.4749 5.4749 8.3256 8.3256 8.9665 8.9665 9.1003 9.1003 10.1159 10.1159 10.5591 10.5591 10.6920 10.6920 10.7389 10.7389 10.9998 10.9998 11.0513 11.0513 11.7758 11.7758 12.0750 12.0750 12.5280 12.5280 12.8531 12.8531 13.4360 13.4360 14.2046 14.2046 16.2378 16.2378 16.3832 16.3832 16.6089 16.6089 k = 0.5000 0.2740 0.7107 ( 2548 PWs) bands (ev): -48.3506 -48.3506 -22.6562 -22.6562 -14.9402 -14.9402 -14.9295 -14.9295 4.4480 4.4480 5.3893 5.3893 8.3686 8.3686 8.9203 8.9203 9.1583 9.1583 10.1094 10.1094 10.5362 10.5362 10.7035 10.7035 10.7388 10.7388 10.9906 10.9906 11.0689 11.0689 11.7861 11.7861 12.0735 12.0735 12.5951 12.5951 12.9165 12.9165 13.4349 13.4349 14.2851 14.2851 16.1639 16.1639 16.3416 16.3416 16.5533 16.5533 k = 0.5000 0.2740 0.6934 ( 2546 PWs) bands (ev): -48.3507 -48.3507 -22.6557 -22.6557 -14.9381 -14.9381 -14.9291 -14.9291 4.4383 4.4383 5.3050 5.3050 8.4134 8.4134 8.8761 8.8761 9.2141 9.2141 10.1042 10.1042 10.5131 10.5131 10.6995 10.6995 10.7550 10.7550 10.9812 10.9812 11.0875 11.0875 11.7978 11.7978 12.0721 12.0721 12.6648 12.6648 12.9816 12.9816 13.4340 13.4340 14.3702 14.3702 16.0818 16.0818 16.3088 16.3088 16.4978 16.4978 k = 0.5000 0.2740 0.6760 ( 2548 PWs) bands (ev): -48.3508 -48.3508 -22.6552 -22.6552 -14.9360 -14.9360 -14.9287 -14.9287 4.4264 4.4264 5.2219 5.2219 8.4600 8.4600 8.8351 8.8351 9.2668 9.2668 10.1006 10.1006 10.4896 10.4896 10.6897 10.6897 10.7778 10.7778 10.9717 10.9717 11.1069 11.1069 11.8105 11.8105 12.0708 12.0708 12.7369 12.7369 13.0483 13.0483 13.4331 13.4331 14.4597 14.4597 15.9950 15.9950 16.2816 16.2816 16.4425 16.4425 k = 0.5000 0.2740 0.6587 ( 2546 PWs) bands (ev): -48.3509 -48.3509 -22.6546 -22.6546 -14.9339 -14.9339 -14.9282 -14.9282 4.4122 4.4122 5.1403 5.1403 8.5081 8.5081 8.7977 8.7977 9.3162 9.3162 10.0987 10.0987 10.4659 10.4659 10.6785 10.6785 10.8024 10.8024 10.9626 10.9626 11.1271 11.1271 11.8243 11.8243 12.0697 12.0697 12.8114 12.8114 13.1166 13.1166 13.4324 13.4324 14.5533 14.5533 15.9056 15.9056 16.2578 16.2578 16.3879 16.3879 k = 0.5000 0.2740 0.6414 ( 2542 PWs) bands (ev): -48.3509 -48.3509 -22.6540 -22.6540 -14.9318 -14.9318 -14.9275 -14.9275 4.3955 4.3955 5.0602 5.0602 8.5573 8.5573 8.7645 8.7645 9.3623 9.3623 10.0987 10.0987 10.4422 10.4422 10.6671 10.6671 10.8271 10.8271 10.9545 10.9545 11.1482 11.1482 11.8391 11.8391 12.0689 12.0689 12.8880 12.8880 13.1865 13.1865 13.4319 13.4319 14.6506 14.6506 15.8148 15.8148 16.2351 16.2351 16.3356 16.3356 k = 0.5000 0.2740 0.6240 ( 2538 PWs) bands (ev): -48.3510 -48.3510 -22.6535 -22.6535 -14.9300 -14.9300 -14.9265 -14.9265 4.3763 4.3763 4.9816 4.9816 8.6061 8.6061 8.7369 8.7369 9.4050 9.4050 10.1007 10.1007 10.4185 10.4185 10.6557 10.6557 10.8503 10.8503 10.9488 10.9488 11.1698 11.1698 11.8547 11.8547 12.0685 12.0685 12.9666 12.9666 13.2579 13.2579 13.4318 13.4318 14.7508 14.7508 15.7234 15.7234 16.2087 16.2087 16.2903 16.2903 k = 0.5000 0.2740 0.6067 ( 2550 PWs) bands (ev): -48.3511 -48.3511 -22.6530 -22.6530 -14.9289 -14.9289 -14.9250 -14.9250 4.3546 4.3546 4.9047 4.9047 8.6480 8.6480 8.7216 8.7216 9.4445 9.4445 10.1051 10.1051 10.3948 10.3948 10.6445 10.6445 10.8685 10.8685 10.9491 10.9491 11.1921 11.1921 11.8709 11.8709 12.0682 12.0682 13.0468 13.0468 13.3305 13.3305 13.4326 13.4326 14.8530 14.8530 15.6322 15.6322 16.1703 16.1703 16.2605 16.2605 k = 0.5000 0.2740 0.5894 ( 2550 PWs) bands (ev): -48.3512 -48.3512 -22.6524 -22.6524 -14.9282 -14.9282 -14.9229 -14.9229 4.3305 4.3305 4.8295 4.8295 8.6591 8.6591 8.7422 8.7422 9.4809 9.4809 10.1118 10.1118 10.3713 10.3713 10.6334 10.6334 10.8768 10.8768 10.9602 10.9602 11.2148 11.2148 11.8878 11.8878 12.0687 12.0687 13.1280 13.1280 13.4029 13.4029 13.4364 13.4364 14.9557 14.9557 15.5419 15.5419 16.1191 16.1191 16.2474 16.2474 k = 0.5000 0.2740 0.5720 ( 2546 PWs) bands (ev): -48.3513 -48.3513 -22.6518 -22.6518 -14.9276 -14.9276 -14.9206 -14.9206 4.3039 4.3039 4.7560 4.7560 8.6471 8.6471 8.7908 8.7908 9.5142 9.5142 10.1211 10.1211 10.3481 10.3481 10.6225 10.6225 10.8754 10.8754 10.9822 10.9822 11.2380 11.2380 11.9052 11.9052 12.0699 12.0699 13.2089 13.2089 13.4351 13.4351 13.4843 13.4843 15.0561 15.0561 15.4546 15.4546 16.0608 16.0608 16.2462 16.2462 k = 0.5000 0.2740 0.5547 ( 2550 PWs) bands (ev): -48.3515 -48.3515 -22.6513 -22.6513 -14.9272 -14.9272 -14.9181 -14.9181 4.2750 4.2750 4.6843 4.6843 8.6326 8.6326 8.8466 8.8466 9.5448 9.5448 10.1331 10.1331 10.3251 10.3251 10.6118 10.6118 10.8685 10.8685 11.0106 11.0106 11.2613 11.2613 11.9227 11.9227 12.0720 12.0720 13.2854 13.2854 13.4467 13.4467 13.5606 13.5606 15.1462 15.1462 15.3767 15.3767 15.9986 15.9986 16.2550 16.2550 k = 0.5000 0.2740 0.5373 ( 2546 PWs) bands (ev): -48.3516 -48.3516 -22.6507 -22.6507 -14.9267 -14.9267 -14.9156 -14.9156 4.2439 4.2439 4.6145 4.6145 8.6197 8.6197 8.9052 8.9052 9.5726 9.5726 10.1478 10.1478 10.3026 10.3026 10.6012 10.6012 10.8592 10.8592 11.0427 11.0427 11.2849 11.2849 11.9404 11.9404 12.0752 12.0752 13.3461 13.3461 13.4751 13.4751 13.6393 13.6393 15.1881 15.1881 15.3441 15.3441 15.9340 15.9340 16.2743 16.2743 k = 0.5000 0.2740 0.5200 ( 2550 PWs) bands (ev): -48.3517 -48.3517 -22.6501 -22.6501 -14.9263 -14.9263 -14.9130 -14.9130 4.2108 4.2108 4.5466 4.5466 8.6090 8.6090 8.9657 8.9657 9.5981 9.5981 10.1652 10.1652 10.2807 10.2807 10.5908 10.5908 10.8487 10.8487 11.0772 11.0772 11.3082 11.3082 11.9580 11.9580 12.0798 12.0798 13.3777 13.3777 13.5340 13.5340 13.7196 13.7196 15.1397 15.1397 15.3963 15.3963 15.8674 15.8674 16.3060 16.3060 k = 0.5000 0.2740 0.5027 ( 2548 PWs) bands (ev): -48.3518 -48.3518 -22.6495 -22.6495 -14.9259 -14.9259 -14.9104 -14.9104 4.1759 4.1759 4.4806 4.4806 8.6004 8.6004 9.0277 9.0277 9.6213 9.6213 10.1846 10.1846 10.2603 10.2603 10.5804 10.5804 10.8375 10.8375 11.1135 11.1135 11.3313 11.3313 11.9753 11.9753 12.0861 12.0861 13.3895 13.3895 13.6141 13.6141 13.8013 13.8013 15.0615 15.0615 15.4694 15.4694 15.7998 15.7998 16.3524 16.3524 k = 0.5000 0.2740 0.4853 ( 2544 PWs) bands (ev): -48.3519 -48.3519 -22.6489 -22.6489 -14.9255 -14.9255 -14.9078 -14.9078 4.1394 4.1394 4.4165 4.4165 8.5939 8.5939 9.0909 9.0909 9.6424 9.6424 10.2024 10.2024 10.2452 10.2452 10.5703 10.5703 10.8260 10.8260 11.1517 11.1517 11.3539 11.3539 11.9923 11.9923 12.0943 12.0943 13.3940 13.3940 13.7026 13.7026 13.8844 13.8844 14.9786 14.9786 15.5343 15.5343 15.7335 15.7335 16.4156 16.4156 k = 0.5000 0.2740 0.4680 ( 2532 PWs) bands (ev): -48.3519 -48.3519 -22.6481 -22.6481 -14.9250 -14.9250 -14.9051 -14.9051 4.1016 4.1016 4.3545 4.3545 8.5892 8.5892 9.1552 9.1552 9.6618 9.6618 10.2024 10.2024 10.2514 10.2514 10.5602 10.5602 10.8144 10.8144 11.1915 11.1915 11.3758 11.3758 12.0086 12.0086 12.1046 12.1046 13.3956 13.3956 13.7945 13.7945 13.9689 13.9689 14.8959 14.8959 15.5726 15.5726 15.6810 15.6810 16.4965 16.4965 k = 0.5000 0.2740 0.4507 ( 2532 PWs) bands (ev): -48.3520 -48.3520 -22.6476 -22.6476 -14.9246 -14.9246 -14.9025 -14.9025 4.0626 4.0626 4.2944 4.2944 8.5860 8.5860 9.2205 9.2205 9.6794 9.6794 10.1864 10.1864 10.2771 10.2771 10.5502 10.5502 10.8027 10.8027 11.2328 11.2328 11.3965 11.3965 12.0247 12.0247 12.1172 12.1172 13.3957 13.3957 13.8874 13.8874 14.0547 14.0547 14.8150 14.8150 15.5454 15.5454 15.6807 15.6807 16.5946 16.5946 k = 0.5000 0.2740 0.4333 ( 2532 PWs) bands (ev): -48.3521 -48.3521 -22.6470 -22.6470 -14.9242 -14.9242 -14.8999 -14.8999 4.0228 4.0228 4.2363 4.2363 8.5840 8.5840 9.2866 9.2866 9.6957 9.6957 10.1676 10.1676 10.3092 10.3092 10.5403 10.5403 10.7908 10.7908 11.2757 11.2757 11.4157 11.4157 12.0405 12.0405 12.1317 12.1317 13.3951 13.3951 13.9793 13.9793 14.1418 14.1418 14.7378 14.7378 15.4785 15.4785 15.7078 15.7078 16.7081 16.7081 k = 0.5000 0.2740 0.4160 ( 2538 PWs) bands (ev): -48.3523 -48.3523 -22.6465 -22.6465 -14.9239 -14.9239 -14.8974 -14.8974 3.9825 3.9825 4.1803 4.1803 8.5830 8.5830 9.3535 9.3535 9.7107 9.7107 10.1485 10.1485 10.3448 10.3448 10.5307 10.5307 10.7789 10.7789 11.3200 11.3200 11.4334 11.4334 12.0565 12.0565 12.1480 12.1480 13.3940 13.3940 14.0668 14.0668 14.2304 14.2304 14.6672 14.6672 15.4027 15.4027 15.7338 15.7338 16.8344 16.8344 k = 0.5000 0.2740 0.3987 ( 2530 PWs) bands (ev): -48.3523 -48.3523 -22.6458 -22.6458 -14.9234 -14.9234 -14.8948 -14.8948 3.9418 3.9418 4.1263 4.1263 8.5828 8.5828 9.4211 9.4211 9.7247 9.7247 10.1297 10.1297 10.3832 10.3832 10.5215 10.5215 10.7671 10.7671 11.3659 11.3659 11.4493 11.4493 12.0735 12.0735 12.1658 12.1658 13.3926 13.3926 14.1438 14.1438 14.3204 14.3204 14.6088 14.6088 15.3236 15.3236 15.7553 15.7553 16.9710 16.9710 k = 0.5000 0.2740 0.3813 ( 2530 PWs) bands (ev): -48.3524 -48.3524 -22.6453 -22.6453 -14.9231 -14.9231 -14.8923 -14.8923 3.9011 3.9011 4.0744 4.0744 8.5830 8.5830 9.4891 9.4891 9.7377 9.7377 10.1113 10.1113 10.4229 10.4229 10.5137 10.5137 10.7553 10.7553 11.4125 11.4125 11.4640 11.4640 12.0916 12.0916 12.1847 12.1847 13.3907 13.3907 14.1975 14.1975 14.4115 14.4115 14.5750 14.5750 15.2430 15.2430 15.7728 15.7728 17.1131 17.1131 k = 0.5000 0.2740 0.3640 ( 2530 PWs) bands (ev): -48.3525 -48.3525 -22.6447 -22.6447 -14.9227 -14.9227 -14.8898 -14.8898 3.8606 3.8606 4.0245 4.0245 8.5836 8.5836 9.5576 9.5576 9.7499 9.7499 10.0935 10.0935 10.4597 10.4597 10.5110 10.5110 10.7435 10.7435 11.4540 11.4540 11.4831 11.4831 12.1113 12.1113 12.2045 12.2045 13.3885 13.3885 14.2111 14.2111 14.5029 14.5029 14.5827 14.5827 15.1619 15.1619 15.7875 15.7875 17.1213 17.1213 k = 0.5000 0.2740 0.3467 ( 2526 PWs) bands (ev): -48.3526 -48.3526 -22.6442 -22.6442 -14.9224 -14.9224 -14.8873 -14.8873 3.8205 3.8205 3.9768 3.9768 8.5844 8.5844 9.6263 9.6263 9.7615 9.7615 10.0763 10.0763 10.4761 10.4761 10.5308 10.5308 10.7317 10.7317 11.4727 11.4727 11.5242 11.5242 12.1327 12.1327 12.2251 12.2251 13.3860 13.3860 14.1837 14.1837 14.5912 14.5912 14.6343 14.6343 15.0819 15.0819 15.8000 15.8000 17.0995 17.0995 k = 0.5000 0.2740 0.3293 ( 2538 PWs) bands (ev): -48.3527 -48.3527 -22.6438 -22.6438 -14.9221 -14.9221 -14.8851 -14.8851 3.7812 3.7812 3.9311 3.9311 8.5853 8.5853 9.6951 9.6951 9.7725 9.7725 10.0597 10.0597 10.4726 10.4726 10.5718 10.5718 10.7199 10.7199 11.4794 11.4794 11.5764 11.5764 12.1557 12.1557 12.2464 12.2464 13.3832 13.3832 14.1324 14.1324 14.6726 14.6726 14.7124 14.7124 15.0070 15.0070 15.8111 15.8111 17.0811 17.0811 k = 0.5000 0.2740 0.3120 ( 2542 PWs) bands (ev): -48.3528 -48.3528 -22.6433 -22.6433 -14.9218 -14.9218 -14.8828 -14.8828 3.7427 3.7427 3.8875 3.8875 8.5862 8.5862 9.7630 9.7630 9.7840 9.7840 10.0440 10.0440 10.4650 10.4650 10.6181 10.6181 10.7084 10.7084 11.4817 11.4817 11.6320 11.6320 12.1802 12.1802 12.2685 12.2685 13.3798 13.3798 14.0703 14.0703 14.7416 14.7416 14.7928 14.7928 14.9533 14.9533 15.8214 15.8214 17.0668 17.0668 k = 0.5000 0.2740 0.2947 ( 2550 PWs) bands (ev): -48.3529 -48.3529 -22.6429 -22.6429 -14.9215 -14.9215 -14.8807 -14.8807 3.7053 3.7053 3.8461 3.8461 8.5869 8.5869 9.7920 9.7920 9.8339 9.8339 10.0289 10.0289 10.4565 10.4565 10.6654 10.6654 10.6976 10.6976 11.4806 11.4806 11.6903 11.6903 12.2057 12.2057 12.2917 12.2917 13.3760 13.3760 14.0037 14.0037 14.7507 14.7507 14.8669 14.8669 14.9698 14.9698 15.8310 15.8310 17.0575 17.0575 k = 0.5000 0.2740 0.2773 ( 2550 PWs) bands (ev): -48.3530 -48.3530 -22.6424 -22.6424 -14.9212 -14.9212 -14.8786 -14.8786 3.6691 3.6691 3.8069 3.8069 8.5876 8.5876 9.8020 9.8020 9.9018 9.9018 10.0151 10.0151 10.4479 10.4479 10.6840 10.6840 10.7160 10.7160 11.4765 11.4765 11.7509 11.7509 12.2315 12.2315 12.3166 12.3166 13.3715 13.3715 13.9354 13.9354 14.6939 14.6939 14.9481 14.9481 15.0458 15.0458 15.8405 15.8405 17.0540 17.0540 k = 0.5000 0.2740 0.2600 ( 2554 PWs) bands (ev): -48.3531 -48.3531 -22.6420 -22.6420 -14.9210 -14.9210 -14.8766 -14.8766 3.6344 3.6344 3.7699 3.7699 8.5881 8.5881 9.8113 9.8113 9.9676 9.9676 10.0040 10.0040 10.4393 10.4393 10.6735 10.6735 10.7636 10.7636 11.4694 11.4694 11.8137 11.8137 12.2567 12.2567 12.3437 12.3437 13.3662 13.3662 13.8665 13.8665 14.6195 14.6195 15.0323 15.0323 15.1346 15.1346 15.8499 15.8499 17.0574 17.0574 k = 0.5000 0.2740 0.2427 ( 2546 PWs) bands (ev): -48.3531 -48.3531 -22.6415 -22.6415 -14.9206 -14.9206 -14.8746 -14.8746 3.6012 3.6012 3.7351 3.7351 8.5885 8.5885 9.8203 9.8203 9.9857 9.9857 10.0412 10.0412 10.4310 10.4310 10.6627 10.6627 10.8109 10.8109 11.4597 11.4597 11.8786 11.8786 12.2806 12.2806 12.3738 12.3738 13.3600 13.3600 13.7980 13.7980 14.5416 14.5416 15.1165 15.1165 15.2235 15.2235 15.8595 15.8595 17.0687 17.0687 k = 0.5000 0.2740 0.2253 ( 2554 PWs) bands (ev): -48.3532 -48.3532 -22.6412 -22.6412 -14.9204 -14.9204 -14.8728 -14.8728 3.5698 3.5698 3.7026 3.7026 8.5887 8.5887 9.8288 9.8288 9.9752 9.9752 10.1070 10.1070 10.4230 10.4230 10.6520 10.6520 10.8570 10.8570 11.4473 11.4473 11.9453 11.9453 12.3025 12.3025 12.4067 12.4067 13.3526 13.3526 13.7301 13.7301 14.4635 14.4635 15.1992 15.1992 15.3086 15.3086 15.8693 15.8693 17.0893 17.0893 k = 0.5000 0.2740 0.2080 ( 2546 PWs) bands (ev): -48.3533 -48.3533 -22.6408 -22.6408 -14.9201 -14.9201 -14.8710 -14.8710 3.5402 3.5402 3.6725 3.6725 8.5888 8.5888 9.8370 9.8370 9.9648 9.9648 10.1728 10.1728 10.4155 10.4155 10.6416 10.6416 10.9014 10.9014 11.4325 11.4325 12.0137 12.0137 12.3224 12.3224 12.4427 12.4427 13.3438 13.3438 13.6630 13.6630 14.3870 14.3870 15.2793 15.2793 15.3877 15.3877 15.8796 15.8796 17.1202 17.1202 k = 0.5000 0.2740 0.1907 ( 2542 PWs) bands (ev): -48.3533 -48.3533 -22.6404 -22.6404 -14.9199 -14.9199 -14.8694 -14.8694 3.5125 3.5125 3.6446 3.6446 8.5888 8.5888 9.8447 9.8447 9.9551 9.9551 10.2376 10.2376 10.4084 10.4084 10.6316 10.6316 10.9436 10.9436 11.4153 11.4153 12.0834 12.0834 12.3404 12.3404 12.4812 12.4812 13.3333 13.3333 13.5970 13.5970 14.3131 14.3131 15.3555 15.3555 15.4597 15.4597 15.8904 15.8904 17.1626 17.1626 k = 0.5000 0.2740 0.1733 ( 2542 PWs) bands (ev): -48.3534 -48.3534 -22.6401 -22.6401 -14.9197 -14.9197 -14.8679 -14.8679 3.4869 3.4869 3.6192 3.6192 8.5886 8.5886 9.8519 9.8519 9.9462 9.9462 10.3008 10.3008 10.4019 10.4019 10.6221 10.6221 10.9833 10.9833 11.3962 11.3962 12.1541 12.1541 12.3568 12.3568 12.5220 12.5220 13.3205 13.3205 13.5321 13.5321 14.2426 14.2426 15.4263 15.4263 15.5244 15.5244 15.9017 15.9017 17.2171 17.2171 k = 0.5000 0.2740 0.1560 ( 2546 PWs) bands (ev): -48.3534 -48.3534 -22.6398 -22.6398 -14.9195 -14.9195 -14.8666 -14.8666 3.4634 3.4634 3.5961 3.5961 8.5884 8.5884 9.8584 9.8584 9.9384 9.9384 10.3607 10.3607 10.3975 10.3975 10.6131 10.6131 11.0200 11.0200 11.3751 11.3751 12.2251 12.2251 12.3720 12.3720 12.5646 12.5646 13.3049 13.3049 13.4685 13.4685 14.1763 14.1763 15.4896 15.4896 15.5822 15.5822 15.9136 15.9136 17.2837 17.2837 k = 0.5000 0.2740 0.1387 ( 2552 PWs) bands (ev): -48.3535 -48.3535 -22.6396 -22.6396 -14.9194 -14.9194 -14.8654 -14.8654 3.4422 3.4422 3.5754 3.5754 8.5881 8.5881 9.8642 9.8642 9.9318 9.9318 10.3860 10.3860 10.4261 10.4261 10.6048 10.6048 11.0534 11.0534 11.3526 11.3526 12.2951 12.2951 12.3870 12.3870 12.6085 12.6085 13.2856 13.2856 13.4067 13.4067 14.1149 14.1149 15.5430 15.5430 15.6349 15.6349 15.9261 15.9261 17.3618 17.3618 k = 0.5000 0.2740 0.1213 ( 2552 PWs) bands (ev): -48.3535 -48.3535 -22.6394 -22.6394 -14.9192 -14.9192 -14.8643 -14.8643 3.4233 3.4233 3.5571 3.5571 8.5878 8.5878 9.8690 9.8690 9.9264 9.9264 10.3824 10.3824 10.4817 10.4817 10.5972 10.5972 11.0832 11.0832 11.3291 11.3291 12.3578 12.3578 12.4079 12.4079 12.6535 12.6535 13.2613 13.2613 13.3476 13.3476 14.0593 14.0593 15.5848 15.5848 15.6837 15.6837 15.9394 15.9394 17.4495 17.4495 k = 0.5000 0.2740 0.1040 ( 2542 PWs) bands (ev): -48.3535 -48.3535 -22.6391 -22.6391 -14.9190 -14.9190 -14.8633 -14.8633 3.4067 3.4067 3.5412 3.5412 8.5874 8.5874 9.8728 9.8728 9.9223 9.9223 10.3782 10.3782 10.5353 10.5353 10.5905 10.5905 11.1089 11.1089 11.3054 11.3054 12.3910 12.3910 12.4568 12.4568 12.6991 12.6991 13.2290 13.2290 13.2940 13.2940 14.0101 14.0101 15.6155 15.6155 15.7279 15.7279 15.9535 15.9535 17.5429 17.5429 k = 0.5000 0.2740 0.0867 ( 2542 PWs) bands (ev): -48.3536 -48.3536 -22.6389 -22.6389 -14.9189 -14.9189 -14.8624 -14.8624 3.3926 3.3926 3.5277 3.5277 8.5871 8.5871 9.8754 9.8754 9.9195 9.9195 10.3744 10.3744 10.5835 10.5835 10.5863 10.5863 11.1298 11.1298 11.2824 11.2824 12.4041 12.4041 12.5234 12.5234 12.7446 12.7446 13.1854 13.1854 13.2490 13.2490 13.9679 13.9679 15.6370 15.6370 15.7660 15.7660 15.9684 15.9684 17.6330 17.6330 k = 0.5000 0.2740 0.0693 ( 2542 PWs) bands (ev): -48.3536 -48.3536 -22.6388 -22.6388 -14.9188 -14.9188 -14.8618 -14.8618 3.3810 3.3810 3.5167 3.5167 8.5868 8.5868 9.8770 9.8770 9.9179 9.9179 10.3712 10.3712 10.5796 10.5796 10.6300 10.6300 11.1451 11.1451 11.2618 11.2618 12.4123 12.4123 12.5923 12.5923 12.7891 12.7891 13.1327 13.1327 13.2109 13.2109 13.9332 13.9332 15.6517 15.6517 15.7965 15.7965 15.9837 15.9837 17.6951 17.6951 k = 0.5000 0.2740 0.0520 ( 2542 PWs) bands (ev): -48.3536 -48.3536 -22.6387 -22.6387 -14.9187 -14.9187 -14.8612 -14.8612 3.3720 3.3720 3.5082 3.5082 8.5866 8.5866 9.8777 9.8777 9.9172 9.9172 10.3686 10.3686 10.5757 10.5757 10.6683 10.6683 11.1538 11.1538 11.2459 11.2459 12.4182 12.4182 12.6604 12.6604 12.8307 12.8307 13.0767 13.0767 13.1758 13.1758 13.9061 13.9061 15.6612 15.6612 15.8191 15.8191 15.9981 15.9981 17.7080 17.7080 k = 0.5000 0.2740 0.0347 ( 2542 PWs) bands (ev): -48.3536 -48.3536 -22.6386 -22.6386 -14.9187 -14.9187 -14.8609 -14.8609 3.3655 3.3655 3.5020 3.5020 8.5864 8.5864 9.8779 9.8779 9.9171 9.9171 10.3668 10.3668 10.5728 10.5728 10.6980 10.6980 11.1559 11.1559 11.2364 11.2364 12.4222 12.4222 12.7264 12.7264 12.8649 12.8649 13.0227 13.0227 13.1432 13.1432 13.8869 13.8869 15.6671 15.6671 15.8342 15.8342 16.0103 16.0103 17.6995 17.6995 k = 0.5000 0.2740 0.0173 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8606 -14.8606 3.3616 3.3616 3.4984 3.4984 8.5863 8.5863 9.8779 9.8779 9.9172 9.9172 10.3657 10.3657 10.5711 10.5711 10.7172 10.7172 11.1541 11.1541 11.2325 11.2325 12.4246 12.4246 12.7880 12.7880 12.8784 12.8784 12.9819 12.9819 13.1173 13.1173 13.8753 13.8753 15.6702 15.6702 15.8428 15.8428 16.0183 16.0183 17.6907 17.6907 k = 0.5000 0.2740-0.0000 ( 2540 PWs) bands (ev): -48.3536 -48.3536 -22.6385 -22.6385 -14.9186 -14.9186 -14.8605 -14.8605 3.3603 3.3603 3.4971 3.4971 8.5863 8.5863 9.8779 9.8779 9.9172 9.9172 10.3653 10.3653 10.5705 10.5705 10.7238 10.7238 11.1529 11.1529 11.2316 11.2316 12.4254 12.4254 12.8286 12.8286 12.8634 12.8634 12.9698 12.9698 13.1066 13.1066 13.8715 13.8715 15.6712 15.6712 15.8455 15.8455 16.0212 16.0212 17.6873 17.6873 k = 0.0000 0.0000 1.0403 ( 2564 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9614 -14.9614 -14.9325 -14.9325 4.4416 4.4416 6.7956 6.7956 7.9338 7.9338 7.9484 7.9484 9.7549 9.7549 10.2727 10.2727 10.3987 10.3987 10.8035 10.8035 10.8741 10.8741 10.9123 10.9123 11.0771 11.0771 11.8248 11.8248 11.8707 11.8707 12.0903 12.0903 12.1173 12.1173 13.4451 13.4451 13.5456 13.5456 16.8302 16.8302 16.8796 16.8796 17.2674 17.2674 k = 0.0147 0.0081 1.0403 ( 2546 PWs) bands (ev): -48.3497 -48.3497 -22.6611 -22.6611 -14.9613 -14.9613 -14.9323 -14.9323 4.4417 4.4417 6.7954 6.7954 7.9328 7.9328 7.9494 7.9494 9.7563 9.7563 10.2734 10.2734 10.3981 10.3981 10.8001 10.8001 10.8761 10.8761 10.9132 10.9132 11.0771 11.0771 11.8249 11.8249 11.8706 11.8706 12.0905 12.0905 12.1173 12.1173 13.4454 13.4454 13.5456 13.5456 16.7788 16.7788 16.9090 16.9090 17.2940 17.2940 k = 0.0294 0.0161 1.0403 ( 2550 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4418 4.4418 6.7946 6.7946 7.9304 7.9304 7.9519 7.9519 9.7602 9.7602 10.2754 10.2754 10.3954 10.3954 10.7907 10.7907 10.8806 10.8806 10.9160 10.9160 11.0767 11.0767 11.8249 11.8249 11.8704 11.8704 12.0906 12.0906 12.1171 12.1171 13.4461 13.4461 13.5451 13.5451 16.6960 16.6960 16.9344 16.9344 17.3645 17.3645 k = 0.0441 0.0242 1.0403 ( 2556 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4420 4.4420 6.7933 6.7933 7.9273 7.9273 7.9549 7.9549 9.7667 9.7667 10.2787 10.2787 10.3911 10.3911 10.7776 10.7776 10.8853 10.8853 10.9210 10.9210 11.0761 11.0761 11.8250 11.8250 11.8701 11.8701 12.0908 12.0908 12.1168 12.1168 13.4474 13.4474 13.5444 13.5444 16.6064 16.6064 16.9479 16.9479 17.4619 17.4619 k = 0.0588 0.0322 1.0403 ( 2552 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4423 4.4423 6.7917 6.7917 7.9241 7.9241 7.9582 7.9582 9.7757 9.7757 10.2833 10.2833 10.3853 10.3853 10.7622 10.7622 10.8890 10.8890 10.9281 10.9281 11.0752 11.0752 11.8252 11.8252 11.8696 11.8696 12.0911 12.0911 12.1165 12.1165 13.4492 13.4492 13.5433 13.5433 16.5162 16.5162 16.9550 16.9550 17.5716 17.5716 k = 0.0735 0.0403 1.0403 ( 2556 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9614 -14.9614 -14.9324 -14.9324 4.4426 4.4426 6.7896 6.7896 7.9208 7.9208 7.9615 7.9615 9.7869 9.7869 10.2890 10.2890 10.3779 10.3779 10.7452 10.7452 10.8916 10.8916 10.9367 10.9367 11.0740 11.0740 11.8253 11.8253 11.8689 11.8689 12.0914 12.0914 12.1162 12.1162 13.4513 13.4513 13.5419 13.5419 16.4284 16.4284 16.9589 16.9589 17.6469 17.6469 k = 0.0882 0.0484 1.0403 ( 2556 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9614 -14.9614 -14.9324 -14.9324 4.4430 4.4430 6.7873 6.7873 7.9175 7.9175 7.9648 7.9648 9.8003 9.8003 10.2955 10.2955 10.3693 10.3693 10.7272 10.7272 10.8934 10.8934 10.9459 10.9459 11.0725 11.0725 11.8256 11.8256 11.8683 11.8683 12.0919 12.0919 12.1158 12.1158 13.4540 13.4540 13.5403 13.5403 16.3447 16.3447 16.9613 16.9613 17.6656 17.6656 k = 0.1029 0.0564 1.0403 ( 2552 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4434 4.4434 6.7847 6.7847 7.9144 7.9144 7.9679 7.9679 9.8154 9.8154 10.3025 10.3025 10.3601 10.3601 10.7085 10.7085 10.8948 10.8948 10.9554 10.9554 11.0708 11.0708 11.8258 11.8258 11.8675 11.8675 12.0923 12.0923 12.1154 12.1154 13.4570 13.4570 13.5383 13.5383 16.2663 16.2663 16.9627 16.9627 17.6811 17.6811 k = 0.1176 0.0645 1.0403 ( 2556 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4438 4.4438 6.7820 6.7820 7.9115 7.9115 7.9709 7.9709 9.8321 9.8321 10.3084 10.3084 10.3517 10.3517 10.6893 10.6893 10.8958 10.8958 10.9647 10.9647 11.0688 11.0688 11.8261 11.8261 11.8667 11.8667 12.0928 12.0928 12.1149 12.1149 13.4604 13.4604 13.5360 13.5360 16.1939 16.1939 16.9637 16.9637 17.6939 17.6939 k = 0.1324 0.0725 1.0403 ( 2550 PWs) bands (ev): -48.3497 -48.3497 -22.6612 -22.6612 -14.9613 -14.9613 -14.9324 -14.9324 4.4442 4.4442 6.7793 6.7793 7.9088 7.9088 7.9736 7.9736 9.8500 9.8500 10.3098 10.3098 10.3478 10.3478 10.6699 10.6699 10.8966 10.8966 10.9737 10.9737 11.0666 11.0666 11.8265 11.8265 11.8659 11.8659 12.0934 12.0934 12.1145 12.1145 13.4641 13.4641 13.5336 13.5336 16.1280 16.1280 16.9643 16.9643 17.7030 17.7030 k = 0.1471 0.0806 1.0403 ( 2558 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9325 -14.9325 4.4447 4.4447 6.7766 6.7766 7.9064 7.9064 7.9761 7.9761 9.8686 9.8686 10.3035 10.3035 10.3514 10.3514 10.6505 10.6505 10.8973 10.8973 10.9821 10.9821 11.0641 11.0641 11.8269 11.8269 11.8649 11.8649 12.0940 12.0940 12.1137 12.1137 13.4679 13.4679 13.5309 13.5309 16.0689 16.0689 16.9648 16.9648 17.7091 17.7091 k = 0.1618 0.0887 1.0403 ( 2562 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4451 4.4451 6.7740 6.7740 7.9042 7.9042 7.9783 7.9783 9.8874 9.8874 10.2923 10.2923 10.3603 10.3603 10.6313 10.6313 10.8978 10.8978 10.9900 10.9900 11.0615 11.0615 11.8274 11.8274 11.8641 11.8641 12.0945 12.0945 12.1130 12.1130 13.4719 13.4719 13.5278 13.5278 16.0172 16.0172 16.9651 16.9651 17.7131 17.7131 k = 0.1765 0.0967 1.0403 ( 2564 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4454 4.4454 6.7717 6.7717 7.9023 7.9023 7.9802 7.9802 9.9059 9.9059 10.2791 10.2791 10.3713 10.3713 10.6128 10.6128 10.8984 10.8984 10.9973 10.9973 11.0587 11.0587 11.8278 11.8278 11.8632 11.8632 12.0951 12.0951 12.1123 12.1123 13.4761 13.4761 13.5246 13.5246 15.9729 15.9729 16.9653 16.9653 17.7156 17.7156 k = 0.1912 0.1048 1.0403 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9325 -14.9325 4.4458 4.4458 6.7697 6.7697 7.9007 7.9007 7.9818 7.9818 9.9233 9.9233 10.2659 10.2659 10.3830 10.3830 10.5954 10.5954 10.8988 10.8988 11.0038 11.0038 11.0559 11.0559 11.8282 11.8282 11.8625 11.8625 12.0958 12.0958 12.1117 12.1117 13.4803 13.4803 13.5212 13.5212 15.9364 15.9364 16.9654 16.9654 17.7174 17.7174 k = 0.2059 0.1128 1.0403 ( 2558 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9325 -14.9325 4.4460 4.4460 6.7681 6.7681 7.8995 7.8995 7.9831 7.9831 9.9386 9.9386 10.2537 10.2537 10.3943 10.3943 10.5798 10.5798 10.8992 10.8992 11.0094 11.0094 11.0532 11.0532 11.8285 11.8285 11.8619 11.8619 12.0965 12.0965 12.1111 12.1111 13.4845 13.4845 13.5177 13.5177 15.9078 15.9078 16.9655 16.9655 17.7185 17.7185 k = 0.2206 0.1209 1.0403 ( 2558 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9325 -14.9325 4.4462 4.4462 6.7669 6.7669 7.8986 7.8986 7.9840 7.9840 9.9508 9.9508 10.2437 10.2437 10.4041 10.4041 10.5670 10.5670 10.8994 10.8994 11.0138 11.0138 11.0509 11.0509 11.8288 11.8288 11.8614 11.8614 12.0971 12.0971 12.1105 12.1105 13.4886 13.4886 13.5142 13.5142 15.8873 15.8873 16.9656 16.9656 17.7193 17.7193 k = 0.2353 0.1290 1.0403 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4463 4.4463 6.7661 6.7661 7.8981 7.8981 7.9845 7.9845 9.9588 9.9588 10.2370 10.2370 10.4109 10.4109 10.5584 10.5584 10.8996 10.8996 11.0164 11.0164 11.0495 11.0495 11.8290 11.8290 11.8611 11.8611 12.0977 12.0977 12.1100 12.1100 13.4923 13.4923 13.5108 13.5108 15.8749 15.8749 16.9656 16.9656 17.7197 17.7197 k = 0.2500 0.1370 1.0403 ( 2560 PWs) bands (ev): -48.3497 -48.3497 -22.6613 -22.6613 -14.9613 -14.9613 -14.9326 -14.9326 4.4464 4.4464 6.7659 6.7659 7.8979 7.8979 7.9847 7.9847 9.9616 9.9616 10.2345 10.2345 10.4133 10.4133 10.5552 10.5552 10.8997 10.8997 11.0169 11.0169 11.0495 11.0495 11.8291 11.8291 11.8610 11.8610 12.0982 12.0982 12.1095 12.1095 13.4949 13.4949 13.5083 13.5083 15.8708 15.8708 16.9656 16.9656 17.7198 17.7198 Writing output data file HfxSiNix2.save init_run : 0.28s CPU 0.44s WALL ( 1 calls) electrons : 184.90s CPU 187.81s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 184.90s CPU 187.80s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.08s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.05s WALL ( 381 calls) cegterg : 166.91s CPU 169.35s WALL ( 452 calls) Called by sum_band: Called by *egterg: h_psi : 108.65s CPU 110.32s WALL ( 7938 calls) s_psi : 6.56s CPU 6.48s WALL ( 7938 calls) g_psi : 0.15s CPU 0.16s WALL ( 7105 calls) cdiaghg : 55.16s CPU 55.97s WALL ( 7486 calls) cegterg:over : 4.36s CPU 4.52s WALL ( 7105 calls) cegterg:upda : 3.37s CPU 3.43s WALL ( 7105 calls) cegterg:last : 1.85s CPU 1.90s WALL ( 1356 calls) cdiaghg:chol : 3.07s CPU 3.12s WALL ( 7486 calls) cdiaghg:inve : 2.15s CPU 2.12s WALL ( 7486 calls) cdiaghg:para : 3.43s CPU 3.40s WALL ( 14972 calls) Called by h_psi: h_psi:vloc : 95.50s CPU 96.97s WALL ( 7938 calls) h_psi:vnl : 13.03s CPU 13.19s WALL ( 7938 calls) add_vuspsi : 7.22s CPU 7.39s WALL ( 7938 calls) General routines calbec : 5.78s CPU 5.77s WALL ( 7938 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 90.37s CPU 91.70s WALL ( 865284 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.16s WALL ( 762 calls) Parallel routines fft_scatter : 28.98s CPU 29.47s WALL ( 865307 calls) PWSCF : 3m20.06s CPU 3m42.83s WALL This run was terminated on: 19:35:11 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=