Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:12: 8 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: ./YS2.save/ file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 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 33 9 1550 751 117 Max 54 34 10 1554 770 121 Sum 1921 1189 349 55849 27317 4279 bravais-lattice index = 14 lattice parameter (alat) = 10.4186 a.u. unit-cell volume = 799.6853 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 46.00 number of Kohn-Sham states= 56 kinetic-energy cutoff = 40.0000 Ry charge density cutoff = 258.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.418648 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 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 Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 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 S 6.00 32.06500 S( 1.00) Y 11.00 88.90590 Y( 1.00) 12 Sym. Ops., with inversion, found (10 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( 0.0000000 ) ( 1 -1 0 ) ( 0.5000000 ) ( 1 0 -1 ) ( 0.5000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.5773503 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( -1 0 1 ) ( 0.0000000 ) cart. s( 3) = ( -0.5000000 -0.8660254 -0.0000000 ) f =( 0.5000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 -1 0 ) ( 0.5000000 ) ( 0 -1 1 ) ( 0.0000000 ) cart. s( 4) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.2500000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.4330127 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) f =( 0.5000000 ) ( -1 0 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 1.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.5773503 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 1 -1 ) ( 0.5000000 ) cart. s( 6) = ( -0.5000000 0.8660254 0.0000000 ) f =( 0.7500000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.1443376 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) f =( 1.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.5773503 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( -1 1 0 ) ( 0.0000000 ) ( -1 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.5000000 ) ( 1 0 -1 ) ( 0.5000000 ) cart. s( 9) = ( 0.5000000 0.8660254 0.0000000 ) f =( 0.5000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.5773503 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) f =( 0.5000000 ) ( -1 1 0 ) ( 0.0000000 ) ( 0 1 -1 ) ( 0.5000000 ) cart. s(10) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.7500000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.1443376 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.4082483 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 -1 1 ) ( 0.0000000 ) cart. s(12) = ( 0.5000000 -0.8660254 -0.0000000 ) f =( 0.2500000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.4330127 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 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 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 274 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036496 k( 2) = ( 0.0121951 -0.0070409 0.0099573), wk = 0.0036496 k( 3) = ( 0.0243902 -0.0140817 0.0199145), wk = 0.0036496 k( 4) = ( 0.0365854 -0.0211226 0.0298718), wk = 0.0036496 k( 5) = ( 0.0487805 -0.0281634 0.0398291), wk = 0.0036496 k( 6) = ( 0.0609756 -0.0352043 0.0497864), wk = 0.0036496 k( 7) = ( 0.0731707 -0.0422451 0.0597437), wk = 0.0036496 k( 8) = ( 0.0853658 -0.0492860 0.0697009), wk = 0.0036496 k( 9) = ( 0.0975610 -0.0563269 0.0796582), wk = 0.0036496 k( 10) = ( 0.1097561 -0.0633677 0.0896155), wk = 0.0036496 k( 11) = ( 0.1219512 -0.0704086 0.0995728), wk = 0.0036496 k( 12) = ( 0.1341463 -0.0774494 0.1095300), wk = 0.0036496 k( 13) = ( 0.1463415 -0.0844903 0.1194873), wk = 0.0036496 k( 14) = ( 0.1585366 -0.0915311 0.1294446), wk = 0.0036496 k( 15) = ( 0.1707317 -0.0985720 0.1394019), wk = 0.0036496 k( 16) = ( 0.1829268 -0.1056129 0.1493591), wk = 0.0036496 k( 17) = ( 0.1951219 -0.1126537 0.1593164), wk = 0.0036496 k( 18) = ( 0.2073171 -0.1196946 0.1692737), wk = 0.0036496 k( 19) = ( 0.2195122 -0.1267354 0.1792310), wk = 0.0036496 k( 20) = ( 0.2317073 -0.1337763 0.1891882), wk = 0.0036496 k( 21) = ( 0.2439024 -0.1408171 0.1991455), wk = 0.0036496 k( 22) = ( 0.2560976 -0.1478580 0.2091028), wk = 0.0036496 k( 23) = ( 0.2682927 -0.1548989 0.2190601), wk = 0.0036496 k( 24) = ( 0.2804878 -0.1619397 0.2290173), wk = 0.0036496 k( 25) = ( 0.2926829 -0.1689806 0.2389746), wk = 0.0036496 k( 26) = ( 0.3048781 -0.1760214 0.2489319), wk = 0.0036496 k( 27) = ( 0.3170732 -0.1830623 0.2588892), wk = 0.0036496 k( 28) = ( 0.3292683 -0.1901031 0.2688464), wk = 0.0036496 k( 29) = ( 0.3414634 -0.1971440 0.2788037), wk = 0.0036496 k( 30) = ( 0.3536585 -0.2041849 0.2887610), wk = 0.0036496 k( 31) = ( 0.3658537 -0.2112257 0.2987183), wk = 0.0036496 k( 32) = ( 0.3780488 -0.2182666 0.3086755), wk = 0.0036496 k( 33) = ( 0.3902439 -0.2253074 0.3186328), wk = 0.0036496 k( 34) = ( 0.4024390 -0.2323483 0.3285901), wk = 0.0036496 k( 35) = ( 0.4146341 -0.2393891 0.3385474), wk = 0.0036496 k( 36) = ( 0.4268293 -0.2464300 0.3485046), wk = 0.0036496 k( 37) = ( 0.4390244 -0.2534708 0.3584619), wk = 0.0036496 k( 38) = ( 0.4512195 -0.2605117 0.3684192), wk = 0.0036496 k( 39) = ( 0.4634146 -0.2675526 0.3783765), wk = 0.0036496 k( 40) = ( 0.4756098 -0.2745934 0.3883337), wk = 0.0036496 k( 41) = ( 0.4878049 -0.2816343 0.3982910), wk = 0.0036496 k( 42) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0036496 k( 43) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0036496 k( 44) = ( 0.5000000 -0.2749287 0.4179685), wk = 0.0036496 k( 45) = ( 0.5000000 -0.2611823 0.4276887), wk = 0.0036496 k( 46) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0036496 k( 47) = ( 0.5000000 -0.2336894 0.4471291), wk = 0.0036496 k( 48) = ( 0.5000000 -0.2199430 0.4568493), wk = 0.0036496 k( 49) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0036496 k( 50) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0036496 k( 51) = ( 0.5000000 -0.1787036 0.4860099), wk = 0.0036496 k( 52) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0036496 k( 53) = ( 0.5000000 -0.1512108 0.5054503), wk = 0.0036496 k( 54) = ( 0.5000000 -0.1374644 0.5151705), wk = 0.0036496 k( 55) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0036496 k( 56) = ( 0.5000000 -0.1099715 0.5346109), wk = 0.0036496 k( 57) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0036496 k( 58) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0036496 k( 59) = ( 0.5000000 -0.0687322 0.5637714), wk = 0.0036496 k( 60) = ( 0.5000000 -0.0549857 0.5734916), wk = 0.0036496 k( 61) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0036496 k( 62) = ( 0.5000000 -0.0274929 0.5929320), wk = 0.0036496 k( 63) = ( 0.5000000 -0.0137464 0.6026522), wk = 0.0036496 k( 64) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0036496 k( 65) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0036496 k( 66) = ( 0.4916667 0.0144338 0.6123724), wk = 0.0036496 k( 67) = ( 0.4833333 0.0288675 0.6123724), wk = 0.0036496 k( 68) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0036496 k( 69) = ( 0.4666667 0.0577350 0.6123724), wk = 0.0036496 k( 70) = ( 0.4583333 0.0721688 0.6123724), wk = 0.0036496 k( 71) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0036496 k( 72) = ( 0.4416667 0.1010363 0.6123724), wk = 0.0036496 k( 73) = ( 0.4333333 0.1154701 0.6123724), wk = 0.0036496 k( 74) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0036496 k( 75) = ( 0.4166667 0.1443376 0.6123724), wk = 0.0036496 k( 76) = ( 0.4083333 0.1587713 0.6123724), wk = 0.0036496 k( 77) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0036496 k( 78) = ( 0.3916667 0.1876388 0.6123724), wk = 0.0036496 k( 79) = ( 0.3833333 0.2020726 0.6123724), wk = 0.0036496 k( 80) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0036496 k( 81) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0036496 k( 82) = ( 0.3662791 0.2114713 0.5981312), wk = 0.0036496 k( 83) = ( 0.3575581 0.2064363 0.5838900), wk = 0.0036496 k( 84) = ( 0.3488372 0.2014013 0.5696488), wk = 0.0036496 k( 85) = ( 0.3401163 0.1963662 0.5554076), wk = 0.0036496 k( 86) = ( 0.3313953 0.1913312 0.5411663), wk = 0.0036496 k( 87) = ( 0.3226744 0.1862962 0.5269251), wk = 0.0036496 k( 88) = ( 0.3139535 0.1812611 0.5126839), wk = 0.0036496 k( 89) = ( 0.3052326 0.1762261 0.4984427), wk = 0.0036496 k( 90) = ( 0.2965116 0.1711911 0.4842015), wk = 0.0036496 k( 91) = ( 0.2877907 0.1661560 0.4699602), wk = 0.0036496 k( 92) = ( 0.2790698 0.1611210 0.4557190), wk = 0.0036496 k( 93) = ( 0.2703488 0.1560860 0.4414778), wk = 0.0036496 k( 94) = ( 0.2616279 0.1510509 0.4272366), wk = 0.0036496 k( 95) = ( 0.2529070 0.1460159 0.4129954), wk = 0.0036496 k( 96) = ( 0.2441860 0.1409809 0.3987541), wk = 0.0036496 k( 97) = ( 0.2354651 0.1359459 0.3845129), wk = 0.0036496 k( 98) = ( 0.2267442 0.1309108 0.3702717), wk = 0.0036496 k( 99) = ( 0.2180233 0.1258758 0.3560305), wk = 0.0036496 k( 100) = ( 0.2093023 0.1208408 0.3417893), wk = 0.0036496 k( 101) = ( 0.2005814 0.1158057 0.3275480), wk = 0.0036496 k( 102) = ( 0.1918605 0.1107707 0.3133068), wk = 0.0036496 k( 103) = ( 0.1831395 0.1057357 0.2990656), wk = 0.0036496 k( 104) = ( 0.1744186 0.1007006 0.2848244), wk = 0.0036496 k( 105) = ( 0.1656977 0.0956656 0.2705832), wk = 0.0036496 k( 106) = ( 0.1569767 0.0906306 0.2563420), wk = 0.0036496 k( 107) = ( 0.1482558 0.0855955 0.2421007), wk = 0.0036496 k( 108) = ( 0.1395349 0.0805605 0.2278595), wk = 0.0036496 k( 109) = ( 0.1308140 0.0755255 0.2136183), wk = 0.0036496 k( 110) = ( 0.1220930 0.0704904 0.1993771), wk = 0.0036496 k( 111) = ( 0.1133721 0.0654554 0.1851359), wk = 0.0036496 k( 112) = ( 0.1046512 0.0604204 0.1708946), wk = 0.0036496 k( 113) = ( 0.0959302 0.0553853 0.1566534), wk = 0.0036496 k( 114) = ( 0.0872093 0.0503503 0.1424122), wk = 0.0036496 k( 115) = ( 0.0784884 0.0453153 0.1281710), wk = 0.0036496 k( 116) = ( 0.0697674 0.0402803 0.1139298), wk = 0.0036496 k( 117) = ( 0.0610465 0.0352452 0.0996885), wk = 0.0036496 k( 118) = ( 0.0523256 0.0302102 0.0854473), wk = 0.0036496 k( 119) = ( 0.0436047 0.0251752 0.0712061), wk = 0.0036496 k( 120) = ( 0.0348837 0.0201401 0.0569649), wk = 0.0036496 k( 121) = ( 0.0261628 0.0151051 0.0427237), wk = 0.0036496 k( 122) = ( 0.0174419 0.0100701 0.0284824), wk = 0.0036496 k( 123) = ( 0.0087209 0.0050350 0.0142412), wk = 0.0036496 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036496 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036496 k( 126) = ( 0.0142857 0.0082479 0.0058321), wk = 0.0036496 k( 127) = ( 0.0285714 0.0164957 0.0116642), wk = 0.0036496 k( 128) = ( 0.0428571 0.0247436 0.0174964), wk = 0.0036496 k( 129) = ( 0.0571429 0.0329914 0.0233285), wk = 0.0036496 k( 130) = ( 0.0714286 0.0412393 0.0291606), wk = 0.0036496 k( 131) = ( 0.0857143 0.0494872 0.0349927), wk = 0.0036496 k( 132) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0036496 k( 133) = ( 0.1142857 0.0659829 0.0466569), wk = 0.0036496 k( 134) = ( 0.1285714 0.0742307 0.0524891), wk = 0.0036496 k( 135) = ( 0.1428571 0.0824786 0.0583212), wk = 0.0036496 k( 136) = ( 0.1571429 0.0907265 0.0641533), wk = 0.0036496 k( 137) = ( 0.1714286 0.0989743 0.0699854), wk = 0.0036496 k( 138) = ( 0.1857143 0.1072222 0.0758175), wk = 0.0036496 k( 139) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0036496 k( 140) = ( 0.2142857 0.1237179 0.0874818), wk = 0.0036496 k( 141) = ( 0.2285714 0.1319658 0.0933139), wk = 0.0036496 k( 142) = ( 0.2428571 0.1402136 0.0991460), wk = 0.0036496 k( 143) = ( 0.2571429 0.1484615 0.1049781), wk = 0.0036496 k( 144) = ( 0.2714286 0.1567094 0.1108102), wk = 0.0036496 k( 145) = ( 0.2857143 0.1649572 0.1166424), wk = 0.0036496 k( 146) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0036496 k( 147) = ( 0.3142857 0.1814529 0.1283066), wk = 0.0036496 k( 148) = ( 0.3285714 0.1897008 0.1341387), wk = 0.0036496 k( 149) = ( 0.3428571 0.1979487 0.1399708), wk = 0.0036496 k( 150) = ( 0.3571429 0.2061965 0.1458030), wk = 0.0036496 k( 151) = ( 0.3714286 0.2144444 0.1516351), wk = 0.0036496 k( 152) = ( 0.3857143 0.2226922 0.1574672), wk = 0.0036496 k( 153) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0036496 k( 154) = ( 0.4142857 0.2391880 0.1691314), wk = 0.0036496 k( 155) = ( 0.4285714 0.2474358 0.1749636), wk = 0.0036496 k( 156) = ( 0.4428571 0.2556837 0.1807957), wk = 0.0036496 k( 157) = ( 0.4571429 0.2639316 0.1866278), wk = 0.0036496 k( 158) = ( 0.4714286 0.2721794 0.1924599), wk = 0.0036496 k( 159) = ( 0.4857143 0.2804273 0.1982920), wk = 0.0036496 k( 160) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0036496 k( 161) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0036496 k( 162) = ( 0.5050000 0.2742414 0.2122891), wk = 0.0036496 k( 163) = ( 0.5100000 0.2598076 0.2204541), wk = 0.0036496 k( 164) = ( 0.5150000 0.2453739 0.2286190), wk = 0.0036496 k( 165) = ( 0.5200000 0.2309401 0.2367840), wk = 0.0036496 k( 166) = ( 0.5250000 0.2165064 0.2449490), wk = 0.0036496 k( 167) = ( 0.5300000 0.2020726 0.2531139), wk = 0.0036496 k( 168) = ( 0.5350000 0.1876388 0.2612789), wk = 0.0036496 k( 169) = ( 0.5400000 0.1732051 0.2694439), wk = 0.0036496 k( 170) = ( 0.5450000 0.1587713 0.2776088), wk = 0.0036496 k( 171) = ( 0.5500000 0.1443376 0.2857738), wk = 0.0036496 k( 172) = ( 0.5550000 0.1299038 0.2939388), wk = 0.0036496 k( 173) = ( 0.5600000 0.1154701 0.3021037), wk = 0.0036496 k( 174) = ( 0.5650000 0.1010363 0.3102687), wk = 0.0036496 k( 175) = ( 0.5700000 0.0866025 0.3184337), wk = 0.0036496 k( 176) = ( 0.5750000 0.0721688 0.3265986), wk = 0.0036496 k( 177) = ( 0.5800000 0.0577350 0.3347636), wk = 0.0036496 k( 178) = ( 0.5850000 0.0433013 0.3429286), wk = 0.0036496 k( 179) = ( 0.5900000 0.0288675 0.3510935), wk = 0.0036496 k( 180) = ( 0.5950000 0.0144338 0.3592585), wk = 0.0036496 k( 181) = ( 0.6000000 -0.0000000 0.3674235), wk = 0.0036496 k( 182) = ( 0.6050000 -0.0144338 0.3755884), wk = 0.0036496 k( 183) = ( 0.6100000 -0.0288675 0.3837534), wk = 0.0036496 k( 184) = ( 0.6150000 -0.0433013 0.3919184), wk = 0.0036496 k( 185) = ( 0.6200000 -0.0577350 0.4000833), wk = 0.0036496 k( 186) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0036496 k( 187) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0036496 k( 188) = ( 0.6166667 -0.0673575 0.4218566), wk = 0.0036496 k( 189) = ( 0.6083333 -0.0625463 0.4354648), wk = 0.0036496 k( 190) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0036496 k( 191) = ( 0.5916667 -0.0529238 0.4626814), wk = 0.0036496 k( 192) = ( 0.5833333 -0.0481125 0.4762897), wk = 0.0036496 k( 193) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0036496 k( 194) = ( 0.5666667 -0.0384900 0.5035062), wk = 0.0036496 k( 195) = ( 0.5583333 -0.0336788 0.5171145), wk = 0.0036496 k( 196) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0036496 k( 197) = ( 0.5416667 -0.0240563 0.5443310), wk = 0.0036496 k( 198) = ( 0.5333333 -0.0192450 0.5579393), wk = 0.0036496 k( 199) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0036496 k( 200) = ( 0.5166667 -0.0096225 0.5851559), wk = 0.0036496 k( 201) = ( 0.5083333 -0.0048113 0.5987642), wk = 0.0036496 k( 202) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0036496 k( 203) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0036496 k( 204) = ( 0.5000000 0.0099543 0.5982949), wk = 0.0036496 k( 205) = ( 0.5000000 0.0199086 0.5842174), wk = 0.0036496 k( 206) = ( 0.5000000 0.0298629 0.5701399), wk = 0.0036496 k( 207) = ( 0.5000000 0.0398173 0.5560623), wk = 0.0036496 k( 208) = ( 0.5000000 0.0497716 0.5419848), wk = 0.0036496 k( 209) = ( 0.5000000 0.0597259 0.5279073), wk = 0.0036496 k( 210) = ( 0.5000000 0.0696802 0.5138297), wk = 0.0036496 k( 211) = ( 0.5000000 0.0796345 0.4997522), wk = 0.0036496 k( 212) = ( 0.5000000 0.0895888 0.4856747), wk = 0.0036496 k( 213) = ( 0.5000000 0.0995432 0.4715972), wk = 0.0036496 k( 214) = ( 0.5000000 0.1094975 0.4575196), wk = 0.0036496 k( 215) = ( 0.5000000 0.1194518 0.4434421), wk = 0.0036496 k( 216) = ( 0.5000000 0.1294061 0.4293646), wk = 0.0036496 k( 217) = ( 0.5000000 0.1393604 0.4152870), wk = 0.0036496 k( 218) = ( 0.5000000 0.1493147 0.4012095), wk = 0.0036496 k( 219) = ( 0.5000000 0.1592690 0.3871320), wk = 0.0036496 k( 220) = ( 0.5000000 0.1692233 0.3730545), wk = 0.0036496 k( 221) = ( 0.5000000 0.1791777 0.3589770), wk = 0.0036496 k( 222) = ( 0.5000000 0.1891320 0.3448994), wk = 0.0036496 k( 223) = ( 0.5000000 0.1990863 0.3308219), wk = 0.0036496 k( 224) = ( 0.5000000 0.2090406 0.3167444), wk = 0.0036496 k( 225) = ( 0.5000000 0.2189949 0.3026668), wk = 0.0036496 k( 226) = ( 0.5000000 0.2289492 0.2885893), wk = 0.0036496 k( 227) = ( 0.5000000 0.2389036 0.2745118), wk = 0.0036496 k( 228) = ( 0.5000000 0.2488579 0.2604343), wk = 0.0036496 k( 229) = ( 0.5000000 0.2588122 0.2463567), wk = 0.0036496 k( 230) = ( 0.5000000 0.2687665 0.2322792), wk = 0.0036496 k( 231) = ( 0.5000000 0.2787208 0.2182017), wk = 0.0036496 k( 232) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0036496 k( 233) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0036496 k( 234) = ( 0.4950000 0.2857884 0.2204541), wk = 0.0036496 k( 235) = ( 0.4900000 0.2829016 0.2367840), wk = 0.0036496 k( 236) = ( 0.4850000 0.2800149 0.2531139), wk = 0.0036496 k( 237) = ( 0.4800000 0.2771281 0.2694439), wk = 0.0036496 k( 238) = ( 0.4750000 0.2742414 0.2857738), wk = 0.0036496 k( 239) = ( 0.4700000 0.2713546 0.3021037), wk = 0.0036496 k( 240) = ( 0.4650000 0.2684679 0.3184337), wk = 0.0036496 k( 241) = ( 0.4600000 0.2655811 0.3347636), wk = 0.0036496 k( 242) = ( 0.4550000 0.2626944 0.3510935), wk = 0.0036496 k( 243) = ( 0.4500000 0.2598076 0.3674235), wk = 0.0036496 k( 244) = ( 0.4450000 0.2569209 0.3837534), wk = 0.0036496 k( 245) = ( 0.4400000 0.2540341 0.4000833), wk = 0.0036496 k( 246) = ( 0.4350000 0.2511474 0.4164133), wk = 0.0036496 k( 247) = ( 0.4300000 0.2482606 0.4327432), wk = 0.0036496 k( 248) = ( 0.4250000 0.2453739 0.4490731), wk = 0.0036496 k( 249) = ( 0.4200000 0.2424871 0.4654031), wk = 0.0036496 k( 250) = ( 0.4150000 0.2396004 0.4817330), wk = 0.0036496 k( 251) = ( 0.4100000 0.2367136 0.4980629), wk = 0.0036496 k( 252) = ( 0.4050000 0.2338269 0.5143928), wk = 0.0036496 k( 253) = ( 0.4000000 0.2309401 0.5307228), wk = 0.0036496 k( 254) = ( 0.3950000 0.2280534 0.5470527), wk = 0.0036496 k( 255) = ( 0.3900000 0.2251666 0.5633826), wk = 0.0036496 k( 256) = ( 0.3850000 0.2222799 0.5797126), wk = 0.0036496 k( 257) = ( 0.3800000 0.2193931 0.5960425), wk = 0.0036496 k( 258) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0036496 k( 259) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0036496 k( 260) = ( 0.6166667 -0.0866025 0.4082483), wk = 0.0036496 k( 261) = ( 0.6083333 -0.1010363 0.4082483), wk = 0.0036496 k( 262) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0036496 k( 263) = ( 0.5916667 -0.1299038 0.4082483), wk = 0.0036496 k( 264) = ( 0.5833333 -0.1443376 0.4082483), wk = 0.0036496 k( 265) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0036496 k( 266) = ( 0.5666667 -0.1732051 0.4082483), wk = 0.0036496 k( 267) = ( 0.5583333 -0.1876388 0.4082483), wk = 0.0036496 k( 268) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0036496 k( 269) = ( 0.5416667 -0.2165064 0.4082483), wk = 0.0036496 k( 270) = ( 0.5333333 -0.2309401 0.4082483), wk = 0.0036496 k( 271) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0036496 k( 272) = ( 0.5166667 -0.2598076 0.4082483), wk = 0.0036496 k( 273) = ( 0.5083333 -0.2742414 0.4082483), wk = 0.0036496 k( 274) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0036496 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036496 k( 2) = ( 0.0121951 0.0000000 0.0121951), wk = 0.0036496 k( 3) = ( 0.0243902 0.0000000 0.0243902), wk = 0.0036496 k( 4) = ( 0.0365854 -0.0000000 0.0365854), wk = 0.0036496 k( 5) = ( 0.0487805 -0.0000000 0.0487805), wk = 0.0036496 k( 6) = ( 0.0609756 -0.0000000 0.0609756), wk = 0.0036496 k( 7) = ( 0.0731707 0.0000000 0.0731707), wk = 0.0036496 k( 8) = ( 0.0853658 0.0000000 0.0853659), wk = 0.0036496 k( 9) = ( 0.0975610 -0.0000000 0.0975610), wk = 0.0036496 k( 10) = ( 0.1097561 0.0000000 0.1097561), wk = 0.0036496 k( 11) = ( 0.1219512 -0.0000000 0.1219512), wk = 0.0036496 k( 12) = ( 0.1341463 0.0000000 0.1341463), wk = 0.0036496 k( 13) = ( 0.1463415 0.0000000 0.1463415), wk = 0.0036496 k( 14) = ( 0.1585366 -0.0000000 0.1585366), wk = 0.0036496 k( 15) = ( 0.1707317 0.0000000 0.1707317), wk = 0.0036496 k( 16) = ( 0.1829268 0.0000000 0.1829268), wk = 0.0036496 k( 17) = ( 0.1951219 -0.0000000 0.1951220), wk = 0.0036496 k( 18) = ( 0.2073171 -0.0000000 0.2073171), wk = 0.0036496 k( 19) = ( 0.2195122 0.0000000 0.2195122), wk = 0.0036496 k( 20) = ( 0.2317073 0.0000000 0.2317073), wk = 0.0036496 k( 21) = ( 0.2439024 -0.0000000 0.2439024), wk = 0.0036496 k( 22) = ( 0.2560976 0.0000000 0.2560976), wk = 0.0036496 k( 23) = ( 0.2682927 0.0000000 0.2682927), wk = 0.0036496 k( 24) = ( 0.2804878 0.0000000 0.2804878), wk = 0.0036496 k( 25) = ( 0.2926829 -0.0000000 0.2926829), wk = 0.0036496 k( 26) = ( 0.3048781 -0.0000000 0.3048781), wk = 0.0036496 k( 27) = ( 0.3170732 -0.0000000 0.3170732), wk = 0.0036496 k( 28) = ( 0.3292683 -0.0000000 0.3292683), wk = 0.0036496 k( 29) = ( 0.3414634 0.0000000 0.3414634), wk = 0.0036496 k( 30) = ( 0.3536585 0.0000000 0.3536585), wk = 0.0036496 k( 31) = ( 0.3658537 0.0000000 0.3658537), wk = 0.0036496 k( 32) = ( 0.3780488 -0.0000000 0.3780488), wk = 0.0036496 k( 33) = ( 0.3902439 -0.0000000 0.3902439), wk = 0.0036496 k( 34) = ( 0.4024390 -0.0000000 0.4024390), wk = 0.0036496 k( 35) = ( 0.4146341 -0.0000000 0.4146341), wk = 0.0036496 k( 36) = ( 0.4268293 0.0000000 0.4268293), wk = 0.0036496 k( 37) = ( 0.4390244 -0.0000000 0.4390244), wk = 0.0036496 k( 38) = ( 0.4512195 -0.0000000 0.4512195), wk = 0.0036496 k( 39) = ( 0.4634146 -0.0000000 0.4634146), wk = 0.0036496 k( 40) = ( 0.4756098 -0.0000000 0.4756098), wk = 0.0036496 k( 41) = ( 0.4878049 -0.0000000 0.4878049), wk = 0.0036496 k( 42) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036496 k( 43) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036496 k( 44) = ( 0.5000000 0.0119048 0.5119048), wk = 0.0036496 k( 45) = ( 0.5000000 0.0238095 0.5238095), wk = 0.0036496 k( 46) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0036496 k( 47) = ( 0.5000000 0.0476191 0.5476190), wk = 0.0036496 k( 48) = ( 0.5000000 0.0595238 0.5595238), wk = 0.0036496 k( 49) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0036496 k( 50) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0036496 k( 51) = ( 0.5000000 0.0952381 0.5952381), wk = 0.0036496 k( 52) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0036496 k( 53) = ( 0.5000000 0.1190476 0.6190476), wk = 0.0036496 k( 54) = ( 0.5000000 0.1309524 0.6309524), wk = 0.0036496 k( 55) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0036496 k( 56) = ( 0.5000000 0.1547619 0.6547619), wk = 0.0036496 k( 57) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0036496 k( 58) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0036496 k( 59) = ( 0.5000000 0.1904762 0.6904762), wk = 0.0036496 k( 60) = ( 0.5000000 0.2023810 0.7023810), wk = 0.0036496 k( 61) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0036496 k( 62) = ( 0.5000000 0.2261905 0.7261905), wk = 0.0036496 k( 63) = ( 0.5000000 0.2380952 0.7380952), wk = 0.0036496 k( 64) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0036496 k( 65) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0036496 k( 66) = ( 0.4916667 0.2583333 0.7500000), wk = 0.0036496 k( 67) = ( 0.4833333 0.2666667 0.7500000), wk = 0.0036496 k( 68) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0036496 k( 69) = ( 0.4666667 0.2833333 0.7500000), wk = 0.0036496 k( 70) = ( 0.4583333 0.2916667 0.7500000), wk = 0.0036496 k( 71) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0036496 k( 72) = ( 0.4416667 0.3083333 0.7500000), wk = 0.0036496 k( 73) = ( 0.4333333 0.3166667 0.7500000), wk = 0.0036496 k( 74) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0036496 k( 75) = ( 0.4166667 0.3333333 0.7500000), wk = 0.0036496 k( 76) = ( 0.4083333 0.3416667 0.7500000), wk = 0.0036496 k( 77) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0036496 k( 78) = ( 0.3916667 0.3583333 0.7500000), wk = 0.0036496 k( 79) = ( 0.3833333 0.3666667 0.7500000), wk = 0.0036496 k( 80) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0036496 k( 81) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0036496 k( 82) = ( 0.3662791 0.3662791 0.7325581), wk = 0.0036496 k( 83) = ( 0.3575581 0.3575581 0.7151163), wk = 0.0036496 k( 84) = ( 0.3488372 0.3488372 0.6976744), wk = 0.0036496 k( 85) = ( 0.3401163 0.3401163 0.6802326), wk = 0.0036496 k( 86) = ( 0.3313953 0.3313953 0.6627907), wk = 0.0036496 k( 87) = ( 0.3226744 0.3226744 0.6453488), wk = 0.0036496 k( 88) = ( 0.3139535 0.3139535 0.6279070), wk = 0.0036496 k( 89) = ( 0.3052326 0.3052326 0.6104651), wk = 0.0036496 k( 90) = ( 0.2965116 0.2965116 0.5930233), wk = 0.0036496 k( 91) = ( 0.2877907 0.2877907 0.5755814), wk = 0.0036496 k( 92) = ( 0.2790698 0.2790698 0.5581395), wk = 0.0036496 k( 93) = ( 0.2703488 0.2703488 0.5406977), wk = 0.0036496 k( 94) = ( 0.2616279 0.2616279 0.5232558), wk = 0.0036496 k( 95) = ( 0.2529070 0.2529070 0.5058140), wk = 0.0036496 k( 96) = ( 0.2441860 0.2441861 0.4883721), wk = 0.0036496 k( 97) = ( 0.2354651 0.2354651 0.4709302), wk = 0.0036496 k( 98) = ( 0.2267442 0.2267442 0.4534884), wk = 0.0036496 k( 99) = ( 0.2180233 0.2180233 0.4360465), wk = 0.0036496 k( 100) = ( 0.2093023 0.2093023 0.4186047), wk = 0.0036496 k( 101) = ( 0.2005814 0.2005814 0.4011628), wk = 0.0036496 k( 102) = ( 0.1918605 0.1918605 0.3837209), wk = 0.0036496 k( 103) = ( 0.1831395 0.1831395 0.3662791), wk = 0.0036496 k( 104) = ( 0.1744186 0.1744186 0.3488372), wk = 0.0036496 k( 105) = ( 0.1656977 0.1656977 0.3313954), wk = 0.0036496 k( 106) = ( 0.1569767 0.1569767 0.3139535), wk = 0.0036496 k( 107) = ( 0.1482558 0.1482558 0.2965116), wk = 0.0036496 k( 108) = ( 0.1395349 0.1395349 0.2790698), wk = 0.0036496 k( 109) = ( 0.1308140 0.1308140 0.2616279), wk = 0.0036496 k( 110) = ( 0.1220930 0.1220930 0.2441861), wk = 0.0036496 k( 111) = ( 0.1133721 0.1133721 0.2267442), wk = 0.0036496 k( 112) = ( 0.1046512 0.1046512 0.2093023), wk = 0.0036496 k( 113) = ( 0.0959302 0.0959302 0.1918605), wk = 0.0036496 k( 114) = ( 0.0872093 0.0872093 0.1744186), wk = 0.0036496 k( 115) = ( 0.0784884 0.0784884 0.1569767), wk = 0.0036496 k( 116) = ( 0.0697674 0.0697674 0.1395349), wk = 0.0036496 k( 117) = ( 0.0610465 0.0610465 0.1220930), wk = 0.0036496 k( 118) = ( 0.0523256 0.0523256 0.1046512), wk = 0.0036496 k( 119) = ( 0.0436047 0.0436047 0.0872093), wk = 0.0036496 k( 120) = ( 0.0348837 0.0348837 0.0697674), wk = 0.0036496 k( 121) = ( 0.0261628 0.0261628 0.0523256), wk = 0.0036496 k( 122) = ( 0.0174419 0.0174419 0.0348837), wk = 0.0036496 k( 123) = ( 0.0087209 0.0087209 0.0174419), wk = 0.0036496 k( 124) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036496 k( 125) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036496 k( 126) = ( 0.0142857 0.0142857 0.0142857), wk = 0.0036496 k( 127) = ( 0.0285714 0.0285714 0.0285714), wk = 0.0036496 k( 128) = ( 0.0428571 0.0428571 0.0428571), wk = 0.0036496 k( 129) = ( 0.0571429 0.0571429 0.0571429), wk = 0.0036496 k( 130) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0036496 k( 131) = ( 0.0857143 0.0857143 0.0857143), wk = 0.0036496 k( 132) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0036496 k( 133) = ( 0.1142857 0.1142857 0.1142857), wk = 0.0036496 k( 134) = ( 0.1285714 0.1285714 0.1285714), wk = 0.0036496 k( 135) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0036496 k( 136) = ( 0.1571429 0.1571429 0.1571429), wk = 0.0036496 k( 137) = ( 0.1714286 0.1714286 0.1714286), wk = 0.0036496 k( 138) = ( 0.1857143 0.1857143 0.1857143), wk = 0.0036496 k( 139) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0036496 k( 140) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0036496 k( 141) = ( 0.2285714 0.2285714 0.2285714), wk = 0.0036496 k( 142) = ( 0.2428571 0.2428571 0.2428571), wk = 0.0036496 k( 143) = ( 0.2571429 0.2571429 0.2571429), wk = 0.0036496 k( 144) = ( 0.2714286 0.2714286 0.2714286), wk = 0.0036496 k( 145) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0036496 k( 146) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0036496 k( 147) = ( 0.3142857 0.3142857 0.3142857), wk = 0.0036496 k( 148) = ( 0.3285714 0.3285714 0.3285714), wk = 0.0036496 k( 149) = ( 0.3428571 0.3428571 0.3428571), wk = 0.0036496 k( 150) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0036496 k( 151) = ( 0.3714286 0.3714286 0.3714286), wk = 0.0036496 k( 152) = ( 0.3857143 0.3857143 0.3857143), wk = 0.0036496 k( 153) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0036496 k( 154) = ( 0.4142857 0.4142857 0.4142857), wk = 0.0036496 k( 155) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0036496 k( 156) = ( 0.4428571 0.4428571 0.4428571), wk = 0.0036496 k( 157) = ( 0.4571429 0.4571429 0.4571429), wk = 0.0036496 k( 158) = ( 0.4714286 0.4714286 0.4714286), wk = 0.0036496 k( 159) = ( 0.4857143 0.4857143 0.4857143), wk = 0.0036496 k( 160) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036496 k( 161) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036496 k( 162) = ( 0.5050000 0.4900000 0.5050000), wk = 0.0036496 k( 163) = ( 0.5100000 0.4800000 0.5100000), wk = 0.0036496 k( 164) = ( 0.5150000 0.4700000 0.5150000), wk = 0.0036496 k( 165) = ( 0.5200000 0.4600000 0.5200000), wk = 0.0036496 k( 166) = ( 0.5250000 0.4500000 0.5250000), wk = 0.0036496 k( 167) = ( 0.5300000 0.4400000 0.5300000), wk = 0.0036496 k( 168) = ( 0.5350000 0.4300000 0.5350000), wk = 0.0036496 k( 169) = ( 0.5400000 0.4200000 0.5400000), wk = 0.0036496 k( 170) = ( 0.5450000 0.4100000 0.5450000), wk = 0.0036496 k( 171) = ( 0.5500000 0.4000000 0.5500000), wk = 0.0036496 k( 172) = ( 0.5550000 0.3900000 0.5550000), wk = 0.0036496 k( 173) = ( 0.5600000 0.3800000 0.5600000), wk = 0.0036496 k( 174) = ( 0.5650000 0.3700000 0.5650000), wk = 0.0036496 k( 175) = ( 0.5700000 0.3600000 0.5700000), wk = 0.0036496 k( 176) = ( 0.5750000 0.3500000 0.5750000), wk = 0.0036496 k( 177) = ( 0.5800000 0.3400000 0.5800000), wk = 0.0036496 k( 178) = ( 0.5850000 0.3300000 0.5850000), wk = 0.0036496 k( 179) = ( 0.5900000 0.3200000 0.5900000), wk = 0.0036496 k( 180) = ( 0.5950000 0.3100000 0.5950000), wk = 0.0036496 k( 181) = ( 0.6000000 0.3000000 0.6000000), wk = 0.0036496 k( 182) = ( 0.6050000 0.2900000 0.6050000), wk = 0.0036496 k( 183) = ( 0.6100000 0.2800000 0.6100000), wk = 0.0036496 k( 184) = ( 0.6150000 0.2700000 0.6150000), wk = 0.0036496 k( 185) = ( 0.6200000 0.2600000 0.6200000), wk = 0.0036496 k( 186) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0036496 k( 187) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0036496 k( 188) = ( 0.6166667 0.2500000 0.6333333), wk = 0.0036496 k( 189) = ( 0.6083333 0.2500000 0.6416667), wk = 0.0036496 k( 190) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0036496 k( 191) = ( 0.5916667 0.2500000 0.6583333), wk = 0.0036496 k( 192) = ( 0.5833333 0.2500000 0.6666667), wk = 0.0036496 k( 193) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0036496 k( 194) = ( 0.5666667 0.2500000 0.6833333), wk = 0.0036496 k( 195) = ( 0.5583333 0.2500000 0.6916667), wk = 0.0036496 k( 196) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0036496 k( 197) = ( 0.5416667 0.2500000 0.7083333), wk = 0.0036496 k( 198) = ( 0.5333333 0.2500000 0.7166667), wk = 0.0036496 k( 199) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0036496 k( 200) = ( 0.5166667 0.2500000 0.7333333), wk = 0.0036496 k( 201) = ( 0.5083333 0.2500000 0.7416667), wk = 0.0036496 k( 202) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0036496 k( 203) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0036496 k( 204) = ( 0.5000000 0.2586207 0.7413793), wk = 0.0036496 k( 205) = ( 0.5000000 0.2672414 0.7327586), wk = 0.0036496 k( 206) = ( 0.5000000 0.2758621 0.7241379), wk = 0.0036496 k( 207) = ( 0.5000000 0.2844828 0.7155172), wk = 0.0036496 k( 208) = ( 0.5000000 0.2931035 0.7068965), wk = 0.0036496 k( 209) = ( 0.5000000 0.3017241 0.6982759), wk = 0.0036496 k( 210) = ( 0.5000000 0.3103448 0.6896552), wk = 0.0036496 k( 211) = ( 0.5000000 0.3189655 0.6810345), wk = 0.0036496 k( 212) = ( 0.5000000 0.3275862 0.6724138), wk = 0.0036496 k( 213) = ( 0.5000000 0.3362069 0.6637931), wk = 0.0036496 k( 214) = ( 0.5000000 0.3448276 0.6551724), wk = 0.0036496 k( 215) = ( 0.5000000 0.3534483 0.6465517), wk = 0.0036496 k( 216) = ( 0.5000000 0.3620690 0.6379310), wk = 0.0036496 k( 217) = ( 0.5000000 0.3706897 0.6293103), wk = 0.0036496 k( 218) = ( 0.5000000 0.3793103 0.6206897), wk = 0.0036496 k( 219) = ( 0.5000000 0.3879310 0.6120690), wk = 0.0036496 k( 220) = ( 0.5000000 0.3965517 0.6034483), wk = 0.0036496 k( 221) = ( 0.5000000 0.4051724 0.5948276), wk = 0.0036496 k( 222) = ( 0.5000000 0.4137931 0.5862069), wk = 0.0036496 k( 223) = ( 0.5000000 0.4224138 0.5775862), wk = 0.0036496 k( 224) = ( 0.5000000 0.4310345 0.5689655), wk = 0.0036496 k( 225) = ( 0.5000000 0.4396552 0.5603448), wk = 0.0036496 k( 226) = ( 0.5000000 0.4482759 0.5517241), wk = 0.0036496 k( 227) = ( 0.5000000 0.4568966 0.5431035), wk = 0.0036496 k( 228) = ( 0.5000000 0.4655172 0.5344828), wk = 0.0036496 k( 229) = ( 0.5000000 0.4741379 0.5258621), wk = 0.0036496 k( 230) = ( 0.5000000 0.4827586 0.5172414), wk = 0.0036496 k( 231) = ( 0.5000000 0.4913793 0.5086207), wk = 0.0036496 k( 232) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036496 k( 233) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036496 k( 234) = ( 0.4950000 0.4950000 0.5100000), wk = 0.0036496 k( 235) = ( 0.4900000 0.4900000 0.5200000), wk = 0.0036496 k( 236) = ( 0.4850000 0.4850000 0.5300000), wk = 0.0036496 k( 237) = ( 0.4800000 0.4800000 0.5400000), wk = 0.0036496 k( 238) = ( 0.4750000 0.4750000 0.5500000), wk = 0.0036496 k( 239) = ( 0.4700000 0.4700000 0.5600000), wk = 0.0036496 k( 240) = ( 0.4650000 0.4650000 0.5700000), wk = 0.0036496 k( 241) = ( 0.4600000 0.4600000 0.5800000), wk = 0.0036496 k( 242) = ( 0.4550000 0.4550000 0.5900000), wk = 0.0036496 k( 243) = ( 0.4500000 0.4500000 0.6000000), wk = 0.0036496 k( 244) = ( 0.4450000 0.4450000 0.6100000), wk = 0.0036496 k( 245) = ( 0.4400000 0.4400000 0.6200000), wk = 0.0036496 k( 246) = ( 0.4350000 0.4350000 0.6300000), wk = 0.0036496 k( 247) = ( 0.4300000 0.4300000 0.6400000), wk = 0.0036496 k( 248) = ( 0.4250000 0.4250000 0.6500000), wk = 0.0036496 k( 249) = ( 0.4200000 0.4200000 0.6600000), wk = 0.0036496 k( 250) = ( 0.4150000 0.4150000 0.6700000), wk = 0.0036496 k( 251) = ( 0.4100000 0.4100000 0.6800000), wk = 0.0036496 k( 252) = ( 0.4050000 0.4050000 0.6900000), wk = 0.0036496 k( 253) = ( 0.4000000 0.4000000 0.7000000), wk = 0.0036496 k( 254) = ( 0.3950000 0.3950000 0.7100000), wk = 0.0036496 k( 255) = ( 0.3900000 0.3900000 0.7200000), wk = 0.0036496 k( 256) = ( 0.3850000 0.3850000 0.7300000), wk = 0.0036496 k( 257) = ( 0.3800000 0.3800000 0.7400000), wk = 0.0036496 k( 258) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0036496 k( 259) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0036496 k( 260) = ( 0.6166667 0.2333333 0.6166667), wk = 0.0036496 k( 261) = ( 0.6083333 0.2166667 0.6083333), wk = 0.0036496 k( 262) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0036496 k( 263) = ( 0.5916667 0.1833333 0.5916667), wk = 0.0036496 k( 264) = ( 0.5833333 0.1666667 0.5833333), wk = 0.0036496 k( 265) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0036496 k( 266) = ( 0.5666667 0.1333333 0.5666667), wk = 0.0036496 k( 267) = ( 0.5583333 0.1166667 0.5583333), wk = 0.0036496 k( 268) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0036496 k( 269) = ( 0.5416667 0.0833333 0.5416667), wk = 0.0036496 k( 270) = ( 0.5333333 0.0666667 0.5333333), wk = 0.0036496 k( 271) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0036496 k( 272) = ( 0.5166667 0.0333333 0.5166667), wk = 0.0036496 k( 273) = ( 0.5083333 0.0166667 0.5083333), wk = 0.0036496 k( 274) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036496 Dense grid: 55849 G-vectors FFT dimensions: ( 54, 54, 54) Smooth grid: 27317 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 200, 56) NL pseudopotentials 0.31 Mb ( 100, 204) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1553) G-vector shells 0.00 Mb ( 413) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.68 Mb ( 200, 224) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.35 Mb ( 204, 2, 56) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./YS2.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 3.5 secs Computing kpt #: 3 total cpu time spent up to now is 4.0 secs Computing kpt #: 4 total cpu time spent up to now is 4.4 secs Computing kpt #: 5 total cpu time spent up to now is 4.9 secs Computing kpt #: 6 total cpu time spent up to now is 5.4 secs Computing kpt #: 7 total cpu time spent up to now is 6.0 secs Computing kpt #: 8 total cpu time spent up to now is 6.5 secs Computing kpt #: 9 total cpu time spent up to now is 7.0 secs Computing kpt #: 10 total cpu time spent up to now is 7.5 secs Computing kpt #: 11 total cpu time spent up to now is 8.0 secs Computing kpt #: 12 total cpu time spent up to now is 8.6 secs Computing kpt #: 13 total cpu time spent up to now is 9.1 secs Computing kpt #: 14 total cpu time spent up to now is 9.6 secs Computing kpt #: 15 total cpu time spent up to now is 10.1 secs Computing kpt #: 16 total cpu time spent up to now is 10.6 secs Computing kpt #: 17 total cpu time spent up to now is 11.1 secs Computing kpt #: 18 total cpu time spent up to now is 11.6 secs Computing kpt #: 19 total cpu time spent up to now is 12.1 secs Computing kpt #: 20 total cpu time spent up to now is 12.6 secs Computing kpt #: 21 total cpu time spent up to now is 13.1 secs Computing kpt #: 22 total cpu time spent up to now is 13.7 secs Computing kpt #: 23 total cpu time spent up to now is 14.3 secs Computing kpt #: 24 total cpu time spent up to now is 14.8 secs Computing kpt #: 25 total cpu time spent up to now is 15.3 secs Computing kpt #: 26 total cpu time spent up to now is 15.8 secs Computing kpt #: 27 total cpu time spent up to now is 16.3 secs Computing kpt #: 28 total cpu time spent up to now is 16.9 secs Computing kpt #: 29 total cpu time spent up to now is 17.4 secs Computing kpt #: 30 total cpu time spent up to now is 17.9 secs Computing kpt #: 31 total cpu time spent up to now is 18.5 secs Computing kpt #: 32 total cpu time spent up to now is 19.0 secs Computing kpt #: 33 total cpu time spent up to now is 19.6 secs Computing kpt #: 34 total cpu time spent up to now is 20.2 secs Computing kpt #: 35 total cpu time spent up to now is 20.9 secs Computing kpt #: 36 total cpu time spent up to now is 21.4 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 23.3 secs Computing kpt #: 40 total cpu time spent up to now is 23.8 secs Computing kpt #: 41 total cpu time spent up to now is 24.4 secs Computing kpt #: 42 total cpu time spent up to now is 24.9 secs Computing kpt #: 43 total cpu time spent up to now is 25.5 secs Computing kpt #: 44 total cpu time spent up to now is 26.0 secs Computing kpt #: 45 total cpu time spent up to now is 26.6 secs Computing kpt #: 46 total cpu time spent up to now is 27.1 secs Computing kpt #: 47 total cpu time spent up to now is 27.7 secs Computing kpt #: 48 total cpu time spent up to now is 28.3 secs Computing kpt #: 49 total cpu time spent up to now is 28.9 secs Computing kpt #: 50 total cpu time spent up to now is 29.6 secs Computing kpt #: 51 total cpu time spent up to now is 30.2 secs Computing kpt #: 52 total cpu time spent up to now is 30.9 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 32.3 secs Computing kpt #: 55 total cpu time spent up to now is 32.9 secs Computing kpt #: 56 total cpu time spent up to now is 33.5 secs Computing kpt #: 57 total cpu time spent up to now is 34.0 secs Computing kpt #: 58 total cpu time spent up to now is 34.6 secs Computing kpt #: 59 total cpu time spent up to now is 35.1 secs Computing kpt #: 60 total cpu time spent up to now is 35.6 secs Computing kpt #: 61 total cpu time spent up to now is 36.1 secs Computing kpt #: 62 total cpu time spent up to now is 36.6 secs Computing kpt #: 63 total cpu time spent up to now is 37.1 secs Computing kpt #: 64 total cpu time spent up to now is 37.6 secs Computing kpt #: 65 total cpu time spent up to now is 38.0 secs Computing kpt #: 66 total cpu time spent up to now is 38.5 secs Computing kpt #: 67 total cpu time spent up to now is 39.0 secs Computing kpt #: 68 total cpu time spent up to now is 39.5 secs Computing kpt #: 69 total cpu time spent up to now is 40.0 secs Computing kpt #: 70 total cpu time spent up to now is 40.5 secs Computing kpt #: 71 total cpu time spent up to now is 41.1 secs Computing kpt #: 72 total cpu time spent up to now is 41.6 secs Computing kpt #: 73 total cpu time spent up to now is 42.2 secs Computing kpt #: 74 total cpu time spent up to now is 42.7 secs Computing kpt #: 75 total cpu time spent up to now is 43.3 secs Computing kpt #: 76 total cpu time spent up to now is 43.8 secs Computing kpt #: 77 total cpu time spent up to now is 44.4 secs Computing kpt #: 78 total cpu time spent up to now is 45.0 secs Computing kpt #: 79 total cpu time spent up to now is 45.5 secs Computing kpt #: 80 total cpu time spent up to now is 46.1 secs Computing kpt #: 81 total cpu time spent up to now is 46.6 secs Computing kpt #: 82 total cpu time spent up to now is 47.2 secs Computing kpt #: 83 total cpu time spent up to now is 47.8 secs Computing kpt #: 84 total cpu time spent up to now is 48.3 secs Computing kpt #: 85 total cpu time spent up to now is 48.9 secs Computing kpt #: 86 total cpu time spent up to now is 49.4 secs Computing kpt #: 87 total cpu time spent up to now is 50.0 secs Computing kpt #: 88 total cpu time spent up to now is 50.5 secs Computing kpt #: 89 total cpu time spent up to now is 51.1 secs Computing kpt #: 90 total cpu time spent up to now is 51.6 secs Computing kpt #: 91 total cpu time spent up to now is 52.2 secs Computing kpt #: 92 total cpu time spent up to now is 52.7 secs Computing kpt #: 93 total cpu time spent up to now is 53.3 secs Computing kpt #: 94 total cpu time spent up to now is 53.9 secs Computing kpt #: 95 total cpu time spent up to now is 54.4 secs Computing kpt #: 96 total cpu time spent up to now is 55.0 secs Computing kpt #: 97 total cpu time spent up to now is 55.6 secs Computing kpt #: 98 total cpu time spent up to now is 56.2 secs Computing kpt #: 99 total cpu time spent up to now is 56.8 secs Computing kpt #: 100 total cpu time spent up to now is 57.4 secs Computing kpt #: 101 total cpu time spent up to now is 58.0 secs Computing kpt #: 102 total cpu time spent up to now is 58.5 secs Computing kpt #: 103 total cpu time spent up to now is 59.1 secs Computing kpt #: 104 total cpu time spent up to now is 59.7 secs Computing kpt #: 105 total cpu time spent up to now is 60.3 secs Computing kpt #: 106 total cpu time spent up to now is 60.8 secs Computing kpt #: 107 total cpu time spent up to now is 61.4 secs Computing kpt #: 108 total cpu time spent up to now is 61.9 secs Computing kpt #: 109 total cpu time spent up to now is 62.5 secs Computing kpt #: 110 total cpu time spent up to now is 63.0 secs Computing kpt #: 111 total cpu time spent up to now is 63.6 secs Computing kpt #: 112 total cpu time spent up to now is 64.1 secs Computing kpt #: 113 total cpu time spent up to now is 64.7 secs Computing kpt #: 114 total cpu time spent up to now is 65.2 secs Computing kpt #: 115 total cpu time spent up to now is 65.7 secs Computing kpt #: 116 total cpu time spent up to now is 66.3 secs Computing kpt #: 117 total cpu time spent up to now is 66.8 secs Computing kpt #: 118 total cpu time spent up to now is 67.3 secs Computing kpt #: 119 total cpu time spent up to now is 67.8 secs Computing kpt #: 120 total cpu time spent up to now is 68.3 secs Computing kpt #: 121 total cpu time spent up to now is 68.8 secs Computing kpt #: 122 total cpu time spent up to now is 69.3 secs Computing kpt #: 123 total cpu time spent up to now is 69.8 secs Computing kpt #: 124 total cpu time spent up to now is 70.3 secs Computing kpt #: 125 total cpu time spent up to now is 70.7 secs Computing kpt #: 126 total cpu time spent up to now is 71.2 secs Computing kpt #: 127 total cpu time spent up to now is 71.7 secs Computing kpt #: 128 total cpu time spent up to now is 72.2 secs Computing kpt #: 129 total cpu time spent up to now is 72.7 secs Computing kpt #: 130 total cpu time spent up to now is 73.2 secs Computing kpt #: 131 total cpu time spent up to now is 73.7 secs Computing kpt #: 132 total cpu time spent up to now is 74.2 secs Computing kpt #: 133 total cpu time spent up to now is 74.7 secs Computing kpt #: 134 total cpu time spent up to now is 75.3 secs Computing kpt #: 135 total cpu time spent up to now is 75.8 secs Computing kpt #: 136 total cpu time spent up to now is 76.3 secs Computing kpt #: 137 total cpu time spent up to now is 76.9 secs Computing kpt #: 138 total cpu time spent up to now is 77.4 secs Computing kpt #: 139 total cpu time spent up to now is 78.1 secs Computing kpt #: 140 total cpu time spent up to now is 78.7 secs Computing kpt #: 141 total cpu time spent up to now is 79.3 secs Computing kpt #: 142 total cpu time spent up to now is 79.9 secs Computing kpt #: 143 total cpu time spent up to now is 80.4 secs Computing kpt #: 144 total cpu time spent up to now is 81.0 secs Computing kpt #: 145 total cpu time spent up to now is 81.5 secs Computing kpt #: 146 total cpu time spent up to now is 82.1 secs Computing kpt #: 147 total cpu time spent up to now is 82.7 secs Computing kpt #: 148 total cpu time spent up to now is 83.3 secs Computing kpt #: 149 total cpu time spent up to now is 83.9 secs Computing kpt #: 150 total cpu time spent up to now is 84.5 secs Computing kpt #: 151 total cpu time spent up to now is 85.1 secs Computing kpt #: 152 total cpu time spent up to now is 85.7 secs Computing kpt #: 153 total cpu time spent up to now is 86.3 secs Computing kpt #: 154 total cpu time spent up to now is 86.9 secs Computing kpt #: 155 total cpu time spent up to now is 87.5 secs Computing kpt #: 156 total cpu time spent up to now is 88.1 secs Computing kpt #: 157 total cpu time spent up to now is 88.8 secs Computing kpt #: 158 total cpu time spent up to now is 89.4 secs Computing kpt #: 159 total cpu time spent up to now is 90.1 secs Computing kpt #: 160 total cpu time spent up to now is 90.8 secs Computing kpt #: 161 total cpu time spent up to now is 91.5 secs Computing kpt #: 162 total cpu time spent up to now is 92.2 secs Computing kpt #: 163 total cpu time spent up to now is 92.8 secs Computing kpt #: 164 total cpu time spent up to now is 93.5 secs Computing kpt #: 165 total cpu time spent up to now is 94.1 secs Computing kpt #: 166 total cpu time spent up to now is 94.7 secs Computing kpt #: 167 total cpu time spent up to now is 95.2 secs Computing kpt #: 168 total cpu time spent up to now is 95.8 secs Computing kpt #: 169 total cpu time spent up to now is 96.4 secs Computing kpt #: 170 total cpu time spent up to now is 96.9 secs Computing kpt #: 171 total cpu time spent up to now is 97.5 secs Computing kpt #: 172 total cpu time spent up to now is 98.0 secs Computing kpt #: 173 total cpu time spent up to now is 98.6 secs Computing kpt #: 174 total cpu time spent up to now is 99.1 secs Computing kpt #: 175 total cpu time spent up to now is 99.7 secs Computing kpt #: 176 total cpu time spent up to now is 100.2 secs Computing kpt #: 177 total cpu time spent up to now is 100.7 secs Computing kpt #: 178 total cpu time spent up to now is 101.2 secs Computing kpt #: 179 total cpu time spent up to now is 101.8 secs Computing kpt #: 180 total cpu time spent up to now is 102.3 secs Computing kpt #: 181 total cpu time spent up to now is 102.9 secs Computing kpt #: 182 total cpu time spent up to now is 103.4 secs Computing kpt #: 183 total cpu time spent up to now is 103.9 secs Computing kpt #: 184 total cpu time spent up to now is 104.5 secs Computing kpt #: 185 total cpu time spent up to now is 105.1 secs Computing kpt #: 186 total cpu time spent up to now is 105.6 secs Computing kpt #: 187 total cpu time spent up to now is 106.2 secs Computing kpt #: 188 total cpu time spent up to now is 106.8 secs Computing kpt #: 189 total cpu time spent up to now is 107.3 secs Computing kpt #: 190 total cpu time spent up to now is 107.9 secs Computing kpt #: 191 total cpu time spent up to now is 108.5 secs Computing kpt #: 192 total cpu time spent up to now is 109.0 secs Computing kpt #: 193 total cpu time spent up to now is 109.6 secs Computing kpt #: 194 total cpu time spent up to now is 110.1 secs Computing kpt #: 195 total cpu time spent up to now is 110.7 secs Computing kpt #: 196 total cpu time spent up to now is 111.2 secs Computing kpt #: 197 total cpu time spent up to now is 111.7 secs Computing kpt #: 198 total cpu time spent up to now is 112.2 secs Computing kpt #: 199 total cpu time spent up to now is 112.7 secs Computing kpt #: 200 total cpu time spent up to now is 113.2 secs Computing kpt #: 201 total cpu time spent up to now is 113.7 secs Computing kpt #: 202 total cpu time spent up to now is 114.2 secs Computing kpt #: 203 total cpu time spent up to now is 114.7 secs Computing kpt #: 204 total cpu time spent up to now is 115.2 secs Computing kpt #: 205 total cpu time spent up to now is 115.7 secs Computing kpt #: 206 total cpu time spent up to now is 116.2 secs Computing kpt #: 207 total cpu time spent up to now is 116.7 secs Computing kpt #: 208 total cpu time spent up to now is 117.2 secs Computing kpt #: 209 total cpu time spent up to now is 117.8 secs Computing kpt #: 210 total cpu time spent up to now is 118.3 secs Computing kpt #: 211 total cpu time spent up to now is 118.9 secs Computing kpt #: 212 total cpu time spent up to now is 119.4 secs Computing kpt #: 213 total cpu time spent up to now is 119.9 secs Computing kpt #: 214 total cpu time spent up to now is 120.5 secs Computing kpt #: 215 total cpu time spent up to now is 121.0 secs Computing kpt #: 216 total cpu time spent up to now is 121.5 secs Computing kpt #: 217 total cpu time spent up to now is 122.0 secs Computing kpt #: 218 total cpu time spent up to now is 122.5 secs Computing kpt #: 219 total cpu time spent up to now is 123.0 secs Computing kpt #: 220 total cpu time spent up to now is 123.5 secs Computing kpt #: 221 total cpu time spent up to now is 124.1 secs Computing kpt #: 222 total cpu time spent up to now is 124.6 secs Computing kpt #: 223 total cpu time spent up to now is 125.2 secs Computing kpt #: 224 total cpu time spent up to now is 125.8 secs Computing kpt #: 225 total cpu time spent up to now is 126.3 secs Computing kpt #: 226 total cpu time spent up to now is 126.9 secs Computing kpt #: 227 total cpu time spent up to now is 127.5 secs Computing kpt #: 228 total cpu time spent up to now is 128.2 secs Computing kpt #: 229 total cpu time spent up to now is 128.8 secs Computing kpt #: 230 total cpu time spent up to now is 129.4 secs Computing kpt #: 231 total cpu time spent up to now is 130.1 secs Computing kpt #: 232 total cpu time spent up to now is 130.8 secs Computing kpt #: 233 total cpu time spent up to now is 131.5 secs Computing kpt #: 234 total cpu time spent up to now is 132.1 secs Computing kpt #: 235 total cpu time spent up to now is 132.8 secs Computing kpt #: 236 total cpu time spent up to now is 133.4 secs Computing kpt #: 237 total cpu time spent up to now is 134.0 secs Computing kpt #: 238 total cpu time spent up to now is 134.6 secs Computing kpt #: 239 total cpu time spent up to now is 135.2 secs Computing kpt #: 240 total cpu time spent up to now is 135.8 secs Computing kpt #: 241 total cpu time spent up to now is 136.4 secs Computing kpt #: 242 total cpu time spent up to now is 137.0 secs Computing kpt #: 243 total cpu time spent up to now is 137.5 secs Computing kpt #: 244 total cpu time spent up to now is 138.1 secs Computing kpt #: 245 total cpu time spent up to now is 138.6 secs Computing kpt #: 246 total cpu time spent up to now is 139.2 secs Computing kpt #: 247 total cpu time spent up to now is 139.7 secs Computing kpt #: 248 total cpu time spent up to now is 140.2 secs Computing kpt #: 249 total cpu time spent up to now is 140.7 secs Computing kpt #: 250 total cpu time spent up to now is 141.3 secs Computing kpt #: 251 total cpu time spent up to now is 141.8 secs Computing kpt #: 252 total cpu time spent up to now is 142.3 secs Computing kpt #: 253 total cpu time spent up to now is 142.9 secs Computing kpt #: 254 total cpu time spent up to now is 143.4 secs Computing kpt #: 255 total cpu time spent up to now is 143.9 secs Computing kpt #: 256 total cpu time spent up to now is 144.5 secs Computing kpt #: 257 total cpu time spent up to now is 145.0 secs Computing kpt #: 258 total cpu time spent up to now is 145.6 secs Computing kpt #: 259 total cpu time spent up to now is 146.2 secs Computing kpt #: 260 total cpu time spent up to now is 146.7 secs Computing kpt #: 261 total cpu time spent up to now is 147.3 secs Computing kpt #: 262 total cpu time spent up to now is 147.8 secs Computing kpt #: 263 total cpu time spent up to now is 148.4 secs Computing kpt #: 264 total cpu time spent up to now is 149.0 secs Computing kpt #: 265 total cpu time spent up to now is 149.6 secs Computing kpt #: 266 total cpu time spent up to now is 150.3 secs Computing kpt #: 267 total cpu time spent up to now is 150.9 secs Computing kpt #: 268 total cpu time spent up to now is 151.6 secs Computing kpt #: 269 total cpu time spent up to now is 152.2 secs Computing kpt #: 270 total cpu time spent up to now is 152.9 secs Computing kpt #: 271 total cpu time spent up to now is 153.4 secs Computing kpt #: 272 total cpu time spent up to now is 154.0 secs Computing kpt #: 273 total cpu time spent up to now is 154.5 secs Computing kpt #: 274 total cpu time spent up to now is 155.1 secs ethr = 2.17E-08, avg # of iterations = 17.9 total cpu time spent up to now is 155.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3479 PWs) bands (ev): -32.4854 -32.4854 -32.3963 -32.3963 -13.5398 -13.5398 -13.3104 -13.3104 -12.1211 -12.1211 -12.1211 -12.1211 -11.8537 -11.8537 -11.8537 -11.8537 -4.8467 -4.8467 -1.0890 -1.0890 -1.0875 -1.0875 -1.0873 -1.0873 3.0969 3.0969 5.0068 5.0068 5.0363 5.0363 5.0363 5.0363 5.7793 5.7793 5.7793 5.7793 10.1641 10.1641 11.2692 11.2692 11.3247 11.3247 11.3247 11.3247 11.5923 11.5923 11.6414 11.6414 11.6415 11.6415 12.5673 12.5673 12.6281 12.6281 12.6282 12.6282 k = 0.0122-0.0070 0.0100 ( 3479 PWs) bands (ev): -32.4853 -32.4853 -32.3963 -32.3963 -13.5397 -13.5397 -13.3105 -13.3105 -12.1211 -12.1211 -12.1210 -12.1210 -11.8537 -11.8537 -11.8537 -11.8537 -4.8457 -4.8457 -1.0914 -1.0914 -1.0885 -1.0885 -1.0876 -1.0876 3.1008 3.1008 5.0075 5.0075 5.0359 5.0359 5.0382 5.0382 5.7805 5.7805 5.7807 5.7807 10.1685 10.1685 11.2591 11.2591 11.3113 11.3113 11.3170 11.3170 11.5984 11.5984 11.6445 11.6445 11.6528 11.6528 12.5636 12.5636 12.6232 12.6232 12.6255 12.6255 k = 0.0244-0.0141 0.0199 ( 3463 PWs) bands (ev): -32.4852 -32.4852 -32.3964 -32.3964 -13.5396 -13.5396 -13.3109 -13.3109 -12.1210 -12.1210 -12.1209 -12.1209 -11.8539 -11.8539 -11.8537 -11.8537 -4.8426 -4.8426 -1.1011 -1.1011 -1.0893 -1.0893 -1.0883 -1.0883 3.1123 3.1123 5.0083 5.0083 5.0362 5.0362 5.0441 5.0441 5.7841 5.7841 5.7849 5.7849 10.1815 10.1815 11.2299 11.2299 11.2759 11.2759 11.2975 11.2975 11.6060 11.6060 11.6600 11.6600 11.6822 11.6822 12.5517 12.5517 12.6092 12.6092 12.6177 12.6177 k = 0.0366-0.0211 0.0299 ( 3447 PWs) bands (ev): -32.4850 -32.4850 -32.3965 -32.3965 -13.5393 -13.5393 -13.3115 -13.3115 -12.1209 -12.1209 -12.1207 -12.1207 -11.8541 -11.8541 -11.8537 -11.8537 -4.8374 -4.8374 -1.1174 -1.1174 -1.0904 -1.0904 -1.0895 -1.0895 3.1313 3.1313 5.0055 5.0055 5.0408 5.0408 5.0539 5.0539 5.7901 5.7901 5.7919 5.7919 10.2031 10.2031 11.1856 11.1856 11.2264 11.2264 11.2697 11.2697 11.6039 11.6039 11.6913 11.6913 11.7215 11.7215 12.5296 12.5296 12.5886 12.5886 12.6049 12.6049 k = 0.0488-0.0282 0.0398 ( 3439 PWs) bands (ev): -32.4848 -32.4848 -32.3967 -32.3967 -13.5388 -13.5388 -13.3124 -13.3124 -12.1208 -12.1208 -12.1203 -12.1203 -11.8545 -11.8545 -11.8538 -11.8538 -4.8302 -4.8302 -1.1398 -1.1398 -1.0920 -1.0920 -1.0911 -1.0911 3.1575 3.1575 4.9972 4.9972 5.0519 5.0519 5.0676 5.0676 5.7984 5.7984 5.8016 5.8016 10.2330 10.2330 11.1316 11.1316 11.1686 11.1686 11.2342 11.2342 11.5947 11.5947 11.7302 11.7302 11.7645 11.7645 12.4945 12.4945 12.5649 12.5649 12.5876 12.5876 k = 0.0610-0.0352 0.0498 ( 3439 PWs) bands (ev): -32.4845 -32.4845 -32.3970 -32.3970 -13.5383 -13.5383 -13.3134 -13.3134 -12.1207 -12.1207 -12.1199 -12.1199 -11.8549 -11.8549 -11.8538 -11.8538 -4.8210 -4.8210 -1.1682 -1.1682 -1.0940 -1.0940 -1.0932 -1.0932 3.1906 3.1906 4.9845 4.9845 5.0684 5.0684 5.0852 5.0852 5.8092 5.8092 5.8140 5.8140 10.2710 10.2710 11.0715 11.0715 11.1056 11.1056 11.1907 11.1907 11.5809 11.5809 11.7706 11.7706 11.8076 11.8076 12.4455 12.4455 12.5402 12.5402 12.5665 12.5665 k = 0.0732-0.0422 0.0597 ( 3431 PWs) bands (ev): -32.4841 -32.4841 -32.3974 -32.3974 -13.5376 -13.5376 -13.3148 -13.3148 -12.1205 -12.1205 -12.1194 -12.1194 -11.8554 -11.8554 -11.8539 -11.8539 -4.8097 -4.8097 -1.2021 -1.2021 -1.0964 -1.0964 -1.0957 -1.0957 3.2303 3.2303 4.9686 4.9686 5.0894 5.0894 5.1066 5.1066 5.8224 5.8224 5.8288 5.8288 10.3168 10.3168 11.0074 11.0074 11.0391 11.0391 11.1394 11.1394 11.5633 11.5633 11.8095 11.8095 11.8488 11.8488 12.3837 12.3837 12.5147 12.5147 12.5424 12.5424 k = 0.0854-0.0493 0.0697 ( 3435 PWs) bands (ev): -32.4837 -32.4837 -32.3978 -32.3978 -13.5368 -13.5368 -13.3163 -13.3163 -12.1203 -12.1203 -12.1189 -12.1189 -11.8560 -11.8560 -11.8540 -11.8540 -4.7965 -4.7965 -1.2412 -1.2412 -1.0992 -1.0992 -1.0986 -1.0986 3.2760 3.2760 4.9501 4.9501 5.1146 5.1146 5.1319 5.1319 5.8379 5.8379 5.8461 5.8461 10.3700 10.3700 10.9404 10.9404 10.9699 10.9699 11.0808 11.0808 11.5424 11.5424 11.8448 11.8448 11.8860 11.8860 12.3106 12.3106 12.4887 12.4887 12.5165 12.5165 k = 0.0976-0.0563 0.0797 ( 3435 PWs) bands (ev): -32.4832 -32.4832 -32.3983 -32.3983 -13.5359 -13.5359 -13.3181 -13.3181 -12.1201 -12.1201 -12.1182 -12.1182 -11.8567 -11.8567 -11.8541 -11.8541 -4.7813 -4.7813 -1.2851 -1.2851 -1.1023 -1.1023 -1.1019 -1.1019 3.3273 3.3273 4.9295 4.9295 5.1438 5.1438 5.1609 5.1609 5.8559 5.8559 5.8655 5.8655 10.4300 10.4300 10.8711 10.8711 10.8986 10.8986 11.0153 11.0153 11.5185 11.5185 11.8749 11.8749 11.9179 11.9179 12.2275 12.2275 12.4628 12.4628 12.4899 12.4899 k = 0.1098-0.0634 0.0896 ( 3427 PWs) bands (ev): -32.4826 -32.4826 -32.3988 -32.3988 -13.5349 -13.5349 -13.3201 -13.3201 -12.1198 -12.1198 -12.1175 -12.1175 -11.8574 -11.8574 -11.8542 -11.8542 -4.7642 -4.7642 -1.3332 -1.3332 -1.1058 -1.1058 -1.1055 -1.1055 3.3836 3.3836 4.9071 4.9071 5.1769 5.1769 5.1936 5.1936 5.8762 5.8762 5.8871 5.8871 10.4965 10.4965 10.7998 10.7998 10.8255 10.8255 10.9436 10.9436 11.4919 11.4919 11.8983 11.8983 11.9426 11.9426 12.1354 12.1354 12.4383 12.4383 12.4643 12.4643 k = 0.1220-0.0704 0.0996 ( 3431 PWs) bands (ev): -32.4820 -32.4820 -32.3994 -32.3994 -13.5337 -13.5337 -13.3223 -13.3223 -12.1196 -12.1196 -12.1168 -12.1168 -11.8582 -11.8582 -11.8544 -11.8544 -4.7451 -4.7451 -1.3852 -1.3852 -1.1097 -1.1097 -1.1095 -1.1095 3.4445 3.4445 4.8833 4.8833 5.2137 5.2137 5.2301 5.2301 5.8989 5.8989 5.9105 5.9105 10.5687 10.5687 10.7268 10.7268 10.7509 10.7509 10.8662 10.8662 11.4631 11.4631 11.9134 11.9134 11.9585 11.9585 12.0354 12.0354 12.4168 12.4168 12.4410 12.4410 k = 0.1341-0.0774 0.1095 ( 3439 PWs) bands (ev): -32.4814 -32.4814 -32.4001 -32.4001 -13.5324 -13.5324 -13.3247 -13.3247 -12.1192 -12.1192 -12.1160 -12.1160 -11.8590 -11.8590 -11.8545 -11.8545 -4.7242 -4.7242 -1.4407 -1.4407 -1.1139 -1.1139 -1.1138 -1.1138 3.5094 3.5094 4.8585 4.8585 5.2542 5.2542 5.2701 5.2701 5.9240 5.9240 5.9355 5.9355 10.6449 10.6449 10.6521 10.6521 10.6760 10.6760 10.7839 10.7839 11.4324 11.4324 11.9192 11.9192 11.9273 11.9273 11.9654 11.9654 12.3995 12.3995 12.4216 12.4216 k = 0.1463-0.0845 0.1195 ( 3447 PWs) bands (ev): -32.4807 -32.4807 -32.4009 -32.4009 -13.5311 -13.5311 -13.3273 -13.3273 -12.1189 -12.1189 -12.1151 -12.1151 -11.8599 -11.8599 -11.8547 -11.8547 -4.7015 -4.7015 -1.4991 -1.4991 -1.1184 -1.1184 -1.1182 -1.1182 3.5778 3.5778 4.8330 4.8330 5.2984 5.2984 5.3137 5.3137 5.9514 5.9514 5.9620 5.9620 10.5758 10.5758 10.5961 10.5961 10.6971 10.6971 10.7291 10.7291 11.4007 11.4007 11.8144 11.8144 11.9149 11.9149 11.9604 11.9604 12.3875 12.3875 12.4068 12.4068 k = 0.1585-0.0915 0.1294 ( 3447 PWs) bands (ev): -32.4799 -32.4799 -32.4016 -32.4016 -13.5296 -13.5296 -13.3301 -13.3301 -12.1186 -12.1186 -12.1142 -12.1142 -11.8608 -11.8608 -11.8549 -11.8549 -4.6769 -4.6769 -1.5602 -1.5602 -1.1232 -1.1232 -1.1229 -1.1229 3.6490 3.6490 4.8073 4.8073 5.3461 5.3461 5.3607 5.3607 5.9812 5.9812 5.9898 5.9898 10.4978 10.4978 10.5171 10.5171 10.6066 10.6066 10.8146 10.8146 11.3685 11.3685 11.6962 11.6962 11.9010 11.9010 11.9454 11.9454 12.3803 12.3803 12.3966 12.3966 k = 0.1707-0.0986 0.1394 ( 3439 PWs) bands (ev): -32.4790 -32.4790 -32.4025 -32.4025 -13.5279 -13.5279 -13.3331 -13.3331 -12.1182 -12.1182 -12.1133 -12.1133 -11.8617 -11.8617 -11.8551 -11.8551 -4.6506 -4.6506 -1.6235 -1.6235 -1.1283 -1.1283 -1.1277 -1.1277 3.7227 3.7227 4.7815 4.7815 5.3972 5.3972 5.4112 5.4112 6.0134 6.0134 6.0184 6.0184 10.4181 10.4181 10.4365 10.4365 10.5129 10.5129 10.9021 10.9021 11.3368 11.3368 11.5747 11.5747 11.8786 11.8786 11.9216 11.9216 12.3770 12.3770 12.3903 12.3903 k = 0.1829-0.1056 0.1494 ( 3439 PWs) bands (ev): -32.4781 -32.4781 -32.4034 -32.4034 -13.5262 -13.5262 -13.3362 -13.3362 -12.1178 -12.1178 -12.1124 -12.1124 -11.8626 -11.8626 -11.8553 -11.8553 -4.6226 -4.6226 -1.6887 -1.6887 -1.1335 -1.1335 -1.1328 -1.1328 3.7981 3.7981 4.7562 4.7562 5.4518 5.4518 5.4650 5.4650 6.0479 6.0479 6.0479 6.0479 10.3365 10.3365 10.3544 10.3544 10.4166 10.4166 10.9880 10.9880 11.3064 11.3064 11.4536 11.4536 11.8492 11.8492 11.8911 11.8911 12.3759 12.3759 12.3864 12.3864 k = 0.1951-0.1127 0.1593 ( 3439 PWs) bands (ev): -32.4772 -32.4772 -32.4043 -32.4043 -13.5243 -13.5243 -13.3395 -13.3395 -12.1174 -12.1174 -12.1115 -12.1115 -11.8635 -11.8635 -11.8555 -11.8555 -4.5929 -4.5929 -1.7554 -1.7554 -1.1388 -1.1388 -1.1380 -1.1380 3.8749 3.8749 4.7314 4.7314 5.5096 5.5096 5.5221 5.5221 6.0780 6.0780 6.0847 6.0847 10.2525 10.2525 10.2708 10.2708 10.3186 10.3186 11.0597 11.0597 11.2781 11.2781 11.3456 11.3456 11.8148 11.8148 11.8556 11.8556 12.3754 12.3754 12.3837 12.3837 k = 0.2073-0.1197 0.1693 ( 3435 PWs) bands (ev): -32.4762 -32.4762 -32.4053 -32.4053 -13.5224 -13.5224 -13.3430 -13.3430 -12.1169 -12.1169 -12.1106 -12.1106 -11.8644 -11.8644 -11.8557 -11.8557 -4.5616 -4.5616 -1.8234 -1.8234 -1.1443 -1.1443 -1.1433 -1.1433 3.9525 3.9525 4.7076 4.7076 5.5706 5.5706 5.5823 5.5823 6.1085 6.1085 6.1239 6.1239 10.1657 10.1657 10.1857 10.1857 10.2198 10.2198 11.0646 11.0646 11.2530 11.2530 11.3030 11.3030 11.7770 11.7770 11.8169 11.8169 12.3744 12.3744 12.3810 12.3810 k = 0.2195-0.1267 0.1792 ( 3439 PWs) bands (ev): -32.4751 -32.4751 -32.4064 -32.4064 -13.5203 -13.5203 -13.3466 -13.3466 -12.1165 -12.1165 -12.1098 -12.1098 -11.8653 -11.8653 -11.8560 -11.8560 -4.5287 -4.5287 -1.8925 -1.8925 -1.1498 -1.1498 -1.1487 -1.1487 4.0302 4.0302 4.6850 4.6850 5.6348 5.6348 5.6456 5.6456 6.1393 6.1393 6.1654 6.1654 10.0748 10.0748 10.0991 10.0991 10.1217 10.1217 10.9710 10.9710 11.2318 11.2318 11.3577 11.3577 11.7371 11.7371 11.7763 11.7763 12.3720 12.3720 12.3773 12.3773 k = 0.2317-0.1338 0.1892 ( 3439 PWs) bands (ev): -32.4740 -32.4740 -32.4075 -32.4075 -13.5181 -13.5181 -13.3503 -13.3503 -12.1160 -12.1160 -12.1089 -12.1089 -11.8661 -11.8661 -11.8563 -11.8563 -4.4943 -4.4943 -1.9623 -1.9623 -1.1554 -1.1554 -1.1541 -1.1541 4.1076 4.1076 4.6638 4.6638 5.7019 5.7019 5.7119 5.7119 6.1706 6.1706 6.2092 6.2092 9.9788 9.9788 10.0111 10.0111 10.0257 10.0257 10.8418 10.8418 11.2154 11.2154 11.4466 11.4466 11.6962 11.6962 11.7349 11.7349 12.3677 12.3677 12.3722 12.3722 k = 0.2439-0.1408 0.1991 ( 3403 PWs) bands (ev): -32.4728 -32.4728 -32.4086 -32.4086 -13.5158 -13.5158 -13.3541 -13.3541 -12.1155 -12.1155 -12.1081 -12.1081 -11.8669 -11.8669 -11.8566 -11.8566 -4.4584 -4.4584 -2.0326 -2.0326 -1.1609 -1.1609 -1.1595 -1.1595 4.1841 4.1841 4.6442 4.6442 5.7719 5.7719 5.7811 5.7811 6.2022 6.2022 6.2553 6.2553 9.8779 9.8779 9.9216 9.9216 9.9318 9.9318 10.7022 10.7022 11.2046 11.2046 11.5441 11.5441 11.6552 11.6552 11.6936 11.6936 12.3615 12.3615 12.3654 12.3654 k = 0.2561-0.1479 0.2091 ( 3407 PWs) bands (ev): -32.4716 -32.4716 -32.4098 -32.4098 -13.5134 -13.5134 -13.3581 -13.3581 -12.1150 -12.1150 -12.1073 -12.1073 -11.8676 -11.8676 -11.8569 -11.8569 -4.4211 -4.4211 -2.1033 -2.1033 -1.1665 -1.1665 -1.1650 -1.1650 4.2590 4.2590 4.6265 4.6265 5.8448 5.8448 5.8531 5.8531 6.2344 6.2344 6.3037 6.3037 9.7738 9.7738 9.8306 9.8306 9.8388 9.8388 10.5580 10.5580 11.2001 11.2001 11.6146 11.6146 11.6378 11.6378 11.6595 11.6595 12.3532 12.3532 12.3568 12.3568 k = 0.2683-0.1549 0.2191 ( 3423 PWs) bands (ev): -32.4703 -32.4703 -32.4111 -32.4111 -13.5109 -13.5109 -13.3621 -13.3621 -12.1145 -12.1145 -12.1066 -12.1066 -11.8682 -11.8682 -11.8573 -11.8573 -4.3823 -4.3823 -2.1742 -2.1742 -1.1720 -1.1720 -1.1704 -1.1704 4.3316 4.3316 4.6107 4.6107 5.9203 5.9203 5.9277 5.9277 6.2675 6.2675 6.3544 6.3544 9.6677 9.6677 9.7382 9.7382 9.7456 9.7456 10.4112 10.4112 11.2023 11.2023 11.5751 11.5751 11.6106 11.6106 11.7480 11.7480 12.3429 12.3429 12.3464 12.3464 k = 0.2805-0.1619 0.2290 ( 3427 PWs) bands (ev): -32.4691 -32.4691 -32.4124 -32.4124 -13.5083 -13.5083 -13.3662 -13.3662 -12.1140 -12.1140 -12.1059 -12.1059 -11.8688 -11.8688 -11.8576 -11.8576 -4.3423 -4.3423 -2.2452 -2.2452 -1.1773 -1.1773 -1.1757 -1.1757 4.4012 4.4012 4.5970 4.5970 5.9984 5.9984 6.0049 6.0049 6.3019 6.3019 6.4073 6.4073 9.5605 9.5605 9.6444 9.6444 9.6517 9.6517 10.2626 10.2626 11.2118 11.2118 11.5369 11.5369 11.5720 11.5720 11.8488 11.8488 12.3310 12.3310 12.3343 12.3343 k = 0.2927-0.1690 0.2390 ( 3435 PWs) bands (ev): -32.4678 -32.4678 -32.4138 -32.4138 -13.5056 -13.5056 -13.3704 -13.3704 -12.1135 -12.1135 -12.1053 -12.1053 -11.8693 -11.8693 -11.8580 -11.8580 -4.3009 -4.3009 -2.3160 -2.3160 -1.1826 -1.1826 -1.1809 -1.1809 4.4672 4.4672 4.5856 4.5856 6.0789 6.0789 6.0846 6.0846 6.3381 6.3381 6.4625 6.4625 9.4526 9.4526 9.5493 9.5493 9.5568 9.5568 10.1130 10.1130 11.2288 11.2288 11.5005 11.5005 11.5346 11.5346 11.9486 11.9486 12.3176 12.3176 12.3208 12.3208 k = 0.3049-0.1760 0.2489 ( 3435 PWs) bands (ev): -32.4664 -32.4664 -32.4151 -32.4151 -13.5027 -13.5027 -13.3747 -13.3747 -12.1130 -12.1130 -12.1047 -12.1047 -11.8698 -11.8698 -11.8584 -11.8584 -4.2583 -4.2583 -2.3866 -2.3866 -1.1877 -1.1877 -1.1860 -1.1860 4.5288 4.5288 4.5765 4.5765 6.1618 6.1618 6.1666 6.1666 6.3768 6.3768 6.5199 6.5199 9.3446 9.3446 9.4529 9.4529 9.4608 9.4608 9.9628 9.9628 11.2535 11.2535 11.4659 11.4659 11.4989 11.4989 12.0465 12.0465 12.3031 12.3031 12.3062 12.3062 k = 0.3171-0.1831 0.2589 ( 3431 PWs) bands (ev): -32.4650 -32.4650 -32.4165 -32.4165 -13.4998 -13.4998 -13.3790 -13.3790 -12.1124 -12.1124 -12.1042 -12.1042 -11.8701 -11.8701 -11.8588 -11.8588 -4.2145 -4.2145 -2.4568 -2.4568 -1.1927 -1.1927 -1.1909 -1.1909 4.5699 4.5699 4.5852 4.5852 6.2468 6.2468 6.2507 6.2507 6.4187 6.4187 6.5795 6.5795 9.2366 9.2366 9.3554 9.3554 9.3637 9.3637 9.8123 9.8123 11.2858 11.2858 11.4337 11.4337 11.4651 11.4651 12.1417 12.1417 12.2881 12.2881 12.2908 12.2908 k = 0.3293-0.1901 0.2688 ( 3423 PWs) bands (ev): -32.4635 -32.4635 -32.4180 -32.4180 -13.4968 -13.4968 -13.3834 -13.3834 -12.1119 -12.1119 -12.1038 -12.1038 -11.8704 -11.8704 -11.8593 -11.8593 -4.1695 -4.1695 -2.5267 -2.5267 -1.1974 -1.1974 -1.1957 -1.1957 4.5656 4.5656 4.6358 4.6358 6.3339 6.3339 6.3369 6.3369 6.4645 6.4645 6.6413 6.6413 9.1289 9.1289 9.2568 9.2568 9.2655 9.2655 9.6619 9.6619 11.3250 11.3250 11.4044 11.4044 11.4331 11.4331 12.2311 12.2311 12.2747 12.2747 12.2753 12.2753 k = 0.3415-0.1971 0.2788 ( 3423 PWs) bands (ev): -32.4620 -32.4620 -32.4195 -32.4195 -13.4937 -13.4937 -13.3878 -13.3878 -12.1113 -12.1113 -12.1035 -12.1035 -11.8706 -11.8706 -11.8598 -11.8598 -4.1234 -4.1234 -2.5961 -2.5961 -1.2019 -1.2019 -1.2002 -1.2002 4.5639 4.5639 4.6801 4.6801 6.4229 6.4229 6.4250 6.4250 6.5150 6.5150 6.7053 6.7053 9.0215 9.0215 9.1572 9.1572 9.1663 9.1663 9.5119 9.5119 11.3600 11.3600 11.3890 11.3890 11.4033 11.4033 12.2521 12.2521 12.2585 12.2585 12.3270 12.3270 k = 0.3537-0.2042 0.2888 ( 3419 PWs) bands (ev): -32.4605 -32.4605 -32.4210 -32.4210 -13.4904 -13.4904 -13.3923 -13.3923 -12.1108 -12.1108 -12.1032 -12.1032 -11.8707 -11.8707 -11.8602 -11.8602 -4.0762 -4.0762 -2.6648 -2.6648 -1.2061 -1.2061 -1.2045 -1.2045 4.5646 4.5646 4.7177 4.7177 6.5136 6.5136 6.5147 6.5147 6.5709 6.5709 6.7715 6.7715 8.9148 8.9148 9.0568 9.0568 9.0663 9.0663 9.3624 9.3624 11.3446 11.3446 11.3755 11.3755 11.4336 11.4336 12.2372 12.2372 12.2422 12.2422 12.4103 12.4103 k = 0.3659-0.2112 0.2987 ( 3415 PWs) bands (ev): -32.4589 -32.4589 -32.4225 -32.4225 -13.4871 -13.4871 -13.3968 -13.3968 -12.1102 -12.1102 -12.1030 -12.1030 -11.8707 -11.8707 -11.8607 -11.8607 -4.0279 -4.0279 -2.7330 -2.7330 -1.2101 -1.2101 -1.2085 -1.2085 4.5678 4.5678 4.7482 4.7482 6.6055 6.6055 6.6058 6.6058 6.6330 6.6330 6.8398 6.8398 8.8088 8.8088 8.9558 8.9558 8.9656 8.9656 9.2138 9.2138 11.3220 11.3220 11.3498 11.3498 11.4947 11.4947 12.2217 12.2217 12.2261 12.2261 12.4897 12.4897 k = 0.3780-0.2183 0.3087 ( 3407 PWs) bands (ev): -32.4573 -32.4573 -32.4241 -32.4241 -13.4837 -13.4837 -13.4012 -13.4012 -12.1097 -12.1097 -12.1029 -12.1029 -11.8707 -11.8707 -11.8613 -11.8613 -3.9786 -3.9786 -2.8005 -2.8005 -1.2138 -1.2138 -1.2123 -1.2123 4.5734 4.5734 4.7718 4.7718 6.6939 6.6939 6.6993 6.6993 6.7051 6.7051 6.9102 6.9102 8.7037 8.7037 8.8543 8.8543 8.8644 8.8644 9.0663 9.0663 11.3008 11.3008 11.3263 11.3263 11.5631 11.5631 12.2065 12.2065 12.2106 12.2106 12.5635 12.5635 k = 0.3902-0.2253 0.3186 ( 3407 PWs) bands (ev): -32.4558 -32.4558 -32.4256 -32.4256 -13.4802 -13.4802 -13.4057 -13.4057 -12.1091 -12.1091 -12.1028 -12.1028 -11.8706 -11.8706 -11.8618 -11.8618 -3.9282 -3.9282 -2.8674 -2.8674 -1.2172 -1.2172 -1.2158 -1.2158 4.5812 4.5812 4.7885 4.7885 6.7720 6.7720 6.7939 6.7939 6.7949 6.7949 6.9827 6.9827 8.5995 8.5995 8.7526 8.7526 8.7628 8.7628 8.9201 8.9201 11.2817 11.2817 11.3049 11.3049 11.6378 11.6378 12.1920 12.1920 12.1959 12.1959 12.6303 12.6303 k = 0.4024-0.2323 0.3286 ( 3411 PWs) bands (ev): -32.4542 -32.4542 -32.4273 -32.4273 -13.4766 -13.4766 -13.4102 -13.4102 -12.1086 -12.1086 -12.1028 -12.1028 -11.8704 -11.8704 -11.8624 -11.8624 -3.8769 -3.8769 -2.9334 -2.9334 -1.2202 -1.2202 -1.2190 -1.2190 4.5912 4.5912 4.7987 4.7987 6.8529 6.8529 6.8890 6.8890 6.8892 6.8892 7.0572 7.0572 8.4965 8.4965 8.6510 8.6510 8.6613 8.6613 8.7754 8.7754 11.2648 11.2648 11.2857 11.2857 11.7179 11.7179 12.1785 12.1785 12.1821 12.1821 12.6883 12.6883 k = 0.4146-0.2394 0.3385 ( 3403 PWs) bands (ev): -32.4525 -32.4525 -32.4289 -32.4289 -13.4730 -13.4730 -13.4147 -13.4147 -12.1081 -12.1081 -12.1029 -12.1029 -11.8701 -11.8701 -11.8629 -11.8629 -3.8246 -3.8246 -2.9987 -2.9987 -1.2230 -1.2230 -1.2218 -1.2218 4.6033 4.6033 4.8030 4.8030 6.9397 6.9397 6.9839 6.9839 6.9848 6.9848 7.1338 7.1338 8.3945 8.3945 8.5499 8.5499 8.5603 8.5603 8.6324 8.6324 11.2501 11.2501 11.2686 11.2686 11.8028 11.8028 12.1662 12.1662 12.1694 12.1694 12.7346 12.7346 k = 0.4268-0.2464 0.3485 ( 3410 PWs) bands (ev): -32.4508 -32.4508 -32.4306 -32.4306 -13.4692 -13.4692 -13.4191 -13.4191 -12.1075 -12.1075 -12.1030 -12.1030 -11.8698 -11.8698 -11.8635 -11.8635 -3.7714 -3.7714 -3.0632 -3.0632 -1.2253 -1.2253 -1.2243 -1.2243 4.6172 4.6172 4.8020 4.8020 7.0323 7.0323 7.0786 7.0786 7.0801 7.0801 7.2123 7.2123 8.2939 8.2939 8.4497 8.4497 8.4602 8.4602 8.4915 8.4915 11.2376 11.2376 11.2536 11.2536 11.8920 11.8920 12.1552 12.1552 12.1581 12.1581 12.7648 12.7648 k = 0.4390-0.2535 0.3585 ( 3410 PWs) bands (ev): -32.4492 -32.4492 -32.4322 -32.4322 -13.4654 -13.4654 -13.4236 -13.4236 -12.1070 -12.1070 -12.1032 -12.1032 -11.8695 -11.8695 -11.8641 -11.8641 -3.7172 -3.7172 -3.1269 -3.1269 -1.2273 -1.2273 -1.2265 -1.2265 4.6327 4.6327 4.7963 4.7963 7.1305 7.1305 7.1724 7.1724 7.1741 7.1741 7.2928 7.2928 8.1946 8.1946 8.3480 8.3480 8.3564 8.3564 8.3621 8.3621 11.2272 11.2272 11.2407 11.2407 11.9845 11.9845 12.1457 12.1457 12.1482 12.1482 12.7729 12.7729 k = 0.4512-0.2605 0.3684 ( 3398 PWs) bands (ev): -32.4475 -32.4475 -32.4339 -32.4339 -13.4615 -13.4615 -13.4280 -13.4280 -12.1065 -12.1065 -12.1034 -12.1034 -11.8690 -11.8690 -11.8647 -11.8647 -3.6621 -3.6621 -3.1898 -3.1898 -1.2290 -1.2290 -1.2282 -1.2282 4.6495 4.6495 4.7868 4.7868 7.2336 7.2336 7.2639 7.2639 7.2655 7.2655 7.3750 7.3750 8.0968 8.0968 8.2150 8.2150 8.2585 8.2585 8.2674 8.2674 11.2191 11.2191 11.2300 11.2300 12.0797 12.0797 12.1378 12.1378 12.1400 12.1400 12.7537 12.7537 k = 0.4634-0.2676 0.3784 ( 3406 PWs) bands (ev): -32.4458 -32.4458 -32.4356 -32.4356 -13.4575 -13.4575 -13.4323 -13.4323 -12.1060 -12.1060 -12.1036 -12.1036 -11.8686 -11.8686 -11.8653 -11.8653 -3.6062 -3.6062 -3.2519 -3.2519 -1.2302 -1.2302 -1.2297 -1.2297 4.6675 4.6675 4.7741 4.7741 7.3386 7.3386 7.3514 7.3514 7.3532 7.3532 7.4590 7.4590 8.0004 8.0004 8.0811 8.0811 8.1704 8.1704 8.1786 8.1786 11.2131 11.2131 11.2213 11.2213 12.1316 12.1316 12.1329 12.1329 12.1772 12.1772 12.7073 12.7073 k = 0.4756-0.2746 0.3883 ( 3398 PWs) bands (ev): -32.4441 -32.4441 -32.4373 -32.4373 -13.4535 -13.4535 -13.4367 -13.4367 -12.1056 -12.1056 -12.1040 -12.1040 -11.8681 -11.8681 -11.8659 -11.8659 -3.5493 -3.5493 -3.3131 -3.3131 -1.2311 -1.2311 -1.2307 -1.2307 4.6861 4.6861 4.7589 4.7589 7.4220 7.4220 7.4267 7.4267 7.4584 7.4584 7.5445 7.5445 7.9058 7.9058 7.9500 7.9500 8.0940 8.0940 8.1008 8.1008 11.2092 11.2092 11.2147 11.2147 12.1272 12.1272 12.1282 12.1282 12.2748 12.2748 12.6395 12.6395 k = 0.4878-0.2816 0.3983 ( 3378 PWs) bands (ev): -32.4423 -32.4423 -32.4389 -32.4389 -13.4494 -13.4494 -13.4410 -13.4410 -12.1051 -12.1051 -12.1043 -12.1043 -11.8676 -11.8676 -11.8665 -11.8665 -3.4915 -3.4915 -3.3734 -3.3734 -1.2316 -1.2316 -1.2314 -1.2314 4.7050 4.7050 4.7420 4.7420 7.4788 7.4788 7.4814 7.4814 7.5747 7.5747 7.6314 7.6314 7.8131 7.8131 7.8222 7.8222 8.0392 8.0392 8.0432 8.0432 11.2075 11.2075 11.2102 11.2102 12.1247 12.1247 12.1252 12.1252 12.3721 12.3721 12.5576 12.5576 k = 0.5000-0.2887 0.4082 ( 3378 PWs) bands (ev): -32.4406 -32.4406 -32.4406 -32.4406 -13.4452 -13.4452 -13.4452 -13.4452 -12.1047 -12.1047 -12.1047 -12.1047 -11.8670 -11.8670 -11.8670 -11.8670 -3.4330 -3.4330 -3.4329 -3.4329 -1.2317 -1.2317 -1.2316 -1.2316 4.7238 4.7238 4.7239 4.7239 7.5013 7.5013 7.5014 7.5014 7.6913 7.6913 7.6914 7.6914 7.7265 7.7265 7.7265 7.7265 8.0198 8.0198 8.0198 8.0198 11.2078 11.2078 11.2078 11.2078 12.1240 12.1240 12.1241 12.1241 12.4672 12.4672 12.4672 12.4672 k = 0.5000-0.2887 0.4082 ( 3378 PWs) bands (ev): -32.4406 -32.4406 -32.4406 -32.4406 -13.4452 -13.4452 -13.4452 -13.4452 -12.1047 -12.1047 -12.1047 -12.1047 -11.8670 -11.8670 -11.8670 -11.8670 -3.4330 -3.4330 -3.4329 -3.4329 -1.2317 -1.2317 -1.2316 -1.2316 4.7238 4.7238 4.7239 4.7239 7.5013 7.5013 7.5014 7.5014 7.6913 7.6913 7.6914 7.6914 7.7265 7.7265 7.7265 7.7265 8.0198 8.0198 8.0198 8.0198 11.2078 11.2078 11.2078 11.2078 12.1240 12.1240 12.1241 12.1241 12.4672 12.4672 12.4672 12.4672 k = 0.5000-0.2749 0.4180 ( 3378 PWs) bands (ev): -32.4406 -32.4406 -32.4406 -32.4406 -13.4458 -13.4458 -13.4445 -13.4445 -12.1094 -12.1094 -12.0998 -12.0998 -11.8712 -11.8712 -11.8630 -11.8630 -3.4331 -3.4331 -3.4325 -3.4325 -1.2322 -1.2322 -1.2318 -1.2318 4.7262 4.7262 4.7262 4.7262 7.4776 7.4776 7.4863 7.4863 7.6864 7.6864 7.6933 7.6933 7.7163 7.7163 7.7249 7.7249 8.0451 8.0451 8.0502 8.0502 11.2079 11.2079 11.2080 11.2080 12.1142 12.1142 12.1157 12.1157 12.4729 12.4729 12.4740 12.4740 k = 0.5000-0.2612 0.4277 ( 3384 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4465 -13.4465 -13.4439 -13.4439 -12.1139 -12.1139 -12.0948 -12.0948 -11.8756 -11.8756 -11.8591 -11.8591 -3.4330 -3.4330 -3.4318 -3.4318 -1.2335 -1.2335 -1.2326 -1.2326 4.7333 4.7333 4.7333 4.7333 7.4224 7.4224 7.4349 7.4349 7.6679 7.6679 7.6858 7.6858 7.7189 7.7189 7.7231 7.7231 8.1133 8.1133 8.1195 8.1195 11.2084 11.2084 11.2086 11.2086 12.0880 12.0880 12.0906 12.0906 12.4897 12.4897 12.4916 12.4916 k = 0.5000-0.2474 0.4374 ( 3390 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4471 -13.4471 -13.4433 -13.4433 -12.1183 -12.1183 -12.0897 -12.0897 -11.8800 -11.8800 -11.8554 -11.8554 -3.4326 -3.4326 -3.4308 -3.4308 -1.2354 -1.2354 -1.2342 -1.2342 4.7451 4.7451 4.7452 4.7452 7.3463 7.3463 7.3587 7.3587 7.6467 7.6467 7.6678 7.6678 7.7311 7.7311 7.7327 7.7327 8.2033 8.2033 8.2087 8.2087 11.2093 11.2093 11.2097 11.2097 12.0490 12.0490 12.0525 12.0525 12.5143 12.5143 12.5165 12.5165 k = 0.5000-0.2337 0.4471 ( 3400 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4477 -13.4477 -13.4427 -13.4427 -12.1224 -12.1224 -12.0844 -12.0844 -11.8847 -11.8847 -11.8519 -11.8519 -3.4321 -3.4321 -3.4296 -3.4296 -1.2380 -1.2380 -1.2363 -1.2363 4.7615 4.7615 4.7616 4.7616 7.2582 7.2582 7.2691 7.2691 7.6282 7.6282 7.6494 7.6494 7.7459 7.7459 7.7463 7.7463 8.3038 8.3038 8.3078 8.3078 11.2108 11.2108 11.2113 11.2113 12.0005 12.0005 12.0045 12.0045 12.5433 12.5433 12.5458 12.5458 k = 0.5000-0.2199 0.4568 ( 3396 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4483 -13.4483 -13.4421 -13.4421 -12.1264 -12.1264 -12.0790 -12.0790 -11.8894 -11.8894 -11.8485 -11.8485 -3.4312 -3.4312 -3.4282 -3.4282 -1.2411 -1.2411 -1.2390 -1.2390 4.7826 4.7826 4.7827 4.7827 7.1636 7.1636 7.1729 7.1729 7.6119 7.6119 7.6326 7.6326 7.7610 7.7610 7.7614 7.7614 8.4096 8.4096 8.4123 8.4123 11.2129 11.2129 11.2136 11.2136 11.9449 11.9449 11.9492 11.9492 12.5748 12.5748 12.5774 12.5774 k = 0.5000-0.2062 0.4666 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4489 -13.4489 -13.4415 -13.4415 -12.1301 -12.1301 -12.0735 -12.0735 -11.8943 -11.8943 -11.8454 -11.8454 -3.4302 -3.4302 -3.4267 -3.4267 -1.2447 -1.2447 -1.2423 -1.2423 4.8082 4.8082 4.8084 4.8084 7.0656 7.0656 7.0735 7.0735 7.5972 7.5972 7.6174 7.6174 7.7759 7.7759 7.7769 7.7769 8.5185 8.5185 8.5199 8.5199 11.2159 11.2159 11.2168 11.2168 11.8838 11.8838 11.8882 11.8882 12.6074 12.6074 12.6099 12.6099 k = 0.5000-0.1925 0.4763 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4495 -13.4495 -13.4410 -13.4410 -12.1337 -12.1337 -12.0679 -12.0679 -11.8993 -11.8993 -11.8424 -11.8424 -3.4290 -3.4290 -3.4249 -3.4249 -1.2488 -1.2488 -1.2459 -1.2459 4.8383 4.8383 4.8385 4.8385 6.9661 6.9661 6.9728 6.9728 7.5836 7.5836 7.6036 7.6036 7.7907 7.7907 7.7921 7.7921 8.6291 8.6291 8.6293 8.6293 11.2198 11.2198 11.2209 11.2209 11.8184 11.8184 11.8228 11.8228 12.6402 12.6402 12.6428 12.6428 k = 0.5000-0.1787 0.4860 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4500 -13.4500 -13.4404 -13.4404 -12.1370 -12.1370 -12.0622 -12.0622 -11.9045 -11.9045 -11.8396 -11.8396 -3.4277 -3.4277 -3.4230 -3.4230 -1.2532 -1.2532 -1.2500 -1.2500 4.8727 4.8727 4.8729 4.8729 6.8660 6.8660 6.8716 6.8716 7.5712 7.5712 7.5909 7.5909 7.8051 7.8051 7.8069 7.8069 8.7395 8.7395 8.7405 8.7405 11.2246 11.2246 11.2260 11.2260 11.7498 11.7498 11.7542 11.7542 12.6726 12.6726 12.6754 12.6754 k = 0.5000-0.1650 0.4957 ( 3398 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4506 -13.4506 -13.4399 -13.4399 -12.1402 -12.1402 -12.0564 -12.0564 -11.9097 -11.9097 -11.8370 -11.8370 -3.4262 -3.4262 -3.4211 -3.4211 -1.2578 -1.2578 -1.2543 -1.2543 4.9113 4.9113 4.9116 4.9116 6.7660 6.7660 6.7707 6.7707 7.5596 7.5596 7.5794 7.5794 7.8190 7.8190 7.8210 7.8210 8.8500 8.8500 8.8521 8.8521 11.2302 11.2302 11.2318 11.2318 11.6793 11.6793 11.6834 11.6834 12.7028 12.7028 12.7072 12.7072 k = 0.5000-0.1512 0.5055 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4511 -13.4511 -13.4395 -13.4395 -12.1431 -12.1431 -12.0506 -12.0506 -11.9150 -11.9150 -11.8346 -11.8346 -3.4247 -3.4247 -3.4190 -3.4190 -1.2626 -1.2626 -1.2587 -1.2587 4.9540 4.9540 4.9544 4.9544 6.6665 6.6665 6.6705 6.6705 7.5491 7.5491 7.5689 7.5689 7.8322 7.8322 7.8344 7.8344 8.9601 8.9601 8.9633 8.9633 11.2357 11.2357 11.2376 11.2376 11.6084 11.6084 11.6122 11.6122 12.7124 12.7124 12.7328 12.7328 k = 0.5000-0.1375 0.5152 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4515 -13.4515 -13.4390 -13.4390 -12.1457 -12.1457 -12.0447 -12.0447 -11.9204 -11.9204 -11.8324 -11.8324 -3.4231 -3.4231 -3.4170 -3.4170 -1.2674 -1.2674 -1.2632 -1.2632 5.0007 5.0007 5.0013 5.0013 6.5679 6.5679 6.5711 6.5711 7.5394 7.5394 7.5594 7.5594 7.8446 7.8446 7.8470 7.8470 9.0692 9.0692 9.0734 9.0734 11.2395 11.2395 11.2417 11.2417 11.5397 11.5397 11.5430 11.5430 12.6476 12.6476 12.6702 12.6702 k = 0.5000-0.1237 0.5249 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4519 -13.4519 -13.4386 -13.4386 -12.1481 -12.1481 -12.0388 -12.0388 -11.9259 -11.9259 -11.8303 -11.8303 -3.4215 -3.4215 -3.4150 -3.4150 -1.2722 -1.2722 -1.2677 -1.2677 5.0513 5.0513 5.0519 5.0519 6.4703 6.4703 6.4729 6.4729 7.5307 7.5307 7.5508 7.5508 7.8561 7.8561 7.8587 7.8587 9.1766 9.1766 9.1820 9.1820 11.2376 11.2376 11.2401 11.2401 11.4779 11.4779 11.4806 11.4806 12.5711 12.5711 12.5927 12.5927 k = 0.5000-0.1100 0.5346 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4523 -13.4523 -13.4383 -13.4383 -12.1503 -12.1503 -12.0328 -12.0328 -11.9315 -11.9315 -11.8285 -11.8285 -3.4200 -3.4200 -3.4131 -3.4131 -1.2768 -1.2768 -1.2720 -1.2720 5.1055 5.1055 5.1063 5.1063 6.3741 6.3741 6.3761 6.3761 7.5229 7.5229 7.5432 7.5432 7.8666 7.8666 7.8694 7.8694 9.2816 9.2816 9.2883 9.2883 11.2221 11.2221 11.2248 11.2248 11.4318 11.4318 11.4337 11.4337 12.4953 12.4953 12.5167 12.5167 k = 0.5000-0.0962 0.5443 ( 3394 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4527 -13.4527 -13.4379 -13.4379 -12.1523 -12.1523 -12.0269 -12.0269 -11.9371 -11.9371 -11.8269 -11.8269 -3.4185 -3.4185 -3.4113 -3.4113 -1.2811 -1.2811 -1.2761 -1.2761 5.1632 5.1632 5.1643 5.1643 6.2793 6.2793 6.2807 6.2807 7.5160 7.5160 7.5365 7.5365 7.8760 7.8760 7.8790 7.8790 9.3832 9.3832 9.3912 9.3912 11.1853 11.1853 11.1881 11.1881 11.4098 11.4098 11.4106 11.4106 12.4221 12.4221 12.4434 12.4434 k = 0.5000-0.0825 0.5541 ( 3402 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4530 -13.4530 -13.4377 -13.4377 -12.1540 -12.1540 -12.0210 -12.0210 -11.9426 -11.9426 -11.8255 -11.8255 -3.4171 -3.4171 -3.4096 -3.4096 -1.2851 -1.2851 -1.2799 -1.2799 5.2242 5.2242 5.2256 5.2256 6.1862 6.1862 6.1870 6.1870 7.5100 7.5100 7.5307 7.5307 7.8844 7.8844 7.8874 7.8874 9.4802 9.4802 9.4896 9.4896 11.1307 11.1307 11.1339 11.1339 11.4087 11.4087 11.4087 11.4087 12.3526 12.3527 12.3741 12.3741 k = 0.5000-0.0687 0.5638 ( 3398 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4533 -13.4533 -13.4374 -13.4374 -12.1554 -12.1554 -12.0151 -12.0151 -11.9482 -11.9482 -11.8244 -11.8244 -3.4159 -3.4159 -3.4081 -3.4081 -1.2886 -1.2886 -1.2832 -1.2832 5.2884 5.2884 5.2901 5.2901 6.0950 6.0950 6.0951 6.0951 7.5050 7.5050 7.5259 7.5259 7.8915 7.8915 7.8946 7.8946 9.5709 9.5709 9.5818 9.5818 11.0681 11.0681 11.0722 11.0722 11.4190 11.4190 11.4195 11.4195 12.2884 12.2884 12.3099 12.3099 k = 0.5000-0.0550 0.5735 ( 3406 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4535 -13.4535 -13.4372 -13.4372 -12.1566 -12.1566 -12.0095 -12.0095 -11.9536 -11.9536 -11.8234 -11.8234 -3.4149 -3.4149 -3.4069 -3.4069 -1.2916 -1.2916 -1.2860 -1.2860 5.3554 5.3554 5.3577 5.3577 6.0052 6.0052 6.0059 6.0059 7.5009 7.5009 7.5219 7.5219 7.8974 7.8974 7.9006 7.9006 9.6530 9.6530 9.6655 9.6655 11.0055 11.0055 11.0108 11.0108 11.4348 11.4348 11.4355 11.4355 12.2310 12.2310 12.2527 12.2527 k = 0.5000-0.0412 0.5832 ( 3402 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4537 -13.4537 -13.4371 -13.4371 -12.1575 -12.1575 -12.0041 -12.0041 -11.9588 -11.9588 -11.8226 -11.8226 -3.4141 -3.4141 -3.4059 -3.4059 -1.2940 -1.2940 -1.2883 -1.2883 5.4247 5.4247 5.4278 5.4278 5.9177 5.9177 5.9193 5.9193 7.4976 7.4976 7.5188 7.5188 7.9020 7.9020 7.9053 7.9053 9.7235 9.7235 9.7377 9.7377 10.9485 10.9485 10.9551 10.9551 11.4519 11.4519 11.4526 11.4526 12.1825 12.1825 12.2043 12.2043 k = 0.5000-0.0275 0.5929 ( 3390 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4538 -13.4538 -13.4369 -13.4369 -12.1581 -12.1581 -11.9993 -11.9993 -11.9635 -11.9635 -11.8221 -11.8221 -3.4134 -3.4134 -3.4051 -3.4051 -1.2957 -1.2957 -1.2899 -1.2899 5.4954 5.4954 5.5000 5.5000 5.8332 5.8332 5.8364 5.8364 7.4954 7.4954 7.5166 7.5166 7.9053 7.9053 7.9087 7.9087 9.7786 9.7786 9.7944 9.7944 10.9022 10.9022 10.9102 10.9102 11.4670 11.4670 11.4677 11.4677 12.1451 12.1451 12.1671 12.1671 k = 0.5000-0.0137 0.6027 ( 3400 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4539 -13.4539 -13.4369 -13.4369 -12.1585 -12.1585 -11.9957 -11.9957 -11.9671 -11.9671 -11.8218 -11.8218 -3.4131 -3.4131 -3.4047 -3.4047 -1.2968 -1.2968 -1.2910 -1.2910 5.5636 5.5636 5.5717 5.5717 5.7541 5.7541 5.7608 5.7608 7.4940 7.4940 7.5153 7.5153 7.9073 7.9073 7.9107 7.9107 9.8142 9.8142 9.8310 9.8310 10.8716 10.8716 10.8806 10.8806 11.4775 11.4775 11.4781 11.4781 12.1213 12.1213 12.1435 12.1435 k = 0.5000-0.0000 0.6124 ( 3400 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4539 -13.4539 -13.4369 -13.4369 -12.1587 -12.1587 -11.9942 -11.9942 -11.9685 -11.9685 -11.8217 -11.8217 -3.4130 -3.4130 -3.4045 -3.4045 -1.2972 -1.2972 -1.2913 -1.2913 5.6038 5.6038 5.6190 5.6190 5.7043 5.7043 5.7182 5.7182 7.4935 7.4935 7.5149 7.5149 7.9080 7.9080 7.9114 7.9114 9.8265 9.8265 9.8437 9.8437 10.8609 10.8609 10.8703 10.8703 11.4813 11.4813 11.4818 11.4818 12.1131 12.1131 12.1354 12.1354 k = 0.5000-0.0000 0.6124 ( 3400 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4539 -13.4539 -13.4369 -13.4369 -12.1587 -12.1587 -11.9942 -11.9942 -11.9685 -11.9685 -11.8217 -11.8217 -3.4130 -3.4130 -3.4045 -3.4045 -1.2972 -1.2972 -1.2913 -1.2913 5.6038 5.6038 5.6190 5.6190 5.7043 5.7043 5.7182 5.7182 7.4935 7.4935 7.5149 7.5149 7.9080 7.9080 7.9114 7.9114 9.8265 9.8265 9.8437 9.8437 10.8609 10.8609 10.8703 10.8703 11.4813 11.4813 11.4818 11.4818 12.1131 12.1131 12.1354 12.1354 k = 0.4917 0.0144 0.6124 ( 3400 PWs) bands (ev): -32.4415 -32.4415 -32.4399 -32.4399 -13.4541 -13.4541 -13.4366 -13.4366 -12.1586 -12.1586 -11.9949 -11.9949 -11.9678 -11.9678 -11.8217 -11.8217 -3.4352 -3.4352 -3.3822 -3.3822 -1.2984 -1.2984 -1.2896 -1.2896 5.5403 5.5403 5.6328 5.6328 5.7234 5.7234 5.7524 5.7524 7.4500 7.4500 7.5473 7.5473 7.8688 7.8688 7.9621 7.9621 9.7852 9.7852 9.8697 9.8697 10.8337 10.8337 10.9107 10.9107 11.4598 11.4598 11.5000 11.5000 12.0873 12.0873 12.1685 12.1685 k = 0.4833 0.0289 0.6124 ( 3396 PWs) bands (ev): -32.4422 -32.4422 -32.4391 -32.4391 -13.4546 -13.4546 -13.4361 -13.4361 -12.1584 -12.1584 -11.9967 -11.9967 -11.9660 -11.9660 -11.8218 -11.8218 -3.4595 -3.4595 -3.3579 -3.3579 -1.3009 -1.3009 -1.2859 -1.2859 5.4523 5.4523 5.6326 5.6326 5.7597 5.7597 5.8154 5.8154 7.3908 7.3908 7.5705 7.5705 7.8469 7.8469 8.0218 8.0218 9.7336 9.7336 9.8770 9.8770 10.8061 10.8061 10.9757 10.9757 11.4354 11.4354 11.5166 11.5166 12.0550 12.0550 12.2212 12.2212 k = 0.4750 0.0433 0.6124 ( 3400 PWs) bands (ev): -32.4430 -32.4430 -32.4384 -32.4384 -13.4553 -13.4553 -13.4353 -13.4353 -12.1582 -12.1582 -11.9992 -11.9992 -11.9636 -11.9636 -11.8221 -11.8221 -3.4821 -3.4821 -3.3352 -3.3352 -1.3034 -1.3034 -1.2814 -1.2814 5.3665 5.3665 5.6236 5.6236 5.8061 5.8061 5.8823 5.8823 7.3277 7.3277 7.5672 7.5672 7.8522 7.8522 8.0857 8.0857 9.6794 9.6794 9.8625 9.8625 10.7817 10.7817 11.0539 11.0539 11.4130 11.4130 11.5310 11.5310 12.0244 12.0244 12.2823 12.2823 k = 0.4667 0.0577 0.6124 ( 3404 PWs) bands (ev): -32.4436 -32.4436 -32.4378 -32.4378 -13.4562 -13.4562 -13.4344 -13.4344 -12.1578 -12.1578 -12.0021 -12.0021 -11.9609 -11.9609 -11.8223 -11.8223 -3.5030 -3.5030 -3.3143 -3.3143 -1.3059 -1.3059 -1.2764 -1.2764 5.2856 5.2856 5.6123 5.6123 5.8564 5.8564 5.9501 5.9501 7.2626 7.2626 7.5396 7.5396 7.8822 7.8822 8.1521 8.1521 9.6234 9.6234 9.8313 9.8313 10.7606 10.7606 11.1330 11.1330 11.4008 11.4008 11.5428 11.5428 11.9960 11.9960 12.3487 12.3487 k = 0.4583 0.0722 0.6124 ( 3398 PWs) bands (ev): -32.4442 -32.4442 -32.4371 -32.4371 -13.4571 -13.4571 -13.4334 -13.4334 -12.1574 -12.1574 -12.0050 -12.0050 -11.9581 -11.9581 -11.8226 -11.8226 -3.5221 -3.5221 -3.2951 -3.2951 -1.3083 -1.3083 -1.2711 -1.2711 5.2105 5.2105 5.6007 5.6007 5.9088 5.9088 6.0179 6.0179 7.1964 7.1964 7.4979 7.4979 7.9263 7.9263 8.2203 8.2203 9.5661 9.5661 9.7880 9.7880 10.7423 10.7423 11.1920 11.1920 11.4160 11.4160 11.5520 11.5520 11.9699 11.9699 12.4175 12.4175 k = 0.4500 0.0866 0.6124 ( 3400 PWs) bands (ev): -32.4448 -32.4448 -32.4366 -32.4366 -13.4580 -13.4580 -13.4324 -13.4324 -12.1569 -12.1569 -12.0079 -12.0079 -11.9553 -11.9553 -11.8230 -11.8230 -3.5395 -3.5395 -3.2777 -3.2777 -1.3104 -1.3104 -1.2656 -1.2656 5.1416 5.1416 5.5896 5.5896 5.9624 5.9624 6.0851 6.0851 7.1299 7.1299 7.4494 7.4494 7.9770 7.9770 8.2896 8.2896 9.5084 9.5084 9.7360 9.7360 10.7267 10.7267 11.2125 11.2125 11.4734 11.4734 11.5587 11.5587 11.9460 11.9460 12.4860 12.4860 k = 0.4417 0.1010 0.6124 ( 3406 PWs) bands (ev): -32.4453 -32.4453 -32.4361 -32.4361 -13.4588 -13.4588 -13.4315 -13.4315 -12.1564 -12.1564 -12.0107 -12.0107 -11.9527 -11.9527 -11.8234 -11.8234 -3.5550 -3.5550 -3.2622 -3.2622 -1.3124 -1.3124 -1.2602 -1.2602 5.0791 5.0791 5.5793 5.5793 6.0169 6.0169 6.1511 6.1511 7.0635 7.0635 7.3981 7.3981 8.0302 8.0302 8.3595 8.3595 9.4509 9.4509 9.6782 9.6782 10.7133 10.7133 11.2065 11.2065 11.5566 11.5566 11.5650 11.5650 11.9242 11.9242 12.5504 12.5504 k = 0.4333 0.1155 0.6124 ( 3413 PWs) bands (ev): -32.4458 -32.4458 -32.4357 -32.4357 -13.4596 -13.4596 -13.4306 -13.4306 -12.1559 -12.1559 -12.0133 -12.0133 -11.9503 -11.9503 -11.8237 -11.8237 -3.5688 -3.5688 -3.2486 -3.2486 -1.3141 -1.3141 -1.2549 -1.2549 5.0234 5.0234 5.5699 5.5699 6.0721 6.0721 6.2155 6.2155 6.9975 6.9975 7.3459 7.3459 8.0835 8.0835 8.4294 8.4294 9.3947 9.3947 9.6165 9.6165 10.7021 10.7021 11.1910 11.1910 11.5654 11.5654 11.6518 11.6518 11.9044 11.9044 12.6071 12.6071 k = 0.4250 0.1299 0.6124 ( 3409 PWs) bands (ev): -32.4461 -32.4461 -32.4353 -32.4353 -13.4603 -13.4603 -13.4299 -13.4299 -12.1554 -12.1554 -12.0156 -12.0156 -11.9481 -11.9481 -11.8241 -11.8241 -3.5808 -3.5808 -3.2367 -3.2367 -1.3156 -1.3156 -1.2499 -1.2499 4.9746 4.9746 5.5617 5.5617 6.1277 6.1277 6.2773 6.2773 6.9323 6.9323 7.2944 7.2944 8.1353 8.1353 8.4987 8.4987 9.3406 9.3406 9.5528 9.5528 10.6928 10.6928 11.1735 11.1735 11.5667 11.5667 11.7432 11.7432 11.8868 11.8868 12.6523 12.6523 k = 0.4167 0.1443 0.6124 ( 3407 PWs) bands (ev): -32.4465 -32.4465 -32.4349 -32.4349 -13.4609 -13.4609 -13.4292 -13.4292 -12.1549 -12.1549 -12.0177 -12.0177 -11.9461 -11.9461 -11.8245 -11.8245 -3.5909 -3.5909 -3.2268 -3.2268 -1.3169 -1.3169 -1.2455 -1.2455 4.9331 4.9331 5.5546 5.5546 6.1833 6.1833 6.3356 6.3356 6.8684 6.8684 7.2447 7.2447 8.1842 8.1842 8.5665 8.5665 9.2899 9.2899 9.4888 9.4888 10.6852 10.6852 11.1569 11.1569 11.5672 11.5672 11.8266 11.8266 11.8728 11.8728 12.6845 12.6845 k = 0.4083 0.1588 0.6124 ( 3401 PWs) bands (ev): -32.4467 -32.4467 -32.4347 -32.4347 -13.4614 -13.4614 -13.4286 -13.4286 -12.1545 -12.1545 -12.0194 -12.0194 -11.9445 -11.9445 -11.8248 -11.8248 -3.5992 -3.5992 -3.2186 -3.2186 -1.3180 -1.3180 -1.2416 -1.2416 4.8988 4.8988 5.5488 5.5488 6.2383 6.2383 6.3891 6.3891 6.8065 6.8065 7.1984 7.1984 8.2284 8.2284 8.6313 8.6313 9.2442 9.2442 9.4264 9.4264 10.6792 10.6792 11.1424 11.1424 11.5672 11.5672 11.8541 11.8541 11.9073 11.9073 12.7044 12.7044 k = 0.4000 0.1732 0.6124 ( 3408 PWs) bands (ev): -32.4469 -32.4469 -32.4345 -32.4345 -13.4617 -13.4617 -13.4282 -13.4282 -12.1542 -12.1542 -12.0208 -12.0208 -11.9433 -11.9433 -11.8250 -11.8250 -3.6056 -3.6056 -3.2123 -3.2123 -1.3188 -1.3188 -1.2385 -1.2385 4.8720 4.8720 5.5442 5.5442 6.2913 6.2913 6.4357 6.4357 6.7479 6.7479 7.1575 7.1575 8.2662 8.2662 8.6908 8.6908 9.2053 9.2053 9.3684 9.3684 10.6746 10.6746 11.1307 11.1307 11.5670 11.5670 11.8444 11.8444 11.9687 11.9687 12.7148 12.7148 k = 0.3917 0.1876 0.6124 ( 3410 PWs) bands (ev): -32.4471 -32.4471 -32.4343 -32.4343 -13.4620 -13.4620 -13.4279 -13.4279 -12.1539 -12.1539 -12.0218 -12.0218 -11.9423 -11.9423 -11.8252 -11.8252 -3.6103 -3.6103 -3.2077 -3.2077 -1.3194 -1.3194 -1.2362 -1.2362 4.8528 4.8528 5.5409 5.5409 6.3397 6.3397 6.4727 6.4727 6.6954 6.6954 7.1246 7.1246 8.2954 8.2954 8.7411 8.7411 9.1752 9.1752 9.3190 9.3190 10.6714 10.6714 11.1222 11.1222 11.5668 11.5668 11.8365 11.8365 12.0158 12.0158 12.7190 12.7190 k = 0.3833 0.2021 0.6124 ( 3422 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4277 -13.4277 -12.1537 -12.1537 -12.0224 -12.0224 -11.9418 -11.9418 -11.8253 -11.8253 -3.6130 -3.6130 -3.2050 -3.2050 -1.3198 -1.3198 -1.2348 -1.2348 4.8412 4.8412 5.5389 5.5389 6.3772 6.3772 6.4972 6.4972 6.6552 6.6552 7.1029 7.1029 8.3141 8.3141 8.7762 8.7762 9.1561 9.1561 9.2843 9.2843 10.6695 10.6695 11.1170 11.1170 11.5667 11.5667 11.8316 11.8316 12.0452 12.0452 12.7201 12.7201 k = 0.3750 0.2165 0.6124 ( 3414 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4276 -13.4276 -12.1537 -12.1537 -12.0226 -12.0226 -11.9416 -11.9416 -11.8254 -11.8254 -3.6140 -3.6140 -3.2041 -3.2041 -1.3199 -1.3199 -1.2343 -1.2343 4.8374 4.8374 5.5382 5.5382 6.3923 6.3923 6.5059 6.5059 6.6390 6.6390 7.0953 7.0953 8.3205 8.3205 8.7891 8.7891 9.1496 9.1496 9.2716 9.2716 10.6688 10.6688 11.1152 11.1152 11.5666 11.5666 11.8299 11.8299 12.0553 12.0553 12.7203 12.7203 k = 0.3750 0.2165 0.6124 ( 3414 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4276 -13.4276 -12.1537 -12.1537 -12.0226 -12.0226 -11.9416 -11.9416 -11.8254 -11.8254 -3.6140 -3.6140 -3.2041 -3.2041 -1.3199 -1.3199 -1.2343 -1.2343 4.8374 4.8374 5.5382 5.5382 6.3923 6.3923 6.5059 6.5059 6.6390 6.6390 7.0953 7.0953 8.3205 8.3205 8.7891 8.7891 9.1496 9.1496 9.2716 9.2716 10.6688 10.6688 11.1152 11.1152 11.5666 11.5666 11.8299 11.8299 12.0553 12.0553 12.7203 12.7203 k = 0.3663 0.2115 0.5981 ( 3418 PWs) bands (ev): -32.4481 -32.4481 -32.4333 -32.4333 -13.4642 -13.4642 -13.4255 -13.4255 -12.1553 -12.1553 -12.0167 -12.0167 -11.9474 -11.9474 -11.8240 -11.8240 -3.6407 -3.6407 -3.1715 -3.1715 -1.3253 -1.3253 -1.2341 -1.2341 4.8449 4.8449 5.6445 5.6445 6.3141 6.3141 6.4317 6.4317 6.5655 6.5655 7.0630 7.0630 8.3778 8.3778 8.8734 8.8734 9.1688 9.1688 9.3662 9.3662 10.5873 10.5873 11.1204 11.1204 11.6156 11.6156 11.7278 11.7278 12.0472 12.0472 12.7293 12.7293 k = 0.3576 0.2064 0.5839 ( 3416 PWs) bands (ev): -32.4490 -32.4490 -32.4324 -32.4324 -13.4662 -13.4662 -13.4232 -13.4232 -12.1566 -12.1566 -12.0108 -12.0108 -11.9531 -11.9531 -11.8228 -11.8228 -3.6691 -3.6691 -3.1368 -3.1368 -1.3295 -1.3295 -1.2337 -1.2337 4.8504 4.8504 5.7530 5.7530 6.2398 6.2398 6.3614 6.3614 6.4936 6.4936 7.0304 7.0304 8.4364 8.4364 8.9578 8.9578 9.1617 9.1617 9.4598 9.4598 10.5297 10.5297 11.1286 11.1286 11.6239 11.6239 11.6738 11.6738 12.0395 12.0395 12.7344 12.7344 k = 0.3488 0.2014 0.5696 ( 3412 PWs) bands (ev): -32.4500 -32.4500 -32.4314 -32.4314 -13.4684 -13.4684 -13.4207 -13.4207 -12.1577 -12.1577 -12.0051 -12.0051 -11.9588 -11.9588 -11.8218 -11.8218 -3.6993 -3.6993 -3.1000 -3.1000 -1.3326 -1.3326 -1.2332 -1.2332 4.8533 4.8533 5.8580 5.8580 6.1752 6.1752 6.2953 6.2953 6.4234 6.4234 6.9976 6.9976 8.4962 8.4962 9.0401 9.0401 9.1278 9.1278 9.5521 9.5521 10.4990 10.4990 11.1400 11.1400 11.5337 11.5337 11.7263 11.7263 12.0323 12.0323 12.7352 12.7352 k = 0.3401 0.1964 0.5554 ( 3420 PWs) bands (ev): -32.4510 -32.4510 -32.4304 -32.4304 -13.4706 -13.4706 -13.4182 -13.4182 -12.1586 -12.1586 -11.9996 -11.9996 -11.9642 -11.9642 -11.8210 -11.8210 -3.7310 -3.7310 -3.0612 -3.0612 -1.3344 -1.3344 -1.2324 -1.2324 4.8530 4.8530 5.9350 5.9350 6.1433 6.1433 6.2346 6.2346 6.3551 6.3551 6.9644 6.9644 8.5573 8.5573 9.0498 9.0498 9.1384 9.1384 9.6431 9.6431 10.4948 10.4948 11.1546 11.1546 11.4468 11.4468 11.7838 11.7838 12.0257 12.0257 12.7316 12.7316 k = 0.3314 0.1913 0.5412 ( 3430 PWs) bands (ev): -32.4521 -32.4521 -32.4294 -32.4294 -13.4728 -13.4728 -13.4155 -13.4155 -12.1592 -12.1592 -11.9948 -11.9948 -11.9691 -11.9691 -11.8204 -11.8204 -3.7642 -3.7642 -3.0205 -3.0205 -1.3350 -1.3350 -1.2314 -1.2314 4.8491 4.8491 5.9336 5.9336 6.1641 6.1641 6.2087 6.2087 6.2901 6.2901 6.9308 6.9308 8.6195 8.6195 8.9626 8.9626 9.2217 9.2217 9.7325 9.7325 10.5135 10.5135 11.1721 11.1721 11.3662 11.3662 11.8439 11.8439 12.0200 12.0200 12.7234 12.7234 k = 0.3227 0.1863 0.5269 ( 3418 PWs) bands (ev): -32.4532 -32.4532 -32.4283 -32.4283 -13.4752 -13.4752 -13.4127 -13.4127 -12.1596 -12.1596 -11.9914 -11.9914 -11.9726 -11.9726 -11.8200 -11.8200 -3.7988 -3.7988 -2.9777 -2.9777 -1.3342 -1.3342 -1.2302 -1.2302 4.8411 4.8411 5.8817 5.8817 6.1188 6.1188 6.2187 6.2187 6.3181 6.3181 6.8967 6.8967 8.6825 8.6825 8.8529 8.8529 9.3088 9.3088 9.8201 9.8201 10.5499 10.5499 11.1922 11.1922 11.2930 11.2930 11.9062 11.9062 12.0154 12.0154 12.7104 12.7104 k = 0.3140 0.1813 0.5127 ( 3430 PWs) bands (ev): -32.4543 -32.4543 -32.4272 -32.4272 -13.4775 -13.4775 -13.4097 -13.4097 -12.1598 -12.1598 -11.9913 -11.9913 -11.9728 -11.9728 -11.8198 -11.8198 -3.8347 -3.8347 -2.9330 -2.9330 -1.3322 -1.3322 -1.2287 -1.2287 4.8286 4.8286 5.8179 5.8179 6.0714 6.0714 6.1570 6.1570 6.4445 6.4445 6.8622 6.8622 8.7204 8.7204 8.7545 8.7545 9.3972 9.3972 9.9056 9.9056 10.5988 10.5988 11.2072 11.2072 11.2355 11.2355 11.9702 11.9702 12.0124 12.0124 12.6924 12.6924 k = 0.3052 0.1762 0.4984 ( 3426 PWs) bands (ev): -32.4554 -32.4554 -32.4261 -32.4261 -13.4800 -13.4800 -13.4067 -13.4067 -12.1598 -12.1598 -11.9945 -11.9945 -11.9698 -11.9698 -11.8197 -11.8197 -3.8716 -3.8716 -2.8865 -2.8865 -1.3289 -1.3289 -1.2270 -1.2270 4.8113 4.8113 5.7519 5.7519 6.0281 6.0281 6.0956 6.0956 6.5810 6.5810 6.8270 6.8270 8.5902 8.5902 8.8150 8.8150 9.4865 9.4865 9.9890 9.9890 10.6556 10.6556 11.1639 11.1639 11.2474 11.2474 12.0087 12.0087 12.0382 12.0382 12.6692 12.6692 k = 0.2965 0.1712 0.4842 ( 3432 PWs) bands (ev): -32.4566 -32.4566 -32.4249 -32.4249 -13.4824 -13.4824 -13.4036 -13.4036 -12.1596 -12.1596 -11.9993 -11.9993 -11.9653 -11.9653 -11.8198 -11.8198 -3.9095 -3.9095 -2.8381 -2.8381 -1.3244 -1.3244 -1.2250 -1.2250 4.7892 4.7892 5.6865 5.6865 5.9889 5.9889 6.0359 6.0359 6.7231 6.7231 6.7913 6.7913 8.4481 8.4481 8.8816 8.8816 9.5767 9.5767 10.0701 10.0701 10.7162 10.7162 11.1165 11.1165 11.2759 11.2759 12.0091 12.0091 12.1053 12.1053 12.6405 12.6405 k = 0.2878 0.1662 0.4700 ( 3424 PWs) bands (ev): -32.4577 -32.4577 -32.4237 -32.4237 -13.4849 -13.4849 -13.4003 -13.4003 -12.1592 -12.1592 -12.0046 -12.0046 -11.9603 -11.9603 -11.8200 -11.8200 -3.9483 -3.9483 -2.7879 -2.7879 -1.3188 -1.3188 -1.2227 -1.2227 4.7622 4.7622 5.6227 5.6227 5.9529 5.9529 5.9789 5.9789 6.7550 6.7550 6.8694 6.8694 8.3012 8.3012 8.9496 8.9496 9.6677 9.6677 10.1486 10.1486 10.7761 10.7761 11.0807 11.0807 11.3077 11.3077 12.0107 12.0107 12.1743 12.1743 12.6061 12.6061 k = 0.2791 0.1611 0.4557 ( 3418 PWs) bands (ev): -32.4589 -32.4589 -32.4225 -32.4225 -13.4874 -13.4874 -13.3970 -13.3970 -12.1586 -12.1586 -12.0101 -12.0101 -11.9551 -11.9551 -11.8204 -11.8204 -3.9877 -3.9877 -2.7360 -2.7360 -1.3121 -1.3121 -1.2201 -1.2201 4.7304 4.7304 5.5612 5.5612 5.9133 5.9133 5.9309 5.9309 6.7181 6.7181 7.0193 7.0193 8.1519 8.1519 9.0188 9.0188 9.7596 9.7596 10.2245 10.2245 10.8284 10.8284 11.0622 11.0622 11.3420 11.3420 12.0142 12.0142 12.2442 12.2442 12.5657 12.5657 k = 0.2703 0.1561 0.4415 ( 3418 PWs) bands (ev): -32.4601 -32.4601 -32.4213 -32.4213 -13.4900 -13.4900 -13.3935 -13.3935 -12.1579 -12.1579 -12.0157 -12.0157 -11.9499 -11.9499 -11.8210 -11.8210 -4.0276 -4.0276 -2.6824 -2.6824 -1.3046 -1.3046 -1.2171 -1.2171 4.6942 4.6942 5.5022 5.5022 5.8622 5.8622 5.8993 5.8993 6.6806 6.6806 7.1722 7.1722 8.0015 8.0015 9.0891 9.0891 9.8523 9.8523 10.2975 10.2975 10.8634 10.8634 11.0700 11.0700 11.3783 11.3783 12.0198 12.0198 12.3144 12.3144 12.5191 12.5191 k = 0.2616 0.1511 0.4272 ( 3422 PWs) bands (ev): -32.4614 -32.4614 -32.4201 -32.4201 -13.4925 -13.4925 -13.3900 -13.3900 -12.1570 -12.1570 -12.0213 -12.0213 -11.9447 -11.9447 -11.8216 -11.8216 -4.0678 -4.0678 -2.6272 -2.6272 -1.2962 -1.2962 -1.2139 -1.2139 4.6539 4.6539 5.4459 5.4459 5.8097 5.8097 5.8734 5.8734 6.6426 6.6426 7.3277 7.3277 7.8514 7.8514 9.1603 9.1603 9.9458 9.9458 10.3676 10.3676 10.8776 10.8776 11.1068 11.1068 11.4164 11.4164 12.0275 12.0275 12.3837 12.3837 12.4660 12.4660 k = 0.2529 0.1460 0.4130 ( 3418 PWs) bands (ev): -32.4626 -32.4626 -32.4189 -32.4189 -13.4950 -13.4950 -13.3864 -13.3864 -12.1560 -12.1560 -12.0269 -12.0269 -11.9396 -11.9396 -11.8225 -11.8225 -4.1083 -4.1083 -2.5705 -2.5705 -1.2870 -1.2870 -1.2104 -1.2104 4.6098 4.6098 5.3927 5.3927 5.7585 5.7585 5.8497 5.8497 6.6040 6.6040 7.4855 7.4855 7.7025 7.7025 9.2326 9.2326 10.0403 10.0403 10.4346 10.4346 10.8803 10.8803 11.1628 11.1628 11.4559 11.4559 12.0374 12.0374 12.4061 12.4061 12.4500 12.4500 k = 0.2442 0.1410 0.3988 ( 3418 PWs) bands (ev): -32.4638 -32.4638 -32.4176 -32.4176 -13.4975 -13.4975 -13.3828 -13.3828 -12.1548 -12.1548 -12.0324 -12.0324 -11.9345 -11.9345 -11.8234 -11.8234 -4.1488 -4.1488 -2.5124 -2.5124 -1.2773 -1.2773 -1.2066 -1.2066 4.5624 4.5624 5.3426 5.3426 5.7088 5.7088 5.8275 5.8275 6.5650 6.5650 7.5554 7.5554 7.6454 7.6454 9.3059 9.3059 10.1355 10.1355 10.4986 10.4986 10.8813 10.8813 11.2276 11.2276 11.4964 11.4964 12.0496 12.0496 12.3397 12.3397 12.5065 12.5065 k = 0.2355 0.1359 0.3845 ( 3423 PWs) bands (ev): -32.4650 -32.4650 -32.4164 -32.4164 -13.5000 -13.5000 -13.3791 -13.3791 -12.1535 -12.1535 -12.0379 -12.0379 -11.9295 -11.9295 -11.8244 -11.8244 -4.1893 -4.1893 -2.4529 -2.4529 -1.2671 -1.2671 -1.2025 -1.2025 4.5120 4.5120 5.2958 5.2958 5.6609 5.6609 5.8058 5.8058 6.5256 6.5256 7.4115 7.4115 7.8067 7.8067 9.3801 9.3801 10.2317 10.2317 10.5595 10.5595 10.8852 10.8852 11.2960 11.2960 11.5375 11.5375 12.0639 12.0639 12.2667 12.2667 12.5361 12.5361 k = 0.2267 0.1309 0.3703 ( 3427 PWs) bands (ev): -32.4662 -32.4662 -32.4152 -32.4152 -13.5025 -13.5025 -13.3754 -13.3754 -12.1522 -12.1522 -12.0432 -12.0432 -11.9247 -11.9247 -11.8255 -11.8255 -4.2295 -4.2295 -2.3921 -2.3921 -1.2566 -1.2566 -1.1982 -1.1982 4.4589 4.4589 5.2523 5.2523 5.6147 5.6147 5.7841 5.7841 6.4858 6.4858 7.2710 7.2710 7.9694 7.9694 9.4551 9.4551 10.3287 10.3287 10.6172 10.6172 10.8940 10.8940 11.3656 11.3656 11.5787 11.5787 12.0800 12.0800 12.1877 12.1877 12.5274 12.5274 k = 0.2180 0.1259 0.3560 ( 3423 PWs) bands (ev): -32.4674 -32.4674 -32.4140 -32.4140 -13.5050 -13.5050 -13.3717 -13.3717 -12.1507 -12.1507 -12.0485 -12.0485 -11.9199 -11.9199 -11.8267 -11.8267 -4.2693 -4.2693 -2.3302 -2.3302 -1.2458 -1.2458 -1.1936 -1.1936 4.4035 4.4035 5.2123 5.2123 5.5702 5.5702 5.7618 5.7618 6.4458 6.4458 7.1348 7.1348 8.1332 8.1332 9.5310 9.5310 10.4266 10.4266 10.6719 10.6719 10.9083 10.9083 11.4353 11.4353 11.6196 11.6196 12.0879 12.0879 12.1132 12.1132 12.4984 12.4984 k = 0.2093 0.1208 0.3418 ( 3415 PWs) bands (ev): -32.4686 -32.4686 -32.4128 -32.4128 -13.5074 -13.5074 -13.3680 -13.3680 -12.1492 -12.1492 -12.0536 -12.0536 -11.9153 -11.9153 -11.8280 -11.8280 -4.3086 -4.3086 -2.2672 -2.2672 -1.2349 -1.2349 -1.1887 -1.1887 4.3461 4.3461 5.1758 5.1758 5.5274 5.5274 5.7384 5.7384 6.4057 6.4057 7.0036 7.0036 8.2976 8.2976 9.6077 9.6077 10.5253 10.5253 10.7235 10.7235 10.9282 10.9282 11.5045 11.5045 11.6593 11.6593 12.0085 12.0085 12.1228 12.1228 12.4637 12.4637 k = 0.2006 0.1158 0.3275 ( 3413 PWs) bands (ev): -32.4698 -32.4698 -32.4116 -32.4116 -13.5097 -13.5097 -13.3642 -13.3642 -12.1476 -12.1476 -12.0586 -12.0586 -11.9107 -11.9107 -11.8293 -11.8293 -4.3472 -4.3472 -2.2034 -2.2034 -1.2239 -1.2239 -1.1836 -1.1836 4.2867 4.2867 5.1428 5.1428 5.4864 5.4864 5.7135 5.7135 6.3656 6.3656 6.8779 6.8779 8.4622 8.4622 9.6851 9.6851 10.6247 10.6247 10.7723 10.7723 10.9535 10.9535 11.5726 11.5726 11.6971 11.6971 11.9147 11.9147 12.1448 12.1448 12.4278 12.4278 k = 0.1919 0.1108 0.3133 ( 3415 PWs) bands (ev): -32.4709 -32.4709 -32.4105 -32.4105 -13.5121 -13.5121 -13.3605 -13.3605 -12.1459 -12.1459 -12.0635 -12.0635 -11.9063 -11.9063 -11.8307 -11.8307 -4.3851 -4.3851 -2.1388 -2.1388 -1.2131 -1.2131 -1.1784 -1.1784 4.2257 4.2257 5.1133 5.1133 5.4472 5.4472 5.6868 5.6868 6.3257 6.3257 6.7585 6.7585 8.6269 8.6269 9.7632 9.7632 10.7249 10.7249 10.8184 10.8184 10.9838 10.9838 11.6392 11.6392 11.7288 11.7288 11.8214 11.8214 12.1689 12.1689 12.3923 12.3923 k = 0.1831 0.1057 0.2991 ( 3425 PWs) bands (ev): -32.4721 -32.4721 -32.4094 -32.4094 -13.5143 -13.5143 -13.3568 -13.3568 -12.1442 -12.1442 -12.0683 -12.0683 -11.9021 -11.9021 -11.8322 -11.8322 -4.4221 -4.4221 -2.0736 -2.0736 -1.2024 -1.2024 -1.1729 -1.1729 4.1632 4.1632 5.0873 5.0873 5.4097 5.4097 5.6578 5.6578 6.2860 6.2860 6.6460 6.6460 8.7910 8.7910 9.8418 9.8418 10.8250 10.8250 10.8623 10.8623 11.0185 11.0185 11.6865 11.6865 11.7168 11.7168 11.7846 11.7846 12.1946 12.1946 12.3577 12.3577 k = 0.1744 0.1007 0.2848 ( 3421 PWs) bands (ev): -32.4732 -32.4732 -32.4083 -32.4083 -13.5165 -13.5165 -13.3532 -13.3532 -12.1425 -12.1425 -12.0728 -12.0728 -11.8980 -11.8980 -11.8337 -11.8337 -4.4581 -4.4581 -2.0080 -2.0080 -1.1919 -1.1919 -1.1674 -1.1674 4.0993 4.0993 5.0646 5.0646 5.3740 5.3740 5.6263 5.6263 6.2467 6.2467 6.5410 6.5410 8.9543 8.9543 9.9210 9.9210 10.9002 10.9002 10.9290 10.9290 11.0570 11.0570 11.5979 11.5979 11.7715 11.7715 11.8114 11.8114 12.2213 12.2213 12.3242 12.3242 k = 0.1657 0.0957 0.2706 ( 3421 PWs) bands (ev): -32.4742 -32.4742 -32.4072 -32.4072 -13.5186 -13.5186 -13.3496 -13.3496 -12.1409 -12.1409 -12.0772 -12.0772 -11.8940 -11.8940 -11.8352 -11.8352 -4.4931 -4.4931 -1.9423 -1.9423 -1.1818 -1.1818 -1.1617 -1.1617 4.0342 4.0342 5.0453 5.0453 5.3400 5.3400 5.5923 5.5923 6.2080 6.2080 6.4439 6.4439 9.1163 9.1163 10.0006 10.0006 10.9396 10.9396 11.0284 11.0284 11.0987 11.0987 11.4955 11.4955 11.8258 11.8258 11.8480 11.8480 12.2488 12.2488 12.2917 12.2917 k = 0.1570 0.0906 0.2563 ( 3433 PWs) bands (ev): -32.4753 -32.4753 -32.4062 -32.4062 -13.5207 -13.5207 -13.3461 -13.3461 -12.1392 -12.1392 -12.0815 -12.0815 -11.8902 -11.8902 -11.8367 -11.8367 -4.5268 -4.5268 -1.8765 -1.8765 -1.1720 -1.1720 -1.1560 -1.1560 3.9681 3.9681 5.0292 5.0292 5.3078 5.3078 5.5557 5.5557 6.1700 6.1700 6.3551 6.3551 9.2766 9.2766 10.0806 10.0806 10.9760 10.9760 11.1242 11.1242 11.1436 11.1436 11.3959 11.3959 11.8573 11.8573 11.9039 11.9039 12.2587 12.2587 12.2782 12.2782 k = 0.1483 0.0856 0.2421 ( 3435 PWs) bands (ev): -32.4763 -32.4763 -32.4052 -32.4052 -13.5226 -13.5226 -13.3427 -13.3427 -12.1375 -12.1375 -12.0855 -12.0855 -11.8865 -11.8865 -11.8382 -11.8382 -4.5592 -4.5592 -1.8110 -1.8110 -1.1627 -1.1627 -1.1503 -1.1503 3.9012 3.9012 5.0162 5.0162 5.2774 5.2774 5.5167 5.5167 6.1328 6.1328 6.2748 6.2748 9.4346 9.4346 10.1608 10.1608 11.0101 11.0101 11.1853 11.1853 11.1968 11.1968 11.3248 11.3248 11.8796 11.8796 11.9643 11.9643 12.2278 12.2278 12.3062 12.3062 k = 0.1395 0.0806 0.2279 ( 3437 PWs) bands (ev): -32.4773 -32.4773 -32.4042 -32.4042 -13.5245 -13.5245 -13.3394 -13.3394 -12.1359 -12.1359 -12.0894 -12.0894 -11.8830 -11.8830 -11.8396 -11.8396 -4.5903 -4.5903 -1.7460 -1.7460 -1.1539 -1.1539 -1.1445 -1.1445 3.8338 3.8338 5.0060 5.0060 5.2487 5.2487 5.4756 5.4756 6.0967 6.0967 6.2028 6.2028 9.5899 9.5899 10.2411 10.2411 11.0422 11.0422 11.1485 11.1485 11.2324 11.2324 11.3713 11.3713 11.8971 11.8971 12.0243 12.0243 12.1966 12.1966 12.3347 12.3347 k = 0.1308 0.0755 0.2136 ( 3449 PWs) bands (ev): -32.4782 -32.4782 -32.4034 -32.4034 -13.5263 -13.5263 -13.3362 -13.3362 -12.1343 -12.1343 -12.0931 -12.0931 -11.8796 -11.8796 -11.8411 -11.8411 -4.6199 -4.6199 -1.6818 -1.6818 -1.1457 -1.1457 -1.1388 -1.1388 3.7662 3.7662 4.9986 4.9986 5.2217 5.2217 5.4331 5.4331 6.0618 6.0618 6.1389 6.1389 9.7419 9.7419 10.3214 10.3214 11.0551 11.0551 11.0725 11.0725 11.2778 11.2778 11.4665 11.4665 11.9103 11.9103 12.0833 12.0833 12.1654 12.1654 12.3630 12.3630 k = 0.1221 0.0705 0.1994 ( 3437 PWs) bands (ev): -32.4790 -32.4790 -32.4025 -32.4025 -13.5279 -13.5279 -13.3331 -13.3331 -12.1327 -12.1327 -12.0966 -12.0966 -11.8764 -11.8764 -11.8425 -11.8425 -4.6479 -4.6479 -1.6188 -1.6188 -1.1379 -1.1379 -1.1333 -1.1333 3.6988 3.6988 4.9936 4.9936 5.1965 5.1965 5.3897 5.3897 6.0283 6.0283 6.0827 6.0827 9.8900 9.8900 10.4016 10.4016 10.9586 10.9586 11.1009 11.1009 11.3219 11.3219 11.5677 11.5677 11.9194 11.9194 12.1316 12.1316 12.1432 12.1432 12.3908 12.3908 k = 0.1134 0.0655 0.1851 ( 3437 PWs) bands (ev): -32.4798 -32.4798 -32.4016 -32.4016 -13.5295 -13.5295 -13.3302 -13.3302 -12.1312 -12.1312 -12.0999 -12.0999 -11.8734 -11.8734 -11.8439 -11.8439 -4.6743 -4.6743 -1.5572 -1.5572 -1.1308 -1.1308 -1.1278 -1.1278 3.6320 3.6320 4.9908 4.9908 5.1731 5.1731 5.3463 5.3463 5.9962 5.9962 6.0333 6.0333 10.0335 10.0335 10.4815 10.4815 10.8644 10.8644 11.1277 11.1277 11.3642 11.3642 11.6689 11.6689 11.9250 11.9250 12.1010 12.1010 12.1977 12.1977 12.4178 12.4178 k = 0.1047 0.0604 0.1709 ( 3423 PWs) bands (ev): -32.4806 -32.4806 -32.4008 -32.4008 -13.5310 -13.5310 -13.3275 -13.3275 -12.1298 -12.1298 -12.1029 -12.1029 -11.8706 -11.8706 -11.8452 -11.8452 -4.6991 -4.6991 -1.4975 -1.4975 -1.1242 -1.1242 -1.1225 -1.1225 3.5664 3.5664 4.9900 4.9900 5.1513 5.1513 5.3038 5.3038 5.9658 5.9658 5.9903 5.9903 10.1713 10.1713 10.5609 10.5609 10.7750 10.7750 11.1527 11.1527 11.4040 11.4040 11.7659 11.7659 11.9298 11.9298 12.0681 12.0681 12.2519 12.2519 12.4439 12.4439 k = 0.0959 0.0554 0.1567 ( 3431 PWs) bands (ev): -32.4813 -32.4813 -32.4001 -32.4001 -13.5324 -13.5324 -13.3249 -13.3249 -12.1285 -12.1285 -12.1058 -12.1058 -11.8680 -11.8680 -11.8465 -11.8465 -4.7221 -4.7221 -1.4401 -1.4401 -1.1184 -1.1184 -1.1174 -1.1174 3.5025 3.5025 4.9907 4.9907 5.1314 5.1314 5.2628 5.2628 5.9371 5.9371 5.9528 5.9528 10.3013 10.3013 10.6389 10.6389 10.6937 10.6937 11.1761 11.1761 11.4407 11.4407 11.8448 11.8448 11.9465 11.9465 12.0342 12.0342 12.3037 12.3037 12.4689 12.4689 k = 0.0872 0.0504 0.1424 ( 3423 PWs) bands (ev): -32.4820 -32.4820 -32.3995 -32.3995 -13.5337 -13.5337 -13.3225 -13.3225 -12.1273 -12.1273 -12.1084 -12.1084 -11.8656 -11.8656 -11.8476 -11.8476 -4.7432 -4.7432 -1.3854 -1.3854 -1.1132 -1.1132 -1.1123 -1.1123 3.4410 3.4410 4.9928 4.9928 5.1132 5.1132 5.2241 5.2241 5.9103 5.9103 5.9203 5.9203 10.4146 10.4146 10.6262 10.6262 10.7187 10.7187 11.1978 11.1978 11.4742 11.4742 11.8724 11.8724 11.9922 11.9922 12.0146 12.0146 12.3528 12.3528 12.4924 12.4924 k = 0.0785 0.0453 0.1282 ( 3425 PWs) bands (ev): -32.4826 -32.4826 -32.3989 -32.3989 -13.5348 -13.5348 -13.3202 -13.3202 -12.1261 -12.1261 -12.1107 -12.1107 -11.8634 -11.8634 -11.8487 -11.8487 -4.7626 -4.7626 -1.3339 -1.3339 -1.1087 -1.1087 -1.1076 -1.1076 3.3824 3.3824 4.9959 4.9959 5.0967 5.0967 5.1882 5.1882 5.8855 5.8855 5.8923 5.8923 10.4639 10.4639 10.6250 10.6250 10.7954 10.7954 11.2178 11.2178 11.5041 11.5041 11.8665 11.8665 11.9601 11.9601 12.0970 12.0970 12.3985 12.3985 12.5146 12.5146 k = 0.0698 0.0403 0.1139 ( 3429 PWs) bands (ev): -32.4832 -32.4832 -32.3983 -32.3983 -13.5358 -13.5358 -13.3182 -13.3182 -12.1251 -12.1251 -12.1129 -12.1129 -11.8614 -11.8614 -11.8497 -11.8497 -4.7800 -4.7800 -1.2860 -1.2860 -1.1046 -1.1046 -1.1033 -1.1033 3.3276 3.3276 4.9996 4.9996 5.0820 5.0820 5.1556 5.1556 5.8630 5.8630 5.8681 5.8681 10.4258 10.4258 10.7111 10.7111 10.8709 10.8709 11.2360 11.2360 11.5303 11.5303 11.8493 11.8493 11.9222 11.9222 12.1862 12.1862 12.4402 12.4402 12.5351 12.5351 k = 0.0610 0.0352 0.0997 ( 3429 PWs) bands (ev): -32.4836 -32.4836 -32.3978 -32.3978 -13.5368 -13.5368 -13.3164 -13.3164 -12.1242 -12.1242 -12.1148 -12.1148 -11.8596 -11.8596 -11.8506 -11.8506 -4.7955 -4.7955 -1.2422 -1.2422 -1.1009 -1.1009 -1.0996 -1.0996 3.2771 3.2771 5.0035 5.0035 5.0691 5.0691 5.1265 5.1265 5.8430 5.8430 5.8472 5.8472 10.3711 10.3711 10.8139 10.8139 10.9450 10.9450 11.2523 11.2523 11.5528 11.5528 11.8255 11.8255 11.8827 11.8827 12.2718 12.2718 12.4777 12.4777 12.5540 12.5540 k = 0.0523 0.0302 0.0854 ( 3441 PWs) bands (ev): -32.4841 -32.4841 -32.3974 -32.3974 -13.5376 -13.5376 -13.3149 -13.3149 -12.1234 -12.1234 -12.1164 -12.1164 -11.8580 -11.8580 -11.8514 -11.8514 -4.8090 -4.8090 -1.2030 -1.2030 -1.0976 -1.0976 -1.0963 -1.0963 3.2317 3.2317 5.0072 5.0072 5.0580 5.0580 5.1013 5.1013 5.8258 5.8258 5.8293 5.8293 10.3190 10.3190 10.9143 10.9143 11.0170 11.0170 11.2669 11.2669 11.5717 11.5717 11.7964 11.7964 11.8422 11.8422 12.3509 12.3509 12.5106 12.5106 12.5712 12.5712 k = 0.0436 0.0252 0.0712 ( 3439 PWs) bands (ev): -32.4845 -32.4845 -32.3970 -32.3970 -13.5382 -13.5382 -13.3135 -13.3135 -12.1227 -12.1227 -12.1179 -12.1179 -11.8567 -11.8567 -11.8521 -11.8521 -4.8204 -4.8204 -1.1689 -1.1689 -1.0948 -1.0948 -1.0936 -1.0936 3.1919 3.1919 5.0102 5.0102 5.0490 5.0490 5.0802 5.0802 5.8114 5.8114 5.8141 5.8141 10.2730 10.2730 11.0081 11.0081 11.0865 11.0865 11.2796 11.2796 11.5871 11.5871 11.7630 11.7630 11.8009 11.8009 12.4210 12.4210 12.5390 12.5390 12.5868 12.5868 k = 0.0349 0.0201 0.0570 ( 3447 PWs) bands (ev): -32.4848 -32.4848 -32.3968 -32.3968 -13.5388 -13.5388 -13.3124 -13.3124 -12.1221 -12.1221 -12.1190 -12.1190 -11.8556 -11.8556 -11.8527 -11.8527 -4.8298 -4.8298 -1.1403 -1.1403 -1.0925 -1.0925 -1.0914 -1.0914 3.1585 3.1585 5.0118 5.0118 5.0424 5.0424 5.0634 5.0634 5.7997 5.7997 5.8016 5.8016 10.2344 10.2344 11.0932 11.0932 11.1527 11.1527 11.2906 11.2906 11.5987 11.5987 11.7268 11.7268 11.7595 11.7595 12.4795 12.4795 12.5635 12.5635 12.6004 12.6004 k = 0.0262 0.0151 0.0427 ( 3455 PWs) bands (ev): -32.4850 -32.4850 -32.3965 -32.3965 -13.5392 -13.5392 -13.3115 -13.3115 -12.1217 -12.1217 -12.1199 -12.1199 -11.8548 -11.8548 -11.8531 -11.8531 -4.8372 -4.8372 -1.1176 -1.1176 -1.0907 -1.0907 -1.0897 -1.0897 3.1319 3.1319 5.0114 5.0114 5.0384 5.0384 5.0509 5.0509 5.7907 5.7907 5.7919 5.7919 10.2039 10.2039 11.1665 11.1665 11.2145 11.2145 11.3003 11.3003 11.6060 11.6060 11.6906 11.6906 11.7188 11.7188 12.5231 12.5231 12.5858 12.5858 12.6119 12.6119 k = 0.0174 0.0101 0.0285 ( 3461 PWs) bands (ev): -32.4852 -32.4852 -32.3964 -32.3964 -13.5396 -13.5396 -13.3109 -13.3109 -12.1213 -12.1213 -12.1206 -12.1206 -11.8542 -11.8542 -11.8534 -11.8534 -4.8425 -4.8425 -1.1012 -1.1012 -1.0894 -1.0894 -1.0884 -1.0884 3.1126 3.1126 5.0096 5.0096 5.0367 5.0367 5.0425 5.0425 5.7844 5.7844 5.7849 5.7849 10.1819 10.1819 11.2236 11.2236 11.2690 11.2690 11.3095 11.3095 11.6067 11.6067 11.6604 11.6604 11.6814 11.6814 12.5501 12.5501 12.6067 12.6067 12.6207 12.6207 k = 0.0087 0.0050 0.0142 ( 3479 PWs) bands (ev): -32.4853 -32.4853 -32.3963 -32.3963 -13.5397 -13.5397 -13.3105 -13.3105 -12.1211 -12.1211 -12.1209 -12.1209 -11.8538 -11.8538 -11.8536 -11.8536 -4.8456 -4.8456 -1.0914 -1.0914 -1.0885 -1.0885 -1.0877 -1.0877 3.1009 3.1009 5.0076 5.0076 5.0363 5.0363 5.0378 5.0378 5.7805 5.7805 5.7807 5.7807 10.1686 10.1686 11.2584 11.2584 11.3092 11.3092 11.3193 11.3193 11.5985 11.5985 11.6448 11.6448 11.6527 11.6527 12.5634 12.5634 12.6224 12.6224 12.6262 12.6262 k = 0.0000 0.0000 0.0000 ( 3479 PWs) bands (ev): -32.4854 -32.4854 -32.3963 -32.3963 -13.5398 -13.5398 -13.3104 -13.3104 -12.1211 -12.1211 -12.1211 -12.1211 -11.8537 -11.8537 -11.8537 -11.8537 -4.8467 -4.8467 -1.0890 -1.0890 -1.0875 -1.0875 -1.0873 -1.0873 3.0969 3.0969 5.0068 5.0068 5.0363 5.0363 5.0363 5.0363 5.7793 5.7793 5.7793 5.7793 10.1641 10.1641 11.2692 11.2692 11.3247 11.3247 11.3247 11.3247 11.5923 11.5923 11.6414 11.6414 11.6415 11.6415 12.5673 12.5673 12.6281 12.6281 12.6282 12.6282 k = 0.0000 0.0000 0.0000 ( 3479 PWs) bands (ev): -32.4854 -32.4854 -32.3963 -32.3963 -13.5398 -13.5398 -13.3104 -13.3104 -12.1211 -12.1211 -12.1211 -12.1211 -11.8537 -11.8537 -11.8537 -11.8537 -4.8467 -4.8467 -1.0890 -1.0890 -1.0875 -1.0875 -1.0873 -1.0873 3.0969 3.0969 5.0068 5.0068 5.0363 5.0363 5.0363 5.0363 5.7793 5.7793 5.7793 5.7793 10.1641 10.1641 11.2692 11.2692 11.3247 11.3247 11.3247 11.3247 11.5923 11.5923 11.6414 11.6414 11.6415 11.6415 12.5673 12.5673 12.6281 12.6281 12.6282 12.6282 k = 0.0143 0.0082 0.0058 ( 3479 PWs) bands (ev): -32.4853 -32.4853 -32.3963 -32.3963 -13.5397 -13.5397 -13.3105 -13.3105 -12.1212 -12.1212 -12.1209 -12.1209 -11.8538 -11.8538 -11.8536 -11.8536 -4.8456 -4.8456 -1.0915 -1.0915 -1.0885 -1.0885 -1.0876 -1.0876 3.1009 3.1009 5.0076 5.0076 5.0366 5.0366 5.0375 5.0375 5.7806 5.7806 5.7807 5.7807 10.1686 10.1686 11.2582 11.2582 11.3085 11.3085 11.3200 11.3200 11.5985 11.5985 11.6449 11.6449 11.6527 11.6527 12.5634 12.5634 12.6222 12.6222 12.6265 12.6265 k = 0.0286 0.0165 0.0117 ( 3461 PWs) bands (ev): -32.4852 -32.4852 -32.3964 -32.3964 -13.5396 -13.5396 -13.3109 -13.3109 -12.1214 -12.1214 -12.1205 -12.1205 -11.8542 -11.8542 -11.8534 -11.8534 -4.8424 -4.8424 -1.1014 -1.1014 -1.0894 -1.0894 -1.0884 -1.0884 3.1127 3.1127 5.0099 5.0099 5.0377 5.0377 5.0412 5.0412 5.7845 5.7845 5.7848 5.7848 10.1820 10.1820 11.2225 11.2225 11.2654 11.2654 11.3139 11.3139 11.6069 11.6069 11.6606 11.6606 11.6810 11.6810 12.5495 12.5495 12.6064 12.6064 12.6214 12.6214 k = 0.0429 0.0247 0.0175 ( 3455 PWs) bands (ev): -32.4850 -32.4850 -32.3965 -32.3965 -13.5392 -13.5392 -13.3115 -13.3115 -12.1218 -12.1218 -12.1198 -12.1198 -11.8549 -11.8549 -11.8530 -11.8530 -4.8371 -4.8371 -1.1179 -1.1179 -1.0907 -1.0907 -1.0897 -1.0897 3.1321 3.1321 5.0132 5.0132 5.0404 5.0404 5.0473 5.0473 5.7910 5.7910 5.7918 5.7918 10.2042 10.2042 11.1659 11.1659 11.2045 11.2045 11.3113 11.3113 11.6066 11.6066 11.6903 11.6903 11.7176 11.7176 12.5199 12.5199 12.5872 12.5872 12.6132 12.6132 k = 0.0571 0.0330 0.0233 ( 3449 PWs) bands (ev): -32.4848 -32.4848 -32.3968 -32.3968 -13.5388 -13.5388 -13.3124 -13.3124 -12.1223 -12.1223 -12.1188 -12.1188 -11.8559 -11.8559 -11.8524 -11.8524 -4.8297 -4.8297 -1.1406 -1.1406 -1.0925 -1.0925 -1.0915 -1.0915 3.1588 3.1588 5.0165 5.0165 5.0457 5.0457 5.0557 5.0557 5.8001 5.8001 5.8016 5.8016 10.2349 10.2349 11.0958 11.0958 11.1319 11.1319 11.3108 11.3108 11.5999 11.5999 11.7260 11.7260 11.7564 11.7564 12.4710 12.4710 12.5695 12.5695 12.6022 12.6022 k = 0.0714 0.0412 0.0292 ( 3443 PWs) bands (ev): -32.4845 -32.4845 -32.3971 -32.3971 -13.5382 -13.5382 -13.3135 -13.3135 -12.1230 -12.1230 -12.1175 -12.1175 -11.8571 -11.8571 -11.8518 -11.8518 -4.8203 -4.8203 -1.1694 -1.1694 -1.0948 -1.0948 -1.0937 -1.0937 3.1922 3.1922 5.0194 5.0194 5.0541 5.0541 5.0664 5.0664 5.8119 5.8119 5.8142 5.8142 10.2738 10.2738 11.0165 11.0165 11.0509 11.0509 11.3114 11.3114 11.5888 11.5888 11.7625 11.7625 11.7946 11.7946 12.4050 12.4050 12.5524 12.5524 12.5886 12.5886 k = 0.0857 0.0495 0.0350 ( 3443 PWs) bands (ev): -32.4841 -32.4841 -32.3974 -32.3974 -13.5376 -13.5376 -13.3149 -13.3149 -12.1239 -12.1239 -12.1159 -12.1159 -11.8585 -11.8585 -11.8509 -11.8509 -4.8087 -4.8087 -1.2037 -1.2037 -1.0975 -1.0975 -1.0964 -1.0964 3.2317 3.2317 5.0223 5.0223 5.0658 5.0658 5.0793 5.0793 5.8265 5.8265 5.8297 5.8297 10.3204 10.3204 10.9302 10.9302 10.9632 10.9632 11.3125 11.3125 11.5738 11.5738 11.7974 11.7974 11.8306 11.8306 12.3247 12.3247 12.5348 12.5348 12.5730 12.5730 k = 0.1000 0.0577 0.0408 ( 3431 PWs) bands (ev): -32.4836 -32.4836 -32.3978 -32.3978 -13.5368 -13.5368 -13.3165 -13.3165 -12.1248 -12.1248 -12.1141 -12.1141 -11.8603 -11.8603 -11.8500 -11.8500 -4.7952 -4.7952 -1.2433 -1.2433 -1.1007 -1.1007 -1.0996 -1.0996 3.2767 3.2767 5.0260 5.0260 5.0804 5.0804 5.0942 5.0942 5.8437 5.8437 5.8481 5.8481 10.3743 10.3743 10.8381 10.8381 10.8701 10.8701 11.3141 11.3141 11.5548 11.5548 11.8299 11.8299 11.8639 11.8639 12.2323 12.2323 12.5165 12.5165 12.5558 12.5558 k = 0.1143 0.0660 0.0467 ( 3431 PWs) bands (ev): -32.4832 -32.4832 -32.3983 -32.3983 -13.5358 -13.5358 -13.3183 -13.3183 -12.1259 -12.1259 -12.1120 -12.1120 -11.8622 -11.8622 -11.8489 -11.8489 -4.7796 -4.7796 -1.2875 -1.2875 -1.1043 -1.1043 -1.1031 -1.1031 3.3262 3.3262 5.0315 5.0315 5.0973 5.0973 5.1110 5.1110 5.8638 5.8638 5.8695 5.8695 10.4348 10.4348 10.7411 10.7411 10.7722 10.7722 11.3160 11.3160 11.5316 11.5316 11.8595 11.8595 11.8940 11.8940 12.1296 12.1296 12.4975 12.4975 12.5376 12.5376 k = 0.1286 0.0742 0.0525 ( 3428 PWs) bands (ev): -32.4826 -32.4826 -32.3989 -32.3989 -13.5348 -13.5348 -13.3203 -13.3203 -12.1271 -12.1271 -12.1097 -12.1097 -11.8644 -11.8644 -11.8478 -11.8478 -4.7622 -4.7622 -1.3360 -1.3360 -1.1082 -1.1082 -1.1070 -1.1070 3.3792 3.3792 5.0395 5.0395 5.1163 5.1163 5.1295 5.1295 5.8868 5.8868 5.8939 5.8939 10.5010 10.5010 10.6398 10.6398 10.6701 10.6701 11.3181 11.3181 11.5039 11.5039 11.8859 11.8859 11.9209 11.9209 12.0185 12.0185 12.4783 12.4783 12.5190 12.5190 k = 0.1429 0.0825 0.0583 ( 3434 PWs) bands (ev): -32.4820 -32.4820 -32.3995 -32.3995 -13.5336 -13.5336 -13.3225 -13.3225 -12.1283 -12.1283 -12.1071 -12.1071 -11.8668 -11.8668 -11.8465 -11.8465 -4.7428 -4.7428 -1.3883 -1.3883 -1.1125 -1.1125 -1.1113 -1.1113 3.4349 3.4349 5.0511 5.0511 5.1371 5.1371 5.1496 5.1496 5.9127 5.9127 5.9214 5.9214 10.5348 10.5348 10.5644 10.5644 10.5719 10.5719 11.3206 11.3206 11.4714 11.4714 11.8971 11.8971 11.9125 11.9125 11.9445 11.9445 12.4594 12.4594 12.5004 12.5004 k = 0.1571 0.0907 0.0642 ( 3437 PWs) bands (ev): -32.4813 -32.4813 -32.4001 -32.4001 -13.5324 -13.5324 -13.3249 -13.3249 -12.1297 -12.1297 -12.1043 -12.1043 -11.8695 -11.8695 -11.8452 -11.8452 -4.7215 -4.7215 -1.4439 -1.4439 -1.1171 -1.1171 -1.1158 -1.1158 3.4920 3.4920 5.0671 5.0671 5.1594 5.1594 5.1710 5.1710 5.9416 5.9416 5.9520 5.9520 10.4265 10.4265 10.4555 10.4555 10.6459 10.6459 11.3232 11.3232 11.4341 11.4341 11.7770 11.7770 11.9299 11.9299 11.9648 11.9648 12.4412 12.4412 12.4824 12.4824 k = 0.1714 0.0990 0.0700 ( 3425 PWs) bands (ev): -32.4806 -32.4806 -32.4009 -32.4009 -13.5310 -13.5310 -13.3275 -13.3275 -12.1311 -12.1311 -12.1013 -12.1013 -11.8723 -11.8723 -11.8438 -11.8438 -4.6985 -4.6985 -1.5023 -1.5023 -1.1220 -1.1220 -1.1206 -1.1206 3.5494 3.5494 5.0886 5.0886 5.1830 5.1830 5.1936 5.1936 5.9736 5.9736 5.9858 5.9858 10.3154 10.3154 10.3439 10.3439 10.7204 10.7204 11.3260 11.3260 11.3921 11.3921 11.6520 11.6520 11.9468 11.9468 11.9818 11.9818 12.4242 12.4242 12.4655 12.4655 k = 0.1857 0.1072 0.0758 ( 3419 PWs) bands (ev): -32.4798 -32.4798 -32.4016 -32.4016 -13.5295 -13.5295 -13.3302 -13.3302 -12.1326 -12.1326 -12.0981 -12.0981 -11.8753 -11.8753 -11.8424 -11.8424 -4.6738 -4.6738 -1.5631 -1.5631 -1.1270 -1.1270 -1.1256 -1.1256 3.6059 3.6059 5.1165 5.1165 5.2076 5.2076 5.2171 5.2171 6.0088 6.0088 6.0229 6.0229 10.2018 10.2018 10.2299 10.2299 10.7910 10.7910 11.3288 11.3288 11.3465 11.3465 11.5287 11.5287 11.9606 11.9606 11.9956 11.9956 12.4089 12.4089 12.4503 12.4503 k = 0.2000 0.1155 0.0816 ( 3413 PWs) bands (ev): -32.4790 -32.4790 -32.4024 -32.4024 -13.5280 -13.5280 -13.3331 -13.3331 -12.1341 -12.1341 -12.0948 -12.0948 -11.8785 -11.8785 -11.8409 -11.8409 -4.6474 -4.6474 -1.6259 -1.6259 -1.1322 -1.1322 -1.1308 -1.1308 3.6605 3.6605 5.1518 5.1518 5.2330 5.2330 5.2413 5.2413 6.0472 6.0472 6.0632 6.0632 10.0862 10.0862 10.1140 10.1140 10.8472 10.8472 11.3011 11.3011 11.3313 11.3313 11.4141 11.4141 11.9714 11.9714 12.0063 12.0063 12.3956 12.3956 12.4370 12.4370 k = 0.2143 0.1237 0.0875 ( 3422 PWs) bands (ev): -32.4782 -32.4782 -32.4033 -32.4033 -13.5263 -13.5263 -13.3361 -13.3361 -12.1357 -12.1357 -12.0912 -12.0912 -11.8819 -11.8819 -11.8393 -11.8393 -4.6196 -4.6196 -1.6902 -1.6902 -1.1376 -1.1376 -1.1362 -1.1362 3.7119 3.7119 5.1953 5.1953 5.2590 5.2590 5.2660 5.2660 6.0889 6.0889 6.1069 6.1069 9.9689 9.9689 9.9964 9.9964 10.8674 10.8674 11.2629 11.2629 11.3173 11.3173 11.3396 11.3396 11.9793 11.9793 12.0139 12.0139 12.3847 12.3847 12.4259 12.4259 k = 0.2286 0.1320 0.0933 ( 3410 PWs) bands (ev): -32.4773 -32.4773 -32.4041 -32.4041 -13.5246 -13.5246 -13.3392 -13.3392 -12.1372 -12.1372 -12.0875 -12.0875 -11.8853 -11.8853 -11.8378 -11.8378 -4.5902 -4.5902 -1.7556 -1.7556 -1.1431 -1.1431 -1.1416 -1.1416 3.7595 3.7595 5.2474 5.2474 5.2854 5.2854 5.2910 5.2910 6.1341 6.1341 6.1539 6.1539 9.8502 9.8502 9.8775 9.8775 10.8263 10.8263 11.2058 11.2058 11.3037 11.3037 11.3399 11.3399 11.9845 11.9845 12.0188 12.0188 12.3763 12.3763 12.4174 12.4174 k = 0.2429 0.1402 0.0991 ( 3416 PWs) bands (ev): -32.4764 -32.4764 -32.4050 -32.4050 -13.5228 -13.5228 -13.3424 -13.3424 -12.1388 -12.1388 -12.0836 -12.0836 -11.8890 -11.8890 -11.8363 -11.8363 -4.5596 -4.5596 -1.8219 -1.8219 -1.1485 -1.1485 -1.1470 -1.1470 3.8026 3.8026 5.3046 5.3046 5.3160 5.3160 5.3161 5.3161 6.1826 6.1826 6.2043 6.2043 9.7304 9.7304 9.7576 9.7576 10.7299 10.7299 11.1342 11.1342 11.3427 11.3427 11.3529 11.3529 11.9874 11.9874 12.0212 12.0212 12.3705 12.3705 12.4114 12.4114 k = 0.2571 0.1485 0.1050 ( 3416 PWs) bands (ev): -32.4754 -32.4754 -32.4060 -32.4060 -13.5209 -13.5209 -13.3457 -13.3457 -12.1404 -12.1404 -12.0797 -12.0797 -11.8927 -11.8927 -11.8348 -11.8348 -4.5277 -4.5277 -1.8885 -1.8885 -1.1540 -1.1540 -1.1524 -1.1524 3.8408 3.8408 5.3358 5.3358 5.3409 5.3409 5.3820 5.3820 6.2345 6.2345 6.2581 6.2581 9.6099 9.6099 9.6370 9.6370 10.6026 10.6026 11.0634 11.0634 11.3461 11.3461 11.4276 11.4276 11.9882 11.9882 12.0216 12.0216 12.3673 12.3673 12.4080 12.4080 k = 0.2714 0.1567 0.1108 ( 3416 PWs) bands (ev): -32.4745 -32.4745 -32.4069 -32.4069 -13.5190 -13.5190 -13.3490 -13.3490 -12.1419 -12.1419 -12.0756 -12.0756 -11.8965 -11.8965 -11.8332 -11.8332 -4.4948 -4.4948 -1.9551 -1.9551 -1.1594 -1.1594 -1.1578 -1.1578 3.8741 3.8741 5.3617 5.3617 5.3654 5.3654 5.4621 5.4621 6.2899 6.2899 6.3152 6.3152 9.4889 9.4889 9.5159 9.5159 10.4599 10.4599 10.9932 10.9932 11.3495 11.3495 11.5133 11.5133 11.9875 11.9875 12.0203 12.0203 12.3666 12.3666 12.4069 12.4069 k = 0.2857 0.1650 0.1166 ( 3419 PWs) bands (ev): -32.4735 -32.4735 -32.4079 -32.4079 -13.5170 -13.5170 -13.3524 -13.3524 -12.1434 -12.1434 -12.0714 -12.0714 -11.9004 -11.9004 -11.8318 -11.8318 -4.4610 -4.4610 -2.0214 -2.0214 -1.1648 -1.1648 -1.1631 -1.1631 3.9027 3.9027 5.3867 5.3867 5.3894 5.3894 5.5513 5.5513 6.3487 6.3487 6.3757 6.3757 9.3677 9.3677 9.3947 9.3947 10.3091 10.3091 10.9236 10.9236 11.3528 11.3528 11.6035 11.6035 11.9857 11.9857 12.0179 12.0179 12.3681 12.3681 12.4080 12.4080 k = 0.3000 0.1732 0.1225 ( 3419 PWs) bands (ev): -32.4725 -32.4725 -32.4090 -32.4090 -13.5150 -13.5150 -13.3558 -13.3558 -12.1449 -12.1449 -12.0672 -12.0672 -11.9044 -11.9044 -11.8304 -11.8304 -4.4265 -4.4265 -2.0871 -2.0871 -1.1700 -1.1700 -1.1683 -1.1683 3.9268 3.9268 5.4108 5.4108 5.4127 5.4127 5.6488 5.6488 6.4110 6.4110 6.4395 6.4395 9.2466 9.2466 9.2735 9.2735 10.1536 10.1536 10.8549 10.8549 11.3561 11.3561 11.6947 11.6947 11.9833 11.9833 12.0147 12.0147 12.3717 12.3717 12.4111 12.4111 k = 0.3143 0.1815 0.1283 ( 3428 PWs) bands (ev): -32.4715 -32.4715 -32.4100 -32.4100 -13.5129 -13.5129 -13.3591 -13.3591 -12.1463 -12.1463 -12.0630 -12.0630 -11.9084 -11.9084 -11.8290 -11.8290 -4.3915 -4.3915 -2.1516 -2.1516 -1.1750 -1.1750 -1.1733 -1.1733 3.9470 3.9470 5.4339 5.4339 5.4351 5.4351 5.7538 5.7538 6.4765 6.4765 6.5064 6.5064 9.1256 9.1256 9.1526 9.1526 9.9951 9.9951 10.7876 10.7876 11.3593 11.3593 11.7850 11.7850 11.9810 11.9810 12.0112 12.0112 12.3772 12.3772 12.4159 12.4159 k = 0.3286 0.1897 0.1341 ( 3428 PWs) bands (ev): -32.4705 -32.4705 -32.4110 -32.4110 -13.5109 -13.5109 -13.3624 -13.3624 -12.1476 -12.1476 -12.0587 -12.0587 -11.9124 -11.9124 -11.8277 -11.8277 -4.3563 -4.3563 -2.2146 -2.2146 -1.1798 -1.1798 -1.1780 -1.1780 3.9637 3.9637 5.4558 5.4558 5.4564 5.4564 5.8655 5.8655 6.5453 6.5453 6.5766 6.5766 9.0052 9.0052 9.0323 9.0323 9.8349 9.8349 10.7224 10.7224 11.3624 11.3624 11.8718 11.8718 11.9800 11.9800 12.0076 12.0076 12.3844 12.3844 12.4223 12.4223 k = 0.3429 0.1979 0.1400 ( 3428 PWs) bands (ev): -32.4695 -32.4695 -32.4119 -32.4119 -13.5088 -13.5088 -13.3656 -13.3656 -12.1489 -12.1489 -12.0544 -12.0544 -11.9165 -11.9165 -11.8264 -11.8264 -4.3211 -4.3211 -2.2758 -2.2758 -1.1844 -1.1844 -1.1826 -1.1826 3.9774 3.9774 5.4765 5.4765 5.4766 5.4766 5.9829 5.9829 6.6172 6.6172 6.6497 6.6497 8.8855 8.8855 8.9126 8.9126 9.6739 9.6739 10.6599 10.6599 11.3654 11.3654 11.9443 11.9443 11.9906 11.9906 12.0043 12.0043 12.3932 12.3932 12.4301 12.4301 k = 0.3571 0.2062 0.1458 ( 3425 PWs) bands (ev): -32.4686 -32.4686 -32.4129 -32.4129 -13.5069 -13.5069 -13.3688 -13.3688 -12.1500 -12.1500 -12.0502 -12.0502 -11.9204 -11.9204 -11.8253 -11.8253 -4.2863 -4.2863 -2.3347 -2.3347 -1.1887 -1.1887 -1.1868 -1.1868 3.9887 3.9887 5.4955 5.4955 5.4957 5.4957 6.1051 6.1051 6.6922 6.6922 6.7258 6.7258 8.7667 8.7667 8.7938 8.7938 9.5128 9.5128 10.6008 10.6008 11.3682 11.3682 11.9629 11.9629 12.0014 12.0014 12.0515 12.0515 12.4034 12.4034 12.4393 12.4393 k = 0.3714 0.2144 0.1516 ( 3425 PWs) bands (ev): -32.4677 -32.4677 -32.4138 -32.4138 -13.5049 -13.5049 -13.3718 -13.3718 -12.1511 -12.1511 -12.0461 -12.0461 -11.9243 -11.9243 -11.8242 -11.8242 -4.2523 -4.2523 -2.3907 -2.3907 -1.1927 -1.1927 -1.1908 -1.1908 3.9979 3.9979 5.5130 5.5130 5.5135 5.5135 6.2311 6.2311 6.7700 6.7700 6.8047 6.8047 8.6490 8.6490 8.6761 8.6761 9.3524 9.3524 10.5456 10.5456 11.3708 11.3708 11.9636 11.9636 11.9991 11.9991 12.1261 12.1261 12.4150 12.4150 12.4497 12.4497 k = 0.3857 0.2227 0.1575 ( 3425 PWs) bands (ev): -32.4668 -32.4668 -32.4147 -32.4147 -13.5031 -13.5031 -13.3746 -13.3746 -12.1521 -12.1521 -12.0421 -12.0421 -11.9281 -11.9281 -11.8233 -11.8233 -4.2195 -4.2195 -2.4435 -2.4435 -1.1963 -1.1963 -1.1944 -1.1944 4.0053 4.0053 5.5289 5.5289 5.5297 5.5297 6.3598 6.3598 6.8505 6.8505 6.8862 6.8862 8.5328 8.5328 8.5598 8.5598 9.1937 9.1937 10.4949 10.4949 11.3732 11.3732 11.9627 11.9627 11.9972 11.9972 12.1973 12.1973 12.4279 12.4279 12.4613 12.4613 k = 0.4000 0.2309 0.1633 ( 3410 PWs) bands (ev): -32.4659 -32.4659 -32.4155 -32.4155 -13.5013 -13.5013 -13.3772 -13.3772 -12.1530 -12.1530 -12.0383 -12.0383 -11.9318 -11.9318 -11.8224 -11.8224 -4.1884 -4.1884 -2.4923 -2.4923 -1.1996 -1.1996 -1.1976 -1.1976 4.0113 4.0113 5.5432 5.5432 5.5441 5.5441 6.4900 6.4900 6.9334 6.9334 6.9701 6.9701 8.4182 8.4182 8.4451 8.4451 9.0375 9.0375 10.4490 10.4490 11.3754 11.3754 11.9619 11.9619 11.9960 11.9960 12.2631 12.2631 12.4418 12.4418 12.4738 12.4738 k = 0.4143 0.2392 0.1691 ( 3410 PWs) bands (ev): -32.4652 -32.4652 -32.4162 -32.4162 -13.4997 -13.4997 -13.3796 -13.3796 -12.1538 -12.1538 -12.0348 -12.0348 -11.9352 -11.9352 -11.8216 -11.8216 -4.1596 -4.1596 -2.5366 -2.5366 -1.2025 -1.2025 -1.2004 -1.2004 4.0161 4.0161 5.5558 5.5558 5.5568 5.5568 6.6199 6.6199 7.0184 7.0184 7.0562 7.0562 8.3057 8.3057 8.3323 8.3323 8.8855 8.8855 10.4085 10.4085 11.3773 11.3773 11.9612 11.9612 11.9952 11.9952 12.3222 12.3222 12.4566 12.4566 12.4872 12.4872 k = 0.4286 0.2474 0.1750 ( 3404 PWs) bands (ev): -32.4645 -32.4645 -32.4168 -32.4168 -13.4983 -13.4983 -13.3816 -13.3816 -12.1545 -12.1545 -12.0315 -12.0315 -11.9383 -11.9383 -11.8210 -11.8210 -4.1337 -4.1337 -2.5757 -2.5757 -1.2049 -1.2049 -1.2029 -1.2029 4.0199 4.0199 5.5666 5.5666 5.5677 5.5677 6.7474 6.7474 7.1049 7.1049 7.1439 7.1439 8.1958 8.1958 8.2218 8.2218 8.7395 8.7395 10.3736 10.3736 11.3790 11.3790 11.9608 11.9608 11.9948 11.9948 12.3740 12.3740 12.4719 12.4719 12.5011 12.5011 k = 0.4429 0.2557 0.1808 ( 3405 PWs) bands (ev): -32.4640 -32.4640 -32.4174 -32.4174 -13.4971 -13.4971 -13.3834 -13.3834 -12.1550 -12.1550 -12.0286 -12.0286 -11.9410 -11.9410 -11.8204 -11.8204 -4.1113 -4.1113 -2.6090 -2.6090 -1.2070 -1.2070 -1.2049 -1.2049 4.0228 4.0228 5.5756 5.5756 5.5766 5.5766 6.8692 6.8692 7.1921 7.1921 7.2327 7.2327 8.0895 8.0895 8.1145 8.1145 8.6029 8.6029 10.3447 10.3447 11.3804 11.3804 11.9606 11.9606 11.9947 11.9947 12.4177 12.4177 12.4871 12.4871 12.5150 12.5150 k = 0.4571 0.2639 0.1866 ( 3405 PWs) bands (ev): -32.4635 -32.4635 -32.4179 -32.4179 -13.4961 -13.4961 -13.3848 -13.3848 -12.1555 -12.1555 -12.0263 -12.0263 -11.9433 -11.9433 -11.8200 -11.8200 -4.0931 -4.0931 -2.6357 -2.6357 -1.2086 -1.2086 -1.2065 -1.2065 4.0250 4.0250 5.5826 5.5826 5.5837 5.5837 6.9803 6.9803 7.2782 7.2782 7.3209 7.3209 7.9884 7.9884 8.0118 8.0118 8.4804 8.4804 10.3219 10.3219 11.3814 11.3814 11.9606 11.9606 11.9948 11.9948 12.4527 12.4527 12.5011 12.5011 12.5282 12.5282 k = 0.4714 0.2722 0.1925 ( 3417 PWs) bands (ev): -32.4632 -32.4632 -32.4182 -32.4182 -13.4954 -13.4954 -13.3859 -13.3859 -12.1558 -12.1558 -12.0245 -12.0245 -11.9450 -11.9450 -11.8197 -11.8197 -4.0795 -4.0795 -2.6553 -2.6553 -1.2098 -1.2098 -1.2077 -1.2077 4.0265 4.0265 5.5876 5.5876 5.5887 5.5887 7.0731 7.0731 7.3593 7.3593 7.4053 7.4053 7.8966 7.8966 7.9171 7.9171 8.3797 8.3797 10.3055 10.3055 11.3822 11.3822 11.9606 11.9606 11.9949 11.9949 12.4783 12.4783 12.5128 12.5128 12.5394 12.5394 k = 0.4857 0.2804 0.1983 ( 3426 PWs) bands (ev): -32.4630 -32.4630 -32.4185 -32.4185 -13.4949 -13.4949 -13.3865 -13.3865 -12.1560 -12.1560 -12.0234 -12.0234 -11.9461 -11.9461 -11.8195 -11.8195 -4.0712 -4.0712 -2.6673 -2.6673 -1.2105 -1.2105 -1.2084 -1.2084 4.0273 4.0273 5.5906 5.5906 5.5918 5.5918 7.1367 7.1367 7.4254 7.4254 7.4761 7.4761 7.8240 7.8240 7.8401 7.8401 8.3114 8.3114 10.2956 10.2956 11.3827 11.3827 11.9607 11.9607 11.9950 11.9950 12.4942 12.4942 12.5206 12.5206 12.5471 12.5471 k = 0.5000 0.2887 0.2041 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4185 -32.4185 -13.4948 -13.4948 -13.3867 -13.3867 -12.1560 -12.1560 -12.0230 -12.0230 -11.9465 -11.9465 -11.8194 -11.8194 -4.0684 -4.0684 -2.6713 -2.6713 -1.2107 -1.2107 -1.2086 -1.2086 4.0276 4.0276 5.5916 5.5916 5.5928 5.5928 7.1597 7.1597 7.4536 7.4536 7.5077 7.5077 7.7935 7.7935 7.8064 7.8064 8.2868 8.2868 10.2923 10.2923 11.3828 11.3828 11.9607 11.9607 11.9951 11.9951 12.4996 12.4996 12.5233 12.5233 12.5498 12.5498 k = 0.5000 0.2887 0.2041 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4185 -32.4185 -13.4948 -13.4948 -13.3867 -13.3867 -12.1560 -12.1560 -12.0230 -12.0230 -11.9465 -11.9465 -11.8194 -11.8194 -4.0684 -4.0684 -2.6713 -2.6713 -1.2107 -1.2107 -1.2086 -1.2086 4.0276 4.0276 5.5916 5.5916 5.5928 5.5928 7.1597 7.1597 7.4536 7.4536 7.5077 7.5077 7.7935 7.7935 7.8064 7.8064 8.2868 8.2868 10.2923 10.2923 11.3828 11.3828 11.9607 11.9607 11.9951 11.9951 12.4996 12.4996 12.5233 12.5233 12.5498 12.5498 k = 0.5050 0.2742 0.2123 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4186 -32.4186 -13.4947 -13.4947 -13.3868 -13.3868 -12.1561 -12.1561 -12.0229 -12.0229 -11.9466 -11.9466 -11.8194 -11.8194 -4.0675 -4.0675 -2.6722 -2.6722 -1.2112 -1.2112 -1.2090 -1.2090 4.0310 4.0310 5.5917 5.5917 5.5943 5.5943 7.1426 7.1426 7.4595 7.4595 7.5145 7.5145 7.7882 7.7882 7.8055 7.8055 8.2981 8.2981 10.2956 10.2956 11.3778 11.3778 11.9569 11.9569 11.9914 11.9914 12.4425 12.4425 12.5324 12.5324 12.5936 12.5936 k = 0.5100 0.2598 0.2205 ( 3429 PWs) bands (ev): -32.4628 -32.4628 -32.4187 -32.4187 -13.4945 -13.4945 -13.3871 -13.3871 -12.1561 -12.1561 -12.0225 -12.0225 -11.9468 -11.9468 -11.8194 -11.8194 -4.0649 -4.0649 -2.6750 -2.6750 -1.2130 -1.2130 -1.2096 -1.2096 4.0412 4.0412 5.5907 5.5907 5.6001 5.6001 7.0992 7.0992 7.4631 7.4631 7.5393 7.5393 7.7671 7.7671 7.8124 7.8124 8.3291 8.3291 10.3052 10.3052 11.3628 11.3628 11.9446 11.9446 11.9815 11.9815 12.3730 12.3730 12.5242 12.5242 12.6548 12.6548 k = 0.5150 0.2454 0.2286 ( 3419 PWs) bands (ev): -32.4627 -32.4627 -32.4188 -32.4188 -13.4942 -13.4942 -13.3875 -13.3875 -12.1563 -12.1563 -12.0218 -12.0218 -11.9473 -11.9473 -11.8194 -11.8194 -4.0605 -4.0605 -2.6796 -2.6796 -1.2165 -1.2165 -1.2102 -1.2102 4.0581 4.0581 5.5890 5.5890 5.6099 5.6099 7.0417 7.0417 7.4567 7.4567 7.5685 7.5685 7.7459 7.7459 7.8260 7.8260 8.3743 8.3743 10.3210 10.3210 11.3373 11.3373 11.9222 11.9222 11.9681 11.9681 12.3054 12.3054 12.5100 12.5100 12.6946 12.6946 k = 0.5200 0.2309 0.2368 ( 3419 PWs) bands (ev): -32.4624 -32.4624 -32.4190 -32.4190 -13.4938 -13.4938 -13.3881 -13.3881 -12.1564 -12.1564 -12.0210 -12.0210 -11.9480 -11.9480 -11.8194 -11.8194 -4.0544 -4.0544 -2.6862 -2.6862 -1.2214 -1.2214 -1.2109 -1.2109 4.0815 4.0815 5.5867 5.5867 5.6236 5.6236 6.9774 6.9774 7.4446 7.4446 7.5690 7.5690 7.7536 7.7536 7.8442 7.8442 8.4285 8.4285 10.3428 10.3428 11.3013 11.3013 11.8888 11.8888 11.9538 11.9538 12.2410 12.2410 12.4908 12.4908 12.7020 12.7020 k = 0.5250 0.2165 0.2449 ( 3414 PWs) bands (ev): -32.4621 -32.4621 -32.4193 -32.4193 -13.4932 -13.4932 -13.3889 -13.3889 -12.1566 -12.1566 -12.0199 -12.0199 -11.9489 -11.9489 -11.8194 -11.8194 -4.0465 -4.0465 -2.6947 -2.6947 -1.2275 -1.2275 -1.2117 -1.2117 4.1110 4.1110 5.5841 5.5841 5.6413 5.6413 6.9096 6.9096 7.4291 7.4291 7.5322 7.5322 7.7973 7.7973 7.8662 7.8662 8.4883 8.4883 10.3704 10.3704 11.2544 11.2544 11.8455 11.8455 11.9393 11.9393 12.1798 12.1798 12.4676 12.4676 12.6870 12.6870 k = 0.5300 0.2021 0.2531 ( 3412 PWs) bands (ev): -32.4618 -32.4618 -32.4196 -32.4196 -13.4925 -13.4925 -13.3899 -13.3899 -12.1569 -12.1569 -12.0185 -12.0185 -11.9499 -11.9499 -11.8194 -11.8194 -4.0369 -4.0369 -2.7051 -2.7051 -1.2346 -1.2346 -1.2126 -1.2126 4.1465 4.1465 5.5814 5.5814 5.6627 5.6627 6.8402 6.8402 7.4113 7.4113 7.4774 7.4774 7.8569 7.8569 7.8919 7.8919 8.5516 8.5516 10.4032 10.4032 11.1968 11.1968 11.7935 11.7935 11.9250 11.9250 12.1219 12.1219 12.4409 12.4409 12.6601 12.6601 k = 0.5350 0.1876 0.2613 ( 3418 PWs) bands (ev): -32.4614 -32.4614 -32.4201 -32.4201 -13.4917 -13.4917 -13.3911 -13.3911 -12.1571 -12.1571 -12.0171 -12.0171 -11.9510 -11.9510 -11.8194 -11.8194 -4.0256 -4.0256 -2.7176 -2.7176 -1.2425 -1.2425 -1.2137 -1.2137 4.1874 4.1874 5.5789 5.5789 5.6881 5.6881 6.7700 6.7700 7.3904 7.3904 7.4171 7.4171 7.9113 7.9113 7.9312 7.9312 8.6171 8.6171 10.4409 10.4409 11.1287 11.1287 11.7339 11.7339 11.9115 11.9115 12.0671 12.0671 12.4114 12.4114 12.6265 12.6265 k = 0.5400 0.1732 0.2694 ( 3420 PWs) bands (ev): -32.4609 -32.4609 -32.4206 -32.4206 -13.4907 -13.4907 -13.3924 -13.3924 -12.1574 -12.1574 -12.0154 -12.0154 -11.9523 -11.9523 -11.8194 -11.8194 -4.0125 -4.0125 -2.7321 -2.7321 -1.2510 -1.2510 -1.2148 -1.2148 4.2332 4.2332 5.5772 5.5772 5.7172 5.7172 6.6995 6.6995 7.3456 7.3456 7.3767 7.3767 7.9435 7.9435 7.9966 7.9966 8.6839 8.6839 10.4828 10.4828 11.0508 11.0508 11.6675 11.6675 11.8987 11.8987 12.0150 12.0150 12.3797 12.3797 12.5892 12.5892 k = 0.5450 0.1588 0.2776 ( 3417 PWs) bands (ev): -32.4603 -32.4603 -32.4211 -32.4211 -13.4897 -13.4897 -13.3939 -13.3939 -12.1577 -12.1577 -12.0137 -12.0137 -11.9537 -11.9537 -11.8195 -11.8195 -3.9978 -3.9978 -2.7487 -2.7487 -1.2598 -1.2598 -1.2161 -1.2161 4.2834 4.2834 5.5765 5.5765 5.7501 5.7501 6.6288 6.6288 7.2808 7.2808 7.3547 7.3547 7.9742 7.9742 8.0654 8.0654 8.7517 8.7517 10.5284 10.5284 10.9640 10.9640 11.5948 11.5948 11.8866 11.8866 11.9655 11.9655 12.3463 12.3463 12.5507 12.5507 k = 0.5500 0.1443 0.2858 ( 3411 PWs) bands (ev): -32.4597 -32.4597 -32.4217 -32.4217 -13.4885 -13.4885 -13.3955 -13.3955 -12.1579 -12.1579 -12.0119 -12.0119 -11.9551 -11.9551 -11.8195 -11.8195 -3.9815 -3.9815 -2.7673 -2.7673 -1.2687 -1.2687 -1.2174 -1.2174 4.3370 4.3370 5.5777 5.5777 5.7867 5.7867 6.5582 6.5582 7.2147 7.2147 7.3334 7.3334 8.0058 8.0058 8.1339 8.1339 8.8199 8.8199 10.5768 10.5768 10.8693 10.8693 11.5164 11.5164 11.8747 11.8747 11.9187 11.9187 12.3118 12.3118 12.5136 12.5136 k = 0.5550 0.1299 0.2939 ( 3417 PWs) bands (ev): -32.4591 -32.4591 -32.4223 -32.4223 -13.4872 -13.4872 -13.3972 -13.3972 -12.1581 -12.1581 -12.0102 -12.0102 -11.9565 -11.9565 -11.8196 -11.8196 -3.9635 -3.9635 -2.7881 -2.7881 -1.2775 -1.2775 -1.2189 -1.2189 4.3933 4.3933 5.5815 5.5815 5.8269 5.8269 6.4876 6.4876 7.1492 7.1492 7.3121 7.3121 8.0381 8.0381 8.2014 8.2014 8.8882 8.8882 10.6273 10.6273 10.7677 10.7677 11.4328 11.4328 11.8583 11.8583 11.8786 11.8786 12.2768 12.2768 12.4804 12.4804 k = 0.5600 0.1155 0.3021 ( 3415 PWs) bands (ev): -32.4584 -32.4584 -32.4231 -32.4231 -13.4858 -13.4858 -13.3991 -13.3991 -12.1583 -12.1583 -12.0085 -12.0085 -11.9578 -11.9578 -11.8197 -11.8197 -3.9439 -3.9439 -2.8110 -2.8110 -1.2860 -1.2860 -1.2203 -1.2203 4.4512 4.4512 5.5887 5.5887 5.8707 5.8707 6.4172 6.4172 7.0848 7.0848 7.2907 7.2907 8.0711 8.0711 8.2673 8.2673 8.9560 8.9560 10.6599 10.6599 10.6793 10.6793 11.3450 11.3450 11.8227 11.8227 11.8593 11.8593 12.2420 12.2420 12.4531 12.4531 k = 0.5650 0.1010 0.3103 ( 3415 PWs) bands (ev): -32.4576 -32.4576 -32.4238 -32.4238 -13.4842 -13.4842 -13.4011 -13.4011 -12.1584 -12.1584 -12.0069 -12.0069 -11.9590 -11.9590 -11.8198 -11.8198 -3.9228 -3.9228 -2.8359 -2.8359 -1.2940 -1.2940 -1.2218 -1.2218 4.5093 4.5093 5.6006 5.6006 5.9179 5.9179 6.3470 6.3470 7.0222 7.0222 7.2692 7.2692 8.1046 8.1046 8.3313 8.3313 9.0227 9.0227 10.5482 10.5482 10.7300 10.7300 11.2544 11.2544 11.7814 11.7814 11.8470 11.8470 12.2081 12.2081 12.4336 12.4336 k = 0.5700 0.0866 0.3184 ( 3413 PWs) bands (ev): -32.4568 -32.4568 -32.4246 -32.4246 -13.4826 -13.4826 -13.4033 -13.4033 -12.1585 -12.1585 -12.0057 -12.0057 -11.9599 -11.9599 -11.8200 -11.8200 -3.9001 -3.9001 -2.8627 -2.8627 -1.3013 -1.3013 -1.2233 -1.2233 4.5663 4.5663 5.6183 5.6183 5.9685 5.9685 6.2771 6.2771 6.9615 6.9615 7.2476 7.2476 8.1382 8.1382 8.3932 8.3932 9.0875 9.0875 10.4325 10.4325 10.7781 10.7781 11.1640 11.1640 11.7416 11.7416 11.8347 11.8347 12.1760 12.1760 12.4230 12.4230 k = 0.5750 0.0722 0.3266 ( 3419 PWs) bands (ev): -32.4560 -32.4560 -32.4255 -32.4255 -13.4809 -13.4809 -13.4055 -13.4055 -12.1585 -12.1585 -12.0048 -12.0048 -11.9605 -11.9605 -11.8202 -11.8202 -3.8761 -3.8761 -2.8914 -2.8914 -1.3079 -1.3079 -1.2248 -1.2248 4.6206 4.6206 5.6432 5.6432 6.0222 6.0222 6.2075 6.2075 6.9030 6.9030 7.2261 7.2261 8.1717 8.1717 8.4528 8.4528 9.1490 9.1490 10.3141 10.3141 10.8172 10.8172 11.0803 11.0803 11.7047 11.7047 11.8208 11.8208 12.1465 12.1465 12.4217 12.4217 k = 0.5800 0.0577 0.3348 ( 3417 PWs) bands (ev): -32.4551 -32.4551 -32.4263 -32.4263 -13.4790 -13.4790 -13.4078 -13.4078 -12.1584 -12.1584 -12.0043 -12.0043 -11.9606 -11.9606 -11.8204 -11.8204 -3.8508 -3.8508 -2.9218 -2.9218 -1.3135 -1.3135 -1.2263 -1.2263 4.6707 4.6707 5.6766 5.6766 6.0782 6.0782 6.1393 6.1393 6.8468 6.8468 7.2047 7.2047 8.2047 8.2047 8.5100 8.5100 9.2054 9.2054 10.1941 10.1941 10.8304 10.8304 11.0216 11.0216 11.6725 11.6725 11.8048 11.8048 12.1204 12.1204 12.4298 12.4298 k = 0.5850 0.0433 0.3429 ( 3412 PWs) bands (ev): -32.4542 -32.4542 -32.4272 -32.4272 -13.4771 -13.4771 -13.4102 -13.4102 -12.1583 -12.1583 -12.0045 -12.0045 -11.9602 -11.9602 -11.8208 -11.8208 -3.8242 -3.8242 -2.9536 -2.9536 -1.3182 -1.3182 -1.2277 -1.2277 4.7152 4.7152 5.7194 5.7194 6.0683 6.0683 6.1406 6.1406 6.7932 6.7932 7.1836 7.1836 8.2366 8.2366 8.5647 8.5647 9.2544 9.2544 10.0734 10.0734 10.7951 10.7951 11.0121 11.0121 11.6466 11.6466 11.7860 11.7860 12.0983 12.0983 12.4468 12.4468 k = 0.5900 0.0289 0.3511 ( 3410 PWs) bands (ev): -32.4532 -32.4532 -32.4282 -32.4282 -13.4752 -13.4752 -13.4126 -13.4126 -12.1581 -12.1581 -12.0052 -12.0052 -11.9593 -11.9593 -11.8211 -11.8211 -3.7966 -3.7966 -2.9868 -2.9868 -1.3219 -1.3219 -1.2290 -1.2290 4.7530 4.7530 5.7716 5.7716 6.0026 6.0026 6.2023 6.2023 6.7422 6.7422 7.1629 7.1629 8.2670 8.2670 8.6168 8.6168 9.2928 9.2928 9.9533 9.9533 10.7315 10.7315 11.0339 11.0339 11.6291 11.6291 11.7644 11.7644 12.0805 12.0806 12.4719 12.4719 k = 0.5950 0.0144 0.3593 ( 3416 PWs) bands (ev): -32.4523 -32.4523 -32.4291 -32.4291 -13.4731 -13.4731 -13.4151 -13.4151 -12.1577 -12.1577 -12.0065 -12.0065 -11.9578 -11.9578 -11.8215 -11.8215 -3.7682 -3.7682 -3.0208 -3.0208 -1.3245 -1.3245 -1.2302 -1.2302 4.7837 4.7837 5.8283 5.8283 5.9434 5.9434 6.2667 6.2667 6.6938 6.6938 7.1429 7.1429 8.2949 8.2949 8.6660 8.6660 9.3169 9.3169 9.8349 9.8349 10.6679 10.6679 11.0616 11.0616 11.6220 11.6220 11.7401 11.7401 12.0672 12.0672 12.5042 12.5042 k = 0.6000-0.0000 0.3674 ( 3410 PWs) bands (ev): -32.4513 -32.4513 -32.4301 -32.4301 -13.4711 -13.4711 -13.4175 -13.4175 -12.1573 -12.1573 -12.0083 -12.0083 -11.9559 -11.9559 -11.8220 -11.8220 -3.7394 -3.7394 -3.0553 -3.0553 -1.3262 -1.3262 -1.2313 -1.2313 4.8071 4.8071 5.8400 5.8400 5.9408 5.9408 6.3328 6.3328 6.6483 6.6483 7.1242 7.1242 8.3194 8.3194 8.7118 8.7118 9.3230 9.3230 9.7197 9.7197 10.6174 10.6174 11.0854 11.0854 11.6269 11.6269 11.7139 11.7139 12.0579 12.0579 12.5424 12.5424 k = 0.6050-0.0144 0.3756 ( 3410 PWs) bands (ev): -32.4503 -32.4503 -32.4311 -32.4311 -13.4690 -13.4690 -13.4199 -13.4199 -12.1568 -12.1568 -12.0106 -12.0106 -11.9535 -11.9535 -11.8225 -11.8225 -3.7105 -3.7105 -3.0896 -3.0896 -1.3268 -1.3268 -1.2322 -1.2322 4.8238 4.8238 5.7860 5.7860 6.0147 6.0147 6.3998 6.3998 6.6057 6.6057 7.1074 7.1074 8.3388 8.3388 8.7533 8.7533 9.3089 9.3089 9.6097 9.6097 10.5864 10.5864 11.1024 11.1024 11.6434 11.6434 11.6876 11.6876 12.0522 12.0522 12.5849 12.5849 k = 0.6100-0.0289 0.3838 ( 3412 PWs) bands (ev): -32.4494 -32.4494 -32.4320 -32.4320 -13.4671 -13.4671 -13.4222 -13.4222 -12.1562 -12.1562 -12.0132 -12.0132 -11.9509 -11.9509 -11.8232 -11.8232 -3.6822 -3.6822 -3.1231 -3.1231 -1.3264 -1.3264 -1.2330 -1.2330 4.8345 4.8345 5.7235 5.7235 6.1070 6.1070 6.4660 6.4660 6.5665 6.5665 7.0937 7.0937 8.3512 8.3512 8.7884 8.7884 9.2753 9.2753 9.5070 9.5070 10.5777 10.5777 11.1123 11.1123 11.6489 11.6489 11.6841 11.6841 12.0496 12.0496 12.6298 12.6298 k = 0.6150-0.0433 0.3919 ( 3415 PWs) bands (ev): -32.4486 -32.4486 -32.4328 -32.4328 -13.4652 -13.4652 -13.4243 -13.4243 -12.1554 -12.1554 -12.0161 -12.0161 -11.9479 -11.9479 -11.8238 -11.8238 -3.6556 -3.6556 -3.1546 -3.1546 -1.3251 -1.3251 -1.2336 -1.2336 4.8398 4.8398 5.6607 5.6607 6.2077 6.2077 6.5221 6.5221 6.5390 6.5390 7.0850 7.0850 8.3542 8.3542 8.8128 8.8128 9.2283 9.2283 9.4143 9.4143 10.5906 10.5906 11.1165 11.1165 11.6231 11.6231 11.7225 11.7225 12.0495 12.0495 12.6733 12.6733 k = 0.6200-0.0577 0.4001 ( 3422 PWs) bands (ev): -32.4478 -32.4478 -32.4336 -32.4336 -13.4636 -13.4636 -13.4262 -13.4262 -12.1546 -12.1546 -12.0193 -12.0193 -11.9448 -11.9448 -11.8246 -11.8246 -3.6321 -3.6321 -3.1823 -3.1823 -1.3230 -1.3230 -1.2340 -1.2340 4.8406 4.8406 5.5988 5.5988 6.3112 6.3112 6.5018 6.5018 6.5903 6.5903 7.0842 7.0842 8.3448 8.3448 8.8175 8.8175 9.1805 9.1805 9.3349 9.3349 10.6222 10.6222 11.1168 11.1168 11.5947 11.5947 11.7726 11.7726 12.0515 12.0515 12.7084 12.7084 k = 0.6250-0.0722 0.4082 ( 3414 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4276 -13.4276 -12.1537 -12.1537 -12.0226 -12.0226 -11.9416 -11.9416 -11.8254 -11.8254 -3.6139 -3.6139 -3.2042 -3.2042 -1.3200 -1.3200 -1.2342 -1.2342 4.8375 4.8375 5.5382 5.5382 6.3923 6.3923 6.5059 6.5059 6.6390 6.6390 7.0953 7.0953 8.3205 8.3205 8.7891 8.7891 9.1496 9.1496 9.2716 9.2716 10.6688 10.6688 11.1152 11.1152 11.5666 11.5666 11.8299 11.8299 12.0554 12.0554 12.7202 12.7202 k = 0.6250-0.0722 0.4082 ( 3414 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4276 -13.4276 -12.1537 -12.1537 -12.0226 -12.0226 -11.9416 -11.9416 -11.8254 -11.8254 -3.6139 -3.6139 -3.2042 -3.2042 -1.3200 -1.3200 -1.2342 -1.2342 4.8375 4.8375 5.5382 5.5382 6.3923 6.3923 6.5059 6.5059 6.6390 6.6390 7.0953 7.0953 8.3205 8.3205 8.7891 8.7891 9.1496 9.1496 9.2716 9.2716 10.6688 10.6688 11.1152 11.1152 11.5666 11.5666 11.8299 11.8299 12.0554 12.0554 12.7202 12.7202 k = 0.6167-0.0674 0.4219 ( 3422 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4277 -13.4277 -12.1537 -12.1537 -12.0224 -12.0224 -11.9418 -11.9418 -11.8253 -11.8253 -3.6130 -3.6130 -3.2051 -3.2051 -1.3199 -1.3199 -1.2347 -1.2347 4.8413 4.8413 5.5388 5.5388 6.3772 6.3772 6.4972 6.4972 6.6552 6.6552 7.1029 7.1029 8.3141 8.3141 8.7762 8.7762 9.1561 9.1561 9.2843 9.2843 10.6694 10.6694 11.1170 11.1170 11.5667 11.5667 11.8316 11.8316 12.0453 12.0453 12.7201 12.7201 k = 0.6083-0.0625 0.4355 ( 3410 PWs) bands (ev): -32.4471 -32.4471 -32.4343 -32.4343 -13.4620 -13.4620 -13.4279 -13.4279 -12.1539 -12.1539 -12.0218 -12.0218 -11.9423 -11.9423 -11.8252 -11.8252 -3.6102 -3.6102 -3.2078 -3.2078 -1.3195 -1.3195 -1.2361 -1.2361 4.8529 4.8529 5.5408 5.5408 6.3397 6.3397 6.4727 6.4727 6.6954 6.6954 7.1246 7.1246 8.2955 8.2955 8.7411 8.7411 9.1752 9.1752 9.3190 9.3190 10.6713 10.6713 11.1221 11.1221 11.5668 11.5668 11.8365 11.8365 12.0159 12.0159 12.7190 12.7190 k = 0.6000-0.0577 0.4491 ( 3408 PWs) bands (ev): -32.4469 -32.4469 -32.4345 -32.4345 -13.4617 -13.4617 -13.4282 -13.4282 -12.1542 -12.1542 -12.0208 -12.0208 -11.9433 -11.9433 -11.8250 -11.8250 -3.6056 -3.6056 -3.2124 -3.2124 -1.3189 -1.3189 -1.2384 -1.2384 4.8721 4.8721 5.5441 5.5441 6.2913 6.2913 6.4357 6.4357 6.7479 6.7479 7.1575 7.1575 8.2662 8.2662 8.6908 8.6908 9.2053 9.2053 9.3684 9.3684 10.6745 10.6745 11.1307 11.1307 11.5670 11.5670 11.8444 11.8444 11.9688 11.9688 12.7148 12.7148 k = 0.5917-0.0529 0.4627 ( 3401 PWs) bands (ev): -32.4467 -32.4467 -32.4347 -32.4347 -13.4614 -13.4614 -13.4286 -13.4286 -12.1545 -12.1545 -12.0194 -12.0194 -11.9445 -11.9445 -11.8248 -11.8248 -3.5991 -3.5991 -3.2187 -3.2187 -1.3181 -1.3181 -1.2415 -1.2415 4.8989 4.8989 5.5487 5.5487 6.2383 6.2383 6.3891 6.3891 6.8065 6.8065 7.1984 7.1984 8.2284 8.2284 8.6313 8.6313 9.2442 9.2442 9.4264 9.4264 10.6791 10.6791 11.1424 11.1424 11.5672 11.5672 11.8540 11.8540 11.9074 11.9074 12.7044 12.7044 k = 0.5833-0.0481 0.4763 ( 3407 PWs) bands (ev): -32.4465 -32.4465 -32.4349 -32.4349 -13.4609 -13.4609 -13.4292 -13.4292 -12.1549 -12.1549 -12.0177 -12.0177 -11.9461 -11.9461 -11.8245 -11.8245 -3.5908 -3.5908 -3.2268 -3.2268 -1.3170 -1.3170 -1.2454 -1.2454 4.9331 4.9331 5.5545 5.5545 6.1833 6.1833 6.3356 6.3356 6.8684 6.8684 7.2447 7.2447 8.1842 8.1842 8.5665 8.5665 9.2899 9.2899 9.4888 9.4888 10.6851 10.6851 11.1568 11.1568 11.5672 11.5672 11.8267 11.8267 11.8728 11.8728 12.6845 12.6845 k = 0.5750-0.0433 0.4899 ( 3409 PWs) bands (ev): -32.4461 -32.4461 -32.4353 -32.4353 -13.4603 -13.4603 -13.4299 -13.4299 -12.1554 -12.1554 -12.0156 -12.0156 -11.9481 -11.9481 -11.8241 -11.8241 -3.5807 -3.5807 -3.2368 -3.2368 -1.3157 -1.3157 -1.2498 -1.2498 4.9747 4.9747 5.5616 5.5616 6.1277 6.1277 6.2773 6.2773 6.9323 6.9323 7.2944 7.2944 8.1354 8.1354 8.4987 8.4987 9.3406 9.3406 9.5528 9.5528 10.6927 10.6927 11.1735 11.1735 11.5668 11.5668 11.7433 11.7433 11.8867 11.8867 12.6523 12.6523 k = 0.5667-0.0385 0.5035 ( 3413 PWs) bands (ev): -32.4458 -32.4458 -32.4357 -32.4357 -13.4596 -13.4596 -13.4306 -13.4306 -12.1559 -12.1559 -12.0133 -12.0133 -11.9503 -11.9503 -11.8237 -11.8237 -3.5687 -3.5687 -3.2487 -3.2487 -1.3142 -1.3142 -1.2548 -1.2548 5.0235 5.0235 5.5699 5.5699 6.0721 6.0721 6.2155 6.2155 6.9975 6.9975 7.3459 7.3459 8.0835 8.0835 8.4294 8.4294 9.3946 9.3946 9.6165 9.6165 10.7020 10.7020 11.1910 11.1910 11.5654 11.5654 11.6519 11.6519 11.9044 11.9044 12.6070 12.6070 k = 0.5583-0.0337 0.5171 ( 3406 PWs) bands (ev): -32.4453 -32.4453 -32.4361 -32.4361 -13.4588 -13.4588 -13.4315 -13.4315 -12.1564 -12.1564 -12.0107 -12.0107 -11.9527 -11.9527 -11.8234 -11.8234 -3.5550 -3.5550 -3.2623 -3.2623 -1.3124 -1.3124 -1.2601 -1.2601 5.0792 5.0792 5.5792 5.5792 6.0169 6.0169 6.1511 6.1511 7.0635 7.0635 7.3981 7.3981 8.0302 8.0302 8.3595 8.3595 9.4509 9.4509 9.6782 9.6782 10.7133 10.7133 11.2065 11.2065 11.5566 11.5566 11.5650 11.5650 11.9241 11.9241 12.5504 12.5504 k = 0.5500-0.0289 0.5307 ( 3400 PWs) bands (ev): -32.4448 -32.4448 -32.4366 -32.4366 -13.4580 -13.4580 -13.4324 -13.4324 -12.1569 -12.1569 -12.0079 -12.0079 -11.9553 -11.9553 -11.8230 -11.8230 -3.5394 -3.5394 -3.2778 -3.2778 -1.3105 -1.3105 -1.2655 -1.2655 5.1416 5.1416 5.5895 5.5895 5.9624 5.9624 6.0851 6.0851 7.1300 7.1300 7.4494 7.4494 7.9770 7.9770 8.2896 8.2896 9.5084 9.5084 9.7360 9.7360 10.7266 10.7266 11.2125 11.2125 11.4735 11.4735 11.5587 11.5587 11.9460 11.9460 12.4860 12.4860 k = 0.5417-0.0241 0.5443 ( 3398 PWs) bands (ev): -32.4442 -32.4442 -32.4371 -32.4371 -13.4571 -13.4571 -13.4334 -13.4334 -12.1574 -12.1574 -12.0050 -12.0050 -11.9581 -11.9581 -11.8226 -11.8226 -3.5220 -3.5220 -3.2952 -3.2952 -1.3083 -1.3083 -1.2710 -1.2710 5.2106 5.2106 5.6007 5.6007 5.9088 5.9088 6.0179 6.0179 7.1965 7.1965 7.4978 7.4978 7.9264 7.9264 8.2203 8.2203 9.5661 9.5661 9.7880 9.7880 10.7422 10.7422 11.1920 11.1920 11.4161 11.4161 11.5520 11.5520 11.9699 11.9699 12.4175 12.4175 k = 0.5333-0.0192 0.5579 ( 3404 PWs) bands (ev): -32.4436 -32.4436 -32.4378 -32.4378 -13.4562 -13.4562 -13.4344 -13.4344 -12.1578 -12.1578 -12.0021 -12.0021 -11.9609 -11.9609 -11.8223 -11.8223 -3.5029 -3.5029 -3.3143 -3.3143 -1.3060 -1.3060 -1.2763 -1.2763 5.2857 5.2857 5.6123 5.6123 5.8564 5.8564 5.9501 5.9501 7.2626 7.2626 7.5395 7.5395 7.8822 7.8822 8.1521 8.1521 9.6233 9.6233 9.8313 9.8313 10.7605 10.7605 11.1331 11.1331 11.4009 11.4009 11.5428 11.5428 11.9960 11.9960 12.3487 12.3487 k = 0.5250-0.0144 0.5715 ( 3400 PWs) bands (ev): -32.4430 -32.4430 -32.4384 -32.4384 -13.4553 -13.4553 -13.4353 -13.4353 -12.1582 -12.1582 -11.9992 -11.9992 -11.9636 -11.9636 -11.8220 -11.8220 -3.4820 -3.4820 -3.3353 -3.3353 -1.3035 -1.3035 -1.2813 -1.2813 5.3666 5.3666 5.6236 5.6236 5.8061 5.8061 5.8823 5.8823 7.3277 7.3277 7.5671 7.5671 7.8523 7.8523 8.0856 8.0856 9.6794 9.6794 9.8625 9.8625 10.7817 10.7817 11.0540 11.0540 11.4130 11.4130 11.5310 11.5310 12.0244 12.0244 12.2823 12.2823 k = 0.5167-0.0096 0.5852 ( 3396 PWs) bands (ev): -32.4422 -32.4422 -32.4391 -32.4391 -13.4546 -13.4546 -13.4361 -13.4361 -12.1584 -12.1584 -11.9967 -11.9967 -11.9660 -11.9660 -11.8218 -11.8218 -3.4594 -3.4594 -3.3580 -3.3580 -1.3009 -1.3009 -1.2858 -1.2858 5.4524 5.4524 5.6325 5.6325 5.7597 5.7597 5.8154 5.8154 7.3908 7.3908 7.5704 7.5704 7.8469 7.8469 8.0218 8.0218 9.7336 9.7336 9.8770 9.8770 10.8060 10.8060 10.9758 10.9758 11.4354 11.4354 11.5166 11.5166 12.0550 12.0550 12.2212 12.2212 k = 0.5083-0.0048 0.5988 ( 3400 PWs) bands (ev): -32.4415 -32.4415 -32.4399 -32.4399 -13.4541 -13.4541 -13.4366 -13.4366 -12.1586 -12.1586 -11.9949 -11.9949 -11.9678 -11.9678 -11.8217 -11.8217 -3.4352 -3.4352 -3.3823 -3.3823 -1.2985 -1.2985 -1.2895 -1.2895 5.5404 5.5404 5.6328 5.6328 5.7233 5.7233 5.7524 5.7524 7.4500 7.4500 7.5473 7.5473 7.8689 7.8689 7.9621 7.9621 9.7852 9.7852 9.8697 9.8697 10.8337 10.8337 10.9108 10.9108 11.4598 11.4598 11.5000 11.5000 12.0873 12.0873 12.1685 12.1685 k = 0.5000-0.0000 0.6124 ( 3400 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4539 -13.4539 -13.4369 -13.4369 -12.1587 -12.1587 -11.9942 -11.9942 -11.9685 -11.9685 -11.8217 -11.8217 -3.4130 -3.4130 -3.4045 -3.4045 -1.2972 -1.2972 -1.2913 -1.2913 5.6038 5.6038 5.6190 5.6190 5.7043 5.7043 5.7182 5.7182 7.4935 7.4935 7.5149 7.5149 7.9080 7.9080 7.9114 7.9114 9.8265 9.8265 9.8437 9.8437 10.8609 10.8609 10.8703 10.8703 11.4813 11.4813 11.4818 11.4818 12.1131 12.1131 12.1354 12.1354 k = 0.5000-0.0000 0.6124 ( 3400 PWs) bands (ev): -32.4407 -32.4407 -32.4407 -32.4407 -13.4539 -13.4539 -13.4369 -13.4369 -12.1587 -12.1587 -11.9942 -11.9942 -11.9685 -11.9685 -11.8217 -11.8217 -3.4130 -3.4130 -3.4045 -3.4045 -1.2972 -1.2972 -1.2913 -1.2913 5.6038 5.6038 5.6190 5.6190 5.7043 5.7043 5.7182 5.7182 7.4935 7.4935 7.5149 7.5149 7.9080 7.9080 7.9114 7.9114 9.8265 9.8265 9.8437 9.8437 10.8609 10.8609 10.8703 10.8703 11.4813 11.4813 11.4818 11.4818 12.1131 12.1131 12.1354 12.1354 k = 0.5000 0.0100 0.5983 ( 3400 PWs) bands (ev): -32.4419 -32.4419 -32.4395 -32.4395 -13.4543 -13.4543 -13.4364 -13.4364 -12.1587 -12.1587 -11.9942 -11.9942 -11.9685 -11.9685 -11.8217 -11.8217 -3.4482 -3.4482 -3.3689 -3.3689 -1.2997 -1.2997 -1.2886 -1.2886 5.5531 5.5531 5.6386 5.6386 5.7192 5.7192 5.7369 5.7369 7.4219 7.4219 7.5628 7.5628 7.8534 7.8534 7.9913 7.9913 9.7624 9.7624 9.9014 9.9014 10.8202 10.8202 10.9177 10.9177 11.4535 11.4535 11.5095 11.5095 12.0700 12.0700 12.1780 12.1780 k = 0.5000 0.0199 0.5842 ( 3402 PWs) bands (ev): -32.4431 -32.4431 -32.4383 -32.4383 -13.4556 -13.4556 -13.4350 -13.4350 -12.1587 -12.1587 -11.9941 -11.9941 -11.9686 -11.9686 -11.8216 -11.8216 -3.4868 -3.4868 -3.3292 -3.3292 -1.3036 -1.3036 -1.2840 -1.2840 5.4878 5.4878 5.6323 5.6323 5.7445 5.7445 5.7911 5.7911 7.3222 7.3222 7.5990 7.5990 7.8181 7.8181 8.0950 8.0950 9.6861 9.6861 9.9575 9.9575 10.7856 10.7856 10.9737 10.9737 11.4248 11.4248 11.5373 11.5373 12.0188 12.0188 12.2273 12.2273 k = 0.5000 0.0299 0.5701 ( 3402 PWs) bands (ev): -32.4443 -32.4443 -32.4371 -32.4371 -13.4574 -13.4574 -13.4331 -13.4331 -12.1587 -12.1587 -11.9940 -11.9940 -11.9688 -11.9688 -11.8215 -11.8215 -3.5249 -3.5249 -3.2893 -3.2893 -1.3073 -1.3073 -1.2792 -1.2792 5.4203 5.4203 5.6188 5.6188 5.7722 5.7722 5.8576 5.8576 7.2117 7.2117 7.6208 7.6208 7.7962 7.7962 8.2132 8.2132 9.6068 9.6068 10.0009 10.0009 10.7655 10.7655 11.0319 11.0319 11.3949 11.3949 11.5652 11.5652 11.9702 11.9702 12.2720 12.2720 k = 0.5000 0.0398 0.5561 ( 3404 PWs) bands (ev): -32.4455 -32.4455 -32.4359 -32.4359 -13.4595 -13.4595 -13.4308 -13.4308 -12.1588 -12.1588 -11.9940 -11.9940 -11.9689 -11.9689 -11.8214 -11.8214 -3.5622 -3.5622 -3.2494 -3.2494 -1.3107 -1.3107 -1.2742 -1.2742 5.3519 5.3519 5.6050 5.6050 5.8025 5.8025 5.9276 5.9276 7.0968 7.0968 7.6339 7.6339 7.7823 7.7823 8.3390 8.3390 9.5256 9.5256 10.0286 10.0286 10.7639 10.7639 11.0908 11.0908 11.3633 11.3633 11.5930 11.5930 11.9258 11.9258 12.3093 12.3093 k = 0.5000 0.0498 0.5420 ( 3402 PWs) bands (ev): -32.4466 -32.4466 -32.4347 -32.4347 -13.4617 -13.4617 -13.4284 -13.4284 -12.1588 -12.1588 -11.9939 -11.9939 -11.9691 -11.9691 -11.8213 -11.8213 -3.5988 -3.5988 -3.2097 -3.2097 -1.3136 -1.3136 -1.2692 -1.2692 5.2831 5.2831 5.5924 5.5924 5.8352 5.8352 5.9993 5.9993 6.9814 6.9814 7.6417 7.6417 7.7729 7.7729 8.4673 8.4673 9.4431 9.4431 10.0400 10.0400 10.7825 10.7825 11.1495 11.1495 11.3290 11.3290 11.6203 11.6203 11.8871 11.8871 12.3376 12.3376 k = 0.5000 0.0597 0.5279 ( 3408 PWs) bands (ev): -32.4478 -32.4478 -32.4336 -32.4336 -13.4640 -13.4640 -13.4258 -13.4258 -12.1589 -12.1589 -11.9940 -11.9940 -11.9692 -11.9692 -11.8212 -11.8212 -3.6344 -3.6344 -3.1703 -3.1703 -1.3159 -1.3159 -1.2643 -1.2643 5.2140 5.2140 5.5813 5.5813 5.8702 5.8702 6.0721 6.0721 6.8679 6.8679 7.6462 7.6462 7.7662 7.7662 8.5941 8.5941 9.3598 9.3598 10.0378 10.0378 10.8200 10.8200 11.2073 11.2073 11.2915 11.2915 11.6469 11.6469 11.8552 11.8552 12.3573 12.3573 k = 0.5000 0.0697 0.5138 ( 3402 PWs) bands (ev): -32.4489 -32.4489 -32.4324 -32.4324 -13.4663 -13.4663 -13.4231 -13.4231 -12.1590 -12.1590 -11.9942 -11.9942 -11.9691 -11.9691 -11.8210 -11.8210 -3.6689 -3.6689 -3.1316 -3.1316 -1.3174 -1.3174 -1.2596 -1.2596 5.1446 5.1446 5.5719 5.5719 5.9070 5.9070 6.1460 6.1460 6.7581 6.7581 7.6484 7.6484 7.7611 7.7611 8.7155 8.7155 9.2761 9.2761 10.0281 10.0281 10.8728 10.8728 11.2502 11.2502 11.2637 11.2637 11.6724 11.6724 11.8313 11.8313 12.3705 12.3705 k = 0.5000 0.0796 0.4998 ( 3392 PWs) bands (ev): -32.4500 -32.4500 -32.4313 -32.4313 -13.4686 -13.4686 -13.4205 -13.4205 -12.1590 -12.1590 -11.9946 -11.9946 -11.9689 -11.9689 -11.8209 -11.8209 -3.7025 -3.7025 -3.0935 -3.0935 -1.3182 -1.3182 -1.2549 -1.2549 5.0748 5.0748 5.5642 5.5642 5.9455 5.9455 6.2207 6.2207 6.6531 6.6531 7.6492 7.6492 7.7570 7.7570 8.8268 8.8268 9.1923 9.1923 10.0181 10.0181 10.9364 10.9364 11.2053 11.2053 11.3181 11.3181 11.6963 11.6963 11.8158 11.8158 12.3807 12.3807 k = 0.5000 0.0896 0.4857 ( 3394 PWs) bands (ev): -32.4511 -32.4511 -32.4302 -32.4302 -13.4708 -13.4708 -13.4179 -13.4179 -12.1591 -12.1591 -11.9952 -11.9952 -11.9685 -11.9685 -11.8207 -11.8207 -3.7348 -3.7348 -3.0563 -3.0563 -1.3181 -1.3181 -1.2505 -1.2505 5.0048 5.0048 5.5582 5.5582 5.9848 5.9848 6.2962 6.2962 6.5546 6.5546 7.6488 7.6488 7.7535 7.7535 8.9223 8.9223 9.1091 9.1091 10.0160 10.0160 11.0066 11.0066 11.1570 11.1570 11.3707 11.3707 11.7188 11.7188 11.8093 11.8093 12.3907 12.3907 k = 0.5000 0.0995 0.4716 ( 3394 PWs) bands (ev): -32.4522 -32.4522 -32.4292 -32.4292 -13.4730 -13.4730 -13.4152 -13.4152 -12.1591 -12.1591 -11.9962 -11.9962 -11.9678 -11.9678 -11.8205 -11.8205 -3.7659 -3.7659 -3.0201 -3.0201 -1.3171 -1.3171 -1.2462 -1.2462 4.9346 4.9346 5.5537 5.5537 6.0236 6.0236 6.3717 6.3717 6.4648 6.4648 7.6475 7.6475 7.7503 7.7503 8.9870 8.9870 9.0355 9.0355 10.0293 10.0293 11.0759 11.0759 11.1099 11.1099 11.4213 11.4213 11.7397 11.7397 11.8118 11.8118 12.4027 12.4027 k = 0.5000 0.1095 0.4575 ( 3398 PWs) bands (ev): -32.4532 -32.4532 -32.4282 -32.4282 -13.4751 -13.4751 -13.4127 -13.4127 -12.1591 -12.1591 -11.9973 -11.9973 -11.9669 -11.9669 -11.8203 -11.8203 -3.7957 -3.7957 -2.9852 -2.9852 -1.3151 -1.3151 -1.2422 -1.2422 4.8644 4.8644 5.5506 5.5506 6.0587 6.0587 6.3824 6.3824 6.4520 6.4520 7.6457 7.6457 7.7472 7.7472 8.9331 8.9331 9.0549 9.0549 10.0638 10.0638 11.0476 11.0476 11.1586 11.1586 11.4698 11.4698 11.7597 11.7597 11.8236 11.8236 12.4180 12.4180 k = 0.5000 0.1195 0.4434 ( 3402 PWs) bands (ev): -32.4541 -32.4541 -32.4272 -32.4272 -13.4772 -13.4772 -13.4102 -13.4102 -12.1591 -12.1591 -11.9987 -11.9987 -11.9658 -11.9658 -11.8202 -11.8202 -3.8242 -3.8242 -2.9517 -2.9517 -1.3122 -1.3122 -1.2384 -1.2384 4.7943 4.7943 5.5489 5.5489 6.0819 6.0819 6.3247 6.3247 6.5285 6.5285 7.6434 7.6434 7.7442 7.7442 8.8502 8.8502 9.0760 9.0760 10.1216 10.1216 10.9919 10.9919 11.2316 11.2316 11.5161 11.5161 11.7794 11.7794 11.8446 11.8446 12.4368 12.4368 k = 0.5000 0.1294 0.4294 ( 3402 PWs) bands (ev): -32.4551 -32.4551 -32.4263 -32.4263 -13.4791 -13.4791 -13.4077 -13.4077 -12.1590 -12.1590 -12.0003 -12.0003 -11.9645 -11.9645 -11.8200 -11.8200 -3.8513 -3.8513 -2.9197 -2.9197 -1.3082 -1.3082 -1.2349 -1.2349 4.7246 4.7246 5.5485 5.5485 6.0777 6.0777 6.3013 6.3013 6.6065 6.6065 7.6408 7.6408 7.7410 7.7410 8.7660 8.7660 9.0739 9.0739 10.2002 10.2002 10.9346 10.9346 11.3020 11.3020 11.5604 11.5604 11.7992 11.7992 11.8752 11.8752 12.4589 12.4589 k = 0.5000 0.1394 0.4153 ( 3404 PWs) bands (ev): -32.4560 -32.4560 -32.4254 -32.4254 -13.4809 -13.4809 -13.4054 -13.4054 -12.1589 -12.1589 -12.0021 -12.0021 -11.9631 -11.9631 -11.8199 -11.8199 -3.8769 -3.8769 -2.8894 -2.8894 -1.3033 -1.3033 -1.2316 -1.2316 4.6556 4.6556 5.5491 5.5491 6.0423 6.0423 6.3171 6.3171 6.6850 6.6850 7.6380 7.6380 7.7376 7.7376 8.6816 8.6816 9.0524 9.0524 10.2941 10.2941 10.8771 10.8771 11.3681 11.3681 11.6027 11.6027 11.8200 11.8200 11.9151 11.9151 12.4838 12.4838 k = 0.5000 0.1493 0.4012 ( 3406 PWs) bands (ev): -32.4568 -32.4568 -32.4245 -32.4245 -13.4827 -13.4827 -13.4032 -13.4032 -12.1588 -12.1588 -12.0039 -12.0039 -11.9616 -11.9616 -11.8198 -11.8198 -3.9011 -3.9011 -2.8609 -2.8609 -1.2974 -1.2974 -1.2286 -1.2286 4.5878 4.5878 5.5507 5.5507 5.9919 5.9919 6.3559 6.3559 6.7637 6.7637 7.6351 7.6351 7.7341 7.7341 8.5972 8.5972 9.0166 9.0166 10.3969 10.3969 10.8210 10.8210 11.4293 11.4293 11.6430 11.6430 11.8426 11.8426 11.9635 11.9635 12.5107 12.5107 k = 0.5000 0.1593 0.3871 ( 3408 PWs) bands (ev): -32.4576 -32.4576 -32.4238 -32.4238 -13.4843 -13.4843 -13.4010 -13.4010 -12.1586 -12.1586 -12.0059 -12.0059 -11.9600 -11.9600 -11.8197 -11.8197 -3.9237 -3.9237 -2.8343 -2.8343 -1.2907 -1.2907 -1.2258 -1.2258 4.5216 4.5216 5.5531 5.5531 5.9384 5.9384 6.4055 6.4055 6.8424 6.8424 7.6324 7.6324 7.7302 7.7302 8.5132 8.5132 8.9709 8.9709 10.5012 10.5012 10.7693 10.7693 11.4856 11.4856 11.6815 11.6815 11.8673 11.8673 12.0188 12.0188 12.5387 12.5387 k = 0.5000 0.1692 0.3731 ( 3414 PWs) bands (ev): -32.4584 -32.4584 -32.4230 -32.4230 -13.4858 -13.4858 -13.3990 -13.3990 -12.1584 -12.1584 -12.0079 -12.0079 -11.9584 -11.9584 -11.8196 -11.8196 -3.9448 -3.9448 -2.8096 -2.8096 -1.2834 -1.2834 -1.2233 -1.2233 4.4575 4.4575 5.5562 5.5562 5.8868 5.8868 6.4608 6.4608 6.9207 6.9207 7.6300 7.6300 7.7259 7.7259 8.4295 8.4295 8.9183 8.9183 10.5895 10.5895 10.7362 10.7362 11.5378 11.5378 11.7185 11.7185 11.8948 11.8948 12.0790 12.0790 12.5671 12.5671 k = 0.5000 0.1792 0.3590 ( 3416 PWs) bands (ev): -32.4591 -32.4591 -32.4223 -32.4223 -13.4873 -13.4873 -13.3971 -13.3971 -12.1582 -12.1582 -12.0099 -12.0099 -11.9568 -11.9568 -11.8195 -11.8195 -3.9643 -3.9643 -2.7870 -2.7870 -1.2754 -1.2754 -1.2210 -1.2210 4.3959 4.3959 5.5597 5.5597 5.8387 5.8387 6.5199 6.5199 6.9983 6.9983 7.6282 7.6282 7.7212 7.7212 8.3467 8.3467 8.8611 8.8611 10.6064 10.6064 10.7744 10.7744 11.5869 11.5869 11.7541 11.7541 11.9252 11.9252 12.1417 12.1417 12.5951 12.5951 k = 0.5000 0.1891 0.3449 ( 3420 PWs) bands (ev): -32.4598 -32.4598 -32.4217 -32.4217 -13.4885 -13.4885 -13.3954 -13.3954 -12.1579 -12.1579 -12.0118 -12.0118 -11.9552 -11.9552 -11.8195 -11.8195 -3.9822 -3.9822 -2.7664 -2.7664 -1.2671 -1.2671 -1.2189 -1.2189 4.3375 4.3375 5.5637 5.5637 5.7948 5.7948 6.5817 6.5817 7.0746 7.0746 7.6273 7.6273 7.7157 7.7157 8.2649 8.2649 8.8008 8.8008 10.5698 10.5698 10.8642 10.8642 11.6342 11.6342 11.7885 11.7885 11.9587 11.9587 12.2044 12.2044 12.6221 12.6221 k = 0.5000 0.1991 0.3308 ( 3420 PWs) bands (ev): -32.4604 -32.4604 -32.4211 -32.4211 -13.4897 -13.4897 -13.3938 -13.3938 -12.1577 -12.1577 -12.0137 -12.0137 -11.9537 -11.9537 -11.8194 -11.8194 -3.9984 -3.9984 -2.7479 -2.7479 -1.2586 -1.2586 -1.2171 -1.2171 4.2828 4.2828 5.5678 5.5678 5.7553 5.7553 6.6455 6.6455 7.1488 7.1488 7.6280 7.6280 7.7092 7.7092 8.1849 8.1849 8.7384 8.7384 10.5249 10.5249 10.9585 10.9585 11.6803 11.6803 11.8214 11.8214 11.9956 11.9956 12.2651 12.2651 12.6475 12.6475 k = 0.5000 0.2090 0.3167 ( 3418 PWs) bands (ev): -32.4609 -32.4609 -32.4205 -32.4205 -13.4908 -13.4908 -13.3923 -13.3923 -12.1574 -12.1574 -12.0154 -12.0154 -11.9523 -11.9523 -11.8194 -11.8194 -4.0130 -4.0130 -2.7315 -2.7315 -1.2501 -1.2501 -1.2155 -1.2155 4.2322 4.2322 5.5720 5.5720 5.7203 5.7203 6.7111 6.7111 7.2198 7.2198 7.6308 7.6308 7.7012 7.7012 8.1074 8.1074 8.6750 8.6750 10.4807 10.4807 11.0472 11.0472 11.7260 11.7260 11.8525 11.8525 12.0363 12.0363 12.3218 12.3218 12.6706 12.6706 k = 0.5000 0.2190 0.3027 ( 3422 PWs) bands (ev): -32.4614 -32.4614 -32.4201 -32.4201 -13.4917 -13.4917 -13.3910 -13.3910 -12.1571 -12.1571 -12.0171 -12.0171 -11.9510 -11.9510 -11.8194 -11.8194 -4.0260 -4.0260 -2.7171 -2.7171 -1.2419 -1.2419 -1.2141 -1.2141 4.1863 4.1863 5.5760 5.5760 5.6897 5.6897 6.7778 6.7778 7.2859 7.2859 7.6369 7.6369 7.6910 7.6910 8.0339 8.0339 8.6112 8.6112 10.4395 10.4395 11.1271 11.1271 11.7711 11.7711 11.8814 11.8814 12.0812 12.0812 12.3730 12.3730 12.6907 12.6907 k = 0.5000 0.2289 0.2886 ( 3412 PWs) bands (ev): -32.4618 -32.4618 -32.4196 -32.4196 -13.4925 -13.4925 -13.3899 -13.3899 -12.1569 -12.1569 -12.0186 -12.0186 -11.9499 -11.9499 -11.8194 -11.8194 -4.0372 -4.0372 -2.7048 -2.7048 -1.2342 -1.2342 -1.2129 -1.2129 4.1456 4.1456 5.5799 5.5799 5.6635 5.6635 6.8452 6.8452 7.3446 7.3446 7.6462 7.6462 7.6787 7.6787 7.9666 7.9666 8.5479 8.5479 10.4022 10.4022 11.1966 11.1966 11.8150 11.8150 11.9074 11.9074 12.1307 12.1307 12.4177 12.4177 12.7068 12.7068 k = 0.5000 0.2389 0.2745 ( 3416 PWs) bands (ev): -32.4621 -32.4621 -32.4193 -32.4193 -13.4932 -13.4932 -13.3889 -13.3889 -12.1566 -12.1566 -12.0199 -12.0199 -11.9489 -11.9489 -11.8194 -11.8194 -4.0467 -4.0467 -2.6944 -2.6944 -1.2272 -1.2272 -1.2118 -1.2118 4.1103 4.1103 5.5834 5.5834 5.6415 5.6415 6.9127 6.9127 7.3931 7.3931 7.6443 7.6443 7.6779 7.6779 7.9086 7.9086 8.4860 8.4860 10.3697 10.3697 11.2548 11.2548 11.8564 11.8564 11.9305 11.9305 12.1849 12.1849 12.4552 12.4552 12.7170 12.7170 k = 0.5000 0.2489 0.2604 ( 3418 PWs) bands (ev): -32.4624 -32.4624 -32.4190 -32.4190 -13.4938 -13.4938 -13.3881 -13.3881 -12.1564 -12.1564 -12.0210 -12.0210 -11.9480 -11.9480 -11.8194 -11.8194 -4.0545 -4.0545 -2.6861 -2.6861 -1.2212 -1.2212 -1.2110 -1.2110 4.0810 4.0810 5.5864 5.5864 5.6237 5.6237 6.9792 6.9792 7.4290 7.4290 7.6172 7.6172 7.7015 7.7015 7.8633 7.8633 8.4271 8.4271 10.3424 10.3424 11.3018 11.3018 11.8934 11.8934 11.9504 11.9504 12.2437 12.2437 12.4854 12.4854 12.7172 12.7172 k = 0.5000 0.2588 0.2464 ( 3420 PWs) bands (ev): -32.4627 -32.4627 -32.4188 -32.4188 -13.4942 -13.4942 -13.3875 -13.3875 -12.1563 -12.1563 -12.0218 -12.0218 -11.9473 -11.9473 -11.8194 -11.8194 -4.0606 -4.0606 -2.6796 -2.6796 -1.2164 -1.2164 -1.2103 -1.2103 4.0578 4.0578 5.5889 5.5889 5.6099 5.6099 7.0427 7.0427 7.4519 7.4519 7.5792 7.5792 7.7335 7.7335 7.8322 7.8322 8.3735 8.3735 10.3207 10.3207 11.3377 11.3377 11.9236 11.9236 11.9674 11.9674 12.3069 12.3069 12.5082 12.5082 12.6990 12.6990 k = 0.5000 0.2688 0.2323 ( 3426 PWs) bands (ev): -32.4628 -32.4628 -32.4186 -32.4186 -13.4945 -13.4945 -13.3871 -13.3871 -12.1561 -12.1561 -12.0225 -12.0225 -11.9468 -11.9468 -11.8194 -11.8194 -4.0649 -4.0649 -2.6750 -2.6750 -1.2129 -1.2129 -1.2097 -1.2097 4.0411 4.0411 5.5907 5.5907 5.6001 5.6001 7.0997 7.0997 7.4623 7.4623 7.5402 7.5402 7.7656 7.7656 7.8135 7.8135 8.3287 8.3287 10.3050 10.3050 11.3629 11.3629 11.9449 11.9449 11.9814 11.9814 12.3737 12.3737 12.5239 12.5239 12.6549 12.6549 k = 0.5000 0.2787 0.2182 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4186 -32.4186 -13.4947 -13.4947 -13.3868 -13.3868 -12.1561 -12.1561 -12.0229 -12.0229 -11.9465 -11.9465 -11.8194 -11.8194 -4.0675 -4.0675 -2.6722 -2.6722 -1.2111 -1.2111 -1.2090 -1.2090 4.0310 4.0310 5.5917 5.5917 5.5943 5.5943 7.1427 7.1427 7.4594 7.4594 7.5144 7.5144 7.7883 7.7883 7.8055 7.8055 8.2980 8.2980 10.2955 10.2955 11.3779 11.3779 11.9569 11.9569 11.9914 11.9914 12.4428 12.4428 12.5324 12.5324 12.5934 12.5934 k = 0.5000 0.2887 0.2041 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4185 -32.4185 -13.4948 -13.4948 -13.3867 -13.3867 -12.1560 -12.1560 -12.0230 -12.0230 -11.9465 -11.9465 -11.8194 -11.8194 -4.0684 -4.0684 -2.6713 -2.6713 -1.2107 -1.2107 -1.2086 -1.2086 4.0276 4.0276 5.5916 5.5916 5.5928 5.5928 7.1597 7.1597 7.4536 7.4536 7.5077 7.5077 7.7935 7.7935 7.8064 7.8064 8.2868 8.2868 10.2923 10.2923 11.3828 11.3828 11.9607 11.9607 11.9951 11.9951 12.4996 12.4996 12.5233 12.5233 12.5498 12.5498 k = 0.5000 0.2887 0.2041 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4185 -32.4185 -13.4948 -13.4948 -13.3867 -13.3867 -12.1560 -12.1560 -12.0230 -12.0230 -11.9465 -11.9465 -11.8194 -11.8194 -4.0684 -4.0684 -2.6713 -2.6713 -1.2107 -1.2107 -1.2086 -1.2086 4.0276 4.0276 5.5916 5.5916 5.5928 5.5928 7.1597 7.1597 7.4536 7.4536 7.5077 7.5077 7.7935 7.7935 7.8064 7.8064 8.2868 8.2868 10.2923 10.2923 11.3828 11.3828 11.9607 11.9607 11.9951 11.9951 12.4996 12.4996 12.5233 12.5233 12.5498 12.5498 k = 0.4950 0.2858 0.2205 ( 3426 PWs) bands (ev): -32.4629 -32.4629 -32.4186 -32.4186 -13.4947 -13.4947 -13.3868 -13.3868 -12.1561 -12.1561 -12.0229 -12.0229 -11.9466 -11.9466 -11.8194 -11.8194 -4.0675 -4.0675 -2.6722 -2.6722 -1.2111 -1.2111 -1.2090 -1.2090 4.0310 4.0310 5.5917 5.5917 5.5943 5.5943 7.1426 7.1426 7.4595 7.4595 7.5145 7.5145 7.7883 7.7883 7.8054 7.8054 8.2981 8.2981 10.2956 10.2956 11.3778 11.3778 11.9569 11.9569 11.9914 11.9914 12.4425 12.4425 12.5324 12.5324 12.5936 12.5936 k = 0.4900 0.2829 0.2368 ( 3429 PWs) bands (ev): -32.4628 -32.4628 -32.4187 -32.4187 -13.4945 -13.4945 -13.3871 -13.3871 -12.1561 -12.1561 -12.0225 -12.0225 -11.9468 -11.9468 -11.8194 -11.8194 -4.0649 -4.0649 -2.6750 -2.6750 -1.2129 -1.2129 -1.2097 -1.2097 4.0412 4.0412 5.5906 5.5906 5.6002 5.6002 7.0992 7.0992 7.4631 7.4631 7.5392 7.5392 7.7671 7.7671 7.8123 7.8123 8.3291 8.3291 10.3052 10.3052 11.3628 11.3628 11.9446 11.9446 11.9814 11.9814 12.3730 12.3730 12.5242 12.5242 12.6548 12.6548 k = 0.4850 0.2800 0.2531 ( 3419 PWs) bands (ev): -32.4627 -32.4627 -32.4188 -32.4188 -13.4942 -13.4942 -13.3875 -13.3875 -12.1563 -12.1563 -12.0218 -12.0218 -11.9473 -11.9473 -11.8194 -11.8194 -4.0605 -4.0605 -2.6796 -2.6796 -1.2164 -1.2164 -1.2103 -1.2103 4.0581 4.0581 5.5889 5.5889 5.6100 5.6100 7.0417 7.0417 7.4567 7.4567 7.5685 7.5685 7.7460 7.7460 7.8259 7.8259 8.3743 8.3743 10.3210 10.3210 11.3373 11.3373 11.9222 11.9222 11.9681 11.9681 12.3054 12.3054 12.5099 12.5099 12.6946 12.6946 k = 0.4800 0.2771 0.2694 ( 3419 PWs) bands (ev): -32.4624 -32.4624 -32.4190 -32.4190 -13.4938 -13.4938 -13.3881 -13.3881 -12.1564 -12.1564 -12.0210 -12.0210 -11.9480 -11.9480 -11.8194 -11.8194 -4.0544 -4.0544 -2.6862 -2.6862 -1.2213 -1.2213 -1.2110 -1.2110 4.0815 4.0815 5.5866 5.5866 5.6237 5.6237 6.9774 6.9774 7.4446 7.4446 7.5690 7.5690 7.7537 7.7537 7.8441 7.8441 8.4285 8.4285 10.3428 10.3428 11.3013 11.3013 11.8889 11.8889 11.9537 11.9537 12.2410 12.2410 12.4908 12.4908 12.7020 12.7020 k = 0.4750 0.2742 0.2858 ( 3414 PWs) bands (ev): -32.4621 -32.4621 -32.4193 -32.4193 -13.4932 -13.4932 -13.3889 -13.3889 -12.1566 -12.1566 -12.0199 -12.0199 -11.9489 -11.9489 -11.8194 -11.8194 -4.0465 -4.0465 -2.6947 -2.6947 -1.2274 -1.2274 -1.2118 -1.2118 4.1110 4.1110 5.5840 5.5840 5.6413 5.6413 6.9096 6.9096 7.4291 7.4291 7.5322 7.5322 7.7973 7.7973 7.8662 7.8662 8.4883 8.4883 10.3704 10.3704 11.2544 11.2544 11.8456 11.8456 11.9392 11.9392 12.1798 12.1798 12.4676 12.4676 12.6870 12.6870 k = 0.4700 0.2714 0.3021 ( 3412 PWs) bands (ev): -32.4618 -32.4618 -32.4196 -32.4196 -13.4925 -13.4925 -13.3899 -13.3899 -12.1569 -12.1569 -12.0185 -12.0185 -11.9499 -11.9499 -11.8194 -11.8194 -4.0369 -4.0369 -2.7051 -2.7051 -1.2345 -1.2345 -1.2127 -1.2127 4.1465 4.1465 5.5813 5.5813 5.6628 5.6628 6.8403 6.8403 7.4113 7.4113 7.4774 7.4774 7.8569 7.8569 7.8919 7.8919 8.5516 8.5516 10.4032 10.4032 11.1968 11.1968 11.7936 11.7936 11.9250 11.9250 12.1219 12.1219 12.4409 12.4409 12.6602 12.6602 k = 0.4650 0.2685 0.3184 ( 3418 PWs) bands (ev): -32.4614 -32.4614 -32.4201 -32.4201 -13.4917 -13.4917 -13.3911 -13.3911 -12.1571 -12.1571 -12.0171 -12.0171 -11.9510 -11.9510 -11.8194 -11.8194 -4.0256 -4.0256 -2.7176 -2.7176 -1.2424 -1.2424 -1.2138 -1.2138 4.1874 4.1874 5.5789 5.5789 5.6881 5.6881 6.7700 6.7700 7.3904 7.3904 7.4171 7.4171 7.9112 7.9112 7.9312 7.9312 8.6171 8.6171 10.4409 10.4409 11.1287 11.1287 11.7340 11.7340 11.9114 11.9114 12.0671 12.0671 12.4114 12.4114 12.6265 12.6265 k = 0.4600 0.2656 0.3348 ( 3420 PWs) bands (ev): -32.4609 -32.4609 -32.4206 -32.4206 -13.4907 -13.4907 -13.3924 -13.3924 -12.1574 -12.1574 -12.0154 -12.0154 -11.9523 -11.9523 -11.8194 -11.8194 -4.0125 -4.0125 -2.7321 -2.7321 -1.2509 -1.2509 -1.2149 -1.2149 4.2332 4.2332 5.5771 5.5771 5.7173 5.7173 6.6995 6.6995 7.3456 7.3456 7.3767 7.3767 7.9435 7.9435 7.9966 7.9966 8.6840 8.6840 10.4828 10.4828 11.0509 11.0509 11.6675 11.6675 11.8986 11.8986 12.0150 12.0150 12.3797 12.3797 12.5892 12.5892 k = 0.4550 0.2627 0.3511 ( 3417 PWs) bands (ev): -32.4603 -32.4603 -32.4211 -32.4211 -13.4897 -13.4897 -13.3939 -13.3939 -12.1577 -12.1577 -12.0137 -12.0137 -11.9537 -11.9537 -11.8195 -11.8195 -3.9978 -3.9978 -2.7487 -2.7487 -1.2597 -1.2597 -1.2162 -1.2162 4.2834 4.2834 5.5765 5.5765 5.7501 5.7501 6.6288 6.6288 7.2808 7.2808 7.3546 7.3546 7.9742 7.9742 8.0654 8.0654 8.7517 8.7517 10.5284 10.5284 10.9640 10.9640 11.5949 11.5949 11.8866 11.8866 11.9655 11.9655 12.3462 12.3462 12.5507 12.5507 k = 0.4500 0.2598 0.3674 ( 3411 PWs) bands (ev): -32.4597 -32.4597 -32.4217 -32.4217 -13.4885 -13.4885 -13.3955 -13.3955 -12.1579 -12.1579 -12.0119 -12.0119 -11.9551 -11.9551 -11.8195 -11.8195 -3.9815 -3.9815 -2.7673 -2.7673 -1.2686 -1.2686 -1.2175 -1.2175 4.3370 4.3370 5.5777 5.5777 5.7867 5.7867 6.5582 6.5582 7.2147 7.2147 7.3334 7.3334 8.0057 8.0057 8.1339 8.1339 8.8199 8.8199 10.5768 10.5768 10.8693 10.8693 11.5164 11.5164 11.8746 11.8746 11.9187 11.9187 12.3117 12.3117 12.5137 12.5137 k = 0.4450 0.2569 0.3838 ( 3417 PWs) bands (ev): -32.4591 -32.4591 -32.4223 -32.4223 -13.4872 -13.4872 -13.3972 -13.3972 -12.1581 -12.1581 -12.0102 -12.0102 -11.9565 -11.9565 -11.8196 -11.8196 -3.9635 -3.9635 -2.7881 -2.7881 -1.2774 -1.2774 -1.2190 -1.2190 4.3933 4.3933 5.5814 5.5814 5.8269 5.8269 6.4877 6.4877 7.1492 7.1492 7.3121 7.3121 8.0381 8.0381 8.2014 8.2014 8.8882 8.8882 10.6273 10.6273 10.7677 10.7677 11.4329 11.4329 11.8582 11.8582 11.8785 11.8785 12.2767 12.2767 12.4804 12.4804 k = 0.4400 0.2540 0.4001 ( 3415 PWs) bands (ev): -32.4584 -32.4584 -32.4231 -32.4231 -13.4858 -13.4858 -13.3991 -13.3991 -12.1583 -12.1583 -12.0085 -12.0085 -11.9578 -11.9578 -11.8197 -11.8197 -3.9439 -3.9439 -2.8110 -2.8110 -1.2859 -1.2859 -1.2204 -1.2204 4.4511 4.4511 5.5887 5.5887 5.8707 5.8707 6.4173 6.4173 7.0848 7.0848 7.2907 7.2907 8.0711 8.0711 8.2673 8.2673 8.9560 8.9560 10.6599 10.6599 10.6793 10.6793 11.3451 11.3451 11.8227 11.8227 11.8592 11.8592 12.2419 12.2419 12.4532 12.4532 k = 0.4350 0.2511 0.4164 ( 3415 PWs) bands (ev): -32.4576 -32.4576 -32.4238 -32.4238 -13.4842 -13.4842 -13.4011 -13.4011 -12.1584 -12.1584 -12.0069 -12.0069 -11.9590 -11.9590 -11.8198 -11.8198 -3.9228 -3.9228 -2.8358 -2.8358 -1.2939 -1.2939 -1.2219 -1.2219 4.5093 4.5093 5.6005 5.6005 5.9180 5.9180 6.3471 6.3471 7.0222 7.0222 7.2692 7.2692 8.1045 8.1045 8.3313 8.3313 9.0228 9.0228 10.5482 10.5482 10.7300 10.7300 11.2545 11.2545 11.7814 11.7814 11.8470 11.8470 12.2081 12.2081 12.4336 12.4336 k = 0.4300 0.2483 0.4327 ( 3413 PWs) bands (ev): -32.4568 -32.4568 -32.4246 -32.4246 -13.4826 -13.4826 -13.4033 -13.4033 -12.1585 -12.1585 -12.0057 -12.0057 -11.9599 -11.9599 -11.8200 -11.8200 -3.9001 -3.9001 -2.8627 -2.8627 -1.3012 -1.3012 -1.2234 -1.2234 4.5662 4.5662 5.6183 5.6183 5.9685 5.9685 6.2771 6.2771 6.9615 6.9615 7.2476 7.2476 8.1382 8.1382 8.3932 8.3932 9.0875 9.0875 10.4325 10.4325 10.7781 10.7781 11.1640 11.1640 11.7416 11.7416 11.8346 11.8346 12.1760 12.1760 12.4230 12.4230 k = 0.4250 0.2454 0.4491 ( 3419 PWs) bands (ev): -32.4560 -32.4560 -32.4255 -32.4255 -13.4809 -13.4809 -13.4055 -13.4055 -12.1585 -12.1585 -12.0048 -12.0048 -11.9605 -11.9605 -11.8202 -11.8202 -3.8761 -3.8761 -2.8914 -2.8914 -1.3078 -1.3078 -1.2249 -1.2249 4.6206 4.6206 5.6432 5.6432 6.0222 6.0222 6.2076 6.2076 6.9029 6.9029 7.2261 7.2261 8.1716 8.1716 8.4528 8.4528 9.1490 9.1490 10.3141 10.3141 10.8172 10.8172 11.0804 11.0804 11.7048 11.7048 11.8208 11.8208 12.1464 12.1464 12.4217 12.4217 k = 0.4200 0.2425 0.4654 ( 3417 PWs) bands (ev): -32.4551 -32.4551 -32.4263 -32.4263 -13.4790 -13.4790 -13.4078 -13.4078 -12.1584 -12.1584 -12.0043 -12.0043 -11.9606 -11.9606 -11.8204 -11.8204 -3.8508 -3.8508 -2.9217 -2.9217 -1.3134 -1.3134 -1.2264 -1.2264 4.6706 4.6706 5.6766 5.6766 6.0783 6.0783 6.1393 6.1393 6.8468 6.8468 7.2047 7.2047 8.2046 8.2046 8.5100 8.5100 9.2054 9.2054 10.1941 10.1941 10.8304 10.8304 11.0216 11.0216 11.6725 11.6725 11.8047 11.8047 12.1203 12.1203 12.4298 12.4298 k = 0.4150 0.2396 0.4817 ( 3412 PWs) bands (ev): -32.4542 -32.4542 -32.4272 -32.4272 -13.4771 -13.4771 -13.4102 -13.4102 -12.1583 -12.1583 -12.0045 -12.0045 -11.9602 -11.9602 -11.8208 -11.8208 -3.8242 -3.8242 -2.9536 -2.9536 -1.3181 -1.3181 -1.2278 -1.2278 4.7151 4.7151 5.7194 5.7194 6.0684 6.0684 6.1407 6.1407 6.7932 6.7932 7.1835 7.1835 8.2366 8.2366 8.5647 8.5647 9.2544 9.2544 10.0734 10.0734 10.7952 10.7952 11.0121 11.0121 11.6466 11.6466 11.7860 11.7860 12.0982 12.0982 12.4468 12.4468 k = 0.4100 0.2367 0.4981 ( 3410 PWs) bands (ev): -32.4532 -32.4532 -32.4282 -32.4282 -13.4752 -13.4752 -13.4126 -13.4126 -12.1581 -12.1581 -12.0052 -12.0052 -11.9593 -11.9593 -11.8211 -11.8211 -3.7966 -3.7966 -2.9867 -2.9867 -1.3218 -1.3218 -1.2291 -1.2291 4.7530 4.7530 5.7716 5.7716 6.0027 6.0027 6.2023 6.2023 6.7421 6.7421 7.1629 7.1629 8.2670 8.2670 8.6168 8.6168 9.2928 9.2928 9.9533 9.9533 10.7316 10.7316 11.0340 11.0340 11.6291 11.6291 11.7643 11.7643 12.0805 12.0805 12.4720 12.4720 k = 0.4050 0.2338 0.5144 ( 3416 PWs) bands (ev): -32.4523 -32.4523 -32.4291 -32.4291 -13.4731 -13.4731 -13.4151 -13.4151 -12.1577 -12.1577 -12.0065 -12.0065 -11.9578 -11.9578 -11.8215 -11.8215 -3.7683 -3.7683 -3.0207 -3.0207 -1.3245 -1.3245 -1.2303 -1.2303 4.7836 4.7836 5.8283 5.8283 5.9435 5.9435 6.2668 6.2668 6.6938 6.6938 7.1429 7.1429 8.2949 8.2949 8.6660 8.6660 9.3169 9.3169 9.8349 9.8349 10.6680 10.6680 11.0616 11.0616 11.6220 11.6220 11.7401 11.7401 12.0671 12.0671 12.5042 12.5042 k = 0.4000 0.2309 0.5307 ( 3410 PWs) bands (ev): -32.4513 -32.4513 -32.4301 -32.4301 -13.4711 -13.4711 -13.4175 -13.4175 -12.1573 -12.1573 -12.0083 -12.0083 -11.9559 -11.9559 -11.8220 -11.8220 -3.7394 -3.7394 -3.0552 -3.0552 -1.3261 -1.3261 -1.2314 -1.2314 4.8071 4.8071 5.8400 5.8400 5.9408 5.9408 6.3329 6.3329 6.6482 6.6482 7.1242 7.1242 8.3193 8.3193 8.7118 8.7118 9.3231 9.3231 9.7198 9.7198 10.6175 10.6175 11.0855 11.0855 11.6269 11.6269 11.7138 11.7138 12.0578 12.0578 12.5424 12.5424 k = 0.3950 0.2281 0.5471 ( 3410 PWs) bands (ev): -32.4503 -32.4503 -32.4311 -32.4311 -13.4690 -13.4690 -13.4199 -13.4199 -12.1568 -12.1568 -12.0106 -12.0106 -11.9535 -11.9535 -11.8225 -11.8225 -3.7105 -3.7105 -3.0896 -3.0896 -1.3267 -1.3267 -1.2323 -1.2323 4.8238 4.8238 5.7860 5.7860 6.0147 6.0147 6.3998 6.3998 6.6056 6.6056 7.1074 7.1074 8.3387 8.3387 8.7533 8.7533 9.3089 9.3089 9.6097 9.6097 10.5865 10.5865 11.1025 11.1025 11.6434 11.6434 11.6876 11.6876 12.0521 12.0521 12.5850 12.5850 k = 0.3900 0.2252 0.5634 ( 3412 PWs) bands (ev): -32.4494 -32.4494 -32.4320 -32.4320 -13.4671 -13.4671 -13.4222 -13.4222 -12.1562 -12.1562 -12.0132 -12.0132 -11.9509 -11.9509 -11.8232 -11.8232 -3.6822 -3.6822 -3.1230 -3.1230 -1.3263 -1.3263 -1.2331 -1.2331 4.8344 4.8344 5.7236 5.7236 6.1070 6.1070 6.4660 6.4660 6.5665 6.5665 7.0937 7.0937 8.3512 8.3512 8.7884 8.7884 9.2754 9.2754 9.5070 9.5070 10.5778 10.5778 11.1124 11.1124 11.6489 11.6489 11.6841 11.6841 12.0495 12.0495 12.6298 12.6298 k = 0.3850 0.2223 0.5797 ( 3415 PWs) bands (ev): -32.4486 -32.4486 -32.4328 -32.4328 -13.4652 -13.4652 -13.4243 -13.4243 -12.1554 -12.1554 -12.0161 -12.0161 -11.9479 -11.9479 -11.8238 -11.8238 -3.6557 -3.6557 -3.1545 -3.1545 -1.3251 -1.3251 -1.2337 -1.2337 4.8397 4.8397 5.6608 5.6608 6.2077 6.2077 6.5221 6.5221 6.5391 6.5391 7.0850 7.0850 8.3541 8.3541 8.8128 8.8128 9.2284 9.2284 9.4143 9.4143 10.5906 10.5906 11.1165 11.1165 11.6231 11.6231 11.7225 11.7225 12.0494 12.0494 12.6733 12.6733 k = 0.3800 0.2194 0.5960 ( 3422 PWs) bands (ev): -32.4478 -32.4478 -32.4336 -32.4336 -13.4636 -13.4636 -13.4262 -13.4262 -12.1546 -12.1546 -12.0193 -12.0193 -11.9448 -11.9448 -11.8246 -11.8246 -3.6322 -3.6322 -3.1822 -3.1822 -1.3229 -1.3229 -1.2341 -1.2341 4.8405 4.8405 5.5988 5.5988 6.3112 6.3112 6.5018 6.5018 6.5903 6.5903 7.0842 7.0842 8.3448 8.3448 8.8175 8.8175 9.1806 9.1806 9.3349 9.3349 10.6223 10.6223 11.1169 11.1169 11.5947 11.5947 11.7727 11.7727 12.0514 12.0514 12.7084 12.7084 k = 0.3750 0.2165 0.6124 ( 3414 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4276 -13.4276 -12.1537 -12.1537 -12.0226 -12.0226 -11.9416 -11.9416 -11.8254 -11.8254 -3.6140 -3.6140 -3.2041 -3.2041 -1.3199 -1.3199 -1.2343 -1.2343 4.8374 4.8374 5.5382 5.5382 6.3923 6.3923 6.5059 6.5059 6.6390 6.6390 7.0953 7.0953 8.3205 8.3205 8.7891 8.7891 9.1496 9.1496 9.2716 9.2716 10.6688 10.6688 11.1152 11.1152 11.5666 11.5666 11.8299 11.8299 12.0553 12.0553 12.7203 12.7203 k = 0.6250-0.0722 0.4082 ( 3414 PWs) bands (ev): -32.4472 -32.4472 -32.4342 -32.4342 -13.4622 -13.4622 -13.4276 -13.4276 -12.1537 -12.1537 -12.0226 -12.0226 -11.9416 -11.9416 -11.8254 -11.8254 -3.6139 -3.6139 -3.2042 -3.2042 -1.3200 -1.3200 -1.2342 -1.2342 4.8375 4.8375 5.5382 5.5382 6.3923 6.3923 6.5059 6.5059 6.6390 6.6390 7.0953 7.0953 8.3205 8.3205 8.7891 8.7891 9.1496 9.1496 9.2716 9.2716 10.6688 10.6688 11.1152 11.1152 11.5666 11.5666 11.8299 11.8299 12.0554 12.0554 12.7202 12.7202 k = 0.6167-0.0866 0.4082 ( 3414 PWs) bands (ev): -32.4464 -32.4464 -32.4350 -32.4350 -13.4605 -13.4605 -13.4296 -13.4296 -12.1519 -12.1519 -12.0284 -12.0284 -11.9361 -11.9361 -11.8269 -11.8269 -3.5901 -3.5901 -3.2334 -3.2334 -1.3140 -1.3140 -1.2343 -1.2343 4.8287 4.8287 5.4406 5.4406 6.4692 6.4692 6.5799 6.5799 6.7107 6.7107 7.1260 7.1260 8.2670 8.2670 8.7090 8.7090 9.1106 9.1106 9.1805 9.1805 10.7644 10.7644 11.1131 11.1131 11.5219 11.5219 11.9318 11.9318 12.0634 12.0634 12.7081 12.7081 k = 0.6083-0.1010 0.4082 ( 3412 PWs) bands (ev): -32.4457 -32.4457 -32.4358 -32.4358 -13.4588 -13.4588 -13.4314 -13.4314 -12.1500 -12.1500 -12.0342 -12.0342 -11.9306 -11.9306 -11.8286 -11.8286 -3.5679 -3.5679 -3.2607 -3.2607 -1.3073 -1.3073 -1.2343 -1.2343 4.8190 4.8190 5.3477 5.3477 6.5474 6.5474 6.6569 6.6569 6.7838 6.7838 7.1566 7.1566 8.2147 8.2147 8.6292 8.6292 9.0556 9.0556 9.0892 9.0892 10.8726 10.8726 11.1137 11.1137 11.4797 11.4797 12.0351 12.0351 12.0732 12.0732 12.6930 12.6930 k = 0.6000-0.1155 0.4082 ( 3400 PWs) bands (ev): -32.4449 -32.4449 -32.4364 -32.4364 -13.4572 -13.4572 -13.4331 -13.4331 -12.1478 -12.1478 -12.0399 -12.0399 -11.9251 -11.9251 -11.8304 -11.8304 -3.5475 -3.5475 -3.2860 -3.2860 -1.2999 -1.2999 -1.2341 -1.2341 4.8086 4.8086 5.2600 5.2600 6.6265 6.6265 6.7365 6.7365 6.8582 6.8582 7.1872 7.1872 8.1636 8.1636 8.5499 8.5499 8.9868 8.9868 8.9995 8.9995 10.9890 10.9890 11.1167 11.1167 11.4403 11.4403 12.0760 12.0760 12.1476 12.1476 12.6752 12.6752 k = 0.5917-0.1299 0.4082 ( 3410 PWs) bands (ev): -32.4443 -32.4443 -32.4371 -32.4371 -13.4557 -13.4557 -13.4346 -13.4346 -12.1453 -12.1453 -12.0457 -12.0457 -11.9197 -11.9197 -11.8325 -11.8325 -3.5288 -3.5288 -3.3094 -3.3094 -1.2921 -1.2921 -1.2339 -1.2339 4.7978 4.7978 5.1780 5.1780 6.7063 6.7063 6.8184 6.8184 6.9339 6.9339 7.2179 7.2179 8.1139 8.1139 8.4710 8.4710 8.9010 8.9010 8.9178 8.9178 11.1099 11.1099 11.1223 11.1223 11.4038 11.4038 12.0839 12.0839 12.2560 12.2560 12.6551 12.6551 k = 0.5833-0.1443 0.4082 ( 3400 PWs) bands (ev): -32.4437 -32.4437 -32.4377 -32.4377 -13.4543 -13.4543 -13.4361 -13.4361 -12.1427 -12.1427 -12.0515 -12.0515 -11.9144 -11.9144 -11.8347 -11.8347 -3.5118 -3.5118 -3.3307 -3.3307 -1.2841 -1.2841 -1.2337 -1.2337 4.7870 4.7870 5.1019 5.1019 6.7863 6.7863 6.9024 6.9024 7.0107 7.0107 7.2485 7.2485 8.0654 8.0654 8.3924 8.3924 8.8093 8.8093 8.8354 8.8354 11.1288 11.1288 11.2338 11.2338 11.3703 11.3703 12.0907 12.0907 12.3651 12.3651 12.6334 12.6334 k = 0.5750-0.1588 0.4082 ( 3398 PWs) bands (ev): -32.4431 -32.4431 -32.4382 -32.4382 -13.4530 -13.4530 -13.4374 -13.4374 -12.1398 -12.1398 -12.0572 -12.0572 -11.9092 -11.9092 -11.8372 -11.8372 -3.4965 -3.4965 -3.3500 -3.3500 -1.2761 -1.2761 -1.2334 -1.2334 4.7765 4.7765 5.0321 5.0321 6.8666 6.8666 6.9883 6.9883 7.0887 7.0887 7.2792 7.2792 8.0184 8.0184 8.3142 8.3142 8.7169 8.7169 8.7490 8.7490 11.1375 11.1375 11.3393 11.3393 11.3575 11.3575 12.0970 12.0970 12.4709 12.4709 12.6106 12.6106 k = 0.5667-0.1732 0.4082 ( 3398 PWs) bands (ev): -32.4426 -32.4426 -32.4387 -32.4387 -13.4518 -13.4518 -13.4386 -13.4386 -12.1367 -12.1367 -12.0628 -12.0628 -11.9040 -11.9040 -11.8398 -11.8398 -3.4830 -3.4830 -3.3674 -3.3674 -1.2682 -1.2682 -1.2331 -1.2331 4.7665 4.7665 4.9689 4.9689 6.9469 6.9469 7.0758 7.0758 7.1676 7.1676 7.3100 7.3100 7.9729 7.9729 8.2364 8.2364 8.6248 8.6248 8.6594 8.6594 11.1473 11.1473 11.3122 11.3122 11.4782 11.4782 12.1026 12.1026 12.5627 12.5627 12.5888 12.5888 k = 0.5583-0.1876 0.4082 ( 3396 PWs) bands (ev): -32.4422 -32.4422 -32.4392 -32.4392 -13.4507 -13.4507 -13.4397 -13.4397 -12.1334 -12.1334 -12.0684 -12.0684 -11.8990 -11.8990 -11.8426 -11.8426 -3.4711 -3.4711 -3.3827 -3.3827 -1.2606 -1.2606 -1.2328 -1.2328 4.7572 4.7572 4.9125 4.9125 7.0269 7.0269 7.1646 7.1646 7.2472 7.2472 7.3409 7.3409 7.9291 7.9291 8.1588 8.1588 8.5331 8.5331 8.5675 8.5675 11.1579 11.1579 11.2879 11.2879 11.5954 11.5954 12.1076 12.1076 12.5629 12.5629 12.6195 12.6195 k = 0.5500-0.2021 0.4082 ( 3392 PWs) bands (ev): -32.4418 -32.4418 -32.4395 -32.4395 -13.4497 -13.4497 -13.4407 -13.4407 -12.1299 -12.1299 -12.0739 -12.0739 -11.8940 -11.8940 -11.8455 -11.8455 -3.4608 -3.4608 -3.3960 -3.3960 -1.2536 -1.2536 -1.2325 -1.2325 4.7488 4.7488 4.8631 4.8631 7.1066 7.1066 7.2543 7.2543 7.3268 7.3268 7.3720 7.3720 7.8870 7.8870 8.0817 8.0817 8.4422 8.4422 8.4744 8.4744 11.1686 11.1686 11.2668 11.2668 11.7072 11.7072 12.1120 12.1120 12.5410 12.5410 12.6204 12.6204 k = 0.5417-0.2165 0.4082 ( 3392 PWs) bands (ev): -32.4415 -32.4415 -32.4399 -32.4399 -13.4488 -13.4488 -13.4416 -13.4416 -12.1262 -12.1262 -12.0793 -12.0793 -11.8892 -11.8892 -11.8487 -11.8487 -3.4522 -3.4522 -3.4073 -3.4073 -1.2473 -1.2473 -1.2322 -1.2322 4.7414 4.7414 4.8209 4.8209 7.1856 7.1856 7.3442 7.3442 7.3962 7.3962 7.4130 7.4130 7.8472 7.8472 8.0051 8.0051 8.3527 8.3527 8.3809 8.3809 11.1790 11.1790 11.2488 11.2488 11.8117 11.8117 12.1157 12.1157 12.5205 12.5205 12.5974 12.5974 k = 0.5333-0.2309 0.4082 ( 3400 PWs) bands (ev): -32.4412 -32.4412 -32.4402 -32.4402 -13.4479 -13.4479 -13.4425 -13.4425 -12.1222 -12.1222 -12.0847 -12.0847 -11.8845 -11.8845 -11.8520 -11.8520 -3.4452 -3.4452 -3.4165 -3.4165 -1.2419 -1.2419 -1.2320 -1.2320 4.7352 4.7352 4.7862 4.7862 7.2634 7.2634 7.4283 7.4283 7.4341 7.4341 7.4893 7.4893 7.8102 7.8102 7.9294 7.9294 8.2652 8.2652 8.2884 8.2884 11.1884 11.1884 11.2341 11.2341 11.9071 11.9071 12.1187 12.1187 12.5024 12.5024 12.5667 12.5667 k = 0.5250-0.2454 0.4082 ( 3384 PWs) bands (ev): -32.4409 -32.4409 -32.4404 -32.4404 -13.4472 -13.4472 -13.4432 -13.4432 -12.1181 -12.1181 -12.0899 -12.0899 -11.8799 -11.8799 -11.8555 -11.8555 -3.4398 -3.4398 -3.4237 -3.4237 -1.2376 -1.2376 -1.2318 -1.2318 4.7303 4.7303 4.7590 4.7590 7.3393 7.3393 7.4560 7.4560 7.5209 7.5209 7.5664 7.5664 7.7770 7.7770 7.8554 7.8554 8.1813 8.1813 8.1988 8.1988 11.1965 11.1965 11.2226 11.2226 11.9909 11.9909 12.1211 12.1211 12.4875 12.4875 12.5335 12.5335 k = 0.5167-0.2598 0.4082 ( 3382 PWs) bands (ev): -32.4408 -32.4408 -32.4405 -32.4405 -13.4465 -13.4465 -13.4439 -13.4439 -12.1138 -12.1138 -12.0949 -12.0949 -11.8755 -11.8755 -11.8592 -11.8592 -3.4360 -3.4360 -3.4288 -3.4288 -1.2344 -1.2344 -1.2317 -1.2317 4.7268 4.7268 4.7395 4.7395 7.4111 7.4111 7.4794 7.4794 7.6018 7.6018 7.6378 7.6378 7.7497 7.7497 7.7853 7.7853 8.1045 8.1045 8.1160 8.1160 11.2026 11.2026 11.2144 11.2144 12.0595 12.0595 12.1228 12.1228 12.4764 12.4764 12.5017 12.5017 k = 0.5083-0.2742 0.4082 ( 3378 PWs) bands (ev): -32.4407 -32.4407 -32.4406 -32.4406 -13.4458 -13.4458 -13.4445 -13.4445 -12.1093 -12.1093 -12.0999 -12.0999 -11.8712 -11.8712 -11.8630 -11.8630 -3.4337 -3.4337 -3.4319 -3.4319 -1.2324 -1.2324 -1.2316 -1.2316 4.7246 4.7246 4.7277 4.7277 7.4721 7.4721 7.4960 7.4960 7.6662 7.6662 7.6920 7.6920 7.7283 7.7283 7.7321 7.7321 8.0436 8.0436 8.0496 8.0496 11.2065 11.2065 11.2095 11.2095 12.1066 12.1066 12.1238 12.1238 12.4695 12.4695 12.4770 12.4770 k = 0.5000-0.2887 0.4082 ( 3378 PWs) bands (ev): -32.4406 -32.4406 -32.4406 -32.4406 -13.4452 -13.4452 -13.4452 -13.4452 -12.1047 -12.1047 -12.1047 -12.1047 -11.8670 -11.8670 -11.8670 -11.8670 -3.4330 -3.4330 -3.4329 -3.4329 -1.2317 -1.2317 -1.2316 -1.2316 4.7238 4.7238 4.7239 4.7239 7.5013 7.5013 7.5014 7.5014 7.6913 7.6913 7.6914 7.6914 7.7265 7.7265 7.7265 7.7265 8.0198 8.0198 8.0198 8.0198 11.2078 11.2078 11.2078 11.2078 12.1240 12.1240 12.1241 12.1241 12.4672 12.4672 12.4672 12.4672 Writing output data file YS2.save init_run : 0.40s CPU 0.59s WALL ( 1 calls) electrons : 150.51s CPU 152.58s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 150.50s CPU 152.58s 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 : 0.07s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.04s WALL ( 274 calls) cegterg : 134.48s CPU 136.08s WALL ( 306 calls) Called by sum_band: Called by *egterg: h_psi : 83.62s CPU 84.89s WALL ( 5473 calls) s_psi : 6.26s CPU 6.25s WALL ( 5473 calls) g_psi : 0.12s CPU 0.16s WALL ( 4893 calls) cdiaghg : 45.89s CPU 46.60s WALL ( 5167 calls) cegterg:over : 4.54s CPU 4.53s WALL ( 4893 calls) cegterg:upda : 3.69s CPU 3.64s WALL ( 4893 calls) cegterg:last : 1.92s CPU 1.97s WALL ( 854 calls) cdiaghg:chol : 2.54s CPU 2.64s WALL ( 5167 calls) cdiaghg:inve : 1.75s CPU 1.82s WALL ( 5167 calls) cdiaghg:para : 2.81s CPU 2.98s WALL ( 10334 calls) Called by h_psi: h_psi:vloc : 70.40s CPU 71.40s WALL ( 5473 calls) h_psi:vnl : 13.05s CPU 13.32s WALL ( 5473 calls) add_vuspsi : 7.39s CPU 7.53s WALL ( 5473 calls) General routines calbec : 5.63s CPU 5.77s WALL ( 5473 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 66.52s CPU 67.26s WALL ( 673568 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.16s CPU 0.16s WALL ( 548 calls) Parallel routines fft_scatter : 20.66s CPU 21.08s WALL ( 673591 calls) PWSCF : 2m43.86s CPU 3m 0.80s WALL This run was terminated on: 21:15: 9 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=