Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:38:54 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: ./Cs2NaTlF6.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S 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 90 89 23 3355 3300 465 Max 91 90 24 3360 3314 471 Sum 3241 3205 859 120837 118981 16889 bravais-lattice index = 14 lattice parameter (alat) = 12.0195 a.u. unit-cell volume = 1227.8350 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 4 number of electrons = 82.00 number of Kohn-Sham states= 98 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.019461 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 Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Cs read from file: /users/gautes/Pseudo/Cs.rel-pbe-oncvpsp.UPF MD5 check sum: b26d75608c6aa7e713949ad9f7a49707 Pseudo is Norm-conserving, Zval = 9.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 2414 points, 14 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 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 atomic species valence mass pseudopotential Tl 13.00 204.38330 Tl( 1.00) Na 9.00 22.98980 Na( 1.00) F 7.00 18.99840 F( 1.00) Cs 9.00 132.90550 Cs( 1.00) 12 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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= 240 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041667 k( 2) = ( 0.0142857 -0.0082479 0.0116642), wk = 0.0041667 k( 3) = ( 0.0285714 -0.0164957 0.0233285), wk = 0.0041667 k( 4) = ( 0.0428571 -0.0247436 0.0349927), wk = 0.0041667 k( 5) = ( 0.0571429 -0.0329914 0.0466569), wk = 0.0041667 k( 6) = ( 0.0714286 -0.0412393 0.0583212), wk = 0.0041667 k( 7) = ( 0.0857143 -0.0494872 0.0699854), wk = 0.0041667 k( 8) = ( 0.1000000 -0.0577350 0.0816497), wk = 0.0041667 k( 9) = ( 0.1142857 -0.0659829 0.0933139), wk = 0.0041667 k( 10) = ( 0.1285714 -0.0742307 0.1049781), wk = 0.0041667 k( 11) = ( 0.1428571 -0.0824786 0.1166424), wk = 0.0041667 k( 12) = ( 0.1571429 -0.0907265 0.1283066), wk = 0.0041667 k( 13) = ( 0.1714286 -0.0989743 0.1399708), wk = 0.0041667 k( 14) = ( 0.1857143 -0.1072222 0.1516351), wk = 0.0041667 k( 15) = ( 0.2000000 -0.1154701 0.1632993), wk = 0.0041667 k( 16) = ( 0.2142857 -0.1237179 0.1749635), wk = 0.0041667 k( 17) = ( 0.2285714 -0.1319658 0.1866278), wk = 0.0041667 k( 18) = ( 0.2428571 -0.1402136 0.1982920), wk = 0.0041667 k( 19) = ( 0.2571429 -0.1484615 0.2099563), wk = 0.0041667 k( 20) = ( 0.2714286 -0.1567094 0.2216205), wk = 0.0041667 k( 21) = ( 0.2857143 -0.1649572 0.2332847), wk = 0.0041667 k( 22) = ( 0.3000000 -0.1732051 0.2449490), wk = 0.0041667 k( 23) = ( 0.3142857 -0.1814529 0.2566132), wk = 0.0041667 k( 24) = ( 0.3285714 -0.1897008 0.2682774), wk = 0.0041667 k( 25) = ( 0.3428571 -0.1979487 0.2799417), wk = 0.0041667 k( 26) = ( 0.3571429 -0.2061965 0.2916059), wk = 0.0041667 k( 27) = ( 0.3714286 -0.2144444 0.3032702), wk = 0.0041667 k( 28) = ( 0.3857143 -0.2226922 0.3149344), wk = 0.0041667 k( 29) = ( 0.4000000 -0.2309401 0.3265986), wk = 0.0041667 k( 30) = ( 0.4142857 -0.2391880 0.3382629), wk = 0.0041667 k( 31) = ( 0.4285714 -0.2474358 0.3499271), wk = 0.0041667 k( 32) = ( 0.4428571 -0.2556837 0.3615913), wk = 0.0041667 k( 33) = ( 0.4571429 -0.2639316 0.3732556), wk = 0.0041667 k( 34) = ( 0.4714286 -0.2721794 0.3849198), wk = 0.0041667 k( 35) = ( 0.4857143 -0.2804273 0.3965841), wk = 0.0041667 k( 36) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0041667 k( 37) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0041667 k( 38) = ( 0.5000000 -0.2726376 0.4195885), wk = 0.0041667 k( 39) = ( 0.5000000 -0.2566001 0.4309288), wk = 0.0041667 k( 40) = ( 0.5000000 -0.2405626 0.4422690), wk = 0.0041667 k( 41) = ( 0.5000000 -0.2245251 0.4536092), wk = 0.0041667 k( 42) = ( 0.5000000 -0.2084876 0.4649494), wk = 0.0041667 k( 43) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0041667 k( 44) = ( 0.5000000 -0.1764126 0.4876299), wk = 0.0041667 k( 45) = ( 0.5000000 -0.1603751 0.4989701), wk = 0.0041667 k( 46) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0041667 k( 47) = ( 0.5000000 -0.1283001 0.5216506), wk = 0.0041667 k( 48) = ( 0.5000000 -0.1122625 0.5329908), wk = 0.0041667 k( 49) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0041667 k( 50) = ( 0.5000000 -0.0801875 0.5556713), wk = 0.0041667 k( 51) = ( 0.5000000 -0.0641500 0.5670115), wk = 0.0041667 k( 52) = ( 0.5000000 -0.0481125 0.5783517), wk = 0.0041667 k( 53) = ( 0.5000000 -0.0320750 0.5896920), wk = 0.0041667 k( 54) = ( 0.5000000 -0.0160375 0.6010322), wk = 0.0041667 k( 55) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0041667 k( 56) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0041667 k( 57) = ( 0.4903846 0.0166543 0.6123724), wk = 0.0041667 k( 58) = ( 0.4807692 0.0333087 0.6123724), wk = 0.0041667 k( 59) = ( 0.4711538 0.0499630 0.6123724), wk = 0.0041667 k( 60) = ( 0.4615385 0.0666173 0.6123724), wk = 0.0041667 k( 61) = ( 0.4519231 0.0832717 0.6123724), wk = 0.0041667 k( 62) = ( 0.4423077 0.0999260 0.6123724), wk = 0.0041667 k( 63) = ( 0.4326923 0.1165803 0.6123724), wk = 0.0041667 k( 64) = ( 0.4230769 0.1332347 0.6123724), wk = 0.0041667 k( 65) = ( 0.4134615 0.1498890 0.6123724), wk = 0.0041667 k( 66) = ( 0.4038462 0.1665434 0.6123724), wk = 0.0041667 k( 67) = ( 0.3942308 0.1831977 0.6123724), wk = 0.0041667 k( 68) = ( 0.3846154 0.1998520 0.6123724), wk = 0.0041667 k( 69) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0041667 k( 70) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0041667 k( 71) = ( 0.3651316 0.2108088 0.5962574), wk = 0.0041667 k( 72) = ( 0.3552632 0.2051113 0.5801423), wk = 0.0041667 k( 73) = ( 0.3453947 0.1994137 0.5640272), wk = 0.0041667 k( 74) = ( 0.3355263 0.1937162 0.5479122), wk = 0.0041667 k( 75) = ( 0.3256579 0.1880187 0.5317971), wk = 0.0041667 k( 76) = ( 0.3157895 0.1823211 0.5156821), wk = 0.0041667 k( 77) = ( 0.3059211 0.1766236 0.4995670), wk = 0.0041667 k( 78) = ( 0.2960526 0.1709261 0.4834519), wk = 0.0041667 k( 79) = ( 0.2861842 0.1652285 0.4673369), wk = 0.0041667 k( 80) = ( 0.2763158 0.1595310 0.4512218), wk = 0.0041667 k( 81) = ( 0.2664474 0.1538335 0.4351067), wk = 0.0041667 k( 82) = ( 0.2565789 0.1481359 0.4189917), wk = 0.0041667 k( 83) = ( 0.2467105 0.1424384 0.4028766), wk = 0.0041667 k( 84) = ( 0.2368421 0.1367409 0.3867615), wk = 0.0041667 k( 85) = ( 0.2269737 0.1310433 0.3706465), wk = 0.0041667 k( 86) = ( 0.2171053 0.1253458 0.3545314), wk = 0.0041667 k( 87) = ( 0.2072368 0.1196482 0.3384163), wk = 0.0041667 k( 88) = ( 0.1973684 0.1139507 0.3223013), wk = 0.0041667 k( 89) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0041667 k( 90) = ( 0.1776316 0.1025556 0.2900712), wk = 0.0041667 k( 91) = ( 0.1677632 0.0968581 0.2739561), wk = 0.0041667 k( 92) = ( 0.1578947 0.0911606 0.2578410), wk = 0.0041667 k( 93) = ( 0.1480263 0.0854630 0.2417260), wk = 0.0041667 k( 94) = ( 0.1381579 0.0797655 0.2256109), wk = 0.0041667 k( 95) = ( 0.1282895 0.0740680 0.2094958), wk = 0.0041667 k( 96) = ( 0.1184210 0.0683704 0.1933808), wk = 0.0041667 k( 97) = ( 0.1085526 0.0626729 0.1772657), wk = 0.0041667 k( 98) = ( 0.0986842 0.0569754 0.1611506), wk = 0.0041667 k( 99) = ( 0.0888158 0.0512778 0.1450356), wk = 0.0041667 k( 100) = ( 0.0789474 0.0455803 0.1289205), wk = 0.0041667 k( 101) = ( 0.0690790 0.0398828 0.1128054), wk = 0.0041667 k( 102) = ( 0.0592105 0.0341852 0.0966904), wk = 0.0041667 k( 103) = ( 0.0493421 0.0284877 0.0805753), wk = 0.0041667 k( 104) = ( 0.0394737 0.0227901 0.0644603), wk = 0.0041667 k( 105) = ( 0.0296053 0.0170926 0.0483452), wk = 0.0041667 k( 106) = ( 0.0197368 0.0113951 0.0322301), wk = 0.0041667 k( 107) = ( 0.0098684 0.0056975 0.0161151), wk = 0.0041667 k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041667 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041667 k( 110) = ( 0.0161290 0.0093121 0.0065846), wk = 0.0041667 k( 111) = ( 0.0322581 0.0186242 0.0131693), wk = 0.0041667 k( 112) = ( 0.0483871 0.0279363 0.0197540), wk = 0.0041667 k( 113) = ( 0.0645161 0.0372484 0.0263386), wk = 0.0041667 k( 114) = ( 0.0806452 0.0465605 0.0329232), wk = 0.0041667 k( 115) = ( 0.0967742 0.0558726 0.0395079), wk = 0.0041667 k( 116) = ( 0.1129032 0.0651847 0.0460926), wk = 0.0041667 k( 117) = ( 0.1290323 0.0744968 0.0526772), wk = 0.0041667 k( 118) = ( 0.1451613 0.0838089 0.0592618), wk = 0.0041667 k( 119) = ( 0.1612903 0.0931210 0.0658465), wk = 0.0041667 k( 120) = ( 0.1774194 0.1024331 0.0724311), wk = 0.0041667 k( 121) = ( 0.1935484 0.1117452 0.0790158), wk = 0.0041667 k( 122) = ( 0.2096774 0.1210573 0.0856004), wk = 0.0041667 k( 123) = ( 0.2258064 0.1303694 0.0921851), wk = 0.0041667 k( 124) = ( 0.2419355 0.1396815 0.0987697), wk = 0.0041667 k( 125) = ( 0.2580645 0.1489936 0.1053544), wk = 0.0041667 k( 126) = ( 0.2741936 0.1583057 0.1119390), wk = 0.0041667 k( 127) = ( 0.2903226 0.1676178 0.1185237), wk = 0.0041667 k( 128) = ( 0.3064516 0.1769299 0.1251083), wk = 0.0041667 k( 129) = ( 0.3225807 0.1862420 0.1316930), wk = 0.0041667 k( 130) = ( 0.3387097 0.1955541 0.1382776), wk = 0.0041667 k( 131) = ( 0.3548387 0.2048662 0.1448623), wk = 0.0041667 k( 132) = ( 0.3709677 0.2141783 0.1514469), wk = 0.0041667 k( 133) = ( 0.3870968 0.2234904 0.1580316), wk = 0.0041667 k( 134) = ( 0.4032258 0.2328025 0.1646162), wk = 0.0041667 k( 135) = ( 0.4193548 0.2421146 0.1712009), wk = 0.0041667 k( 136) = ( 0.4354839 0.2514267 0.1777855), wk = 0.0041667 k( 137) = ( 0.4516129 0.2607388 0.1843702), wk = 0.0041667 k( 138) = ( 0.4677419 0.2700509 0.1909548), wk = 0.0041667 k( 139) = ( 0.4838710 0.2793630 0.1975395), wk = 0.0041667 k( 140) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041667 k( 141) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041667 k( 142) = ( 0.5056818 0.2722731 0.2134025), wk = 0.0041667 k( 143) = ( 0.5113636 0.2558711 0.2226809), wk = 0.0041667 k( 144) = ( 0.5170455 0.2394691 0.2319593), wk = 0.0041667 k( 145) = ( 0.5227273 0.2230671 0.2412376), wk = 0.0041667 k( 146) = ( 0.5284091 0.2066652 0.2505160), wk = 0.0041667 k( 147) = ( 0.5340909 0.1902632 0.2597944), wk = 0.0041667 k( 148) = ( 0.5397727 0.1738612 0.2690727), wk = 0.0041667 k( 149) = ( 0.5454545 0.1574592 0.2783511), wk = 0.0041667 k( 150) = ( 0.5511364 0.1410572 0.2876295), wk = 0.0041667 k( 151) = ( 0.5568182 0.1246552 0.2969078), wk = 0.0041667 k( 152) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0041667 k( 153) = ( 0.5681818 0.0918512 0.3154646), wk = 0.0041667 k( 154) = ( 0.5738636 0.0754492 0.3247430), wk = 0.0041667 k( 155) = ( 0.5795455 0.0590472 0.3340213), wk = 0.0041667 k( 156) = ( 0.5852273 0.0426452 0.3432997), wk = 0.0041667 k( 157) = ( 0.5909091 0.0262432 0.3525781), wk = 0.0041667 k( 158) = ( 0.5965909 0.0098412 0.3618564), wk = 0.0041667 k( 159) = ( 0.6022727 -0.0065608 0.3711348), wk = 0.0041667 k( 160) = ( 0.6079545 -0.0229628 0.3804132), wk = 0.0041667 k( 161) = ( 0.6136364 -0.0393648 0.3896915), wk = 0.0041667 k( 162) = ( 0.6193182 -0.0557668 0.3989699), wk = 0.0041667 k( 163) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0041667 k( 164) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0041667 k( 165) = ( 0.6153846 -0.0666173 0.4239501), wk = 0.0041667 k( 166) = ( 0.6057692 -0.0610659 0.4396520), wk = 0.0041667 k( 167) = ( 0.5961538 -0.0555145 0.4553539), wk = 0.0041667 k( 168) = ( 0.5865385 -0.0499630 0.4710557), wk = 0.0041667 k( 169) = ( 0.5769231 -0.0444116 0.4867576), wk = 0.0041667 k( 170) = ( 0.5673077 -0.0388601 0.5024594), wk = 0.0041667 k( 171) = ( 0.5576923 -0.0333087 0.5181613), wk = 0.0041667 k( 172) = ( 0.5480769 -0.0277572 0.5338632), wk = 0.0041667 k( 173) = ( 0.5384615 -0.0222058 0.5495650), wk = 0.0041667 k( 174) = ( 0.5288462 -0.0166543 0.5652669), wk = 0.0041667 k( 175) = ( 0.5192308 -0.0111029 0.5809687), wk = 0.0041667 k( 176) = ( 0.5096154 -0.0055514 0.5966706), wk = 0.0041667 k( 177) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0041667 k( 178) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0041667 k( 179) = ( 0.5000000 0.0115470 0.5960425), wk = 0.0041667 k( 180) = ( 0.5000000 0.0230940 0.5797126), wk = 0.0041667 k( 181) = ( 0.5000000 0.0346410 0.5633826), wk = 0.0041667 k( 182) = ( 0.5000000 0.0461880 0.5470527), wk = 0.0041667 k( 183) = ( 0.5000000 0.0577350 0.5307228), wk = 0.0041667 k( 184) = ( 0.5000000 0.0692820 0.5143928), wk = 0.0041667 k( 185) = ( 0.5000000 0.0808290 0.4980629), wk = 0.0041667 k( 186) = ( 0.5000000 0.0923760 0.4817330), wk = 0.0041667 k( 187) = ( 0.5000000 0.1039230 0.4654031), wk = 0.0041667 k( 188) = ( 0.5000000 0.1154701 0.4490731), wk = 0.0041667 k( 189) = ( 0.5000000 0.1270171 0.4327432), wk = 0.0041667 k( 190) = ( 0.5000000 0.1385641 0.4164133), wk = 0.0041667 k( 191) = ( 0.5000000 0.1501111 0.4000833), wk = 0.0041667 k( 192) = ( 0.5000000 0.1616581 0.3837534), wk = 0.0041667 k( 193) = ( 0.5000000 0.1732051 0.3674235), wk = 0.0041667 k( 194) = ( 0.5000000 0.1847521 0.3510935), wk = 0.0041667 k( 195) = ( 0.5000000 0.1962991 0.3347636), wk = 0.0041667 k( 196) = ( 0.5000000 0.2078461 0.3184337), wk = 0.0041667 k( 197) = ( 0.5000000 0.2193931 0.3021037), wk = 0.0041667 k( 198) = ( 0.5000000 0.2309401 0.2857738), wk = 0.0041667 k( 199) = ( 0.5000000 0.2424871 0.2694439), wk = 0.0041667 k( 200) = ( 0.5000000 0.2540341 0.2531139), wk = 0.0041667 k( 201) = ( 0.5000000 0.2655811 0.2367840), wk = 0.0041667 k( 202) = ( 0.5000000 0.2771281 0.2204541), wk = 0.0041667 k( 203) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041667 k( 204) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0041667 k( 205) = ( 0.4943182 0.2853947 0.2226809), wk = 0.0041667 k( 206) = ( 0.4886364 0.2821143 0.2412376), wk = 0.0041667 k( 207) = ( 0.4829545 0.2788339 0.2597944), wk = 0.0041667 k( 208) = ( 0.4772727 0.2755535 0.2783511), wk = 0.0041667 k( 209) = ( 0.4715909 0.2722731 0.2969078), wk = 0.0041667 k( 210) = ( 0.4659091 0.2689927 0.3154646), wk = 0.0041667 k( 211) = ( 0.4602273 0.2657123 0.3340213), wk = 0.0041667 k( 212) = ( 0.4545455 0.2624319 0.3525781), wk = 0.0041667 k( 213) = ( 0.4488636 0.2591515 0.3711348), wk = 0.0041667 k( 214) = ( 0.4431818 0.2558711 0.3896915), wk = 0.0041667 k( 215) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0041667 k( 216) = ( 0.4318182 0.2493103 0.4268050), wk = 0.0041667 k( 217) = ( 0.4261364 0.2460299 0.4453618), wk = 0.0041667 k( 218) = ( 0.4204545 0.2427495 0.4639185), wk = 0.0041667 k( 219) = ( 0.4147727 0.2394691 0.4824753), wk = 0.0041667 k( 220) = ( 0.4090909 0.2361887 0.5010320), wk = 0.0041667 k( 221) = ( 0.4034091 0.2329083 0.5195887), wk = 0.0041667 k( 222) = ( 0.3977273 0.2296279 0.5381455), wk = 0.0041667 k( 223) = ( 0.3920455 0.2263475 0.5567022), wk = 0.0041667 k( 224) = ( 0.3863636 0.2230672 0.5752590), wk = 0.0041667 k( 225) = ( 0.3806818 0.2197868 0.5938157), wk = 0.0041667 k( 226) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0041667 k( 227) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0041667 k( 228) = ( 0.6153846 -0.0888231 0.4082483), wk = 0.0041667 k( 229) = ( 0.6057692 -0.1054775 0.4082483), wk = 0.0041667 k( 230) = ( 0.5961538 -0.1221318 0.4082483), wk = 0.0041667 k( 231) = ( 0.5865385 -0.1387861 0.4082483), wk = 0.0041667 k( 232) = ( 0.5769231 -0.1554405 0.4082483), wk = 0.0041667 k( 233) = ( 0.5673077 -0.1720948 0.4082483), wk = 0.0041667 k( 234) = ( 0.5576923 -0.1887491 0.4082483), wk = 0.0041667 k( 235) = ( 0.5480769 -0.2054035 0.4082483), wk = 0.0041667 k( 236) = ( 0.5384615 -0.2220578 0.4082483), wk = 0.0041667 k( 237) = ( 0.5288462 -0.2387121 0.4082483), wk = 0.0041667 k( 238) = ( 0.5192308 -0.2553665 0.4082483), wk = 0.0041667 k( 239) = ( 0.5096154 -0.2720208 0.4082483), wk = 0.0041667 k( 240) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0041667 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041667 k( 2) = ( 0.0142857 0.0000000 0.0142857), wk = 0.0041667 k( 3) = ( 0.0285714 0.0000000 0.0285714), wk = 0.0041667 k( 4) = ( 0.0428571 0.0000000 0.0428571), wk = 0.0041667 k( 5) = ( 0.0571429 0.0000000 0.0571429), wk = 0.0041667 k( 6) = ( 0.0714286 0.0000000 0.0714286), wk = 0.0041667 k( 7) = ( 0.0857143 0.0000000 0.0857143), wk = 0.0041667 k( 8) = ( 0.1000000 0.0000000 0.1000000), wk = 0.0041667 k( 9) = ( 0.1142857 0.0000000 0.1142857), wk = 0.0041667 k( 10) = ( 0.1285714 0.0000000 0.1285714), wk = 0.0041667 k( 11) = ( 0.1428571 0.0000000 0.1428571), wk = 0.0041667 k( 12) = ( 0.1571429 -0.0000000 0.1571429), wk = 0.0041667 k( 13) = ( 0.1714286 0.0000000 0.1714286), wk = 0.0041667 k( 14) = ( 0.1857143 -0.0000000 0.1857143), wk = 0.0041667 k( 15) = ( 0.2000000 0.0000000 0.2000000), wk = 0.0041667 k( 16) = ( 0.2142857 0.0000000 0.2142857), wk = 0.0041667 k( 17) = ( 0.2285714 -0.0000000 0.2285714), wk = 0.0041667 k( 18) = ( 0.2428571 -0.0000000 0.2428571), wk = 0.0041667 k( 19) = ( 0.2571429 0.0000000 0.2571429), wk = 0.0041667 k( 20) = ( 0.2714286 0.0000000 0.2714286), wk = 0.0041667 k( 21) = ( 0.2857143 0.0000000 0.2857143), wk = 0.0041667 k( 22) = ( 0.3000000 -0.0000000 0.3000000), wk = 0.0041667 k( 23) = ( 0.3142857 -0.0000000 0.3142857), wk = 0.0041667 k( 24) = ( 0.3285714 -0.0000000 0.3285714), wk = 0.0041667 k( 25) = ( 0.3428571 0.0000000 0.3428571), wk = 0.0041667 k( 26) = ( 0.3571429 0.0000000 0.3571429), wk = 0.0041667 k( 27) = ( 0.3714286 0.0000000 0.3714286), wk = 0.0041667 k( 28) = ( 0.3857143 0.0000000 0.3857143), wk = 0.0041667 k( 29) = ( 0.4000000 0.0000000 0.4000000), wk = 0.0041667 k( 30) = ( 0.4142857 -0.0000000 0.4142857), wk = 0.0041667 k( 31) = ( 0.4285714 0.0000000 0.4285714), wk = 0.0041667 k( 32) = ( 0.4428571 0.0000000 0.4428571), wk = 0.0041667 k( 33) = ( 0.4571429 -0.0000000 0.4571429), wk = 0.0041667 k( 34) = ( 0.4714286 0.0000000 0.4714286), wk = 0.0041667 k( 35) = ( 0.4857143 0.0000000 0.4857143), wk = 0.0041667 k( 36) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041667 k( 37) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041667 k( 38) = ( 0.5000000 0.0138889 0.5138889), wk = 0.0041667 k( 39) = ( 0.5000000 0.0277778 0.5277778), wk = 0.0041667 k( 40) = ( 0.5000000 0.0416667 0.5416667), wk = 0.0041667 k( 41) = ( 0.5000000 0.0555556 0.5555556), wk = 0.0041667 k( 42) = ( 0.5000000 0.0694444 0.5694444), wk = 0.0041667 k( 43) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0041667 k( 44) = ( 0.5000000 0.0972222 0.5972222), wk = 0.0041667 k( 45) = ( 0.5000000 0.1111111 0.6111111), wk = 0.0041667 k( 46) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0041667 k( 47) = ( 0.5000000 0.1388889 0.6388889), wk = 0.0041667 k( 48) = ( 0.5000000 0.1527778 0.6527778), wk = 0.0041667 k( 49) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0041667 k( 50) = ( 0.5000000 0.1805556 0.6805556), wk = 0.0041667 k( 51) = ( 0.5000000 0.1944444 0.6944444), wk = 0.0041667 k( 52) = ( 0.5000000 0.2083333 0.7083333), wk = 0.0041667 k( 53) = ( 0.5000000 0.2222222 0.7222222), wk = 0.0041667 k( 54) = ( 0.5000000 0.2361111 0.7361111), wk = 0.0041667 k( 55) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041667 k( 56) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041667 k( 57) = ( 0.4903846 0.2596154 0.7500000), wk = 0.0041667 k( 58) = ( 0.4807692 0.2692308 0.7500000), wk = 0.0041667 k( 59) = ( 0.4711538 0.2788462 0.7500000), wk = 0.0041667 k( 60) = ( 0.4615385 0.2884615 0.7500000), wk = 0.0041667 k( 61) = ( 0.4519231 0.2980769 0.7500000), wk = 0.0041667 k( 62) = ( 0.4423077 0.3076923 0.7500000), wk = 0.0041667 k( 63) = ( 0.4326923 0.3173077 0.7500000), wk = 0.0041667 k( 64) = ( 0.4230769 0.3269231 0.7500000), wk = 0.0041667 k( 65) = ( 0.4134615 0.3365385 0.7500000), wk = 0.0041667 k( 66) = ( 0.4038462 0.3461538 0.7500000), wk = 0.0041667 k( 67) = ( 0.3942308 0.3557692 0.7500000), wk = 0.0041667 k( 68) = ( 0.3846154 0.3653846 0.7500000), wk = 0.0041667 k( 69) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0041667 k( 70) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0041667 k( 71) = ( 0.3651316 0.3651316 0.7302632), wk = 0.0041667 k( 72) = ( 0.3552632 0.3552632 0.7105263), wk = 0.0041667 k( 73) = ( 0.3453947 0.3453947 0.6907895), wk = 0.0041667 k( 74) = ( 0.3355263 0.3355263 0.6710526), wk = 0.0041667 k( 75) = ( 0.3256579 0.3256579 0.6513158), wk = 0.0041667 k( 76) = ( 0.3157895 0.3157895 0.6315789), wk = 0.0041667 k( 77) = ( 0.3059211 0.3059211 0.6118421), wk = 0.0041667 k( 78) = ( 0.2960526 0.2960526 0.5921053), wk = 0.0041667 k( 79) = ( 0.2861842 0.2861842 0.5723684), wk = 0.0041667 k( 80) = ( 0.2763158 0.2763158 0.5526316), wk = 0.0041667 k( 81) = ( 0.2664474 0.2664474 0.5328947), wk = 0.0041667 k( 82) = ( 0.2565789 0.2565790 0.5131579), wk = 0.0041667 k( 83) = ( 0.2467105 0.2467105 0.4934211), wk = 0.0041667 k( 84) = ( 0.2368421 0.2368421 0.4736842), wk = 0.0041667 k( 85) = ( 0.2269737 0.2269737 0.4539474), wk = 0.0041667 k( 86) = ( 0.2171053 0.2171053 0.4342105), wk = 0.0041667 k( 87) = ( 0.2072368 0.2072368 0.4144737), wk = 0.0041667 k( 88) = ( 0.1973684 0.1973684 0.3947368), wk = 0.0041667 k( 89) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0041667 k( 90) = ( 0.1776316 0.1776316 0.3552632), wk = 0.0041667 k( 91) = ( 0.1677632 0.1677632 0.3355263), wk = 0.0041667 k( 92) = ( 0.1578947 0.1578947 0.3157895), wk = 0.0041667 k( 93) = ( 0.1480263 0.1480263 0.2960526), wk = 0.0041667 k( 94) = ( 0.1381579 0.1381579 0.2763158), wk = 0.0041667 k( 95) = ( 0.1282895 0.1282895 0.2565789), wk = 0.0041667 k( 96) = ( 0.1184210 0.1184210 0.2368421), wk = 0.0041667 k( 97) = ( 0.1085526 0.1085526 0.2171053), wk = 0.0041667 k( 98) = ( 0.0986842 0.0986842 0.1973684), wk = 0.0041667 k( 99) = ( 0.0888158 0.0888158 0.1776316), wk = 0.0041667 k( 100) = ( 0.0789474 0.0789474 0.1578947), wk = 0.0041667 k( 101) = ( 0.0690790 0.0690790 0.1381579), wk = 0.0041667 k( 102) = ( 0.0592105 0.0592105 0.1184210), wk = 0.0041667 k( 103) = ( 0.0493421 0.0493421 0.0986842), wk = 0.0041667 k( 104) = ( 0.0394737 0.0394737 0.0789474), wk = 0.0041667 k( 105) = ( 0.0296053 0.0296053 0.0592105), wk = 0.0041667 k( 106) = ( 0.0197368 0.0197368 0.0394737), wk = 0.0041667 k( 107) = ( 0.0098684 0.0098684 0.0197368), wk = 0.0041667 k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041667 k( 109) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041667 k( 110) = ( 0.0161290 0.0161290 0.0161290), wk = 0.0041667 k( 111) = ( 0.0322581 0.0322581 0.0322581), wk = 0.0041667 k( 112) = ( 0.0483871 0.0483871 0.0483871), wk = 0.0041667 k( 113) = ( 0.0645161 0.0645161 0.0645161), wk = 0.0041667 k( 114) = ( 0.0806452 0.0806452 0.0806452), wk = 0.0041667 k( 115) = ( 0.0967742 0.0967742 0.0967742), wk = 0.0041667 k( 116) = ( 0.1129032 0.1129032 0.1129032), wk = 0.0041667 k( 117) = ( 0.1290323 0.1290323 0.1290323), wk = 0.0041667 k( 118) = ( 0.1451613 0.1451613 0.1451613), wk = 0.0041667 k( 119) = ( 0.1612903 0.1612903 0.1612903), wk = 0.0041667 k( 120) = ( 0.1774194 0.1774194 0.1774194), wk = 0.0041667 k( 121) = ( 0.1935484 0.1935484 0.1935484), wk = 0.0041667 k( 122) = ( 0.2096774 0.2096774 0.2096774), wk = 0.0041667 k( 123) = ( 0.2258064 0.2258065 0.2258064), wk = 0.0041667 k( 124) = ( 0.2419355 0.2419355 0.2419355), wk = 0.0041667 k( 125) = ( 0.2580645 0.2580645 0.2580645), wk = 0.0041667 k( 126) = ( 0.2741936 0.2741936 0.2741936), wk = 0.0041667 k( 127) = ( 0.2903226 0.2903226 0.2903226), wk = 0.0041667 k( 128) = ( 0.3064516 0.3064516 0.3064516), wk = 0.0041667 k( 129) = ( 0.3225807 0.3225807 0.3225807), wk = 0.0041667 k( 130) = ( 0.3387097 0.3387097 0.3387097), wk = 0.0041667 k( 131) = ( 0.3548387 0.3548387 0.3548387), wk = 0.0041667 k( 132) = ( 0.3709677 0.3709677 0.3709677), wk = 0.0041667 k( 133) = ( 0.3870968 0.3870968 0.3870968), wk = 0.0041667 k( 134) = ( 0.4032258 0.4032258 0.4032258), wk = 0.0041667 k( 135) = ( 0.4193548 0.4193548 0.4193548), wk = 0.0041667 k( 136) = ( 0.4354839 0.4354839 0.4354839), wk = 0.0041667 k( 137) = ( 0.4516129 0.4516129 0.4516129), wk = 0.0041667 k( 138) = ( 0.4677419 0.4677419 0.4677419), wk = 0.0041667 k( 139) = ( 0.4838710 0.4838710 0.4838710), wk = 0.0041667 k( 140) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041667 k( 141) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041667 k( 142) = ( 0.5056818 0.4886364 0.5056818), wk = 0.0041667 k( 143) = ( 0.5113636 0.4772727 0.5113636), wk = 0.0041667 k( 144) = ( 0.5170455 0.4659091 0.5170455), wk = 0.0041667 k( 145) = ( 0.5227273 0.4545455 0.5227273), wk = 0.0041667 k( 146) = ( 0.5284091 0.4431818 0.5284091), wk = 0.0041667 k( 147) = ( 0.5340909 0.4318182 0.5340909), wk = 0.0041667 k( 148) = ( 0.5397727 0.4204546 0.5397727), wk = 0.0041667 k( 149) = ( 0.5454545 0.4090909 0.5454545), wk = 0.0041667 k( 150) = ( 0.5511364 0.3977273 0.5511364), wk = 0.0041667 k( 151) = ( 0.5568182 0.3863636 0.5568182), wk = 0.0041667 k( 152) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0041667 k( 153) = ( 0.5681818 0.3636364 0.5681818), wk = 0.0041667 k( 154) = ( 0.5738636 0.3522727 0.5738636), wk = 0.0041667 k( 155) = ( 0.5795455 0.3409091 0.5795454), wk = 0.0041667 k( 156) = ( 0.5852273 0.3295455 0.5852273), wk = 0.0041667 k( 157) = ( 0.5909091 0.3181818 0.5909091), wk = 0.0041667 k( 158) = ( 0.5965909 0.3068182 0.5965909), wk = 0.0041667 k( 159) = ( 0.6022727 0.2954545 0.6022727), wk = 0.0041667 k( 160) = ( 0.6079545 0.2840909 0.6079545), wk = 0.0041667 k( 161) = ( 0.6136364 0.2727273 0.6136364), wk = 0.0041667 k( 162) = ( 0.6193182 0.2613636 0.6193182), wk = 0.0041667 k( 163) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0041667 k( 164) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0041667 k( 165) = ( 0.6153846 0.2500000 0.6346154), wk = 0.0041667 k( 166) = ( 0.6057692 0.2500000 0.6442308), wk = 0.0041667 k( 167) = ( 0.5961538 0.2500000 0.6538461), wk = 0.0041667 k( 168) = ( 0.5865385 0.2500000 0.6634615), wk = 0.0041667 k( 169) = ( 0.5769231 0.2500000 0.6730769), wk = 0.0041667 k( 170) = ( 0.5673077 0.2500000 0.6826923), wk = 0.0041667 k( 171) = ( 0.5576923 0.2500000 0.6923077), wk = 0.0041667 k( 172) = ( 0.5480769 0.2500000 0.7019231), wk = 0.0041667 k( 173) = ( 0.5384615 0.2500000 0.7115385), wk = 0.0041667 k( 174) = ( 0.5288462 0.2500000 0.7211538), wk = 0.0041667 k( 175) = ( 0.5192308 0.2500000 0.7307692), wk = 0.0041667 k( 176) = ( 0.5096154 0.2500000 0.7403846), wk = 0.0041667 k( 177) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041667 k( 178) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0041667 k( 179) = ( 0.5000000 0.2600000 0.7400000), wk = 0.0041667 k( 180) = ( 0.5000000 0.2700000 0.7300000), wk = 0.0041667 k( 181) = ( 0.5000000 0.2800000 0.7200000), wk = 0.0041667 k( 182) = ( 0.5000000 0.2900000 0.7100000), wk = 0.0041667 k( 183) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0041667 k( 184) = ( 0.5000000 0.3100000 0.6900000), wk = 0.0041667 k( 185) = ( 0.5000000 0.3200000 0.6800000), wk = 0.0041667 k( 186) = ( 0.5000000 0.3300000 0.6700000), wk = 0.0041667 k( 187) = ( 0.5000000 0.3400000 0.6600000), wk = 0.0041667 k( 188) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0041667 k( 189) = ( 0.5000000 0.3600000 0.6400000), wk = 0.0041667 k( 190) = ( 0.5000000 0.3700000 0.6300000), wk = 0.0041667 k( 191) = ( 0.5000000 0.3800000 0.6200000), wk = 0.0041667 k( 192) = ( 0.5000000 0.3900000 0.6100000), wk = 0.0041667 k( 193) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0041667 k( 194) = ( 0.5000000 0.4100000 0.5900000), wk = 0.0041667 k( 195) = ( 0.5000000 0.4200000 0.5800000), wk = 0.0041667 k( 196) = ( 0.5000000 0.4300000 0.5700000), wk = 0.0041667 k( 197) = ( 0.5000000 0.4400000 0.5600000), wk = 0.0041667 k( 198) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0041667 k( 199) = ( 0.5000000 0.4600000 0.5400000), wk = 0.0041667 k( 200) = ( 0.5000000 0.4700000 0.5300000), wk = 0.0041667 k( 201) = ( 0.5000000 0.4800000 0.5200000), wk = 0.0041667 k( 202) = ( 0.5000000 0.4900000 0.5100000), wk = 0.0041667 k( 203) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041667 k( 204) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041667 k( 205) = ( 0.4943182 0.4943182 0.5113636), wk = 0.0041667 k( 206) = ( 0.4886364 0.4886364 0.5227273), wk = 0.0041667 k( 207) = ( 0.4829545 0.4829545 0.5340909), wk = 0.0041667 k( 208) = ( 0.4772727 0.4772727 0.5454545), wk = 0.0041667 k( 209) = ( 0.4715909 0.4715909 0.5568182), wk = 0.0041667 k( 210) = ( 0.4659091 0.4659091 0.5681818), wk = 0.0041667 k( 211) = ( 0.4602273 0.4602273 0.5795455), wk = 0.0041667 k( 212) = ( 0.4545455 0.4545455 0.5909091), wk = 0.0041667 k( 213) = ( 0.4488636 0.4488636 0.6022727), wk = 0.0041667 k( 214) = ( 0.4431818 0.4431818 0.6136364), wk = 0.0041667 k( 215) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0041667 k( 216) = ( 0.4318182 0.4318182 0.6363636), wk = 0.0041667 k( 217) = ( 0.4261364 0.4261364 0.6477273), wk = 0.0041667 k( 218) = ( 0.4204545 0.4204546 0.6590909), wk = 0.0041667 k( 219) = ( 0.4147727 0.4147727 0.6704545), wk = 0.0041667 k( 220) = ( 0.4090909 0.4090909 0.6818182), wk = 0.0041667 k( 221) = ( 0.4034091 0.4034091 0.6931818), wk = 0.0041667 k( 222) = ( 0.3977273 0.3977273 0.7045454), wk = 0.0041667 k( 223) = ( 0.3920455 0.3920455 0.7159091), wk = 0.0041667 k( 224) = ( 0.3863636 0.3863636 0.7272727), wk = 0.0041667 k( 225) = ( 0.3806818 0.3806818 0.7386364), wk = 0.0041667 k( 226) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0041667 k( 227) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0041667 k( 228) = ( 0.6153846 0.2307692 0.6153846), wk = 0.0041667 k( 229) = ( 0.6057692 0.2115385 0.6057692), wk = 0.0041667 k( 230) = ( 0.5961538 0.1923077 0.5961538), wk = 0.0041667 k( 231) = ( 0.5865385 0.1730769 0.5865385), wk = 0.0041667 k( 232) = ( 0.5769231 0.1538462 0.5769231), wk = 0.0041667 k( 233) = ( 0.5673077 0.1346154 0.5673077), wk = 0.0041667 k( 234) = ( 0.5576923 0.1153846 0.5576923), wk = 0.0041667 k( 235) = ( 0.5480769 0.0961539 0.5480769), wk = 0.0041667 k( 236) = ( 0.5384615 0.0769231 0.5384615), wk = 0.0041667 k( 237) = ( 0.5288462 0.0576923 0.5288462), wk = 0.0041667 k( 238) = ( 0.5192308 0.0384615 0.5192308), wk = 0.0041667 k( 239) = ( 0.5096154 0.0192308 0.5096154), wk = 0.0041667 k( 240) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041667 Dense grid: 120837 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 118981 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.28 Mb ( 854, 98) NL pseudopotentials 1.67 Mb ( 427, 256) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.03 Mb ( 3356) G-vector shells 0.01 Mb ( 716) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 5.11 Mb ( 854, 392) Each subspace H/S matrix 0.15 Mb ( 98, 98) Each matrix 0.77 Mb ( 256, 2, 98) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./Cs2NaTlF6.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.6 secs Computing kpt #: 2 total cpu time spent up to now is 8.2 secs Computing kpt #: 3 total cpu time spent up to now is 10.9 secs Computing kpt #: 4 total cpu time spent up to now is 13.5 secs Computing kpt #: 5 total cpu time spent up to now is 16.9 secs Computing kpt #: 6 total cpu time spent up to now is 20.4 secs Computing kpt #: 7 total cpu time spent up to now is 23.4 secs Computing kpt #: 8 total cpu time spent up to now is 26.6 secs Computing kpt #: 9 total cpu time spent up to now is 30.1 secs Computing kpt #: 10 total cpu time spent up to now is 33.1 secs Computing kpt #: 11 total cpu time spent up to now is 36.7 secs Computing kpt #: 12 total cpu time spent up to now is 39.6 secs Computing kpt #: 13 total cpu time spent up to now is 42.9 secs Computing kpt #: 14 total cpu time spent up to now is 46.1 secs Computing kpt #: 15 total cpu time spent up to now is 50.1 secs Computing kpt #: 16 total cpu time spent up to now is 53.0 secs Computing kpt #: 17 total cpu time spent up to now is 55.7 secs Computing kpt #: 18 total cpu time spent up to now is 58.3 secs Computing kpt #: 19 total cpu time spent up to now is 60.9 secs Computing kpt #: 20 total cpu time spent up to now is 63.5 secs Computing kpt #: 21 total cpu time spent up to now is 65.8 secs Computing kpt #: 22 total cpu time spent up to now is 68.0 secs Computing kpt #: 23 total cpu time spent up to now is 70.7 secs Computing kpt #: 24 total cpu time spent up to now is 73.7 secs Computing kpt #: 25 total cpu time spent up to now is 76.7 secs Computing kpt #: 26 total cpu time spent up to now is 79.4 secs Computing kpt #: 27 total cpu time spent up to now is 82.0 secs Computing kpt #: 28 total cpu time spent up to now is 84.7 secs Computing kpt #: 29 total cpu time spent up to now is 87.4 secs Computing kpt #: 30 total cpu time spent up to now is 90.1 secs Computing kpt #: 31 total cpu time spent up to now is 92.8 secs Computing kpt #: 32 total cpu time spent up to now is 95.4 secs Computing kpt #: 33 total cpu time spent up to now is 98.0 secs Computing kpt #: 34 total cpu time spent up to now is 100.7 secs Computing kpt #: 35 total cpu time spent up to now is 103.3 secs Computing kpt #: 36 total cpu time spent up to now is 108.3 secs Computing kpt #: 37 total cpu time spent up to now is 113.1 secs Computing kpt #: 38 total cpu time spent up to now is 117.9 secs Computing kpt #: 39 total cpu time spent up to now is 122.6 secs Computing kpt #: 40 total cpu time spent up to now is 126.1 secs Computing kpt #: 41 total cpu time spent up to now is 128.9 secs Computing kpt #: 42 total cpu time spent up to now is 132.1 secs Computing kpt #: 43 total cpu time spent up to now is 134.9 secs Computing kpt #: 44 total cpu time spent up to now is 137.6 secs Computing kpt #: 45 total cpu time spent up to now is 140.3 secs Computing kpt #: 46 total cpu time spent up to now is 143.0 secs Computing kpt #: 47 total cpu time spent up to now is 145.8 secs Computing kpt #: 48 total cpu time spent up to now is 148.5 secs Computing kpt #: 49 total cpu time spent up to now is 151.2 secs Computing kpt #: 50 total cpu time spent up to now is 154.0 secs Computing kpt #: 51 total cpu time spent up to now is 156.8 secs Computing kpt #: 52 total cpu time spent up to now is 159.5 secs Computing kpt #: 53 total cpu time spent up to now is 162.3 secs Computing kpt #: 54 total cpu time spent up to now is 165.1 secs Computing kpt #: 55 total cpu time spent up to now is 167.8 secs Computing kpt #: 56 total cpu time spent up to now is 170.6 secs Computing kpt #: 57 total cpu time spent up to now is 173.3 secs Computing kpt #: 58 total cpu time spent up to now is 176.1 secs Computing kpt #: 59 total cpu time spent up to now is 178.9 secs Computing kpt #: 60 total cpu time spent up to now is 181.6 secs Computing kpt #: 61 total cpu time spent up to now is 184.3 secs Computing kpt #: 62 total cpu time spent up to now is 187.0 secs Computing kpt #: 63 total cpu time spent up to now is 189.8 secs Computing kpt #: 64 total cpu time spent up to now is 192.5 secs Computing kpt #: 65 total cpu time spent up to now is 195.2 secs Computing kpt #: 66 total cpu time spent up to now is 197.9 secs Computing kpt #: 67 total cpu time spent up to now is 200.6 secs Computing kpt #: 68 total cpu time spent up to now is 203.2 secs Computing kpt #: 69 total cpu time spent up to now is 205.9 secs Computing kpt #: 70 total cpu time spent up to now is 208.6 secs Computing kpt #: 71 total cpu time spent up to now is 211.0 secs Computing kpt #: 72 total cpu time spent up to now is 213.3 secs Computing kpt #: 73 total cpu time spent up to now is 215.7 secs Computing kpt #: 74 total cpu time spent up to now is 218.4 secs Computing kpt #: 75 total cpu time spent up to now is 220.7 secs Computing kpt #: 76 total cpu time spent up to now is 223.0 secs Computing kpt #: 77 total cpu time spent up to now is 225.4 secs Computing kpt #: 78 total cpu time spent up to now is 227.7 secs Computing kpt #: 79 total cpu time spent up to now is 230.3 secs Computing kpt #: 80 total cpu time spent up to now is 233.0 secs Computing kpt #: 81 total cpu time spent up to now is 235.7 secs Computing kpt #: 82 total cpu time spent up to now is 238.3 secs Computing kpt #: 83 total cpu time spent up to now is 241.0 secs Computing kpt #: 84 total cpu time spent up to now is 243.7 secs Computing kpt #: 85 total cpu time spent up to now is 246.4 secs Computing kpt #: 86 total cpu time spent up to now is 248.6 secs Computing kpt #: 87 total cpu time spent up to now is 250.9 secs Computing kpt #: 88 total cpu time spent up to now is 253.1 secs Computing kpt #: 89 total cpu time spent up to now is 255.4 secs Computing kpt #: 90 total cpu time spent up to now is 258.0 secs Computing kpt #: 91 total cpu time spent up to now is 260.6 secs Computing kpt #: 92 total cpu time spent up to now is 262.9 secs Computing kpt #: 93 total cpu time spent up to now is 265.5 secs Computing kpt #: 94 total cpu time spent up to now is 268.2 secs Computing kpt #: 95 total cpu time spent up to now is 270.8 secs Computing kpt #: 96 total cpu time spent up to now is 273.5 secs Computing kpt #: 97 total cpu time spent up to now is 276.1 secs Computing kpt #: 98 total cpu time spent up to now is 279.1 secs Computing kpt #: 99 total cpu time spent up to now is 282.4 secs Computing kpt #: 100 total cpu time spent up to now is 286.1 secs Computing kpt #: 101 total cpu time spent up to now is 289.8 secs Computing kpt #: 102 total cpu time spent up to now is 293.3 secs Computing kpt #: 103 total cpu time spent up to now is 296.9 secs Computing kpt #: 104 total cpu time spent up to now is 300.5 secs Computing kpt #: 105 total cpu time spent up to now is 304.0 secs Computing kpt #: 106 total cpu time spent up to now is 306.7 secs Computing kpt #: 107 total cpu time spent up to now is 309.3 secs Computing kpt #: 108 total cpu time spent up to now is 312.0 secs Computing kpt #: 109 total cpu time spent up to now is 314.7 secs Computing kpt #: 110 total cpu time spent up to now is 317.3 secs Computing kpt #: 111 total cpu time spent up to now is 320.0 secs Computing kpt #: 112 total cpu time spent up to now is 322.7 secs Computing kpt #: 113 total cpu time spent up to now is 325.3 secs Computing kpt #: 114 total cpu time spent up to now is 328.9 secs Computing kpt #: 115 total cpu time spent up to now is 332.2 secs Computing kpt #: 116 total cpu time spent up to now is 334.9 secs Computing kpt #: 117 total cpu time spent up to now is 337.6 secs Computing kpt #: 118 total cpu time spent up to now is 340.3 secs Computing kpt #: 119 total cpu time spent up to now is 342.9 secs Computing kpt #: 120 total cpu time spent up to now is 345.6 secs Computing kpt #: 121 total cpu time spent up to now is 348.8 secs Computing kpt #: 122 total cpu time spent up to now is 351.5 secs Computing kpt #: 123 total cpu time spent up to now is 354.1 secs Computing kpt #: 124 total cpu time spent up to now is 356.8 secs Computing kpt #: 125 total cpu time spent up to now is 359.5 secs Computing kpt #: 126 total cpu time spent up to now is 362.2 secs Computing kpt #: 127 total cpu time spent up to now is 364.9 secs Computing kpt #: 128 total cpu time spent up to now is 367.6 secs Computing kpt #: 129 total cpu time spent up to now is 370.3 secs Computing kpt #: 130 total cpu time spent up to now is 373.1 secs Computing kpt #: 131 total cpu time spent up to now is 375.8 secs Computing kpt #: 132 total cpu time spent up to now is 378.5 secs Computing kpt #: 133 total cpu time spent up to now is 381.3 secs Computing kpt #: 134 total cpu time spent up to now is 384.1 secs Computing kpt #: 135 total cpu time spent up to now is 386.8 secs Computing kpt #: 136 total cpu time spent up to now is 389.6 secs Computing kpt #: 137 total cpu time spent up to now is 392.3 secs Computing kpt #: 138 total cpu time spent up to now is 395.0 secs Computing kpt #: 139 total cpu time spent up to now is 397.7 secs Computing kpt #: 140 total cpu time spent up to now is 400.4 secs Computing kpt #: 141 total cpu time spent up to now is 403.1 secs Computing kpt #: 142 total cpu time spent up to now is 405.9 secs Computing kpt #: 143 total cpu time spent up to now is 408.6 secs Computing kpt #: 144 total cpu time spent up to now is 411.3 secs Computing kpt #: 145 total cpu time spent up to now is 414.1 secs Computing kpt #: 146 total cpu time spent up to now is 416.8 secs Computing kpt #: 147 total cpu time spent up to now is 419.5 secs Computing kpt #: 148 total cpu time spent up to now is 422.2 secs Computing kpt #: 149 total cpu time spent up to now is 424.6 secs Computing kpt #: 150 total cpu time spent up to now is 427.0 secs Computing kpt #: 151 total cpu time spent up to now is 429.4 secs Computing kpt #: 152 total cpu time spent up to now is 431.8 secs Computing kpt #: 153 total cpu time spent up to now is 434.1 secs Computing kpt #: 154 total cpu time spent up to now is 436.5 secs Computing kpt #: 155 total cpu time spent up to now is 438.8 secs Computing kpt #: 156 total cpu time spent up to now is 441.1 secs Computing kpt #: 157 total cpu time spent up to now is 443.4 secs Computing kpt #: 158 total cpu time spent up to now is 446.1 secs Computing kpt #: 159 total cpu time spent up to now is 448.4 secs Computing kpt #: 160 total cpu time spent up to now is 450.7 secs Computing kpt #: 161 total cpu time spent up to now is 453.1 secs Computing kpt #: 162 total cpu time spent up to now is 455.8 secs Computing kpt #: 163 total cpu time spent up to now is 458.5 secs Computing kpt #: 164 total cpu time spent up to now is 461.2 secs Computing kpt #: 165 total cpu time spent up to now is 463.8 secs Computing kpt #: 166 total cpu time spent up to now is 466.5 secs Computing kpt #: 167 total cpu time spent up to now is 469.2 secs Computing kpt #: 168 total cpu time spent up to now is 471.9 secs Computing kpt #: 169 total cpu time spent up to now is 474.6 secs Computing kpt #: 170 total cpu time spent up to now is 477.3 secs Computing kpt #: 171 total cpu time spent up to now is 480.1 secs Computing kpt #: 172 total cpu time spent up to now is 482.8 secs Computing kpt #: 173 total cpu time spent up to now is 485.6 secs Computing kpt #: 174 total cpu time spent up to now is 488.3 secs Computing kpt #: 175 total cpu time spent up to now is 491.1 secs Computing kpt #: 176 total cpu time spent up to now is 493.8 secs Computing kpt #: 177 total cpu time spent up to now is 496.6 secs Computing kpt #: 178 total cpu time spent up to now is 499.3 secs Computing kpt #: 179 total cpu time spent up to now is 502.0 secs Computing kpt #: 180 total cpu time spent up to now is 504.8 secs Computing kpt #: 181 total cpu time spent up to now is 507.5 secs Computing kpt #: 182 total cpu time spent up to now is 510.3 secs Computing kpt #: 183 total cpu time spent up to now is 512.7 secs Computing kpt #: 184 total cpu time spent up to now is 515.0 secs Computing kpt #: 185 total cpu time spent up to now is 517.4 secs Computing kpt #: 186 total cpu time spent up to now is 519.8 secs Computing kpt #: 187 total cpu time spent up to now is 522.1 secs Computing kpt #: 188 total cpu time spent up to now is 524.4 secs Computing kpt #: 189 total cpu time spent up to now is 526.7 secs Computing kpt #: 190 total cpu time spent up to now is 529.1 secs Computing kpt #: 191 total cpu time spent up to now is 531.4 secs Computing kpt #: 192 total cpu time spent up to now is 533.8 secs Computing kpt #: 193 total cpu time spent up to now is 536.2 secs Computing kpt #: 194 total cpu time spent up to now is 538.5 secs Computing kpt #: 195 total cpu time spent up to now is 540.9 secs Computing kpt #: 196 total cpu time spent up to now is 543.3 secs Computing kpt #: 197 total cpu time spent up to now is 545.7 secs Computing kpt #: 198 total cpu time spent up to now is 548.4 secs Computing kpt #: 199 total cpu time spent up to now is 550.9 secs Computing kpt #: 200 total cpu time spent up to now is 553.6 secs Computing kpt #: 201 total cpu time spent up to now is 556.3 secs Computing kpt #: 202 total cpu time spent up to now is 559.1 secs Computing kpt #: 203 total cpu time spent up to now is 561.8 secs Computing kpt #: 204 total cpu time spent up to now is 564.5 secs Computing kpt #: 205 total cpu time spent up to now is 567.2 secs Computing kpt #: 206 total cpu time spent up to now is 570.0 secs Computing kpt #: 207 total cpu time spent up to now is 572.7 secs Computing kpt #: 208 total cpu time spent up to now is 575.4 secs Computing kpt #: 209 total cpu time spent up to now is 578.1 secs Computing kpt #: 210 total cpu time spent up to now is 580.9 secs Computing kpt #: 211 total cpu time spent up to now is 583.6 secs Computing kpt #: 212 total cpu time spent up to now is 586.0 secs Computing kpt #: 213 total cpu time spent up to now is 588.4 secs Computing kpt #: 214 total cpu time spent up to now is 590.7 secs Computing kpt #: 215 total cpu time spent up to now is 593.1 secs Computing kpt #: 216 total cpu time spent up to now is 595.5 secs Computing kpt #: 217 total cpu time spent up to now is 597.9 secs Computing kpt #: 218 total cpu time spent up to now is 600.2 secs Computing kpt #: 219 total cpu time spent up to now is 602.5 secs Computing kpt #: 220 total cpu time spent up to now is 604.8 secs Computing kpt #: 221 total cpu time spent up to now is 607.1 secs Computing kpt #: 222 total cpu time spent up to now is 609.4 secs Computing kpt #: 223 total cpu time spent up to now is 611.8 secs Computing kpt #: 224 total cpu time spent up to now is 614.2 secs Computing kpt #: 225 total cpu time spent up to now is 616.9 secs Computing kpt #: 226 total cpu time spent up to now is 619.5 secs Computing kpt #: 227 total cpu time spent up to now is 622.2 secs Computing kpt #: 228 total cpu time spent up to now is 624.9 secs Computing kpt #: 229 total cpu time spent up to now is 627.6 secs Computing kpt #: 230 total cpu time spent up to now is 630.3 secs Computing kpt #: 231 total cpu time spent up to now is 633.0 secs Computing kpt #: 232 total cpu time spent up to now is 635.7 secs Computing kpt #: 233 total cpu time spent up to now is 638.3 secs Computing kpt #: 234 total cpu time spent up to now is 640.9 secs Computing kpt #: 235 total cpu time spent up to now is 643.6 secs Computing kpt #: 236 total cpu time spent up to now is 646.3 secs Computing kpt #: 237 total cpu time spent up to now is 650.9 secs Computing kpt #: 238 total cpu time spent up to now is 654.3 secs Computing kpt #: 239 total cpu time spent up to now is 657.7 secs Computing kpt #: 240 total cpu time spent up to now is 662.0 secs ethr = 1.22E-08, avg # of iterations = 26.4 total cpu time spent up to now is 662.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1022 -17.1022 -16.9698 -16.9698 -16.8772 -16.8772 -16.8772 -16.8772 -16.7550 -16.7550 -16.7550 -16.7550 -16.4815 -16.4815 -16.3613 -16.3613 -16.3613 -16.3613 -13.1739 -13.1739 -13.1558 -13.1558 -5.9613 -5.9613 -5.9613 -5.9613 -4.0500 -4.0500 -4.0500 -4.0500 -3.9986 -3.9986 -2.2560 -2.2560 -2.1041 -2.1041 -1.6796 -1.6796 -1.1700 -1.1700 -1.1700 -1.1700 -0.8681 -0.8681 -0.8681 -0.8681 0.6648 0.6648 1.0921 1.0921 1.0921 1.0921 2.1212 2.1212 2.1212 2.1212 2.1496 2.1496 2.3608 2.3608 2.4131 2.4131 2.5308 2.5308 2.5581 2.5581 2.5581 2.5581 2.5738 2.5738 2.5738 2.5738 2.6224 2.6224 2.6224 2.6224 3.2293 3.2293 3.2293 3.2293 7.4658 7.4658 10.9107 10.9107 11.0239 11.0239 11.0239 11.0239 11.2022 11.2022 11.2022 11.2022 12.1544 12.1544 13.7006 13.7006 k = 0.0143-0.0082 0.0117 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1023 -17.1023 -16.9697 -16.9697 -16.8773 -16.8773 -16.8772 -16.8772 -16.7550 -16.7550 -16.7546 -16.7546 -16.4816 -16.4816 -16.3615 -16.3615 -16.3613 -16.3613 -13.1739 -13.1739 -13.1559 -13.1559 -5.9613 -5.9613 -5.9612 -5.9612 -4.0500 -4.0500 -4.0500 -4.0500 -3.9984 -3.9984 -2.2558 -2.2558 -2.1038 -2.1038 -1.6791 -1.6791 -1.1698 -1.1698 -1.1691 -1.1691 -0.8677 -0.8677 -0.8674 -0.8674 0.6646 0.6646 1.0916 1.0916 1.0917 1.0917 2.1210 2.1210 2.1211 2.1211 2.1494 2.1494 2.3602 2.3602 2.4125 2.4125 2.5303 2.5303 2.5557 2.5557 2.5579 2.5579 2.5729 2.5729 2.5753 2.5753 2.6214 2.6214 2.6218 2.6218 3.2287 3.2287 3.2293 3.2293 7.4682 7.4682 10.9123 10.9123 11.0253 11.0253 11.0269 11.0269 11.2027 11.2027 11.2050 11.2050 12.1573 12.1573 13.6998 13.6998 k = 0.0286-0.0165 0.0233 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1028 -17.1028 -16.9693 -16.9693 -16.8775 -16.8775 -16.8772 -16.8772 -16.7550 -16.7550 -16.7533 -16.7533 -16.4819 -16.4819 -16.3622 -16.3622 -16.3613 -16.3613 -13.1741 -13.1741 -13.1561 -13.1561 -5.9613 -5.9613 -5.9612 -5.9612 -4.0501 -4.0501 -4.0498 -4.0498 -3.9977 -3.9977 -2.2552 -2.2552 -2.1032 -2.1032 -1.6777 -1.6777 -1.1692 -1.1692 -1.1663 -1.1663 -0.8664 -0.8664 -0.8654 -0.8654 0.6639 0.6639 1.0901 1.0901 1.0907 1.0907 2.1203 2.1203 2.1208 2.1208 2.1490 2.1490 2.3581 2.3581 2.4108 2.4108 2.5288 2.5288 2.5499 2.5499 2.5570 2.5570 2.5700 2.5700 2.5779 2.5779 2.6186 2.6186 2.6200 2.6200 3.2269 3.2269 3.2292 3.2292 7.4755 7.4755 10.9169 10.9169 11.0297 11.0297 11.0358 11.0358 11.2041 11.2041 11.2132 11.2132 12.1659 12.1659 13.6975 13.6976 k = 0.0429-0.0247 0.0350 ( 14845 PWs) bands (ev): -44.6796 -44.6796 -17.1036 -17.1036 -16.9686 -16.9686 -16.8777 -16.8777 -16.8773 -16.8773 -16.7550 -16.7550 -16.7512 -16.7512 -16.4824 -16.4824 -16.3632 -16.3632 -16.3613 -16.3613 -13.1743 -13.1743 -13.1566 -13.1566 -5.9613 -5.9613 -5.9611 -5.9611 -4.0502 -4.0502 -4.0495 -4.0495 -3.9967 -3.9967 -2.2543 -2.2543 -2.1021 -2.1021 -1.6754 -1.6754 -1.1681 -1.1681 -1.1616 -1.1616 -0.8643 -0.8643 -0.8620 -0.8620 0.6629 0.6629 1.0876 1.0876 1.0891 1.0891 2.1193 2.1193 2.1204 2.1204 2.1482 2.1482 2.3546 2.3546 2.4080 2.4080 2.5258 2.5258 2.5422 2.5422 2.5552 2.5552 2.5661 2.5661 2.5803 2.5803 2.6141 2.6141 2.6171 2.6171 3.2240 3.2240 3.2292 3.2292 7.4875 7.4875 10.9240 10.9240 11.0369 11.0369 11.0505 11.0505 11.2071 11.2071 11.2268 11.2268 12.1801 12.1801 13.6938 13.6938 k = 0.0571-0.0330 0.0467 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1047 -17.1047 -16.9678 -16.9678 -16.8781 -16.8781 -16.8773 -16.8773 -16.7550 -16.7550 -16.7484 -16.7484 -16.4832 -16.4832 -16.3646 -16.3646 -16.3613 -16.3613 -13.1747 -13.1747 -13.1571 -13.1571 -5.9614 -5.9614 -5.9609 -5.9609 -4.0503 -4.0503 -4.0492 -4.0492 -3.9953 -3.9953 -2.2529 -2.2529 -2.1005 -2.1005 -1.6721 -1.6721 -1.1667 -1.1667 -1.1550 -1.1550 -0.8613 -0.8613 -0.8573 -0.8573 0.6614 0.6614 1.0843 1.0843 1.0868 1.0868 2.1177 2.1177 2.1197 2.1197 2.1473 2.1473 2.3496 2.3496 2.4039 2.4039 2.5211 2.5211 2.5331 2.5331 2.5518 2.5518 2.5622 2.5622 2.5816 2.5816 2.6082 2.6082 2.6132 2.6132 3.2198 3.2198 3.2291 3.2291 7.5040 7.5040 10.9333 10.9333 11.0470 11.0470 11.0709 11.0709 11.2123 11.2123 11.2459 11.2459 12.1997 12.1997 13.6887 13.6887 k = 0.0714-0.0412 0.0583 ( 14821 PWs) bands (ev): -44.6796 -44.6796 -17.1059 -17.1059 -16.9667 -16.9667 -16.8785 -16.8785 -16.8774 -16.8774 -16.7549 -16.7549 -16.7449 -16.7449 -16.4841 -16.4841 -16.3664 -16.3664 -16.3614 -16.3614 -13.1751 -13.1751 -13.1579 -13.1579 -5.9614 -5.9614 -5.9607 -5.9607 -4.0504 -4.0504 -4.0487 -4.0487 -3.9935 -3.9935 -2.2512 -2.2512 -2.0986 -2.0986 -1.6680 -1.6680 -1.1648 -1.1648 -1.1465 -1.1465 -0.8575 -0.8575 -0.8512 -0.8512 0.6595 0.6595 1.0800 1.0800 1.0838 1.0838 2.1157 2.1157 2.1189 2.1189 2.1461 2.1461 2.3432 2.3432 2.3986 2.3986 2.5138 2.5138 2.5228 2.5228 2.5467 2.5467 2.5595 2.5595 2.5809 2.5809 2.6019 2.6019 2.6085 2.6085 3.2145 3.2145 3.2290 3.2290 7.5251 7.5251 10.9437 10.9437 11.0598 11.0598 11.0966 11.0966 11.2211 11.2211 11.2704 11.2704 12.2247 12.2247 13.6823 13.6823 k = 0.0857-0.0495 0.0700 ( 14813 PWs) bands (ev): -44.6796 -44.6796 -17.1072 -17.1072 -16.9655 -16.9655 -16.8790 -16.8790 -16.8775 -16.8775 -16.7549 -16.7549 -16.7409 -16.7409 -16.4853 -16.4853 -16.3684 -16.3684 -16.3614 -16.3614 -13.1756 -13.1756 -13.1588 -13.1588 -5.9615 -5.9615 -5.9604 -5.9604 -4.0506 -4.0506 -4.0482 -4.0482 -3.9913 -3.9913 -2.2492 -2.2492 -2.0962 -2.0962 -1.6630 -1.6630 -1.1625 -1.1625 -1.1362 -1.1362 -0.8529 -0.8529 -0.8439 -0.8439 0.6572 0.6572 1.0750 1.0750 1.0802 1.0802 2.1133 2.1133 2.1180 2.1180 2.1447 2.1447 2.3353 2.3353 2.3920 2.3920 2.5035 2.5035 2.5114 2.5114 2.5407 2.5407 2.5575 2.5575 2.5769 2.5769 2.5967 2.5967 2.6030 2.6030 3.2079 3.2079 3.2289 3.2289 7.5503 7.5503 10.9543 10.9543 11.0753 11.0753 11.1274 11.1274 11.2346 11.2346 11.3002 11.3002 12.2548 12.2548 13.6747 13.6747 k = 0.1000-0.0577 0.0816 ( 14796 PWs) bands (ev): -44.6796 -44.6796 -17.1085 -17.1085 -16.9643 -16.9643 -16.8794 -16.8794 -16.8776 -16.8776 -16.7548 -16.7548 -16.7365 -16.7365 -16.4866 -16.4866 -16.3706 -16.3706 -16.3614 -16.3614 -13.1762 -13.1762 -13.1598 -13.1598 -5.9616 -5.9616 -5.9602 -5.9602 -4.0508 -4.0508 -4.0475 -4.0475 -3.9887 -3.9887 -2.2468 -2.2468 -2.0935 -2.0935 -1.6572 -1.6572 -1.1598 -1.1598 -1.1240 -1.1240 -0.8474 -0.8474 -0.8354 -0.8354 0.6546 0.6546 1.0692 1.0692 1.0758 1.0758 2.1103 2.1103 2.1169 2.1169 2.1433 2.1433 2.3258 2.3258 2.3841 2.3841 2.4904 2.4904 2.4988 2.4988 2.5343 2.5343 2.5560 2.5560 2.5687 2.5687 2.5937 2.5937 2.5970 2.5970 3.2000 3.2000 3.2288 3.2288 7.5795 7.5795 10.9641 10.9641 11.0934 11.0934 11.1627 11.1627 11.2542 11.2542 11.3352 11.3352 12.2899 12.2899 13.6660 13.6660 k = 0.1143-0.0660 0.0933 ( 14796 PWs) bands (ev): -44.6796 -44.6796 -17.1098 -17.1098 -16.9630 -16.9630 -16.8798 -16.8798 -16.8777 -16.8777 -16.7548 -16.7548 -16.7319 -16.7319 -16.4881 -16.4881 -16.3730 -16.3730 -16.3614 -16.3614 -13.1769 -13.1769 -13.1610 -13.1610 -5.9617 -5.9617 -5.9598 -5.9598 -4.0511 -4.0511 -4.0468 -4.0468 -3.9859 -3.9859 -2.2442 -2.2442 -2.0904 -2.0904 -1.6507 -1.6507 -1.1567 -1.1567 -1.1100 -1.1100 -0.8412 -0.8412 -0.8256 -0.8256 0.6517 0.6517 1.0627 1.0627 1.0708 1.0708 2.1069 2.1069 2.1156 2.1156 2.1417 2.1417 2.3147 2.3147 2.3747 2.3747 2.4750 2.4750 2.4850 2.4850 2.5275 2.5275 2.5547 2.5547 2.5576 2.5576 2.5907 2.5907 2.5918 2.5918 3.1908 3.1908 3.2287 3.2287 7.6123 7.6123 10.9723 10.9723 11.1140 11.1140 11.2023 11.2023 11.2810 11.2810 11.3754 11.3754 12.3298 12.3298 13.6564 13.6564 k = 0.1286-0.0742 0.1050 ( 14788 PWs) bands (ev): -44.6796 -44.6796 -17.1110 -17.1110 -16.9616 -16.9616 -16.8802 -16.8802 -16.8778 -16.8778 -16.7547 -16.7547 -16.7273 -16.7273 -16.4897 -16.4897 -16.3755 -16.3755 -16.3615 -16.3615 -13.1777 -13.1777 -13.1623 -13.1623 -5.9618 -5.9618 -5.9595 -5.9595 -4.0515 -4.0515 -4.0460 -4.0460 -3.9827 -3.9827 -2.2413 -2.2413 -2.0870 -2.0870 -1.6434 -1.6434 -1.1533 -1.1533 -1.0942 -1.0942 -0.8343 -0.8343 -0.8147 -0.8147 0.6485 0.6485 1.0556 1.0556 1.0650 1.0650 2.1030 2.1030 2.1143 2.1143 2.1402 2.1402 2.3018 2.3018 2.3637 2.3637 2.4579 2.4579 2.4701 2.4701 2.5201 2.5201 2.5451 2.5451 2.5536 2.5536 2.5843 2.5843 2.5900 2.5900 3.1803 3.1803 3.2285 3.2285 7.6484 7.6484 10.9786 10.9786 11.1370 11.1370 11.2457 11.2457 11.3153 11.3153 11.4206 11.4206 12.3745 12.3745 13.6460 13.6460 k = 0.1429-0.0825 0.1166 ( 14812 PWs) bands (ev): -44.6796 -44.6796 -17.1119 -17.1119 -16.9603 -16.9603 -16.8806 -16.8806 -16.8780 -16.8780 -16.7546 -16.7546 -16.7227 -16.7227 -16.4914 -16.4914 -16.3780 -16.3780 -16.3615 -16.3615 -13.1786 -13.1786 -13.1637 -13.1637 -5.9620 -5.9620 -5.9591 -5.9591 -4.0519 -4.0519 -4.0452 -4.0452 -3.9793 -3.9793 -2.2382 -2.2382 -2.0832 -2.0832 -1.6355 -1.6355 -1.1495 -1.1495 -1.0766 -1.0766 -0.8266 -0.8266 -0.8027 -0.8027 0.6451 0.6451 1.0480 1.0480 1.0584 1.0584 2.0987 2.0987 2.1129 2.1129 2.1386 2.1386 2.2870 2.2870 2.3509 2.3509 2.4395 2.4395 2.4539 2.4539 2.5119 2.5119 2.5319 2.5319 2.5526 2.5526 2.5780 2.5780 2.5880 2.5880 3.1685 3.1685 3.2284 3.2284 7.6875 7.6875 10.9831 10.9831 11.1622 11.1622 11.2929 11.2929 11.3566 11.3566 11.4708 11.4708 12.4239 12.4239 13.6349 13.6349 k = 0.1571-0.0907 0.1283 ( 14804 PWs) bands (ev): -44.6796 -44.6796 -17.1126 -17.1126 -16.9590 -16.9590 -16.8809 -16.8809 -16.8781 -16.8781 -16.7545 -16.7545 -16.7185 -16.7185 -16.4931 -16.4931 -16.3805 -16.3805 -16.3615 -16.3615 -13.1795 -13.1795 -13.1652 -13.1652 -5.9622 -5.9622 -5.9587 -5.9587 -4.0524 -4.0524 -4.0443 -4.0443 -3.9756 -3.9756 -2.2349 -2.2349 -2.0792 -2.0792 -1.6271 -1.6271 -1.1454 -1.1454 -1.0573 -1.0573 -0.8182 -0.8182 -0.7897 -0.7897 0.6415 0.6415 1.0400 1.0400 1.0512 1.0512 2.0940 2.0940 2.1114 2.1114 2.1370 2.1370 2.2705 2.2705 2.3361 2.3361 2.4204 2.4204 2.4368 2.4368 2.5029 2.5029 2.5186 2.5186 2.5516 2.5516 2.5718 2.5718 2.5857 2.5857 3.1554 3.1554 3.2282 3.2282 7.7291 7.7291 10.9862 10.9862 11.1894 11.1894 11.3440 11.3440 11.4041 11.4041 11.5259 11.5259 12.4783 12.4783 13.6234 13.6234 k = 0.1714-0.0990 0.1400 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.1129 -17.1129 -16.9578 -16.9578 -16.8812 -16.8812 -16.8783 -16.8783 -16.7544 -16.7544 -16.7148 -16.7148 -16.4947 -16.4947 -16.3828 -16.3828 -16.3616 -16.3616 -13.1804 -13.1804 -13.1668 -13.1668 -5.9624 -5.9624 -5.9582 -5.9582 -4.0530 -4.0530 -4.0433 -4.0433 -3.9717 -3.9717 -2.2314 -2.2314 -2.0749 -2.0749 -1.6182 -1.6182 -1.1409 -1.1409 -1.0363 -1.0363 -0.8092 -0.8092 -0.7757 -0.7757 0.6378 0.6378 1.0317 1.0317 1.0432 1.0432 2.0889 2.0889 2.1098 2.1098 2.1355 2.1355 2.2521 2.2521 2.3193 2.3193 2.4009 2.4009 2.4188 2.4188 2.4933 2.4933 2.5053 2.5053 2.5506 2.5506 2.5657 2.5657 2.5829 2.5829 3.1410 3.1410 3.2281 3.2281 7.7729 7.7729 10.9887 10.9887 11.2185 11.2185 11.3987 11.3987 11.4564 11.4564 11.5857 11.5857 12.5376 12.5376 13.6114 13.6114 k = 0.1857-0.1072 0.1516 ( 14824 PWs) bands (ev): -44.6796 -44.6796 -17.1129 -17.1129 -16.9567 -16.9567 -16.8814 -16.8814 -16.8784 -16.8784 -16.7543 -16.7543 -16.7118 -16.7118 -16.4960 -16.4960 -16.3850 -16.3850 -16.3616 -16.3616 -13.1814 -13.1814 -13.1685 -13.1685 -5.9627 -5.9627 -5.9578 -5.9578 -4.0536 -4.0536 -4.0423 -4.0423 -3.9676 -3.9676 -2.2278 -2.2278 -2.0705 -2.0705 -1.6089 -1.6089 -1.1361 -1.1361 -1.0137 -1.0137 -0.7996 -0.7996 -0.7609 -0.7609 0.6341 0.6341 1.0232 1.0232 1.0344 1.0344 2.0835 2.0835 2.1082 2.1082 2.1340 2.1340 2.2320 2.2320 2.3000 2.3000 2.3812 2.3812 2.4002 2.4002 2.4832 2.4832 2.4926 2.4926 2.5496 2.5496 2.5599 2.5599 2.5798 2.5798 3.1254 3.1254 3.2279 3.2279 7.8184 7.8184 10.9912 10.9912 11.2494 11.2494 11.4568 11.4568 11.5125 11.5125 11.6502 11.6502 12.6022 12.6022 13.5993 13.5993 k = 0.2000-0.1155 0.1633 ( 14844 PWs) bands (ev): -44.6796 -44.6796 -17.1124 -17.1124 -16.9556 -16.9556 -16.8815 -16.8815 -16.8786 -16.8786 -16.7543 -16.7543 -16.7097 -16.7097 -16.4971 -16.4971 -16.3869 -16.3869 -16.3617 -16.3617 -13.1825 -13.1825 -13.1702 -13.1702 -5.9630 -5.9630 -5.9573 -5.9573 -4.0543 -4.0543 -4.0413 -4.0413 -3.9634 -3.9634 -2.2240 -2.2240 -2.0658 -2.0658 -1.5992 -1.5992 -1.1311 -1.1311 -0.9896 -0.9896 -0.7895 -0.7895 -0.7452 -0.7452 0.6302 0.6302 1.0146 1.0146 1.0250 1.0250 2.0778 2.0778 2.1066 2.1066 2.1324 2.1324 2.2104 2.2104 2.2783 2.2783 2.3616 2.3616 2.3815 2.3815 2.4729 2.4729 2.4804 2.4804 2.5482 2.5482 2.5546 2.5546 2.5763 2.5763 3.1087 3.1087 3.2278 3.2278 7.8653 7.8653 10.9941 10.9941 11.2817 11.2817 11.5173 11.5173 11.5719 11.5719 11.7191 11.7191 12.6724 12.6724 13.5871 13.5871 k = 0.2143-0.1237 0.1750 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.1115 -17.1115 -16.9547 -16.9547 -16.8816 -16.8816 -16.8788 -16.8788 -16.7542 -16.7542 -16.7087 -16.7087 -16.4977 -16.4977 -16.3885 -16.3885 -16.3617 -16.3617 -13.1836 -13.1836 -13.1720 -13.1720 -5.9633 -5.9633 -5.9568 -5.9568 -4.0551 -4.0551 -4.0402 -4.0402 -3.9590 -3.9590 -2.2202 -2.2202 -2.0610 -2.0610 -1.5893 -1.5893 -1.1259 -1.1259 -0.9640 -0.9640 -0.7789 -0.7789 -0.7288 -0.7288 0.6264 0.6264 1.0059 1.0059 1.0148 1.0148 2.0720 2.0720 2.1048 2.1048 2.1308 2.1308 2.1876 2.1876 2.2542 2.2542 2.3420 2.3420 2.3628 2.3628 2.4625 2.4625 2.4688 2.4688 2.5453 2.5453 2.5509 2.5509 2.5725 2.5725 3.0909 3.0909 3.2276 3.2276 7.9131 7.9131 10.9980 10.9980 11.3153 11.3153 11.5784 11.5784 11.6350 11.6350 11.7923 11.7923 12.7484 12.7484 13.5749 13.5749 k = 0.2286-0.1320 0.1866 ( 14832 PWs) bands (ev): -44.6796 -44.6796 -17.1101 -17.1101 -16.9538 -16.9538 -16.8817 -16.8817 -16.8789 -16.8789 -16.7541 -16.7541 -16.7089 -16.7089 -16.4979 -16.4979 -16.3899 -16.3899 -16.3617 -16.3617 -13.1847 -13.1847 -13.1739 -13.1739 -5.9637 -5.9637 -5.9563 -5.9563 -4.0560 -4.0560 -4.0392 -4.0392 -3.9546 -3.9546 -2.2164 -2.2164 -2.0561 -2.0561 -1.5793 -1.5793 -1.1204 -1.1204 -0.9372 -0.9372 -0.7679 -0.7679 -0.7119 -0.7119 0.6227 0.6227 0.9973 0.9973 1.0039 1.0039 2.0659 2.0659 2.1029 2.1029 2.1289 2.1289 2.1639 2.1639 2.2280 2.2280 2.3225 2.3225 2.3444 2.3444 2.4523 2.4523 2.4579 2.4579 2.5404 2.5404 2.5492 2.5492 2.5684 2.5684 3.0720 3.0720 3.2275 3.2275 7.9614 7.9614 11.0033 11.0033 11.3499 11.3499 11.6376 11.6376 11.7027 11.7027 11.8698 11.8698 12.8308 12.8308 13.5573 13.5573 k = 0.2429-0.1402 0.1983 ( 14808 PWs) bands (ev): -44.6796 -44.6796 -17.1081 -17.1081 -16.9531 -16.9531 -16.8818 -16.8818 -16.8791 -16.8791 -16.7540 -16.7540 -16.7103 -16.7103 -16.4974 -16.4974 -16.3909 -16.3909 -16.3618 -16.3618 -13.1858 -13.1858 -13.1757 -13.1757 -5.9641 -5.9641 -5.9558 -5.9558 -4.0569 -4.0569 -4.0381 -4.0381 -3.9502 -3.9502 -2.2125 -2.2125 -2.0512 -2.0512 -1.5692 -1.5692 -1.1148 -1.1148 -0.9092 -0.9092 -0.7566 -0.7566 -0.6944 -0.6944 0.6191 0.6191 0.9889 0.9889 0.9925 0.9925 2.0598 2.0598 2.1004 2.1004 2.1264 2.1264 2.1402 2.1402 2.2002 2.2002 2.3032 2.3032 2.3265 2.3265 2.4424 2.4424 2.4478 2.4478 2.5348 2.5348 2.5482 2.5482 2.5640 2.5640 3.0524 3.0524 3.2274 3.2274 8.0098 8.0098 11.0104 11.0104 11.3853 11.3853 11.6927 11.6927 11.7758 11.7758 11.9512 11.9512 12.9198 12.9198 13.4663 13.4663 k = 0.2571-0.1485 0.2100 ( 14808 PWs) bands (ev): -44.6796 -44.6796 -17.1056 -17.1056 -16.9524 -16.9524 -16.8820 -16.8820 -16.8793 -16.8793 -16.7539 -16.7539 -16.7130 -16.7130 -16.4965 -16.4965 -16.3916 -16.3916 -16.3618 -16.3618 -13.1869 -13.1869 -13.1776 -13.1776 -5.9645 -5.9645 -5.9553 -5.9553 -4.0579 -4.0579 -4.0370 -4.0370 -3.9457 -3.9457 -2.2087 -2.2087 -2.0462 -2.0462 -1.5591 -1.5591 -1.1091 -1.1091 -0.8802 -0.8802 -0.7451 -0.7451 -0.6765 -0.6765 0.6156 0.6156 0.9804 0.9804 0.9807 0.9807 2.0537 2.0537 2.0954 2.0954 2.1187 2.1187 2.1219 2.1219 2.1727 2.1727 2.2840 2.2840 2.3091 2.3091 2.4330 2.4330 2.4383 2.4383 2.5290 2.5290 2.5474 2.5474 2.5594 2.5594 3.0319 3.0319 3.2272 3.2272 8.0578 8.0578 11.0195 11.0195 11.4212 11.4212 11.7424 11.7424 11.8542 11.8542 12.0366 12.0366 13.0157 13.0157 13.3706 13.3706 k = 0.2714-0.1567 0.2216 ( 14808 PWs) bands (ev): -44.6796 -44.6796 -17.1025 -17.1025 -16.9519 -16.9519 -16.8821 -16.8821 -16.8795 -16.8795 -16.7537 -16.7537 -16.7170 -16.7170 -16.4950 -16.4950 -16.3920 -16.3920 -16.3619 -16.3619 -13.1880 -13.1880 -13.1794 -13.1794 -5.9649 -5.9649 -5.9548 -5.9548 -4.0589 -4.0589 -4.0360 -4.0360 -3.9413 -3.9413 -2.2049 -2.2049 -2.0413 -2.0413 -1.5491 -1.5491 -1.1033 -1.1033 -0.8503 -0.8503 -0.7334 -0.7334 -0.6584 -0.6584 0.6122 0.6122 0.9679 0.9679 0.9729 0.9729 2.0475 2.0475 2.0810 2.0810 2.1067 2.1067 2.1106 2.1106 2.1504 2.1504 2.2651 2.2651 2.2922 2.2922 2.4241 2.4241 2.4296 2.4296 2.5232 2.5232 2.5468 2.5468 2.5547 2.5547 3.0109 3.0109 3.2271 3.2271 8.1050 8.1050 11.0308 11.0308 11.4573 11.4573 11.7862 11.7862 11.9372 11.9372 12.1256 12.1256 13.1186 13.1186 13.2757 13.2757 k = 0.2857-0.1650 0.2333 ( 14836 PWs) bands (ev): -44.6796 -44.6796 -17.0989 -17.0989 -16.9515 -16.9515 -16.8824 -16.8824 -16.8797 -16.8797 -16.7536 -16.7536 -16.7221 -16.7221 -16.4931 -16.4931 -16.3920 -16.3920 -16.3619 -16.3619 -13.1891 -13.1891 -13.1813 -13.1813 -5.9654 -5.9654 -5.9543 -5.9543 -4.0600 -4.0600 -4.0349 -4.0349 -3.9370 -3.9370 -2.2012 -2.2012 -2.0364 -2.0364 -1.5393 -1.5393 -1.0975 -1.0975 -0.8199 -0.8199 -0.7216 -0.7216 -0.6401 -0.6401 0.6090 0.6090 0.9550 0.9550 0.9655 0.9655 2.0415 2.0415 2.0588 2.0588 2.0870 2.0870 2.1028 2.1028 2.1395 2.1395 2.2464 2.2464 2.2759 2.2759 2.4157 2.4157 2.4216 2.4216 2.5173 2.5173 2.5461 2.5461 2.5498 2.5498 2.9895 2.9895 3.2270 3.2270 8.1511 8.1511 11.0444 11.0444 11.4934 11.4934 11.8238 11.8238 12.0241 12.0241 12.2181 12.2181 13.1839 13.1839 13.2285 13.2285 k = 0.3000-0.1732 0.2449 ( 14824 PWs) bands (ev): -44.6796 -44.6796 -17.0947 -17.0947 -16.9511 -16.9511 -16.8828 -16.8828 -16.8798 -16.8798 -16.7536 -16.7536 -16.7282 -16.7282 -16.4909 -16.4909 -16.3917 -16.3917 -16.3620 -16.3620 -13.1902 -13.1902 -13.1830 -13.1830 -5.9659 -5.9659 -5.9539 -5.9539 -4.0611 -4.0611 -4.0339 -4.0339 -3.9327 -3.9327 -2.1977 -2.1977 -2.0316 -2.0316 -1.5298 -1.5298 -1.0917 -1.0917 -0.7891 -0.7891 -0.7099 -0.7099 -0.6219 -0.6219 0.6060 0.6060 0.9417 0.9417 0.9587 0.9587 2.0352 2.0352 2.0354 2.0354 2.0561 2.0561 2.1009 2.1009 2.1353 2.1353 2.2281 2.2281 2.2602 2.2602 2.4080 2.4080 2.4142 2.4142 2.5114 2.5114 2.5447 2.5447 2.5456 2.5456 2.9679 2.9679 3.2269 3.2269 8.1958 8.1958 11.0606 11.0606 11.5292 11.5292 11.8548 11.8548 12.1144 12.1144 12.3139 12.3139 13.0964 13.0964 13.3451 13.3451 k = 0.3143-0.1815 0.2566 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0900 -17.0900 -16.9509 -16.9509 -16.8834 -16.8834 -16.8800 -16.8800 -16.7535 -16.7535 -16.7351 -16.7351 -16.4884 -16.4884 -16.3911 -16.3911 -16.3620 -16.3620 -13.1912 -13.1912 -13.1848 -13.1848 -5.9664 -5.9664 -5.9534 -5.9534 -4.0623 -4.0623 -4.0329 -4.0329 -3.9287 -3.9287 -2.1942 -2.1942 -2.0270 -2.0270 -1.5206 -1.5206 -1.0860 -1.0860 -0.7581 -0.7581 -0.6984 -0.6984 -0.6037 -0.6037 0.6031 0.6031 0.9283 0.9283 0.9524 0.9524 2.0119 2.0119 2.0221 2.0221 2.0302 2.0302 2.0996 2.0996 2.1334 2.1334 2.2103 2.2103 2.2452 2.2452 2.4009 2.4009 2.4075 2.4075 2.5056 2.5056 2.5397 2.5397 2.5450 2.5450 2.9463 2.9463 3.2267 3.2267 8.2386 8.2386 11.0794 11.0794 11.5643 11.5643 11.8789 11.8789 12.2074 12.2074 12.4129 12.4129 13.0140 13.0140 13.4645 13.4645 k = 0.3286-0.1897 0.2683 ( 14808 PWs) bands (ev): -44.6796 -44.6796 -17.0847 -17.0847 -16.9508 -16.9508 -16.8841 -16.8841 -16.8802 -16.8802 -16.7534 -16.7534 -16.7426 -16.7426 -16.4859 -16.4859 -16.3901 -16.3901 -16.3620 -16.3620 -13.1923 -13.1923 -13.1864 -13.1864 -5.9669 -5.9669 -5.9530 -5.9530 -4.0634 -4.0634 -4.0320 -4.0320 -3.9247 -3.9247 -2.1909 -2.1909 -2.0225 -2.0225 -1.5118 -1.5118 -1.0804 -1.0804 -0.7274 -0.7274 -0.6871 -0.6871 -0.5859 -0.5859 0.6004 0.6004 0.9149 0.9149 0.9468 0.9468 1.9882 1.9882 1.9894 1.9894 2.0244 2.0244 2.0987 2.0987 2.1323 2.1323 2.1932 2.1932 2.2309 2.2309 2.3945 2.3945 2.4016 2.4016 2.4998 2.4998 2.5346 2.5346 2.5445 2.5445 2.9249 2.9249 3.2266 3.2266 8.2793 8.2793 11.1007 11.1007 11.5985 11.5985 11.8962 11.8962 12.3027 12.3027 12.5146 12.5146 12.9371 12.9371 13.4939 13.4939 k = 0.3429-0.1979 0.2799 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0789 -17.0789 -16.9508 -16.9508 -16.8851 -16.8851 -16.8803 -16.8803 -16.7533 -16.7533 -16.7504 -16.7504 -16.4834 -16.4834 -16.3890 -16.3890 -16.3621 -16.3621 -13.1932 -13.1932 -13.1880 -13.1880 -5.9674 -5.9674 -5.9526 -5.9526 -4.0645 -4.0645 -4.0311 -4.0311 -3.9210 -3.9210 -2.1877 -2.1877 -2.0183 -2.0183 -1.5035 -1.5035 -1.0750 -1.0750 -0.6970 -0.6970 -0.6762 -0.6762 -0.5686 -0.5686 0.5977 0.5977 0.9016 0.9016 0.9419 0.9419 1.9543 1.9543 1.9680 1.9680 2.0191 2.0191 2.0979 2.0979 2.1316 2.1316 2.1768 2.1768 2.2174 2.2174 2.3886 2.3886 2.3962 2.3962 2.4943 2.4943 2.5296 2.5296 2.5440 2.5440 2.9039 2.9039 3.2265 3.2265 8.3175 8.3175 11.1246 11.1246 11.6314 11.6314 11.9066 11.9066 12.3998 12.3998 12.6186 12.6186 12.8662 12.8662 13.4902 13.4902 k = 0.3571-0.2062 0.2916 ( 14820 PWs) bands (ev): -44.6796 -44.6796 -17.0727 -17.0727 -16.9510 -16.9510 -16.8865 -16.8865 -16.8805 -16.8805 -16.7584 -16.7584 -16.7532 -16.7532 -16.4809 -16.4809 -16.3876 -16.3876 -16.3621 -16.3621 -13.1941 -13.1941 -13.1895 -13.1895 -5.9679 -5.9679 -5.9522 -5.9522 -4.0656 -4.0656 -4.0303 -4.0303 -3.9175 -3.9175 -2.1848 -2.1848 -2.0143 -2.0143 -1.4958 -1.4958 -1.0698 -1.0698 -0.6675 -0.6675 -0.6657 -0.6657 -0.5520 -0.5520 0.5952 0.5952 0.8885 0.8885 0.9377 0.9377 1.9211 1.9211 1.9479 1.9479 2.0141 2.0141 2.0973 2.0973 2.1311 2.1311 2.1613 2.1613 2.2048 2.2048 2.3834 2.3834 2.3916 2.3916 2.4889 2.4889 2.5247 2.5247 2.5436 2.5436 2.8836 2.8836 3.2265 3.2265 8.3531 8.3531 11.1507 11.1507 11.6628 11.6628 11.9104 11.9104 12.4979 12.4979 12.7221 12.7221 12.8040 12.8040 13.4877 13.4877 k = 0.3714-0.2144 0.3033 ( 14816 PWs) bands (ev): -44.6796 -44.6796 -17.0661 -17.0661 -16.9513 -16.9513 -16.8882 -16.8882 -16.8806 -16.8806 -16.7664 -16.7664 -16.7531 -16.7531 -16.4786 -16.4786 -16.3861 -16.3861 -16.3621 -16.3621 -13.1950 -13.1950 -13.1909 -13.1909 -5.9684 -5.9684 -5.9518 -5.9518 -4.0667 -4.0667 -4.0295 -4.0295 -3.9143 -3.9143 -2.1821 -2.1821 -2.0106 -2.0106 -1.4886 -1.4886 -1.0649 -1.0649 -0.6559 -0.6559 -0.6391 -0.6391 -0.5362 -0.5362 0.5929 0.5929 0.8759 0.8759 0.9342 0.9342 1.8891 1.8891 1.9293 1.9293 2.0095 2.0095 2.0968 2.0968 2.1309 2.1309 2.1468 2.1468 2.1931 2.1931 2.3787 2.3787 2.3876 2.3876 2.4838 2.4838 2.5200 2.5200 2.5432 2.5432 2.8643 2.8643 3.2264 3.2264 8.3858 8.3858 11.1790 11.1790 11.6922 11.6922 11.9080 11.9080 12.5961 12.5961 12.7355 12.7355 12.8400 12.8400 13.4876 13.4876 k = 0.3857-0.2227 0.3149 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0591 -17.0591 -16.9518 -16.9518 -16.8902 -16.8902 -16.8807 -16.8807 -16.7740 -16.7740 -16.7530 -16.7530 -16.4766 -16.4766 -16.3845 -16.3845 -16.3622 -16.3622 -13.1957 -13.1957 -13.1922 -13.1922 -5.9688 -5.9688 -5.9515 -5.9515 -4.0677 -4.0677 -4.0288 -4.0288 -3.9113 -3.9113 -2.1796 -2.1796 -2.0072 -2.0072 -1.4820 -1.4820 -1.0604 -1.0604 -0.6467 -0.6467 -0.6122 -0.6122 -0.5215 -0.5215 0.5906 0.5906 0.8640 0.8640 0.9313 0.9313 1.8588 1.8588 1.9123 1.9123 2.0052 2.0052 2.0964 2.0964 2.1307 2.1307 2.1335 2.1335 2.1824 2.1824 2.3746 2.3746 2.3842 2.3842 2.4791 2.4791 2.5154 2.5154 2.5428 2.5428 2.8461 2.8461 3.2263 3.2263 8.4155 8.4155 11.2090 11.2090 11.7195 11.7195 11.9001 11.9001 12.6843 12.6843 12.6935 12.6935 12.9482 12.9482 13.4909 13.4909 k = 0.4000-0.2309 0.3266 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0519 -17.0519 -16.9525 -16.9525 -16.8927 -16.8927 -16.8808 -16.8808 -16.7810 -16.7810 -16.7530 -16.7530 -16.4747 -16.4747 -16.3829 -16.3829 -16.3622 -16.3622 -13.1964 -13.1964 -13.1933 -13.1933 -5.9692 -5.9692 -5.9512 -5.9512 -4.0686 -4.0686 -4.0282 -4.0282 -3.9086 -3.9086 -2.1773 -2.1773 -2.0041 -2.0041 -1.4762 -1.4762 -1.0563 -1.0563 -0.6384 -0.6384 -0.5872 -0.5872 -0.5080 -0.5080 0.5885 0.5885 0.8529 0.8529 0.9291 0.9291 1.8307 1.8307 1.8971 1.8971 2.0014 2.0014 2.0959 2.0959 2.1215 2.1215 2.1307 2.1307 2.1728 2.1728 2.3710 2.3710 2.3813 2.3813 2.4748 2.4748 2.5112 2.5112 2.5424 2.5424 2.8293 2.8293 3.2262 3.2262 8.4419 8.4419 11.2404 11.2404 11.7444 11.7444 11.8873 11.8873 12.6374 12.6374 12.7883 12.7883 13.0591 13.0591 13.4988 13.4988 k = 0.4143-0.2392 0.3383 ( 14832 PWs) bands (ev): -44.6796 -44.6796 -17.0446 -17.0446 -16.9535 -16.9535 -16.8954 -16.8954 -16.8809 -16.8809 -16.7873 -16.7873 -16.7529 -16.7529 -16.4731 -16.4731 -16.3813 -16.3813 -16.3622 -16.3622 -13.1971 -13.1971 -13.1944 -13.1944 -5.9696 -5.9696 -5.9509 -5.9509 -4.0694 -4.0694 -4.0276 -4.0276 -3.9063 -3.9063 -2.1754 -2.1754 -2.0014 -2.0014 -1.4710 -1.4710 -1.0527 -1.0527 -0.6310 -0.6310 -0.5645 -0.5645 -0.4959 -0.4959 0.5866 0.5866 0.8428 0.8428 0.9275 0.9275 1.8053 1.8053 1.8837 1.8837 1.9981 1.9981 2.0954 2.0954 2.1112 2.1112 2.1307 2.1307 2.1643 2.1643 2.3680 2.3680 2.3790 2.3790 2.4709 2.4709 2.5074 2.5074 2.5421 2.5421 2.8143 2.8143 3.2262 3.2262 8.4650 8.4650 11.2724 11.2724 11.7665 11.7665 11.8706 11.8706 12.5965 12.5965 12.8782 12.8782 13.1698 13.1698 13.5132 13.5132 k = 0.4286-0.2474 0.3499 ( 14824 PWs) bands (ev): -44.6796 -44.6796 -17.0374 -17.0374 -16.9548 -16.9548 -16.8984 -16.8984 -16.8810 -16.8810 -16.7928 -16.7928 -16.7529 -16.7529 -16.4718 -16.4718 -16.3799 -16.3799 -16.3623 -16.3623 -13.1976 -13.1976 -13.1952 -13.1952 -5.9699 -5.9699 -5.9507 -5.9507 -4.0701 -4.0701 -4.0272 -4.0272 -3.9042 -3.9042 -2.1737 -2.1737 -1.9991 -1.9991 -1.4666 -1.4666 -1.0495 -1.0495 -0.6245 -0.6245 -0.5444 -0.5444 -0.4854 -0.4854 0.5848 0.5848 0.8339 0.8339 0.9263 0.9263 1.7829 1.7829 1.8723 1.8723 1.9952 1.9952 2.0941 2.0941 2.1030 2.1030 2.1307 2.1307 2.1570 2.1570 2.3654 2.3654 2.3771 2.3771 2.4676 2.4676 2.5040 2.5040 2.5419 2.5419 2.8011 2.8011 3.2261 3.2261 8.4847 8.4847 11.3042 11.3042 11.7857 11.7857 11.8512 11.8512 12.5617 12.5617 12.9603 12.9603 13.2775 13.2775 13.5365 13.5365 k = 0.4429-0.2557 0.3616 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.0304 -17.0304 -16.9564 -16.9564 -16.9013 -16.9013 -16.8811 -16.8811 -16.7973 -16.7973 -16.7528 -16.7528 -16.4707 -16.4707 -16.3786 -16.3786 -16.3623 -16.3623 -13.1980 -13.1980 -13.1960 -13.1960 -5.9702 -5.9702 -5.9505 -5.9505 -4.0707 -4.0707 -4.0268 -4.0268 -3.9026 -3.9026 -2.1723 -2.1723 -1.9971 -1.9971 -1.4630 -1.4630 -1.0468 -1.0468 -0.6191 -0.6191 -0.5272 -0.5272 -0.4767 -0.4767 0.5834 0.5834 0.8263 0.8263 0.9255 0.9255 1.7639 1.7639 1.8629 1.8629 1.9928 1.9928 2.0906 2.0906 2.0988 2.0988 2.1308 2.1308 2.1508 2.1508 2.3633 2.3633 2.3757 2.3757 2.4648 2.4648 2.5011 2.5011 2.5416 2.5416 2.7900 2.7900 3.2261 3.2261 8.5009 8.5009 11.3346 11.3346 11.8017 11.8017 11.8305 11.8305 12.5332 12.5332 13.0307 13.0307 13.3753 13.3753 13.5676 13.5676 k = 0.4571-0.2639 0.3733 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.0241 -17.0241 -16.9582 -16.9582 -16.9040 -16.9040 -16.8812 -16.8812 -16.8008 -16.8008 -16.7528 -16.7528 -16.4699 -16.4699 -16.3776 -16.3776 -16.3623 -16.3623 -13.1984 -13.1984 -13.1965 -13.1965 -5.9704 -5.9704 -5.9504 -5.9504 -4.0712 -4.0712 -4.0265 -4.0265 -3.9013 -3.9013 -2.1711 -2.1711 -1.9956 -1.9956 -1.4601 -1.4601 -1.0447 -1.0447 -0.6148 -0.6148 -0.5134 -0.5134 -0.4699 -0.4699 0.5821 0.5821 0.8203 0.8203 0.9250 0.9250 1.7488 1.7488 1.8555 1.8555 1.9909 1.9909 2.0857 2.0857 2.0976 2.0976 2.1310 2.1310 2.1460 2.1460 2.3616 2.3616 2.3747 2.3747 2.4626 2.4626 2.4988 2.4988 2.5415 2.5415 2.7811 2.7811 3.2261 3.2261 8.5135 8.5135 11.3620 11.3620 11.8103 11.8103 11.8143 11.8143 12.5110 12.5110 13.0862 13.0862 13.4457 13.4457 13.6063 13.6063 k = 0.4714-0.2722 0.3849 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.0189 -17.0189 -16.9601 -16.9601 -16.9062 -16.9062 -16.8812 -16.8812 -16.8033 -16.8033 -16.7528 -16.7528 -16.4693 -16.4693 -16.3768 -16.3768 -16.3623 -16.3623 -13.1986 -13.1986 -13.1969 -13.1969 -5.9706 -5.9706 -5.9503 -5.9503 -4.0715 -4.0715 -4.0262 -4.0262 -3.9003 -3.9003 -2.1704 -2.1704 -1.9945 -1.9945 -1.4581 -1.4581 -1.0432 -1.0432 -0.6117 -0.6117 -0.5032 -0.5032 -0.4650 -0.4650 0.5812 0.5812 0.8159 0.8159 0.9247 0.9247 1.7378 1.7378 1.8502 1.8502 1.9895 1.9895 2.0816 2.0816 2.0972 2.0972 2.1313 2.1313 2.1423 2.1423 2.3604 2.3604 2.3740 2.3740 2.4610 2.4610 2.4971 2.4971 2.5413 2.5413 2.7747 2.7747 3.2260 3.2260 8.5225 8.5225 11.3844 11.3844 11.7930 11.7930 11.8234 11.8234 12.4951 12.4951 13.1250 13.1250 13.4779 13.4779 13.6768 13.6768 k = 0.4857-0.2804 0.3966 ( 14832 PWs) bands (ev): -44.6796 -44.6796 -17.0153 -17.0153 -16.9615 -16.9615 -16.9075 -16.9075 -16.8812 -16.8812 -16.8047 -16.8047 -16.7528 -16.7528 -16.4690 -16.4690 -16.3763 -16.3763 -16.3623 -16.3623 -13.1988 -13.1988 -13.1972 -13.1972 -5.9707 -5.9707 -5.9502 -5.9502 -4.0718 -4.0718 -4.0261 -4.0261 -3.8997 -3.8997 -2.1699 -2.1699 -1.9938 -1.9938 -1.4569 -1.4569 -1.0423 -1.0423 -0.6098 -0.6098 -0.4970 -0.4970 -0.4622 -0.4622 0.5807 0.5807 0.8132 0.8132 0.9246 0.9246 1.7311 1.7311 1.8470 1.8470 1.9887 1.9887 2.0791 2.0791 2.0970 2.0970 2.1315 2.1315 2.1400 2.1400 2.3597 2.3597 2.3736 2.3736 2.4600 2.4600 2.4960 2.4960 2.5413 2.5413 2.7708 2.7708 3.2260 3.2260 8.5280 8.5280 11.3993 11.3993 11.7811 11.7811 11.8290 11.8290 12.4856 12.4856 13.1474 13.1474 13.4888 13.4888 13.7498 13.7498 k = 0.5000-0.2887 0.4082 ( 14844 PWs) bands (ev): -44.6796 -44.6796 -17.0141 -17.0141 -16.9620 -16.9620 -16.9080 -16.9080 -16.8812 -16.8812 -16.8052 -16.8052 -16.7528 -16.7528 -16.4689 -16.4689 -16.3761 -16.3761 -16.3623 -16.3623 -13.1988 -13.1988 -13.1973 -13.1973 -5.9707 -5.9707 -5.9502 -5.9502 -4.0718 -4.0718 -4.0261 -4.0261 -3.8995 -3.8995 -2.1697 -2.1697 -1.9936 -1.9936 -1.4565 -1.4565 -1.0420 -1.0420 -0.6092 -0.6092 -0.4948 -0.4948 -0.4612 -0.4612 0.5805 0.5805 0.8123 0.8123 0.9245 0.9245 1.7288 1.7288 1.8460 1.8460 1.9884 1.9884 2.0783 2.0783 2.0970 2.0970 2.1317 2.1317 2.1392 2.1392 2.3595 2.3595 2.3734 2.3734 2.4597 2.4597 2.4957 2.4957 2.5412 2.5412 2.7695 2.7695 3.2260 3.2260 8.5298 8.5298 11.4045 11.4045 11.7768 11.7768 11.8308 11.8308 12.4824 12.4824 13.1547 13.1547 13.4914 13.4914 13.7835 13.7835 k = 0.5000-0.2887 0.4082 ( 14844 PWs) bands (ev): -44.6796 -44.6796 -17.0141 -17.0141 -16.9620 -16.9620 -16.9080 -16.9080 -16.8812 -16.8812 -16.8052 -16.8052 -16.7528 -16.7528 -16.4689 -16.4689 -16.3761 -16.3761 -16.3623 -16.3623 -13.1988 -13.1988 -13.1973 -13.1973 -5.9707 -5.9707 -5.9502 -5.9502 -4.0718 -4.0718 -4.0261 -4.0261 -3.8995 -3.8995 -2.1697 -2.1697 -1.9936 -1.9936 -1.4565 -1.4565 -1.0420 -1.0420 -0.6092 -0.6092 -0.4948 -0.4948 -0.4612 -0.4612 0.5805 0.5805 0.8123 0.8123 0.9245 0.9245 1.7288 1.7288 1.8460 1.8460 1.9884 1.9884 2.0783 2.0783 2.0970 2.0970 2.1317 2.1317 2.1392 2.1392 2.3595 2.3595 2.3734 2.3734 2.4597 2.4597 2.4957 2.4957 2.5412 2.5412 2.7695 2.7695 3.2260 3.2260 8.5298 8.5298 11.4045 11.4045 11.7768 11.7768 11.8308 11.8308 12.4824 12.4824 13.1547 13.1547 13.4914 13.4914 13.7835 13.7835 k = 0.5000-0.2726 0.4196 ( 14836 PWs) bands (ev): -44.6796 -44.6796 -17.0150 -17.0150 -16.9615 -16.9615 -16.9079 -16.9079 -16.8810 -16.8810 -16.8052 -16.8052 -16.7525 -16.7525 -16.4690 -16.4690 -16.3762 -16.3762 -16.3625 -16.3625 -13.1988 -13.1988 -13.1973 -13.1973 -5.9707 -5.9707 -5.9502 -5.9502 -4.0718 -4.0718 -4.0261 -4.0261 -3.8996 -3.8996 -2.1693 -2.1693 -1.9939 -1.9939 -1.4564 -1.4564 -1.0412 -1.0412 -0.6099 -0.6099 -0.4950 -0.4950 -0.4617 -0.4617 0.5805 0.5805 0.8123 0.8123 0.9243 0.9243 1.7290 1.7290 1.8459 1.8459 1.9890 1.9890 2.0786 2.0786 2.0971 2.0971 2.1316 2.1316 2.1397 2.1397 2.3596 2.3596 2.3728 2.3728 2.4587 2.4587 2.4955 2.4955 2.5414 2.5414 2.7705 2.7705 3.2257 3.2257 8.5299 8.5299 11.4071 11.4071 11.7782 11.7782 11.8328 11.8328 12.4798 12.4798 13.1549 13.1549 13.4909 13.4909 13.7824 13.7824 k = 0.5000-0.2566 0.4309 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0176 -17.0176 -16.9599 -16.9599 -16.9076 -16.9076 -16.8804 -16.8804 -16.8052 -16.8052 -16.7516 -16.7516 -16.4693 -16.4693 -16.3762 -16.3762 -16.3629 -16.3629 -13.1988 -13.1988 -13.1973 -13.1973 -5.9706 -5.9706 -5.9503 -5.9503 -4.0716 -4.0716 -4.0262 -4.0262 -3.8996 -3.8996 -2.1682 -2.1682 -1.9948 -1.9948 -1.4563 -1.4563 -1.0390 -1.0390 -0.6119 -0.6119 -0.4953 -0.4953 -0.4631 -0.4631 0.5803 0.5803 0.8124 0.8124 0.9236 0.9236 1.7297 1.7297 1.8457 1.8457 1.9906 1.9906 2.0796 2.0796 2.0975 2.0975 2.1315 2.1315 2.1412 2.1412 2.3598 2.3598 2.3710 2.3710 2.4557 2.4557 2.4949 2.4949 2.5417 2.5417 2.7734 2.7734 3.2247 3.2247 8.5304 8.5304 11.4148 11.4148 11.7823 11.7823 11.8389 11.8389 12.4720 12.4720 13.1555 13.1555 13.4893 13.4893 13.7789 13.7789 k = 0.5000-0.2406 0.4423 ( 14824 PWs) bands (ev): -44.6796 -44.6796 -17.0214 -17.0214 -16.9577 -16.9577 -16.9070 -16.9070 -16.8793 -16.8793 -16.8051 -16.8051 -16.7502 -16.7502 -16.4699 -16.4699 -16.3764 -16.3764 -16.3636 -16.3636 -13.1988 -13.1988 -13.1973 -13.1973 -5.9704 -5.9704 -5.9504 -5.9504 -4.0712 -4.0712 -4.0265 -4.0265 -3.8996 -3.8996 -2.1664 -2.1664 -1.9963 -1.9963 -1.4560 -1.4560 -1.0352 -1.0352 -0.6152 -0.6152 -0.4959 -0.4959 -0.4655 -0.4655 0.5801 0.5801 0.8125 0.8125 0.9225 0.9225 1.7308 1.7308 1.8454 1.8454 1.9932 1.9932 2.0811 2.0811 2.0981 2.0981 2.1315 2.1315 2.1434 2.1434 2.3601 2.3601 2.3681 2.3681 2.4508 2.4508 2.4939 2.4939 2.5421 2.5421 2.7781 2.7781 3.2230 3.2230 8.5312 8.5312 11.4274 11.4274 11.7890 11.7890 11.8490 11.8490 12.4593 12.4593 13.1562 13.1562 13.4865 13.4865 13.7728 13.7728 k = 0.5000-0.2245 0.4536 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0261 -17.0261 -16.9553 -16.9553 -16.9064 -16.9064 -16.8778 -16.8778 -16.8051 -16.8051 -16.7482 -16.7482 -16.4707 -16.4707 -16.3766 -16.3766 -16.3645 -16.3645 -13.1988 -13.1988 -13.1973 -13.1973 -5.9702 -5.9702 -5.9505 -5.9505 -4.0707 -4.0707 -4.0268 -4.0268 -3.8996 -3.8996 -2.1639 -2.1639 -1.9983 -1.9983 -1.4557 -1.4557 -1.0300 -1.0300 -0.6200 -0.6200 -0.4966 -0.4966 -0.4685 -0.4685 0.5798 0.5798 0.8126 0.8126 0.9209 0.9209 1.7324 1.7324 1.8448 1.8448 1.9970 1.9970 2.0832 2.0832 2.0989 2.0989 2.1319 2.1319 2.1464 2.1464 2.3603 2.3603 2.3642 2.3642 2.4441 2.4441 2.4927 2.4927 2.5424 2.5424 2.7846 2.7846 3.2206 3.2206 8.5323 8.5323 11.4448 11.4448 11.7984 11.7984 11.8635 11.8635 12.4421 12.4421 13.1569 13.1569 13.4822 13.4822 13.7632 13.7632 k = 0.5000-0.2085 0.4649 ( 14824 PWs) bands (ev): -44.6796 -44.6796 -17.0313 -17.0313 -16.9529 -16.9529 -16.9057 -16.9057 -16.8759 -16.8759 -16.8050 -16.8050 -16.7457 -16.7457 -16.4717 -16.4717 -16.3769 -16.3769 -16.3656 -16.3656 -13.1988 -13.1988 -13.1973 -13.1973 -5.9700 -5.9700 -5.9507 -5.9507 -4.0701 -4.0701 -4.0272 -4.0272 -3.8997 -3.8997 -2.1607 -2.1607 -2.0009 -2.0009 -1.4553 -1.4553 -1.0233 -1.0233 -0.6263 -0.6263 -0.4976 -0.4976 -0.4721 -0.4721 0.5794 0.5794 0.8129 0.8129 0.9189 0.9189 1.7344 1.7344 1.8438 1.8438 2.0019 2.0019 2.0859 2.0859 2.0999 2.0999 2.1328 2.1328 2.1500 2.1500 2.3582 2.3582 2.3613 2.3613 2.4360 2.4360 2.4913 2.4913 2.5426 2.5426 2.7925 2.7925 3.2177 3.2177 8.5337 8.5337 11.4666 11.4666 11.8101 11.8101 11.8824 11.8824 12.4207 12.4207 13.1571 13.1571 13.4758 13.4758 13.7469 13.7469 k = 0.5000-0.1925 0.4763 ( 14826 PWs) bands (ev): -44.6796 -44.6796 -17.0367 -17.0367 -16.9507 -16.9507 -16.9050 -16.9050 -16.8737 -16.8737 -16.8049 -16.8049 -16.7426 -16.7426 -16.4730 -16.4730 -16.3773 -16.3773 -16.3668 -16.3668 -13.1987 -13.1987 -13.1974 -13.1974 -5.9696 -5.9696 -5.9509 -5.9509 -4.0694 -4.0694 -4.0276 -4.0276 -3.8997 -3.8997 -2.1568 -2.1568 -2.0041 -2.0041 -1.4549 -1.4549 -1.0152 -1.0152 -0.6341 -0.6341 -0.4987 -0.4987 -0.4760 -0.4760 0.5789 0.5789 0.8132 0.8132 0.9166 0.9166 1.7368 1.7368 1.8424 1.8424 2.0080 2.0080 2.0889 2.0889 2.1010 2.1010 2.1343 2.1343 2.1543 2.1543 2.3525 2.3525 2.3609 2.3609 2.4265 2.4265 2.4899 2.4899 2.5426 2.5426 2.8018 2.8018 3.2141 3.2141 8.5352 8.5352 11.4925 11.4925 11.8241 11.8241 11.9061 11.9061 12.3956 12.3956 13.1565 13.1565 13.4664 13.4664 13.7215 13.7215 k = 0.5000-0.1764 0.4876 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.0421 -17.0421 -16.9488 -16.9488 -16.9044 -16.9044 -16.8713 -16.8713 -16.8048 -16.8048 -16.7390 -16.7390 -16.4745 -16.4745 -16.3779 -16.3779 -16.3680 -16.3680 -13.1987 -13.1987 -13.1974 -13.1974 -5.9693 -5.9693 -5.9511 -5.9511 -4.0686 -4.0686 -4.0282 -4.0282 -3.8998 -3.8998 -2.1523 -2.1523 -2.0078 -2.0078 -1.4544 -1.4544 -1.0058 -1.0058 -0.6435 -0.6435 -0.5000 -0.5000 -0.4801 -0.4801 0.5784 0.5784 0.8136 0.8136 0.9140 0.9140 1.7396 1.7396 1.8406 1.8406 2.0150 2.0150 2.0922 2.0922 2.1023 2.1023 2.1367 2.1367 2.1591 2.1591 2.3456 2.3456 2.3602 2.3602 2.4159 2.4159 2.4887 2.4887 2.5421 2.5421 2.8121 2.8121 3.2100 3.2100 8.5369 8.5369 11.5220 11.5220 11.8401 11.8401 11.9348 11.9348 12.3674 12.3674 13.1547 13.1547 13.4525 13.4525 13.6911 13.6911 k = 0.5000-0.1604 0.4990 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.0474 -17.0474 -16.9471 -16.9471 -16.9039 -16.9039 -16.8688 -16.8688 -16.8047 -16.8047 -16.7350 -16.7350 -16.4762 -16.4762 -16.3787 -16.3787 -16.3691 -16.3691 -13.1986 -13.1986 -13.1974 -13.1974 -5.9689 -5.9689 -5.9514 -5.9514 -4.0678 -4.0678 -4.0288 -4.0288 -3.8998 -3.8998 -2.1473 -2.1473 -2.0121 -2.0121 -1.4538 -1.4538 -0.9951 -0.9951 -0.6544 -0.6544 -0.5014 -0.5014 -0.4841 -0.4841 0.5777 0.5777 0.8142 0.8142 0.9111 0.9111 1.7427 1.7427 1.8383 1.8383 2.0230 2.0230 2.0956 2.0956 2.1038 2.1038 2.1400 2.1400 2.1646 2.1646 2.3380 2.3380 2.3589 2.3589 2.4042 2.4042 2.4878 2.4878 2.5413 2.5413 2.8232 2.8232 3.2054 3.2054 8.5388 8.5388 11.5545 11.5545 11.8577 11.8577 11.9689 11.9689 12.3365 12.3365 13.1511 13.1511 13.4323 13.4323 13.6620 13.6620 k = 0.5000-0.1443 0.5103 ( 14826 PWs) bands (ev): -44.6796 -44.6796 -17.0524 -17.0524 -16.9458 -16.9458 -16.9034 -16.9034 -16.8663 -16.8663 -16.8046 -16.8046 -16.7306 -16.7306 -16.4781 -16.4781 -16.3797 -16.3797 -16.3700 -16.3700 -13.1986 -13.1986 -13.1975 -13.1975 -5.9685 -5.9685 -5.9517 -5.9517 -4.0669 -4.0669 -4.0294 -4.0294 -3.8999 -3.8999 -2.1417 -2.1417 -2.0168 -2.0168 -1.4532 -1.4532 -0.9832 -0.9832 -0.6667 -0.6667 -0.5029 -0.5029 -0.4879 -0.4879 0.5770 0.5770 0.8148 0.8148 0.9080 0.9080 1.7462 1.7462 1.8354 1.8354 2.0316 2.0316 2.0983 2.0983 2.1061 2.1061 2.1443 2.1443 2.1706 2.1706 2.3298 2.3298 2.3568 2.3568 2.3917 2.3917 2.4875 2.4875 2.5400 2.5400 2.8347 2.8347 3.2005 3.2005 8.5407 8.5407 11.5895 11.5895 11.8767 11.8767 12.0088 12.0088 12.3035 12.3035 13.1451 13.1451 13.4043 13.4043 13.6381 13.6381 k = 0.5000-0.1283 0.5217 ( 14846 PWs) bands (ev): -44.6796 -44.6796 -17.0570 -17.0570 -16.9446 -16.9446 -16.9031 -16.9031 -16.8640 -16.8640 -16.8046 -16.8046 -16.7260 -16.7260 -16.4802 -16.4802 -16.3808 -16.3808 -16.3707 -16.3707 -13.1985 -13.1985 -13.1975 -13.1975 -5.9680 -5.9680 -5.9520 -5.9520 -4.0659 -4.0659 -4.0301 -4.0301 -3.8999 -3.8999 -2.1357 -2.1357 -2.0221 -2.0221 -1.4526 -1.4526 -0.9701 -0.9701 -0.6805 -0.6805 -0.5044 -0.5044 -0.4914 -0.4914 0.5763 0.5763 0.8156 0.8156 0.9048 0.9048 1.7500 1.7500 1.8322 1.8322 2.0405 2.0405 2.0998 2.0998 2.1101 2.1101 2.1497 2.1497 2.1770 2.1770 2.3213 2.3213 2.3537 2.3537 2.3784 2.3784 2.4877 2.4877 2.5383 2.5383 2.8465 2.8465 3.1953 3.1953 8.5426 8.5426 11.6262 11.6262 11.8965 11.8965 12.0545 12.0545 12.2690 12.2690 13.1356 13.1356 13.3682 13.3682 13.6190 13.6190 k = 0.5000-0.1123 0.5330 ( 14858 PWs) bands (ev): -44.6796 -44.6796 -17.0613 -17.0613 -16.9437 -16.9437 -16.9028 -16.9028 -16.8618 -16.8618 -16.8045 -16.8045 -16.7214 -16.7214 -16.4823 -16.4823 -16.3821 -16.3821 -16.3713 -16.3713 -13.1985 -13.1985 -13.1976 -13.1976 -5.9676 -5.9676 -5.9523 -5.9523 -4.0649 -4.0649 -4.0308 -4.0308 -3.9000 -3.9000 -2.1292 -2.1292 -2.0277 -2.0277 -1.4521 -1.4521 -0.9560 -0.9560 -0.6956 -0.6956 -0.5059 -0.5059 -0.4945 -0.4945 0.5755 0.5755 0.8165 0.8165 0.9016 0.9016 1.7541 1.7541 1.8285 1.8285 2.0493 2.0493 2.1001 2.1001 2.1155 2.1155 2.1560 2.1560 2.1836 2.1836 2.3127 2.3127 2.3496 2.3496 2.3646 2.3646 2.4886 2.4886 2.5361 2.5361 2.8581 2.8581 3.1899 3.1899 8.5444 8.5444 11.6642 11.6642 11.9167 11.9167 12.1057 12.1057 12.2340 12.2340 13.1208 13.1208 13.3255 13.3255 13.5625 13.5625 k = 0.5000-0.0962 0.5443 ( 14880 PWs) bands (ev): -44.6796 -44.6796 -17.0651 -17.0651 -16.9429 -16.9429 -16.9026 -16.9026 -16.8599 -16.8599 -16.8044 -16.8044 -16.7168 -16.7168 -16.4845 -16.4845 -16.3834 -16.3834 -16.3717 -16.3717 -13.1984 -13.1984 -13.1976 -13.1976 -5.9671 -5.9671 -5.9526 -5.9526 -4.0640 -4.0640 -4.0315 -4.0315 -3.9000 -3.9000 -2.1223 -2.1223 -2.0338 -2.0338 -1.4515 -1.4515 -0.9410 -0.9410 -0.7116 -0.7116 -0.5074 -0.5074 -0.4971 -0.4971 0.5748 0.5748 0.8175 0.8175 0.8985 0.8985 1.7583 1.7583 1.8245 1.8245 2.0578 2.0578 2.0999 2.0999 2.1222 2.1222 2.1630 2.1630 2.1904 2.1904 2.3043 2.3043 2.3446 2.3446 2.3505 2.3505 2.4903 2.4903 2.5336 2.5336 2.8692 2.8692 3.1845 3.1845 8.5462 8.5462 11.7029 11.7029 11.9365 11.9365 12.1558 12.1558 12.2055 12.2055 13.0974 13.0974 13.2787 13.2787 13.4917 13.4917 k = 0.5000-0.0802 0.5557 ( 14868 PWs) bands (ev): -44.6796 -44.6796 -17.0684 -17.0684 -16.9423 -16.9423 -16.9024 -16.9024 -16.8582 -16.8582 -16.8043 -16.8043 -16.7125 -16.7125 -16.4866 -16.4866 -16.3845 -16.3845 -16.3720 -16.3720 -13.1984 -13.1984 -13.1977 -13.1977 -5.9667 -5.9667 -5.9529 -5.9529 -4.0631 -4.0631 -4.0322 -4.0322 -3.9001 -3.9001 -2.1152 -2.1152 -2.0403 -2.0403 -1.4510 -1.4510 -0.9252 -0.9252 -0.7285 -0.7285 -0.5088 -0.5088 -0.4993 -0.4993 0.5741 0.5741 0.8185 0.8185 0.8956 0.8956 1.7627 1.7627 1.8203 1.8203 2.0654 2.0654 2.0992 2.0992 2.1299 2.1299 2.1703 2.1703 2.1971 2.1971 2.2964 2.2964 2.3360 2.3360 2.3392 2.3392 2.4926 2.4926 2.5307 2.5307 2.8795 2.8795 3.1794 3.1794 8.5478 8.5478 11.7419 11.7419 11.9552 11.9552 12.1488 12.1488 12.2400 12.2400 13.0599 13.0599 13.2326 13.2326 13.4321 13.4321 k = 0.5000-0.0642 0.5670 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0711 -17.0711 -16.9419 -16.9419 -16.9023 -16.9023 -16.8569 -16.8569 -16.8043 -16.8043 -16.7086 -16.7086 -16.4885 -16.4885 -16.3856 -16.3856 -16.3723 -16.3723 -13.1983 -13.1983 -13.1978 -13.1978 -5.9664 -5.9664 -5.9532 -5.9532 -4.0623 -4.0623 -4.0328 -4.0328 -3.9001 -3.9001 -2.1078 -2.1078 -2.0471 -2.0471 -1.4506 -1.4506 -0.9089 -0.9089 -0.7458 -0.7458 -0.5100 -0.5100 -0.5011 -0.5011 0.5735 0.5735 0.8195 0.8195 0.8929 0.8929 1.7671 1.7671 1.8160 1.8160 2.0720 2.0720 2.0982 2.0982 2.1385 2.1385 2.1769 2.1769 2.2039 2.2039 2.2894 2.2894 2.3225 2.3225 2.3327 2.3327 2.4954 2.4954 2.5274 2.5274 2.8886 2.8886 3.1746 3.1746 8.5491 8.5491 11.7809 11.7809 11.9722 11.9722 12.1134 12.1134 12.3087 12.3087 13.0031 13.0031 13.1940 13.1940 13.3870 13.3870 k = 0.5000-0.0481 0.5784 ( 14850 PWs) bands (ev): -44.6796 -44.6796 -17.0732 -17.0732 -16.9415 -16.9415 -16.9022 -16.9022 -16.8558 -16.8558 -16.8043 -16.8043 -16.7053 -16.7053 -16.4902 -16.4902 -16.3864 -16.3864 -16.3724 -16.3724 -13.1982 -13.1982 -13.1978 -13.1978 -5.9661 -5.9661 -5.9534 -5.9534 -4.0616 -4.0616 -4.0333 -4.0333 -3.9002 -3.9002 -2.1003 -2.1003 -2.0541 -2.0541 -1.4503 -1.4503 -0.8925 -0.8925 -0.7632 -0.7632 -0.5110 -0.5110 -0.5024 -0.5024 0.5729 0.5729 0.8203 0.8203 0.8907 0.8907 1.7714 1.7714 1.8118 1.8118 2.0776 2.0776 2.0969 2.0969 2.1477 2.1477 2.1814 2.1814 2.2114 2.2114 2.2830 2.2830 2.3106 2.3106 2.3262 2.3262 2.4986 2.4986 2.5240 2.5240 2.8961 2.8961 3.1706 3.1706 8.5502 8.5502 11.8193 11.8193 11.9865 11.9865 12.0761 12.0761 12.3849 12.3849 12.9288 12.9288 13.1659 13.1659 13.3556 13.3556 k = 0.5000-0.0321 0.5897 ( 14850 PWs) bands (ev): -44.6796 -44.6796 -17.0748 -17.0748 -16.9413 -16.9413 -16.9022 -16.9022 -16.8550 -16.8550 -16.8042 -16.8042 -16.7029 -16.7029 -16.4915 -16.4915 -16.3871 -16.3871 -16.3725 -16.3725 -13.1982 -13.1982 -13.1979 -13.1979 -5.9658 -5.9658 -5.9536 -5.9536 -4.0611 -4.0611 -4.0337 -4.0337 -3.9002 -3.9002 -2.0927 -2.0927 -2.0614 -2.0614 -1.4500 -1.4500 -0.8767 -0.8767 -0.7796 -0.7796 -0.5117 -0.5117 -0.5034 -0.5034 0.5725 0.5725 0.8211 0.8211 0.8890 0.8890 1.7753 1.7753 1.8080 1.8080 2.0820 2.0820 2.0954 2.0954 2.1570 2.1570 2.1825 2.1825 2.2198 2.2198 2.2761 2.2761 2.3022 2.3022 2.3202 2.3202 2.5021 2.5021 2.5204 2.5204 2.9018 2.9018 3.1675 3.1675 8.5510 8.5510 11.8562 11.8562 11.9973 11.9973 12.0396 12.0396 12.4657 12.4657 12.8446 12.8446 13.1470 13.1470 13.3354 13.3354 k = 0.5000-0.0160 0.6010 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.0757 -17.0757 -16.9411 -16.9411 -16.9021 -16.9021 -16.8546 -16.8546 -16.8042 -16.8042 -16.7013 -16.7013 -16.4923 -16.4923 -16.3875 -16.3875 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9657 -5.9657 -5.9537 -5.9537 -4.0608 -4.0608 -4.0339 -4.0339 -3.9002 -3.9002 -2.0853 -2.0853 -2.0686 -2.0686 -1.4498 -1.4498 -0.8636 -0.8636 -0.7932 -0.7932 -0.5122 -0.5122 -0.5039 -0.5039 0.5723 0.5723 0.8215 0.8215 0.8879 0.8879 1.7782 1.7782 1.8051 1.8051 2.0853 2.0853 2.0938 2.0938 2.1657 2.1657 2.1799 2.1799 2.2282 2.2282 2.2684 2.2684 2.2986 2.2986 2.3154 2.3154 2.5053 2.5053 2.5172 2.5172 2.9054 2.9054 3.1655 3.1655 8.5515 8.5515 11.8886 11.8886 12.0033 12.0033 12.0082 12.0082 12.5466 12.5466 12.7599 12.7599 13.1358 13.1358 13.3243 13.3243 k = 0.5000-0.0000 0.6124 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9411 -16.9411 -16.9021 -16.9021 -16.8544 -16.8544 -16.8042 -16.8042 -16.7008 -16.7008 -16.4926 -16.4926 -16.3876 -16.3876 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0607 -4.0607 -4.0340 -4.0340 -3.9002 -3.9002 -2.0801 -2.0801 -2.0737 -2.0737 -1.4498 -1.4498 -0.8578 -0.8578 -0.7992 -0.7992 -0.5123 -0.5123 -0.5041 -0.5041 0.5722 0.5722 0.8217 0.8217 0.8875 0.8875 1.7793 1.7793 1.8040 1.8040 2.0867 2.0867 2.0929 2.0929 2.1717 2.1717 2.1760 2.1760 2.2324 2.2324 2.2643 2.2643 2.2979 2.2979 2.3135 2.3135 2.5069 2.5069 2.5155 2.5155 2.9066 2.9066 3.1649 3.1649 8.5517 8.5517 11.9044 11.9044 11.9912 11.9912 12.0068 12.0068 12.5982 12.5982 12.7067 12.7067 13.1321 13.1321 13.3207 13.3207 k = 0.5000-0.0000 0.6124 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9411 -16.9411 -16.9021 -16.9021 -16.8544 -16.8544 -16.8042 -16.8042 -16.7008 -16.7008 -16.4926 -16.4926 -16.3876 -16.3876 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0607 -4.0607 -4.0340 -4.0340 -3.9002 -3.9002 -2.0801 -2.0801 -2.0737 -2.0737 -1.4498 -1.4498 -0.8578 -0.8578 -0.7992 -0.7992 -0.5123 -0.5123 -0.5041 -0.5041 0.5722 0.5722 0.8217 0.8217 0.8875 0.8875 1.7793 1.7793 1.8040 1.8040 2.0867 2.0867 2.0929 2.0929 2.1717 2.1717 2.1760 2.1760 2.2324 2.2324 2.2643 2.2643 2.2979 2.2979 2.3135 2.3135 2.5069 2.5069 2.5155 2.5155 2.9066 2.9066 3.1649 3.1649 8.5517 8.5517 11.9044 11.9044 11.9912 11.9912 12.0068 12.0068 12.5982 12.5982 12.7067 12.7067 13.1321 13.1321 13.3207 13.3207 k = 0.4904 0.0167 0.6124 ( 14833 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9412 -16.9412 -16.9022 -16.9022 -16.8541 -16.8541 -16.8041 -16.8041 -16.7010 -16.7010 -16.4925 -16.4925 -16.3876 -16.3876 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0607 -4.0607 -4.0340 -4.0340 -3.9003 -3.9003 -2.0831 -2.0831 -2.0708 -2.0708 -1.4499 -1.4499 -0.8606 -0.8606 -0.7964 -0.7964 -0.5126 -0.5126 -0.5045 -0.5045 0.5719 0.5719 0.8214 0.8214 0.8884 0.8884 1.7790 1.7790 1.8048 1.8048 2.0860 2.0860 2.0935 2.0935 2.1682 2.1682 2.1782 2.1782 2.2304 2.2304 2.2665 2.2665 2.2984 2.2984 2.3148 2.3148 2.5060 2.5060 2.5164 2.5164 2.9064 2.9064 3.1652 3.1652 8.5513 8.5513 11.8960 11.8960 11.9898 11.9898 12.0149 12.0149 12.5692 12.5692 12.7369 12.7369 13.1326 13.1326 13.3173 13.3173 k = 0.4808 0.0333 0.6124 ( 14829 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9417 -16.9417 -16.9026 -16.9026 -16.8531 -16.8531 -16.8039 -16.8039 -16.7017 -16.7017 -16.4922 -16.4922 -16.3875 -16.3875 -16.3727 -16.3727 -13.1981 -13.1981 -13.1979 -13.1979 -5.9657 -5.9657 -5.9537 -5.9537 -4.0608 -4.0608 -4.0339 -4.0339 -3.9004 -3.9004 -2.0879 -2.0879 -2.0663 -2.0663 -1.4501 -1.4501 -0.8676 -0.8676 -0.7893 -0.7893 -0.5132 -0.5132 -0.5054 -0.5054 0.5712 0.5712 0.8206 0.8206 0.8908 0.8908 1.7780 1.7780 1.8073 1.8073 2.0840 2.0840 2.0950 2.0950 2.1629 2.1629 2.1800 2.1800 2.2256 2.2256 2.2708 2.2708 2.3008 2.3008 2.3185 2.3185 2.5040 2.5040 2.5186 2.5186 2.9060 2.9060 3.1660 3.1660 8.5503 8.5503 11.8788 11.8788 11.9832 11.9832 12.0338 12.0338 12.5166 12.5166 12.7929 12.7929 13.1336 13.1336 13.3098 13.3098 k = 0.4712 0.0500 0.6124 ( 14839 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9423 -16.9423 -16.9031 -16.9031 -16.8515 -16.8515 -16.8035 -16.8035 -16.7028 -16.7028 -16.4918 -16.4918 -16.3874 -16.3874 -16.3729 -16.3729 -13.1980 -13.1980 -13.1978 -13.1978 -5.9657 -5.9657 -5.9537 -5.9537 -4.0609 -4.0609 -4.0338 -4.0338 -3.9005 -3.9005 -2.0928 -2.0928 -2.0619 -2.0619 -1.4505 -1.4505 -0.8765 -0.8765 -0.7802 -0.7802 -0.5144 -0.5144 -0.5067 -0.5067 0.5699 0.5699 0.8196 0.8196 0.8943 0.8943 1.7766 1.7766 1.8111 1.8111 2.0812 2.0812 2.0970 2.0970 2.1572 2.1572 2.1803 2.1803 2.2199 2.2199 2.2743 2.2743 2.3063 2.3063 2.3237 2.3237 2.5015 2.5015 2.5213 2.5213 2.9052 2.9052 3.1673 3.1673 8.5487 8.5487 11.8597 11.8597 11.9747 11.9747 12.0539 12.0539 12.4613 12.4613 12.8518 12.8518 13.1354 13.1354 13.3030 13.3030 k = 0.4615 0.0666 0.6124 ( 14851 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9432 -16.9432 -16.9037 -16.9037 -16.8494 -16.8494 -16.8030 -16.8030 -16.7043 -16.7043 -16.4913 -16.4913 -16.3873 -16.3873 -16.3732 -16.3732 -13.1980 -13.1980 -13.1977 -13.1977 -5.9658 -5.9658 -5.9536 -5.9536 -4.0611 -4.0611 -4.0336 -4.0336 -3.9007 -3.9007 -2.0976 -2.0976 -2.0577 -2.0577 -1.4509 -1.4509 -0.8860 -0.8860 -0.7703 -0.7703 -0.5162 -0.5162 -0.5081 -0.5081 0.5683 0.5683 0.8186 0.8186 0.8985 0.8985 1.7750 1.7750 1.8156 1.8156 2.0778 2.0778 2.0993 2.0993 2.1518 2.1518 2.1793 2.1793 2.2143 2.2143 2.2760 2.2760 2.3144 2.3144 2.3300 2.3300 2.4989 2.4989 2.5241 2.5241 2.9042 2.9042 3.1689 3.1689 8.5468 8.5468 11.8413 11.8413 11.9654 11.9654 12.0725 12.0725 12.4079 12.4079 12.9048 12.9048 13.1408 13.1408 13.3012 13.3012 k = 0.4519 0.0833 0.6124 ( 14865 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9442 -16.9442 -16.9044 -16.9044 -16.8470 -16.8470 -16.8024 -16.8024 -16.7061 -16.7061 -16.4907 -16.4907 -16.3871 -16.3871 -16.3735 -16.3735 -13.1979 -13.1979 -13.1976 -13.1976 -5.9659 -5.9659 -5.9536 -5.9536 -4.0613 -4.0613 -4.0334 -4.0334 -3.9009 -3.9009 -2.1020 -2.1020 -2.0539 -2.0539 -1.4514 -1.4514 -0.8953 -0.8953 -0.7603 -0.7603 -0.5188 -0.5188 -0.5093 -0.5093 0.5663 0.5663 0.8178 0.8178 0.9030 0.9030 1.7733 1.7733 1.8207 1.8207 2.0738 2.0738 2.1018 2.1018 2.1467 2.1467 2.1772 2.1772 2.2091 2.2091 2.2768 2.2768 2.3239 2.3239 2.3368 2.3368 2.4962 2.4962 2.5270 2.5270 2.9030 2.9030 3.1709 3.1709 8.5446 8.5446 11.8243 11.8243 11.9559 11.9559 12.0888 12.0888 12.3580 12.3580 12.9434 12.9434 13.1557 13.1557 13.3070 13.3070 k = 0.4423 0.0999 0.6124 ( 14867 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9453 -16.9453 -16.9052 -16.9052 -16.8445 -16.8445 -16.8017 -16.8017 -16.7080 -16.7080 -16.4901 -16.4901 -16.3868 -16.3868 -16.3739 -16.3739 -13.1979 -13.1979 -13.1975 -13.1975 -5.9659 -5.9659 -5.9535 -5.9535 -4.0615 -4.0615 -4.0331 -4.0331 -3.9011 -3.9011 -2.1061 -2.1061 -2.0504 -2.0504 -1.4520 -1.4520 -0.9041 -0.9041 -0.7507 -0.7507 -0.5219 -0.5219 -0.5102 -0.5102 0.5642 0.5642 0.8173 0.8173 0.9076 0.9076 1.7717 1.7717 1.8258 1.8258 2.0694 2.0694 2.1043 2.1043 2.1422 2.1422 2.1741 2.1741 2.2045 2.2045 2.2772 2.2772 2.3336 2.3336 2.3438 2.3438 2.4935 2.4935 2.5299 2.5299 2.9016 2.9016 3.1730 3.1730 8.5424 8.5424 11.8092 11.8092 11.9465 11.9465 12.1028 12.1028 12.3125 12.3125 12.9616 12.9616 13.1838 13.1838 13.3219 13.3219 k = 0.4327 0.1166 0.6124 ( 14863 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9464 -16.9464 -16.9058 -16.9058 -16.8421 -16.8421 -16.8009 -16.8009 -16.7101 -16.7101 -16.4894 -16.4894 -16.3865 -16.3865 -16.3744 -16.3744 -13.1978 -13.1978 -13.1974 -13.1974 -5.9660 -5.9660 -5.9534 -5.9534 -4.0617 -4.0617 -4.0329 -4.0329 -3.9013 -3.9013 -2.1098 -2.1098 -2.0474 -2.0474 -1.4525 -1.4525 -0.9120 -0.9120 -0.7416 -0.7416 -0.5255 -0.5255 -0.5110 -0.5110 0.5620 0.5620 0.8169 0.8169 0.9120 0.9120 1.7703 1.7703 1.8310 1.8310 2.0649 2.0649 2.1070 2.1070 2.1384 2.1384 2.1705 2.1705 2.2007 2.2007 2.2775 2.2775 2.3427 2.3427 2.3508 2.3508 2.4908 2.4908 2.5327 2.5327 2.9002 2.9002 3.1751 3.1751 8.5402 8.5402 11.7961 11.7961 11.9376 11.9376 12.1146 12.1146 12.2719 12.2719 12.9632 12.9632 13.2181 13.2181 13.3486 13.3486 k = 0.4231 0.1332 0.6124 ( 14858 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9474 -16.9474 -16.9064 -16.9064 -16.8398 -16.8398 -16.8000 -16.8000 -16.7122 -16.7122 -16.4887 -16.4887 -16.3862 -16.3862 -16.3748 -16.3748 -13.1977 -13.1977 -13.1974 -13.1974 -5.9661 -5.9661 -5.9533 -5.9533 -4.0619 -4.0619 -4.0327 -4.0327 -3.9015 -3.9015 -2.1131 -2.1131 -2.0448 -2.0448 -1.4529 -1.4529 -0.9189 -0.9189 -0.7334 -0.7334 -0.5291 -0.5291 -0.5115 -0.5115 0.5599 0.5599 0.8168 0.8168 0.9159 0.9159 1.7691 1.7691 1.8358 1.8358 2.0603 2.0603 2.1096 2.1096 2.1354 2.1354 2.1665 2.1665 2.1975 2.1975 2.2777 2.2777 2.3508 2.3508 2.3573 2.3573 2.4883 2.4883 2.5352 2.5352 2.8988 2.8988 3.1772 3.1772 8.5382 8.5382 11.7850 11.7850 11.9295 11.9295 12.1244 12.1244 12.2368 12.2368 12.9560 12.9560 13.2477 13.2477 13.3886 13.3886 k = 0.4135 0.1499 0.6124 ( 14852 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9483 -16.9483 -16.9069 -16.9069 -16.8378 -16.8378 -16.7992 -16.7992 -16.7142 -16.7142 -16.4882 -16.4882 -16.3859 -16.3859 -16.3753 -16.3753 -13.1977 -13.1977 -13.1973 -13.1973 -5.9662 -5.9662 -5.9532 -5.9532 -4.0621 -4.0621 -4.0325 -4.0325 -3.9017 -3.9017 -2.1158 -2.1158 -2.0426 -2.0426 -1.4533 -1.4533 -0.9246 -0.9246 -0.7263 -0.7263 -0.5325 -0.5325 -0.5120 -0.5120 0.5580 0.5580 0.8169 0.8169 0.9194 0.9194 1.7680 1.7680 1.8401 1.8401 2.0561 2.0561 2.1121 2.1121 2.1331 2.1331 2.1626 2.1626 2.1950 2.1950 2.2780 2.2780 2.3575 2.3575 2.3633 2.3633 2.4860 2.4860 2.5375 2.5375 2.8975 2.8975 3.1790 3.1790 8.5364 8.5364 11.7760 11.7760 11.9225 11.9225 12.1323 12.1323 12.2074 12.2074 12.9458 12.9458 13.2687 13.2687 13.4378 13.4378 k = 0.4038 0.1665 0.6124 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9491 -16.9491 -16.9073 -16.9073 -16.8361 -16.8361 -16.7983 -16.7983 -16.7159 -16.7159 -16.4877 -16.4877 -16.3855 -16.3855 -16.3757 -16.3757 -13.1976 -13.1976 -13.1972 -13.1972 -5.9662 -5.9662 -5.9532 -5.9532 -4.0623 -4.0623 -4.0323 -4.0323 -3.9018 -3.9018 -2.1180 -2.1180 -2.0409 -2.0409 -1.4537 -1.4537 -0.9292 -0.9292 -0.7204 -0.7204 -0.5355 -0.5355 -0.5123 -0.5123 0.5564 0.5564 0.8170 0.8170 0.9221 0.9221 1.7672 1.7672 1.8438 1.8438 2.0524 2.0524 2.1143 2.1143 2.1316 2.1316 2.1589 2.1589 2.1931 2.1931 2.2782 2.2782 2.3628 2.3628 2.3683 2.3683 2.4841 2.4841 2.5393 2.5393 2.8964 2.8964 3.1805 3.1805 8.5349 8.5349 11.7691 11.7691 11.9168 11.9168 12.1385 12.1385 12.1841 12.1841 12.9358 12.9358 13.2831 13.2831 13.4890 13.4890 k = 0.3942 0.1832 0.6124 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9497 -16.9497 -16.9076 -16.9076 -16.8349 -16.8349 -16.7977 -16.7977 -16.7173 -16.7173 -16.4873 -16.4873 -16.3853 -16.3853 -16.3761 -16.3761 -13.1976 -13.1976 -13.1972 -13.1972 -5.9663 -5.9663 -5.9531 -5.9531 -4.0624 -4.0624 -4.0322 -4.0322 -3.9019 -3.9019 -2.1195 -2.1195 -2.0397 -2.0397 -1.4539 -1.4539 -0.9325 -0.9325 -0.7161 -0.7161 -0.5379 -0.5379 -0.5125 -0.5125 0.5552 0.5552 0.8171 0.8171 0.9242 0.9242 1.7666 1.7666 1.8465 1.8465 2.0495 2.0495 2.1160 2.1160 2.1308 2.1308 2.1558 2.1558 2.1918 2.1918 2.2784 2.2784 2.3666 2.3666 2.3721 2.3721 2.4825 2.4825 2.5407 2.5407 2.8956 2.8956 3.1817 3.1817 8.5338 8.5338 11.7643 11.7643 11.9126 11.9126 12.1430 12.1430 12.1671 12.1671 12.9278 12.9278 13.2926 13.2926 13.5349 13.5349 k = 0.3846 0.1999 0.6124 ( 14870 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9500 -16.9500 -16.9077 -16.9077 -16.8342 -16.8342 -16.7972 -16.7972 -16.7182 -16.7182 -16.4871 -16.4871 -16.3851 -16.3851 -16.3763 -16.3763 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1205 -2.1205 -2.0390 -2.0390 -1.4541 -1.4541 -0.9345 -0.9345 -0.7134 -0.7134 -0.5394 -0.5394 -0.5127 -0.5127 0.5544 0.5544 0.8173 0.8173 0.9254 0.9254 1.7662 1.7662 1.8482 1.8482 2.0477 2.0477 2.1170 2.1170 2.1305 2.1305 2.1537 2.1537 2.1910 2.1910 2.2785 2.2785 2.3689 2.3689 2.3745 2.3745 2.4816 2.4816 2.5416 2.5416 2.8950 2.8950 3.1824 3.1824 8.5331 8.5331 11.7614 11.7614 11.9101 11.9101 12.1463 12.1463 12.1562 12.1562 12.9226 12.9226 13.2980 13.2980 13.5683 13.5683 k = 0.3750 0.2165 0.6124 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0758 -17.0758 -16.9501 -16.9501 -16.9078 -16.9078 -16.8340 -16.8340 -16.7971 -16.7971 -16.7185 -16.7185 -16.4870 -16.4870 -16.3851 -16.3851 -16.3764 -16.3764 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1208 -2.1208 -2.0387 -2.0387 -1.4541 -1.4541 -0.9352 -0.9352 -0.7125 -0.7125 -0.5399 -0.5399 -0.5127 -0.5127 0.5542 0.5542 0.8173 0.8173 0.9259 0.9259 1.7661 1.7661 1.8488 1.8488 2.0471 2.0471 2.1174 2.1174 2.1305 2.1305 2.1529 2.1529 2.1908 2.1908 2.2786 2.2786 2.3697 2.3697 2.3754 2.3754 2.4812 2.4812 2.5419 2.5419 2.8949 2.8949 3.1826 3.1826 8.5329 8.5329 11.7604 11.7604 11.9092 11.9092 12.1486 12.1486 12.1514 12.1514 12.9209 12.9209 13.2998 13.2998 13.5809 13.5809 k = 0.3750 0.2165 0.6124 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0758 -17.0758 -16.9501 -16.9501 -16.9078 -16.9078 -16.8340 -16.8340 -16.7971 -16.7971 -16.7185 -16.7185 -16.4870 -16.4870 -16.3851 -16.3851 -16.3764 -16.3764 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1208 -2.1208 -2.0387 -2.0387 -1.4541 -1.4541 -0.9352 -0.9352 -0.7125 -0.7125 -0.5399 -0.5399 -0.5127 -0.5127 0.5542 0.5542 0.8173 0.8173 0.9259 0.9259 1.7661 1.7661 1.8488 1.8488 2.0471 2.0471 2.1174 2.1174 2.1305 2.1305 2.1529 2.1529 2.1908 2.1908 2.2786 2.2786 2.3697 2.3697 2.3754 2.3754 2.4812 2.4812 2.5419 2.5419 2.8949 2.8949 3.1826 3.1826 8.5329 8.5329 11.7604 11.7604 11.9092 11.9092 12.1486 12.1486 12.1514 12.1514 12.9209 12.9209 13.2998 13.2998 13.5809 13.5809 k = 0.3651 0.2108 0.5963 ( 14845 PWs) bands (ev): -44.6796 -44.6796 -17.0810 -17.0810 -16.9510 -16.9510 -16.9080 -16.9080 -16.8300 -16.8300 -16.7934 -16.7934 -16.7145 -16.7145 -16.4898 -16.4898 -16.3875 -16.3875 -16.3767 -16.3767 -13.1972 -13.1972 -13.1970 -13.1970 -5.9657 -5.9657 -5.9535 -5.9535 -4.0613 -4.0613 -4.0328 -4.0328 -3.9027 -3.9027 -2.1146 -2.1146 -2.0456 -2.0456 -1.4548 -1.4548 -0.9209 -0.9209 -0.7281 -0.7281 -0.5528 -0.5528 -0.5157 -0.5157 0.5485 0.5485 0.8177 0.8177 0.9315 0.9315 1.7725 1.7725 1.8516 1.8516 2.0525 2.0525 2.1218 2.1218 2.1358 2.1358 2.1578 2.1578 2.1945 2.1945 2.2716 2.2716 2.3625 2.3625 2.3777 2.3777 2.4814 2.4814 2.5412 2.5412 2.9109 2.9109 3.1775 3.1775 8.5292 8.5292 11.8015 11.8015 11.9101 11.9101 12.1167 12.1167 12.2025 12.2025 12.8716 12.8716 13.2529 13.2529 13.5519 13.5519 k = 0.3553 0.2051 0.5801 ( 14857 PWs) bands (ev): -44.6796 -44.6796 -17.0859 -17.0859 -16.9519 -16.9519 -16.9081 -16.9081 -16.8271 -16.8271 -16.7887 -16.7887 -16.7105 -16.7105 -16.4927 -16.4927 -16.3901 -16.3901 -16.3770 -16.3770 -13.1969 -13.1969 -13.1968 -13.1968 -5.9651 -5.9651 -5.9539 -5.9539 -4.0602 -4.0602 -4.0336 -4.0336 -3.9035 -3.9035 -2.1084 -2.1084 -2.0528 -2.0528 -1.4557 -1.4557 -0.9065 -0.9065 -0.7445 -0.7445 -0.5668 -0.5668 -0.5190 -0.5190 0.5426 0.5426 0.8182 0.8182 0.9382 0.9382 1.7795 1.7795 1.8554 1.8554 2.0575 2.0575 2.1261 2.1261 2.1404 2.1404 2.1612 2.1612 2.1990 2.1990 2.2685 2.2685 2.3551 2.3551 2.3810 2.3810 2.4820 2.4820 2.5404 2.5404 2.9272 2.9272 3.1724 3.1724 8.5239 8.5239 11.8274 11.8274 11.9139 11.9139 12.0917 12.0917 12.2577 12.2577 12.8194 12.8194 13.2122 13.2122 13.4870 13.4870 k = 0.3454 0.1994 0.5640 ( 14845 PWs) bands (ev): -44.6796 -44.6796 -17.0905 -17.0905 -16.9530 -16.9530 -16.9081 -16.9081 -16.8253 -16.8253 -16.7832 -16.7832 -16.7067 -16.7067 -16.4956 -16.4956 -16.3926 -16.3926 -16.3771 -16.3771 -13.1967 -13.1967 -13.1963 -13.1963 -5.9645 -5.9645 -5.9543 -5.9543 -4.0591 -4.0591 -4.0343 -4.0343 -3.9045 -3.9045 -2.1023 -2.1023 -2.0603 -2.0603 -1.4571 -1.4571 -0.8923 -0.8923 -0.7614 -0.7614 -0.5818 -0.5818 -0.5225 -0.5225 0.5366 0.5366 0.8189 0.8189 0.9460 0.9460 1.7872 1.7872 1.8603 1.8603 2.0621 2.0621 2.1297 2.1297 2.1424 2.1424 2.1635 2.1635 2.2062 2.2062 2.2691 2.2691 2.3480 2.3480 2.3850 2.3850 2.4831 2.4831 2.5398 2.5398 2.9435 2.9435 3.1676 3.1676 8.5170 8.5170 11.8197 11.8197 11.9379 11.9379 12.0740 12.0740 12.3164 12.3164 12.7648 12.7648 13.1786 13.1786 13.4048 13.4048 k = 0.3355 0.1937 0.5479 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0949 -17.0949 -16.9540 -16.9540 -16.9080 -16.9080 -16.8242 -16.8242 -16.7772 -16.7772 -16.7031 -16.7031 -16.4986 -16.4986 -16.3951 -16.3951 -16.3772 -16.3772 -13.1964 -13.1964 -13.1957 -13.1957 -5.9639 -5.9639 -5.9548 -5.9548 -4.0580 -4.0580 -4.0349 -4.0349 -3.9057 -3.9057 -2.0964 -2.0964 -2.0680 -2.0680 -1.4589 -1.4589 -0.8786 -0.8786 -0.7787 -0.7787 -0.5978 -0.5978 -0.5263 -0.5263 0.5308 0.5308 0.8198 0.8198 0.9546 0.9546 1.7956 1.7956 1.8665 1.8665 2.0663 2.0663 2.1305 2.1305 2.1414 2.1414 2.1678 2.1678 2.2164 2.2164 2.2725 2.2725 2.3413 2.3413 2.3896 2.3896 2.4846 2.4846 2.5392 2.5392 2.9598 2.9598 3.1630 3.1630 8.5082 8.5082 11.7872 11.7872 11.9748 11.9748 12.0609 12.0609 12.3786 12.3786 12.7081 12.7081 13.1525 13.1525 13.3145 13.3145 k = 0.3257 0.1880 0.5318 ( 14845 PWs) bands (ev): -44.6796 -44.6796 -17.0989 -17.0989 -16.9551 -16.9551 -16.9078 -16.9078 -16.8238 -16.8238 -16.7708 -16.7708 -16.6998 -16.6998 -16.5016 -16.5016 -16.3975 -16.3975 -16.3772 -16.3772 -13.1961 -13.1961 -13.1951 -13.1951 -5.9633 -5.9633 -5.9552 -5.9552 -4.0570 -4.0570 -4.0356 -4.0356 -3.9070 -3.9070 -2.0908 -2.0908 -2.0760 -2.0760 -1.4612 -1.4612 -0.8657 -0.8657 -0.7962 -0.7962 -0.6149 -0.6149 -0.5304 -0.5304 0.5253 0.5253 0.8212 0.8212 0.9638 0.9638 1.8048 1.8048 1.8740 1.8740 2.0701 2.0701 2.1245 2.1245 2.1430 2.1430 2.1745 2.1745 2.2287 2.2287 2.2775 2.2775 2.3352 2.3352 2.3947 2.3947 2.4865 2.4865 2.5387 2.5387 2.9759 2.9759 3.1587 3.1587 8.4972 8.4972 11.7438 11.7438 12.0116 12.0116 12.0501 12.0501 12.4440 12.4440 12.6498 12.6498 13.1339 13.1339 13.2198 13.2198 k = 0.3158 0.1823 0.5157 ( 14833 PWs) bands (ev): -44.6796 -44.6796 -17.1027 -17.1027 -16.9561 -16.9561 -16.9076 -16.9076 -16.8238 -16.8238 -16.7645 -16.7645 -16.6967 -16.6967 -16.5045 -16.5045 -16.3997 -16.3997 -16.3772 -16.3772 -13.1958 -13.1958 -13.1944 -13.1944 -5.9628 -5.9628 -5.9556 -5.9556 -4.0562 -4.0562 -4.0361 -4.0361 -3.9085 -3.9085 -2.0855 -2.0855 -2.0842 -2.0842 -1.4641 -1.4641 -0.8544 -0.8544 -0.8134 -0.8134 -0.6330 -0.6330 -0.5348 -0.5348 0.5205 0.5205 0.8231 0.8231 0.9734 0.9734 1.8149 1.8149 1.8829 1.8829 2.0735 2.0735 2.1146 2.1146 2.1467 2.1467 2.1827 2.1827 2.2425 2.2425 2.2832 2.2832 2.3301 2.3301 2.4004 2.4004 2.4888 2.4888 2.5385 2.5385 2.9919 2.9919 3.1548 3.1548 8.4839 8.4839 11.6955 11.6955 12.0266 12.0266 12.0561 12.0561 12.5116 12.5116 12.5912 12.5912 13.1110 13.1110 13.1343 13.1343 k = 0.3059 0.1766 0.4996 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1062 -17.1062 -16.9571 -16.9571 -16.9073 -16.9073 -16.8241 -16.8241 -16.7584 -16.7584 -16.6939 -16.6939 -16.5073 -16.5073 -16.4017 -16.4017 -16.3771 -16.3771 -13.1954 -13.1954 -13.1936 -13.1936 -5.9622 -5.9622 -5.9560 -5.9560 -4.0554 -4.0554 -4.0366 -4.0366 -3.9101 -3.9101 -2.0925 -2.0925 -2.0804 -2.0804 -1.4675 -1.4675 -0.8478 -0.8478 -0.8271 -0.8271 -0.6520 -0.6520 -0.5396 -0.5396 0.5166 0.5166 0.8256 0.8256 0.9831 0.9831 1.8259 1.8259 1.8934 1.8934 2.0763 2.0763 2.1042 2.1042 2.1509 2.1509 2.1917 2.1917 2.2573 2.2573 2.2888 2.2888 2.3265 2.3265 2.4065 2.4065 2.4914 2.4914 2.5385 2.5385 3.0076 3.0076 3.1512 3.1512 8.4682 8.4682 11.6451 11.6451 12.0119 12.0119 12.0827 12.0827 12.5251 12.5251 12.5893 12.5893 13.0183 13.0183 13.1242 13.1242 k = 0.2961 0.1709 0.4835 ( 14829 PWs) bands (ev): -44.6796 -44.6796 -17.1094 -17.1094 -16.9580 -16.9580 -16.9070 -16.9070 -16.8247 -16.8247 -16.7526 -16.7526 -16.6915 -16.6915 -16.5098 -16.5098 -16.4034 -16.4034 -16.3769 -16.3769 -13.1950 -13.1950 -13.1927 -13.1927 -5.9617 -5.9617 -5.9565 -5.9565 -4.0547 -4.0547 -4.0370 -4.0370 -3.9120 -3.9120 -2.1010 -2.1010 -2.0759 -2.0759 -1.4715 -1.4715 -0.8566 -0.8566 -0.8266 -0.8266 -0.6719 -0.6719 -0.5450 -0.5450 0.5138 0.5138 0.8287 0.8287 0.9929 0.9929 1.8380 1.8380 1.9055 1.9055 2.0776 2.0776 2.0953 2.0953 2.1553 2.1553 2.2013 2.2013 2.2726 2.2726 2.2933 2.2933 2.3253 2.3253 2.4131 2.4131 2.4943 2.4943 2.5388 2.5388 3.0229 3.0229 3.1482 3.1482 8.4498 8.4498 11.5943 11.5943 11.9906 11.9906 12.1041 12.1041 12.4663 12.4663 12.6627 12.6627 12.9177 12.9177 13.1282 13.1282 k = 0.2862 0.1652 0.4673 ( 14839 PWs) bands (ev): -44.6796 -44.6796 -17.1123 -17.1123 -16.9587 -16.9587 -16.9066 -16.9066 -16.8256 -16.8256 -16.7472 -16.7472 -16.6894 -16.6894 -16.5121 -16.5121 -16.4049 -16.4049 -16.3767 -16.3767 -13.1945 -13.1945 -13.1917 -13.1917 -5.9612 -5.9612 -5.9568 -5.9568 -4.0541 -4.0541 -4.0373 -4.0373 -3.9141 -3.9141 -2.1094 -2.1094 -2.0718 -2.0718 -1.4761 -1.4761 -0.8734 -0.8734 -0.8196 -0.8196 -0.6925 -0.6925 -0.5508 -0.5508 0.5121 0.5121 0.8326 0.8326 1.0024 1.0024 1.8511 1.8511 1.9191 1.9191 2.0748 2.0748 2.0911 2.0911 2.1596 2.1596 2.2113 2.2113 2.2879 2.2879 2.2963 2.2963 2.3275 2.3275 2.4199 2.4199 2.4976 2.4976 2.5395 2.5395 3.0379 3.0379 3.1456 3.1456 8.4288 8.4288 11.5442 11.5442 11.9648 11.9648 12.1159 12.1159 12.4069 12.4069 12.7406 12.7406 12.8164 12.8164 13.1388 13.1388 k = 0.2763 0.1595 0.4512 ( 14827 PWs) bands (ev): -44.6796 -44.6796 -17.1148 -17.1148 -16.9594 -16.9594 -16.9062 -16.9062 -16.8266 -16.8266 -16.7423 -16.7423 -16.6879 -16.6879 -16.5141 -16.5141 -16.4060 -16.4060 -16.3764 -16.3764 -13.1939 -13.1939 -13.1906 -13.1906 -5.9608 -5.9608 -5.9572 -5.9572 -4.0537 -4.0537 -4.0376 -4.0376 -3.9164 -3.9164 -2.1179 -2.1179 -2.0683 -2.0683 -1.4814 -1.4814 -0.8912 -0.8912 -0.8130 -0.8130 -0.7138 -0.7138 -0.5573 -0.5573 0.5119 0.5119 0.8372 0.8372 1.0117 1.0117 1.8654 1.8654 1.9344 1.9344 2.0683 2.0683 2.0918 2.0918 2.1637 2.1637 2.2215 2.2215 2.2952 2.2952 2.3059 2.3059 2.3327 2.3327 2.4269 2.4269 2.5011 2.5011 2.5406 2.5406 3.0524 3.0524 3.1435 3.1435 8.4050 8.4050 11.4956 11.4956 11.9349 11.9349 12.1159 12.1159 12.3496 12.3496 12.7151 12.7151 12.8220 12.8220 13.1548 13.1548 k = 0.2664 0.1538 0.4351 ( 14831 PWs) bands (ev): -44.6796 -44.6796 -17.1171 -17.1171 -16.9600 -16.9600 -16.9057 -16.9057 -16.8279 -16.8279 -16.7381 -16.7381 -16.6867 -16.6867 -16.5157 -16.5157 -16.4068 -16.4068 -16.3760 -16.3760 -13.1933 -13.1933 -13.1895 -13.1895 -5.9604 -5.9604 -5.9576 -5.9576 -4.0533 -4.0533 -4.0379 -4.0379 -3.9189 -3.9189 -2.1264 -2.1264 -2.0653 -2.0653 -1.4872 -1.4872 -0.9091 -0.9091 -0.8077 -0.8077 -0.7356 -0.7356 -0.5646 -0.5646 0.5131 0.5131 0.8425 0.8425 1.0205 1.0205 1.8809 1.8809 1.9511 1.9511 2.0614 2.0614 2.0941 2.0941 2.1672 2.1672 2.2320 2.2320 2.2961 2.2961 2.3218 2.3218 2.3400 2.3400 2.4339 2.4339 2.5048 2.5048 2.5421 2.5421 3.0664 3.0664 3.1419 3.1419 8.3784 8.3784 11.4490 11.4490 11.9014 11.9014 12.1021 12.1021 12.2961 12.2961 12.6147 12.6147 12.9059 12.9059 13.1752 13.1752 k = 0.2566 0.1481 0.4190 ( 14827 PWs) bands (ev): -44.6796 -44.6796 -17.1190 -17.1190 -16.9604 -16.9604 -16.9052 -16.9052 -16.8293 -16.8293 -16.7346 -16.7346 -16.6861 -16.6861 -16.5168 -16.5168 -16.4072 -16.4072 -16.3757 -16.3757 -13.1926 -13.1926 -13.1883 -13.1883 -5.9600 -5.9600 -5.9580 -5.9580 -4.0531 -4.0531 -4.0380 -4.0380 -3.9217 -3.9217 -2.1347 -2.1347 -2.0628 -2.0628 -1.4937 -1.4937 -0.9269 -0.9269 -0.8043 -0.8043 -0.7575 -0.7575 -0.5726 -0.5726 0.5158 0.5158 0.8486 0.8486 1.0288 1.0288 1.8976 1.8976 1.9691 1.9691 2.0557 2.0557 2.0970 2.0970 2.1701 2.1701 2.2427 2.2427 2.2974 2.2974 2.3380 2.3380 2.3485 2.3485 2.4409 2.4409 2.5087 2.5087 2.5440 2.5440 3.0799 3.0799 3.1409 3.1409 8.3490 8.3490 11.4047 11.4047 11.8648 11.8648 12.0739 12.0739 12.2471 12.2471 12.5156 12.5156 12.9923 12.9923 13.1989 13.1989 k = 0.2467 0.1424 0.4029 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.1207 -17.1207 -16.9608 -16.9608 -16.9047 -16.9047 -16.8309 -16.8309 -16.7318 -16.7318 -16.6859 -16.6859 -16.5175 -16.5175 -16.4073 -16.4073 -16.3752 -16.3752 -13.1919 -13.1919 -13.1869 -13.1869 -5.9597 -5.9597 -5.9583 -5.9583 -4.0529 -4.0529 -4.0382 -4.0382 -3.9246 -3.9246 -2.1430 -2.1430 -2.0609 -2.0609 -1.5008 -1.5008 -0.9444 -0.9444 -0.8038 -0.8038 -0.7781 -0.7781 -0.5816 -0.5816 0.5200 0.5200 0.8555 0.8555 1.0364 1.0364 1.9156 1.9156 1.9881 1.9881 2.0517 2.0517 2.1003 2.1003 2.1720 2.1720 2.2535 2.2535 2.3000 2.3000 2.3542 2.3542 2.3578 2.3578 2.4478 2.4478 2.5128 2.5128 2.5463 2.5463 3.0928 3.0928 3.1405 3.1405 8.3169 8.3169 11.3630 11.3630 11.8255 11.8255 12.0329 12.0329 12.2018 12.2018 12.4181 12.4181 13.0811 13.0811 13.2248 13.2248 k = 0.2368 0.1367 0.3868 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.1220 -17.1220 -16.9610 -16.9610 -16.9041 -16.9041 -16.8326 -16.8326 -16.7297 -16.7297 -16.6862 -16.6862 -16.5177 -16.5177 -16.4070 -16.4070 -16.3748 -16.3748 -13.1912 -13.1912 -13.1856 -13.1856 -5.9595 -5.9595 -5.9586 -5.9586 -4.0528 -4.0528 -4.0384 -4.0384 -3.9277 -3.9277 -2.1512 -2.1512 -2.0596 -2.0596 -1.5084 -1.5084 -0.9615 -0.9615 -0.8127 -0.8127 -0.7910 -0.7910 -0.5916 -0.5916 0.5255 0.5255 0.8632 0.8632 1.0434 1.0434 1.9348 1.9348 2.0073 2.0073 2.0500 2.0500 2.1040 2.1040 2.1730 2.1730 2.2644 2.2644 2.3043 2.3043 2.3673 2.3673 2.3706 2.3706 2.4546 2.4546 2.5170 2.5170 2.5491 2.5491 3.1051 3.1051 3.1406 3.1406 8.2823 8.2823 11.3242 11.3242 11.7842 11.7842 11.9828 11.9828 12.1573 12.1573 12.3226 12.3226 13.1716 13.1716 13.2503 13.2503 k = 0.2270 0.1310 0.3706 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1231 -17.1231 -16.9611 -16.9611 -16.9034 -16.9034 -16.8345 -16.8345 -16.7283 -16.7283 -16.6870 -16.6870 -16.5174 -16.5174 -16.4063 -16.4063 -16.3742 -16.3742 -13.1903 -13.1903 -13.1841 -13.1841 -5.9593 -5.9593 -5.9588 -5.9588 -4.0527 -4.0527 -4.0386 -4.0386 -3.9310 -3.9310 -2.1592 -2.1592 -2.0589 -2.0589 -1.5166 -1.5166 -0.9782 -0.9782 -0.8326 -0.8326 -0.7944 -0.7944 -0.6025 -0.6025 0.5323 0.5323 0.8717 0.8717 1.0498 1.0498 1.9551 1.9551 2.0243 2.0243 2.0527 2.0527 2.1085 2.1085 2.1729 2.1729 2.2754 2.2754 2.3104 2.3104 2.3775 2.3775 2.3864 2.3864 2.4611 2.4611 2.5213 2.5213 2.5522 2.5522 3.1168 3.1168 3.1413 3.1413 8.2452 8.2452 11.2883 11.2883 11.7411 11.7411 11.9274 11.9274 12.1112 12.1112 12.2294 12.2294 13.2490 13.2490 13.2645 13.2645 k = 0.2171 0.1253 0.3545 ( 14835 PWs) bands (ev): -44.6796 -44.6796 -17.1238 -17.1238 -16.9611 -16.9611 -16.9028 -16.9028 -16.8365 -16.8365 -16.7276 -16.7276 -16.6884 -16.6884 -16.5166 -16.5166 -16.4052 -16.4052 -16.3737 -16.3737 -13.1895 -13.1895 -13.1826 -13.1826 -5.9593 -5.9593 -5.9590 -5.9590 -4.0526 -4.0526 -4.0389 -4.0389 -3.9345 -3.9345 -2.1669 -2.1669 -2.0587 -2.0587 -1.5252 -1.5252 -0.9944 -0.9944 -0.8551 -0.8551 -0.7961 -0.7961 -0.6144 -0.6144 0.5401 0.5401 0.8809 0.8809 1.0554 1.0554 1.9763 1.9763 2.0349 2.0349 2.0631 2.0631 2.1145 2.1145 2.1721 2.1721 2.2864 2.2864 2.3182 2.3182 2.3880 2.3880 2.4019 2.4019 2.4674 2.4674 2.5256 2.5256 2.5557 2.5557 3.1278 3.1278 3.1427 3.1427 8.2059 8.2059 11.2553 11.2553 11.6968 11.6968 11.8693 11.8693 12.0619 12.0619 12.1392 12.1392 13.1887 13.1887 13.3243 13.3243 k = 0.2072 0.1196 0.3384 ( 14843 PWs) bands (ev): -44.6796 -44.6796 -17.1243 -17.1243 -16.9611 -16.9611 -16.9021 -16.9021 -16.8387 -16.8387 -16.7275 -16.7275 -16.6901 -16.6901 -16.5154 -16.5154 -16.4038 -16.4038 -16.3731 -16.3731 -13.1886 -13.1886 -13.1810 -13.1810 -5.9595 -5.9595 -5.9589 -5.9589 -4.0526 -4.0526 -4.0391 -4.0391 -3.9381 -3.9381 -2.1745 -2.1745 -2.0590 -2.0590 -1.5342 -1.5342 -1.0100 -1.0100 -0.8781 -0.8781 -0.7983 -0.7983 -0.6273 -0.6273 0.5488 0.5488 0.8909 0.8909 1.0604 1.0604 1.9976 1.9976 2.0409 2.0409 2.0778 2.0778 2.1239 2.1239 2.1705 2.1705 2.2974 2.2974 2.3275 2.3275 2.3987 2.3987 2.4170 2.4170 2.4735 2.4735 2.5300 2.5300 2.5594 2.5594 3.1381 3.1381 3.1448 3.1448 8.1646 8.1646 11.2251 11.2251 11.6516 11.6516 11.8102 11.8102 12.0082 12.0082 12.0531 12.0531 13.1176 13.1176 13.3541 13.3541 k = 0.1974 0.1140 0.3223 ( 14821 PWs) bands (ev): -44.6796 -44.6796 -17.1244 -17.1244 -16.9610 -16.9610 -16.9013 -16.9013 -16.8410 -16.8410 -16.7279 -16.7279 -16.6923 -16.6923 -16.5139 -16.5139 -16.4021 -16.4021 -16.3724 -16.3724 -13.1877 -13.1877 -13.1794 -13.1794 -5.9597 -5.9597 -5.9588 -5.9588 -4.0525 -4.0525 -4.0395 -4.0395 -3.9418 -3.9418 -2.1818 -2.1818 -2.0599 -2.0599 -1.5436 -1.5436 -1.0250 -1.0250 -0.9011 -0.9011 -0.8010 -0.8010 -0.6411 -0.6411 0.5580 0.5580 0.9015 0.9015 1.0648 1.0648 2.0172 2.0172 2.0487 2.0487 2.0901 2.0901 2.1386 2.1386 2.1687 2.1687 2.3085 2.3085 2.3380 2.3380 2.4096 2.4096 2.4317 2.4317 2.4795 2.4795 2.5344 2.5344 2.5633 2.5633 3.1459 3.1459 3.1492 3.1492 8.1216 8.1216 11.1976 11.1976 11.6058 11.6058 11.7512 11.7512 11.9465 11.9465 11.9755 11.9755 13.0453 13.0453 13.3851 13.3851 k = 0.1875 0.1083 0.3062 ( 14821 PWs) bands (ev): -44.6796 -44.6796 -17.1243 -17.1243 -16.9608 -16.9608 -16.9005 -16.9005 -16.8434 -16.8434 -16.7288 -16.7288 -16.6949 -16.6949 -16.5120 -16.5120 -16.4001 -16.4001 -16.3717 -16.3717 -13.1867 -13.1867 -13.1777 -13.1777 -5.9599 -5.9599 -5.9588 -5.9588 -4.0525 -4.0525 -4.0399 -4.0399 -3.9457 -3.9457 -2.1888 -2.1888 -2.0612 -2.0612 -1.5532 -1.5532 -1.0393 -1.0393 -0.9239 -0.9239 -0.8044 -0.8044 -0.6556 -0.6556 0.5677 0.5677 0.9128 0.9128 1.0686 1.0686 2.0310 2.0310 2.0633 2.0633 2.0982 2.0982 2.1572 2.1572 2.1679 2.1679 2.3198 2.3198 2.3495 2.3495 2.4206 2.4206 2.4457 2.4457 2.4853 2.4853 2.5389 2.5389 2.5673 2.5673 3.1495 3.1495 3.1577 3.1577 8.0773 8.0773 11.1728 11.1728 11.5599 11.5599 11.6929 11.6929 11.8729 11.8729 11.9108 11.9108 12.9732 12.9732 13.4161 13.4161 k = 0.1776 0.1026 0.2901 ( 14819 PWs) bands (ev): -44.6796 -44.6796 -17.1240 -17.1240 -16.9607 -16.9607 -16.8996 -16.8996 -16.8459 -16.8459 -16.7301 -16.7301 -16.6979 -16.6979 -16.5099 -16.5099 -16.3979 -16.3979 -16.3710 -16.3710 -13.1858 -13.1858 -13.1760 -13.1760 -5.9601 -5.9601 -5.9588 -5.9588 -4.0524 -4.0524 -4.0404 -4.0404 -3.9496 -3.9496 -2.1955 -2.1955 -2.0629 -2.0629 -1.5630 -1.5630 -1.0530 -1.0530 -0.9462 -0.9462 -0.8082 -0.8082 -0.6707 -0.6707 0.5774 0.5774 0.9247 0.9247 1.0718 1.0718 2.0393 2.0393 2.0844 2.0844 2.1041 2.1041 2.1621 2.1621 2.1839 2.1839 2.3313 2.3313 2.3617 2.3617 2.4318 2.4318 2.4591 2.4591 2.4909 2.4909 2.5434 2.5434 2.5713 2.5713 3.1531 3.1531 3.1662 3.1662 8.0319 8.0319 11.1503 11.1503 11.5142 11.5142 11.6360 11.6360 11.7963 11.7963 11.8514 11.8514 12.9020 12.9020 13.4464 13.4464 k = 0.1678 0.0969 0.2740 ( 14835 PWs) bands (ev): -44.6796 -44.6796 -17.1234 -17.1234 -16.9605 -16.9605 -16.8986 -16.8986 -16.8484 -16.8484 -16.7317 -16.7317 -16.7012 -16.7012 -16.5076 -16.5076 -16.3954 -16.3954 -16.3703 -16.3703 -13.1848 -13.1848 -13.1744 -13.1744 -5.9603 -5.9603 -5.9589 -5.9589 -4.0523 -4.0523 -4.0409 -4.0409 -3.9536 -3.9536 -2.2020 -2.2020 -2.0650 -2.0650 -1.5728 -1.5728 -1.0659 -1.0659 -0.9680 -0.9680 -0.8124 -0.8124 -0.6863 -0.6863 0.5871 0.5871 0.9371 0.9371 1.0747 1.0747 2.0456 2.0456 2.1032 2.1032 2.1138 2.1138 2.1601 2.1601 2.2080 2.2080 2.3432 2.3432 2.3745 2.3745 2.4432 2.4432 2.4718 2.4718 2.4966 2.4966 2.5480 2.5480 2.5752 2.5752 3.1572 3.1572 3.1740 3.1740 7.9858 7.9858 11.1300 11.1300 11.4689 11.4689 11.5808 11.5808 11.7216 11.7216 11.7931 11.7931 12.8323 12.8323 13.4757 13.4757 k = 0.1579 0.0912 0.2578 ( 14839 PWs) bands (ev): -44.6796 -44.6796 -17.1226 -17.1226 -16.9604 -16.9604 -16.8975 -16.8975 -16.8511 -16.8511 -16.7336 -16.7336 -16.7048 -16.7048 -16.5053 -16.5053 -16.3928 -16.3928 -16.3696 -16.3696 -13.1838 -13.1838 -13.1727 -13.1727 -5.9604 -5.9604 -5.9590 -5.9590 -4.0522 -4.0522 -4.0415 -4.0415 -3.9576 -3.9576 -2.2080 -2.2080 -2.0675 -2.0675 -1.5827 -1.5827 -1.0781 -1.0781 -0.9891 -0.9891 -0.8169 -0.8169 -0.7022 -0.7022 0.5965 0.5965 0.9498 0.9498 1.0771 1.0771 2.0516 2.0516 2.1086 2.1086 2.1369 2.1369 2.1583 2.1583 2.2327 2.2327 2.3554 2.3554 2.3876 2.3876 2.4546 2.4546 2.4834 2.4834 2.5023 2.5023 2.5527 2.5527 2.5789 2.5789 3.1617 3.1617 3.1813 3.1813 7.9395 7.9395 11.1115 11.1115 11.4243 11.4243 11.5276 11.5276 11.6502 11.6502 11.7354 11.7354 12.7643 12.7643 13.5036 13.5036 k = 0.1480 0.0855 0.2417 ( 14845 PWs) bands (ev): -44.6796 -44.6796 -17.1216 -17.1216 -16.9604 -16.9604 -16.8964 -16.8964 -16.8537 -16.8537 -16.7355 -16.7355 -16.7086 -16.7086 -16.5028 -16.5028 -16.3901 -16.3901 -16.3688 -16.3688 -13.1828 -13.1828 -13.1710 -13.1710 -5.9606 -5.9606 -5.9591 -5.9591 -4.0521 -4.0521 -4.0421 -4.0421 -3.9616 -3.9616 -2.2138 -2.2138 -2.0702 -2.0702 -1.5925 -1.5925 -1.0895 -1.0895 -1.0094 -1.0094 -0.8216 -0.8216 -0.7182 -0.7182 0.6055 0.6055 0.9629 0.9629 1.0792 1.0792 2.0576 2.0576 2.1114 2.1114 2.1527 2.1527 2.1660 2.1660 2.2568 2.2568 2.3683 2.3683 2.4010 2.4010 2.4660 2.4660 2.4940 2.4940 2.5083 2.5083 2.5576 2.5576 2.5824 2.5824 3.1665 3.1665 3.1879 3.1879 7.8932 7.8932 11.0946 11.0946 11.3808 11.3808 11.4766 11.4766 11.5827 11.5827 11.6789 11.6789 12.6984 12.6984 13.5299 13.5299 k = 0.1382 0.0798 0.2256 ( 14833 PWs) bands (ev): -44.6796 -44.6796 -17.1203 -17.1203 -16.9605 -16.9605 -16.8952 -16.8952 -16.8563 -16.8563 -16.7376 -16.7376 -16.7126 -16.7126 -16.5004 -16.5004 -16.3872 -16.3872 -16.3681 -16.3681 -13.1818 -13.1818 -13.1693 -13.1693 -5.9607 -5.9607 -5.9592 -5.9592 -4.0519 -4.0519 -4.0428 -4.0428 -3.9656 -3.9656 -2.2192 -2.2192 -2.0731 -2.0731 -1.6021 -1.6021 -1.1001 -1.1001 -1.0288 -1.0288 -0.8263 -0.8263 -0.7342 -0.7342 0.6139 0.6139 0.9760 0.9760 1.0810 1.0810 2.0638 2.0638 2.1137 2.1137 2.1519 2.1519 2.1904 2.1904 2.2796 2.2796 2.3820 2.3820 2.4146 2.4146 2.4774 2.4774 2.5033 2.5033 2.5147 2.5147 2.5626 2.5626 2.5855 2.5855 3.1717 3.1717 3.1940 3.1940 7.8474 7.8474 11.0788 11.0788 11.3387 11.3387 11.4280 11.4280 11.5196 11.5196 11.6238 11.6238 12.6351 12.6351 13.5543 13.5543 k = 0.1283 0.0741 0.2095 ( 14827 PWs) bands (ev): -44.6796 -44.6796 -17.1190 -17.1190 -16.9607 -16.9607 -16.8938 -16.8938 -16.8589 -16.8589 -16.7396 -16.7396 -16.7167 -16.7167 -16.4980 -16.4980 -16.3844 -16.3844 -16.3673 -16.3673 -13.1809 -13.1809 -13.1677 -13.1677 -5.9608 -5.9608 -5.9594 -5.9594 -4.0518 -4.0518 -4.0435 -4.0435 -3.9695 -3.9695 -2.2243 -2.2243 -2.0762 -2.0762 -1.6115 -1.6115 -1.1100 -1.1100 -1.0473 -1.0473 -0.8311 -0.8311 -0.7499 -0.7499 0.6217 0.6217 0.9891 0.9891 1.0826 1.0826 2.0702 2.0702 2.1155 2.1155 2.1502 2.1502 2.2153 2.2153 2.3008 2.3008 2.3965 2.3965 2.4282 2.4282 2.4885 2.4885 2.5114 2.5114 2.5215 2.5215 2.5678 2.5678 2.5883 2.5883 3.1772 3.1772 3.1995 3.1995 7.8026 7.8026 11.0638 11.0638 11.2983 11.2983 11.3817 11.3817 11.4614 11.4614 11.5707 11.5707 12.5745 12.5745 13.5768 13.5768 k = 0.1184 0.0684 0.1934 ( 14821 PWs) bands (ev): -44.6796 -44.6796 -17.1174 -17.1174 -16.9610 -16.9610 -16.8924 -16.8924 -16.8614 -16.8614 -16.7417 -16.7417 -16.7209 -16.7209 -16.4958 -16.4958 -16.3815 -16.3815 -16.3666 -16.3666 -13.1800 -13.1800 -13.1662 -13.1662 -5.9609 -5.9609 -5.9596 -5.9596 -4.0516 -4.0516 -4.0442 -4.0442 -3.9733 -3.9733 -2.2290 -2.2290 -2.0794 -2.0794 -1.6206 -1.6206 -1.1191 -1.1191 -1.0646 -1.0646 -0.8358 -0.8358 -0.7652 -0.7652 0.6288 0.6288 1.0020 1.0020 1.0840 1.0840 2.0766 2.0766 2.1171 2.1171 2.1487 2.1487 2.2389 2.2389 2.3199 2.3199 2.4118 2.4118 2.4419 2.4419 2.4990 2.4990 2.5192 2.5192 2.5283 2.5283 2.5732 2.5732 2.5908 2.5908 3.1829 3.1829 3.2044 3.2044 7.7590 7.7590 11.0492 11.0492 11.2600 11.2600 11.3373 11.3373 11.4090 11.4090 11.5200 11.5200 12.5170 12.5170 13.5973 13.5973 k = 0.1086 0.0627 0.1773 ( 14817 PWs) bands (ev): -44.6796 -44.6796 -17.1158 -17.1158 -16.9615 -16.9615 -16.8908 -16.8908 -16.8638 -16.8638 -16.7436 -16.7436 -16.7252 -16.7252 -16.4936 -16.4936 -16.3787 -16.3787 -16.3658 -16.3658 -13.1791 -13.1791 -13.1647 -13.1647 -5.9610 -5.9610 -5.9598 -5.9598 -4.0514 -4.0514 -4.0449 -4.0449 -3.9769 -3.9769 -2.2333 -2.2333 -2.0826 -2.0826 -1.6292 -1.6292 -1.1275 -1.1275 -1.0809 -1.0809 -0.8404 -0.8404 -0.7799 -0.7799 0.6351 0.6351 1.0146 1.0146 1.0852 1.0852 2.0829 2.0829 2.1183 2.1183 2.1474 2.1474 2.2607 2.2607 2.3368 2.3368 2.4279 2.4279 2.4556 2.4556 2.5083 2.5083 2.5274 2.5274 2.5350 2.5350 2.5785 2.5785 2.5929 2.5929 3.1886 3.1886 3.2088 3.2088 7.7172 7.7172 11.0346 11.0346 11.2239 11.2239 11.2945 11.2945 11.3632 11.3632 11.4721 11.4721 12.4628 12.4628 13.6156 13.6156 k = 0.0987 0.0570 0.1612 ( 14809 PWs) bands (ev): -44.6796 -44.6796 -17.1141 -17.1141 -16.9622 -16.9622 -16.8892 -16.8892 -16.8661 -16.8661 -16.7455 -16.7455 -16.7293 -16.7293 -16.4916 -16.4916 -16.3760 -16.3760 -16.3651 -16.3651 -13.1783 -13.1783 -13.1632 -13.1632 -5.9610 -5.9610 -5.9600 -5.9600 -4.0512 -4.0512 -4.0457 -4.0457 -3.9803 -3.9803 -2.2372 -2.2372 -2.0857 -2.0857 -1.6373 -1.6373 -1.1350 -1.1350 -1.0959 -1.0959 -0.8447 -0.8447 -0.7939 -0.7939 0.6408 0.6408 1.0267 1.0267 1.0864 1.0864 2.0891 2.0891 2.1193 2.1193 2.1465 2.1465 2.2804 2.2804 2.3515 2.3515 2.4445 2.4445 2.4690 2.4690 2.5158 2.5158 2.5362 2.5362 2.5418 2.5418 2.5835 2.5835 2.5950 2.5950 3.1944 3.1944 3.2127 3.2127 7.6774 7.6774 11.0198 11.0198 11.1905 11.1905 11.2530 11.2530 11.3247 11.3247 11.4273 11.4273 12.4122 12.4122 13.6318 13.6318 k = 0.0888 0.0513 0.1450 ( 14813 PWs) bands (ev): -44.6796 -44.6796 -17.1124 -17.1124 -16.9630 -16.9630 -16.8876 -16.8876 -16.8682 -16.8682 -16.7472 -16.7472 -16.7334 -16.7334 -16.4897 -16.4897 -16.3735 -16.3735 -16.3645 -16.3645 -13.1775 -13.1775 -13.1619 -13.1619 -5.9611 -5.9611 -5.9602 -5.9602 -4.0510 -4.0510 -4.0464 -4.0464 -3.9836 -3.9836 -2.2408 -2.2408 -2.0888 -2.0888 -1.6449 -1.6449 -1.1418 -1.1418 -1.1097 -1.1097 -0.8489 -0.8489 -0.8071 -0.8071 0.6458 0.6458 1.0381 1.0381 1.0874 1.0874 2.0949 2.0949 2.1201 2.1201 2.1460 2.1460 2.2977 2.2977 2.3643 2.3643 2.4610 2.4610 2.4821 2.4821 2.5220 2.5220 2.5434 2.5434 2.5506 2.5506 2.5875 2.5875 2.5975 2.5975 3.2000 3.2000 3.2161 3.2161 7.6401 7.6401 11.0046 11.0046 11.1598 11.1598 11.2132 11.2132 11.2932 11.2932 11.3861 11.3861 12.3655 12.3655 13.6460 13.6460 k = 0.0789 0.0456 0.1289 ( 14811 PWs) bands (ev): -44.6796 -44.6796 -17.1106 -17.1106 -16.9639 -16.9639 -16.8859 -16.8859 -16.8701 -16.8701 -16.7488 -16.7488 -16.7374 -16.7374 -16.4880 -16.4880 -16.3711 -16.3711 -16.3639 -16.3639 -13.1768 -13.1768 -13.1607 -13.1607 -5.9611 -5.9611 -5.9604 -5.9604 -4.0508 -4.0508 -4.0471 -4.0471 -3.9865 -3.9865 -2.2440 -2.2440 -2.0917 -2.0917 -1.6519 -1.6519 -1.1478 -1.1478 -1.1221 -1.1221 -0.8527 -0.8527 -0.8192 -0.8192 0.6501 0.6501 1.0487 1.0487 1.0883 1.0883 2.1004 2.1004 2.1206 2.1206 2.1458 2.1458 2.3125 2.3125 2.3753 2.3753 2.4771 2.4771 2.4945 2.4945 2.5273 2.5273 2.5484 2.5484 2.5614 2.5614 2.5900 2.5900 2.6009 2.6009 3.2054 3.2054 3.2191 3.2191 7.6056 7.6056 10.9891 10.9891 11.1320 11.1320 11.1758 11.1758 11.2681 11.2681 11.3485 11.3485 12.3229 12.3229 13.6583 13.6583 k = 0.0691 0.0399 0.1128 ( 14811 PWs) bands (ev): -44.6796 -44.6796 -17.1089 -17.1089 -16.9649 -16.9649 -16.8843 -16.8843 -16.8717 -16.8717 -16.7503 -16.7503 -16.7410 -16.7410 -16.4865 -16.4865 -16.3689 -16.3689 -16.3633 -16.3633 -13.1761 -13.1761 -13.1596 -13.1596 -5.9612 -5.9612 -5.9606 -5.9606 -4.0507 -4.0507 -4.0477 -4.0477 -3.9892 -3.9892 -2.2468 -2.2468 -2.0944 -2.0944 -1.6582 -1.6582 -1.1531 -1.1531 -1.1332 -1.1332 -0.8561 -0.8561 -0.8302 -0.8302 0.6538 0.6538 1.0584 1.0584 1.0892 1.0892 2.1053 2.1053 2.1210 2.1210 2.1459 2.1459 2.3249 2.3249 2.3847 2.3847 2.4919 2.4919 2.5063 2.5063 2.5323 2.5323 2.5525 2.5525 2.5722 2.5722 2.5912 2.5912 2.6050 2.6050 3.2105 3.2105 3.2216 3.2216 7.5743 7.5743 10.9738 10.9738 11.1073 11.1073 11.1417 11.1417 11.2486 11.2486 11.3149 11.3149 12.2846 12.2846 13.6687 13.6687 k = 0.0592 0.0342 0.0967 ( 14821 PWs) bands (ev): -44.6796 -44.6796 -17.1074 -17.1074 -16.9660 -16.9660 -16.8827 -16.8827 -16.8732 -16.8732 -16.7515 -16.7515 -16.7445 -16.7445 -16.4852 -16.4852 -16.3670 -16.3670 -16.3628 -16.3628 -13.1755 -13.1755 -13.1586 -13.1586 -5.9612 -5.9612 -5.9607 -5.9607 -4.0505 -4.0505 -4.0483 -4.0483 -3.9916 -3.9916 -2.2493 -2.2493 -2.0968 -2.0968 -1.6637 -1.6637 -1.1576 -1.1576 -1.1429 -1.1429 -0.8592 -0.8592 -0.8400 -0.8400 0.6569 0.6569 1.0670 1.0670 1.0899 1.0899 2.1096 2.1096 2.1212 2.1212 2.1463 2.1463 2.3352 2.3352 2.3926 2.3926 2.5047 2.5047 2.5172 2.5172 2.5375 2.5375 2.5560 2.5560 2.5809 2.5809 2.5930 2.5930 2.6091 2.6091 3.2151 3.2151 3.2237 3.2237 7.5464 7.5464 10.9591 10.9591 11.0856 11.0856 11.1113 11.1113 11.2336 11.2336 11.2854 11.2854 12.2508 12.2508 13.6775 13.6775 k = 0.0493 0.0285 0.0806 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1059 -17.1059 -16.9670 -16.9670 -16.8812 -16.8812 -16.8744 -16.8744 -16.7526 -16.7526 -16.7475 -16.7475 -16.4840 -16.4840 -16.3653 -16.3653 -16.3624 -16.3624 -13.1750 -13.1750 -13.1578 -13.1578 -5.9612 -5.9612 -5.9609 -5.9609 -4.0504 -4.0504 -4.0488 -4.0488 -3.9937 -3.9937 -2.2513 -2.2513 -2.0989 -2.0989 -1.6685 -1.6685 -1.1615 -1.1615 -1.1511 -1.1511 -0.8619 -0.8619 -0.8484 -0.8484 0.6594 0.6594 1.0745 1.0745 1.0905 1.0905 2.1132 2.1132 2.1212 2.1212 2.1470 2.1470 2.3434 2.3434 2.3991 2.3991 2.5147 2.5147 2.5271 2.5271 2.5430 2.5430 2.5593 2.5593 2.5842 2.5842 2.5985 2.5985 2.6129 2.6129 3.2192 3.2192 3.2255 3.2255 7.5224 7.5224 10.9455 10.9455 11.0670 11.0670 11.0850 11.0850 11.2225 11.2225 11.2602 11.2602 12.2218 12.2218 13.6848 13.6848 k = 0.0395 0.0228 0.0645 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.1046 -17.1046 -16.9679 -16.9679 -16.8798 -16.8798 -16.8755 -16.8755 -16.7535 -16.7535 -16.7501 -16.7501 -16.4831 -16.4831 -16.3639 -16.3639 -16.3620 -16.3620 -13.1746 -13.1746 -13.1571 -13.1571 -5.9612 -5.9612 -5.9610 -5.9610 -4.0502 -4.0502 -4.0492 -4.0492 -3.9954 -3.9954 -2.2530 -2.2530 -2.1007 -2.1007 -1.6724 -1.6724 -1.1646 -1.1646 -1.1579 -1.1579 -0.8641 -0.8641 -0.8554 -0.8554 0.6614 0.6614 1.0807 1.0807 1.0911 1.0911 2.1162 2.1162 2.1213 2.1213 2.1477 2.1477 2.3499 2.3499 2.4042 2.4042 2.5216 2.5216 2.5361 2.5361 2.5486 2.5486 2.5626 2.5626 2.5833 2.5833 2.6061 2.6061 2.6162 2.6162 3.2227 3.2227 3.2269 3.2269 7.5023 7.5023 10.9336 10.9336 11.0516 11.0516 11.0633 11.0633 11.2144 11.2144 11.2395 11.2395 12.1978 12.1978 13.6906 13.6906 k = 0.0296 0.0171 0.0483 ( 14847 PWs) bands (ev): -44.6796 -44.6796 -17.1036 -17.1036 -16.9687 -16.9687 -16.8787 -16.8787 -16.8762 -16.8762 -16.7541 -16.7541 -16.7522 -16.7522 -16.4824 -16.4824 -16.3628 -16.3628 -16.3617 -16.3617 -13.1743 -13.1743 -13.1565 -13.1565 -5.9612 -5.9612 -5.9611 -5.9611 -4.0502 -4.0502 -4.0496 -4.0496 -3.9968 -3.9968 -2.2543 -2.2543 -2.1022 -2.1022 -1.6756 -1.6756 -1.1670 -1.1670 -1.1632 -1.1632 -0.8658 -0.8658 -0.8609 -0.8609 0.6629 0.6629 1.0856 1.0856 1.0915 1.0915 2.1184 2.1184 2.1212 2.1212 2.1484 2.1484 2.3548 2.3548 2.4082 2.4082 2.5261 2.5261 2.5441 2.5441 2.5532 2.5532 2.5664 2.5664 2.5811 2.5811 2.6129 2.6129 2.6189 2.6189 3.2255 3.2255 3.2279 3.2279 7.4865 7.4865 10.9238 10.9238 11.0396 11.0396 11.0461 11.0461 11.2087 11.2087 11.2232 11.2232 12.1790 12.1790 13.6950 13.6950 k = 0.0197 0.0114 0.0322 ( 14837 PWs) bands (ev): -44.6796 -44.6796 -17.1028 -17.1028 -16.9693 -16.9693 -16.8779 -16.8779 -16.8768 -16.8768 -16.7546 -16.7546 -16.7538 -16.7538 -16.4819 -16.4819 -16.3620 -16.3620 -16.3615 -16.3615 -13.1741 -13.1741 -13.1561 -13.1561 -5.9613 -5.9613 -5.9612 -5.9612 -4.0501 -4.0501 -4.0498 -4.0498 -3.9978 -3.9978 -2.2553 -2.2553 -2.1032 -2.1032 -1.6778 -1.6778 -1.1687 -1.1687 -1.1670 -1.1670 -0.8671 -0.8671 -0.8649 -0.8649 0.6640 0.6640 1.0892 1.0892 1.0918 1.0918 2.1200 2.1200 2.1212 2.1212 2.1490 2.1490 2.3582 2.3582 2.4109 2.4109 2.5289 2.5289 2.5508 2.5508 2.5562 2.5562 2.5701 2.5701 2.5781 2.5781 2.6181 2.6181 2.6208 2.6208 3.2276 3.2276 3.2287 3.2287 7.4750 7.4750 10.9167 10.9167 11.0309 11.0309 11.0338 11.0338 11.2050 11.2050 11.2116 11.2116 12.1654 12.1654 13.6981 13.6982 k = 0.0099 0.0057 0.0161 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1023 -17.1023 -16.9697 -16.9697 -16.8774 -16.8774 -16.8771 -16.8771 -16.7549 -16.7549 -16.7547 -16.7547 -16.4816 -16.4816 -16.3615 -16.3615 -16.3614 -16.3614 -13.1739 -13.1739 -13.1559 -13.1559 -5.9613 -5.9613 -5.9613 -5.9613 -4.0500 -4.0500 -4.0500 -4.0500 -3.9984 -3.9984 -2.2558 -2.2558 -2.1039 -2.1039 -1.6791 -1.6791 -1.1697 -1.1697 -1.1693 -1.1693 -0.8679 -0.8679 -0.8673 -0.8673 0.6646 0.6646 1.0913 1.0913 1.0920 1.0920 2.1209 2.1209 2.1212 2.1212 2.1494 2.1494 2.3602 2.3602 2.4126 2.4126 2.5303 2.5303 2.5560 2.5560 2.5577 2.5577 2.5729 2.5729 2.5753 2.5753 2.6213 2.6213 2.6220 2.6220 3.2288 3.2288 3.2291 3.2291 7.4681 7.4681 10.9122 10.9122 11.0256 11.0256 11.0264 11.0264 11.2029 11.2029 11.2046 11.2046 12.1572 12.1572 13.6999 13.7000 k = 0.0000 0.0000 0.0000 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1022 -17.1022 -16.9698 -16.9698 -16.8772 -16.8772 -16.8772 -16.8772 -16.7550 -16.7550 -16.7550 -16.7550 -16.4815 -16.4815 -16.3613 -16.3613 -16.3613 -16.3613 -13.1739 -13.1739 -13.1558 -13.1558 -5.9613 -5.9613 -5.9613 -5.9613 -4.0500 -4.0500 -4.0500 -4.0500 -3.9986 -3.9986 -2.2560 -2.2560 -2.1041 -2.1041 -1.6796 -1.6796 -1.1700 -1.1700 -1.1700 -1.1700 -0.8681 -0.8681 -0.8681 -0.8681 0.6648 0.6648 1.0921 1.0921 1.0921 1.0921 2.1212 2.1212 2.1212 2.1212 2.1496 2.1496 2.3608 2.3608 2.4131 2.4131 2.5308 2.5308 2.5581 2.5581 2.5581 2.5581 2.5738 2.5738 2.5738 2.5738 2.6224 2.6224 2.6224 2.6224 3.2293 3.2293 3.2293 3.2293 7.4658 7.4658 10.9107 10.9107 11.0239 11.0239 11.0239 11.0239 11.2022 11.2022 11.2022 11.2022 12.1544 12.1544 13.7006 13.7006 k = 0.0000 0.0000 0.0000 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1022 -17.1022 -16.9698 -16.9698 -16.8772 -16.8772 -16.8772 -16.8772 -16.7550 -16.7550 -16.7550 -16.7550 -16.4815 -16.4815 -16.3613 -16.3613 -16.3613 -16.3613 -13.1739 -13.1739 -13.1558 -13.1558 -5.9613 -5.9613 -5.9613 -5.9613 -4.0500 -4.0500 -4.0500 -4.0500 -3.9986 -3.9986 -2.2560 -2.2560 -2.1041 -2.1041 -1.6796 -1.6796 -1.1700 -1.1700 -1.1700 -1.1700 -0.8681 -0.8681 -0.8681 -0.8681 0.6648 0.6648 1.0921 1.0921 1.0921 1.0921 2.1212 2.1212 2.1212 2.1212 2.1496 2.1496 2.3608 2.3608 2.4131 2.4131 2.5308 2.5308 2.5581 2.5581 2.5581 2.5581 2.5738 2.5738 2.5738 2.5738 2.6224 2.6224 2.6224 2.6224 3.2293 3.2293 3.2293 3.2293 7.4658 7.4658 10.9107 10.9107 11.0239 11.0239 11.0239 11.0239 11.2022 11.2022 11.2022 11.2022 12.1544 12.1544 13.7006 13.7006 k = 0.0161 0.0093 0.0066 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1023 -17.1023 -16.9697 -16.9697 -16.8774 -16.8774 -16.8771 -16.8771 -16.7549 -16.7549 -16.7548 -16.7548 -16.4816 -16.4816 -16.3615 -16.3615 -16.3614 -16.3614 -13.1739 -13.1739 -13.1559 -13.1559 -5.9613 -5.9613 -5.9613 -5.9613 -4.0500 -4.0500 -4.0500 -4.0500 -3.9984 -3.9984 -2.2558 -2.2558 -2.1039 -2.1039 -1.6791 -1.6791 -1.1696 -1.1696 -1.1693 -1.1693 -0.8679 -0.8679 -0.8673 -0.8673 0.6646 0.6646 1.0913 1.0913 1.0920 1.0920 2.1209 2.1209 2.1212 2.1212 2.1494 2.1494 2.3602 2.3602 2.4126 2.4126 2.5303 2.5303 2.5560 2.5560 2.5576 2.5576 2.5728 2.5728 2.5753 2.5753 2.6212 2.6212 2.6220 2.6220 3.2290 3.2290 3.2290 3.2290 7.4681 7.4681 10.9122 10.9122 11.0260 11.0260 11.0261 11.0261 11.2030 11.2030 11.2045 11.2045 12.1572 12.1572 13.7000 13.7000 k = 0.0323 0.0186 0.0132 ( 14833 PWs) bands (ev): -44.6796 -44.6796 -17.1028 -17.1028 -16.9693 -16.9693 -16.8780 -16.8780 -16.8767 -16.8767 -16.7544 -16.7544 -16.7540 -16.7540 -16.4819 -16.4819 -16.3619 -16.3619 -16.3616 -16.3616 -13.1741 -13.1741 -13.1561 -13.1561 -5.9612 -5.9612 -5.9612 -5.9612 -4.0501 -4.0501 -4.0498 -4.0498 -3.9978 -3.9978 -2.2553 -2.2553 -2.1032 -2.1032 -1.6778 -1.6778 -1.1684 -1.1684 -1.1673 -1.1673 -0.8672 -0.8672 -0.8648 -0.8648 0.6640 0.6640 1.0890 1.0890 1.0920 1.0920 2.1199 2.1199 2.1213 2.1213 2.1490 2.1490 2.3582 2.3582 2.4109 2.4109 2.5289 2.5289 2.5511 2.5511 2.5558 2.5558 2.5701 2.5701 2.5783 2.5783 2.6179 2.6179 2.6210 2.6210 3.2281 3.2281 3.2282 3.2282 7.4750 7.4750 10.9167 10.9167 11.0322 11.0322 11.0325 11.0325 11.2054 11.2054 11.2111 11.2111 12.1654 12.1654 13.6983 13.6983 k = 0.0484 0.0279 0.0198 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1036 -17.1036 -16.9687 -16.9687 -16.8789 -16.8789 -16.8760 -16.8760 -16.7536 -16.7536 -16.7527 -16.7527 -16.4824 -16.4824 -16.3626 -16.3626 -16.3619 -16.3619 -13.1743 -13.1743 -13.1565 -13.1565 -5.9612 -5.9612 -5.9612 -5.9612 -4.0502 -4.0502 -4.0496 -4.0496 -3.9968 -3.9968 -2.2543 -2.2543 -2.1022 -2.1022 -1.6755 -1.6755 -1.1663 -1.1663 -1.1638 -1.1638 -0.8662 -0.8662 -0.8606 -0.8606 0.6629 0.6629 1.0852 1.0852 1.0919 1.0919 2.1183 2.1183 2.1213 2.1213 2.1484 2.1484 2.3547 2.3547 2.4082 2.4082 2.5261 2.5261 2.5446 2.5446 2.5525 2.5525 2.5664 2.5664 2.5814 2.5814 2.6124 2.6124 2.6194 2.6194 3.2267 3.2267 3.2268 3.2268 7.4865 7.4865 10.9240 10.9240 11.0425 11.0425 11.0432 11.0432 11.2096 11.2096 11.2222 11.2222 12.1790 12.1790 13.6954 13.6955 k = 0.0645 0.0372 0.0263 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1047 -17.1047 -16.9679 -16.9679 -16.8802 -16.8802 -16.8750 -16.8750 -16.7525 -16.7525 -16.7510 -16.7510 -16.4831 -16.4831 -16.3636 -16.3636 -16.3624 -16.3624 -13.1746 -13.1746 -13.1571 -13.1571 -5.9611 -5.9611 -5.9611 -5.9611 -4.0503 -4.0503 -4.0492 -4.0492 -3.9954 -3.9954 -2.2530 -2.2530 -2.1008 -2.1008 -1.6724 -1.6724 -1.1634 -1.1634 -1.1590 -1.1590 -0.8647 -0.8647 -0.8548 -0.8548 0.6613 0.6613 1.0800 1.0800 1.0918 1.0918 2.1161 2.1161 2.1211 2.1211 2.1479 2.1479 2.3498 2.3498 2.4042 2.4042 2.5216 2.5216 2.5370 2.5370 2.5473 2.5473 2.5627 2.5627 2.5840 2.5840 2.6048 2.6048 2.6174 2.6174 3.2247 3.2247 3.2250 3.2250 7.5024 7.5024 10.9340 10.9340 11.0570 11.0570 11.0581 11.0581 11.2157 11.2157 11.2377 11.2377 12.1980 12.1980 13.6915 13.6915 k = 0.0806 0.0466 0.0329 ( 14830 PWs) bands (ev): -44.6796 -44.6796 -17.1060 -17.1060 -16.9670 -16.9670 -16.8818 -16.8818 -16.8737 -16.8737 -16.7511 -16.7511 -16.7489 -16.7489 -16.4840 -16.4840 -16.3648 -16.3648 -16.3629 -16.3629 -13.1750 -13.1750 -13.1578 -13.1578 -5.9611 -5.9611 -5.9610 -5.9610 -4.0504 -4.0504 -4.0488 -4.0488 -3.9937 -3.9937 -2.2513 -2.2513 -2.0990 -2.0990 -1.6685 -1.6685 -1.1598 -1.1598 -1.1528 -1.1528 -0.8628 -0.8628 -0.8475 -0.8475 0.6592 0.6592 1.0734 1.0734 1.0916 1.0916 2.1134 2.1134 2.1206 2.1206 2.1475 2.1475 2.3431 2.3431 2.3990 2.3990 2.5146 2.5146 2.5286 2.5286 2.5411 2.5411 2.5593 2.5593 2.5858 2.5858 2.5954 2.5954 2.6152 2.6152 3.2222 3.2222 3.2226 3.2226 7.5224 7.5224 10.9464 10.9464 11.0755 11.0755 11.0768 11.0768 11.2241 11.2241 11.2574 11.2574 12.2221 12.2221 13.6863 13.6863 k = 0.0968 0.0559 0.0395 ( 14818 PWs) bands (ev): -44.6796 -44.6796 -17.1075 -17.1075 -16.9660 -16.9660 -16.8837 -16.8837 -16.8720 -16.8720 -16.7495 -16.7495 -16.7464 -16.7464 -16.4852 -16.4852 -16.3663 -16.3663 -16.3636 -16.3636 -13.1755 -13.1755 -13.1586 -13.1586 -5.9610 -5.9610 -5.9610 -5.9610 -4.0505 -4.0505 -4.0482 -4.0482 -3.9916 -3.9916 -2.2492 -2.2492 -2.0969 -2.0969 -1.6637 -1.6637 -1.1553 -1.1553 -1.1451 -1.1451 -0.8606 -0.8606 -0.8388 -0.8388 0.6566 0.6566 1.0656 1.0656 1.0914 1.0914 2.1102 2.1102 2.1195 2.1195 2.1475 2.1475 2.3346 2.3346 2.3925 2.3925 2.5045 2.5045 2.5193 2.5193 2.5351 2.5351 2.5560 2.5560 2.5844 2.5844 2.5864 2.5864 2.6132 2.6132 3.2193 3.2193 3.2199 3.2199 7.5465 7.5465 10.9610 10.9610 11.0979 11.0979 11.0993 11.0993 11.2352 11.2352 11.2813 11.2813 12.2512 12.2512 13.6801 13.6801 k = 0.1129 0.0652 0.0461 ( 14788 PWs) bands (ev): -44.6796 -44.6796 -17.1092 -17.1092 -16.9651 -16.9651 -16.8857 -16.8857 -16.8698 -16.8698 -16.7476 -16.7476 -16.7435 -16.7435 -16.4865 -16.4865 -16.3680 -16.3680 -16.3644 -16.3644 -13.1761 -13.1761 -13.1596 -13.1596 -5.9609 -5.9609 -5.9608 -5.9608 -4.0507 -4.0507 -4.0476 -4.0476 -3.9892 -3.9892 -2.2467 -2.2467 -2.0945 -2.0945 -1.6581 -1.6581 -1.1501 -1.1501 -1.1361 -1.1361 -0.8580 -0.8580 -0.8286 -0.8286 0.6533 0.6533 1.0567 1.0567 1.0911 1.0911 2.1066 2.1066 2.1177 2.1177 2.1482 2.1482 2.3238 2.3238 2.3845 2.3845 2.4918 2.4918 2.5090 2.5090 2.5294 2.5294 2.5526 2.5526 2.5722 2.5722 2.5858 2.5858 2.6116 2.6116 3.2160 3.2160 3.2167 3.2167 7.5744 7.5744 10.9772 10.9772 11.1243 11.1243 11.1253 11.1253 11.2496 11.2496 11.3093 11.3093 12.2851 12.2851 13.6728 13.6728 k = 0.1290 0.0745 0.0527 ( 14809 PWs) bands (ev): -44.6796 -44.6796 -17.1110 -17.1110 -16.9641 -16.9641 -16.8880 -16.8880 -16.8673 -16.8673 -16.7455 -16.7455 -16.7404 -16.7404 -16.4880 -16.4880 -16.3700 -16.3700 -16.3654 -16.3654 -13.1768 -13.1768 -13.1607 -13.1607 -5.9608 -5.9608 -5.9607 -5.9607 -4.0509 -4.0509 -4.0469 -4.0469 -3.9866 -3.9866 -2.2438 -2.2438 -2.0918 -2.0918 -1.6518 -1.6518 -1.1441 -1.1441 -1.1257 -1.1257 -0.8552 -0.8552 -0.8172 -0.8172 0.6492 0.6492 1.0468 1.0468 1.0907 1.0907 2.1026 2.1026 2.1151 2.1151 2.1496 2.1496 2.3105 2.3105 2.3751 2.3751 2.4775 2.4775 2.4979 2.4979 2.5233 2.5233 2.5488 2.5488 2.5597 2.5597 2.5837 2.5837 2.6108 2.6108 3.2124 3.2124 3.2132 3.2132 7.6057 7.6057 10.9946 10.9946 11.1543 11.1543 11.1545 11.1545 11.2679 11.2679 11.3412 11.3412 12.3236 12.3236 13.6645 13.6645 k = 0.1452 0.0838 0.0593 ( 14803 PWs) bands (ev): -44.6796 -44.6796 -17.1129 -17.1129 -16.9633 -16.9633 -16.8903 -16.8903 -16.8643 -16.8643 -16.7432 -16.7432 -16.7371 -16.7371 -16.4898 -16.4898 -16.3721 -16.3721 -16.3664 -16.3664 -13.1775 -13.1775 -13.1619 -13.1619 -5.9606 -5.9606 -5.9606 -5.9606 -4.0512 -4.0512 -4.0462 -4.0462 -3.9836 -3.9836 -2.2405 -2.2405 -2.0890 -2.0890 -1.6448 -1.6448 -1.1375 -1.1375 -1.1138 -1.1138 -0.8522 -0.8522 -0.8046 -0.8046 0.6443 0.6443 1.0361 1.0361 1.0902 1.0902 2.0983 2.0983 2.1118 2.1118 2.1517 2.1517 2.2944 2.2944 2.3641 2.3641 2.4625 2.4625 2.4858 2.4858 2.5160 2.5160 2.5432 2.5432 2.5492 2.5492 2.5804 2.5804 2.6105 2.6105 3.2084 3.2084 3.2094 3.2094 7.6401 7.6401 11.0126 11.0126 11.1861 11.1861 11.1884 11.1884 11.2908 11.2908 11.3768 11.3768 12.3665 12.3665 13.6552 13.6552 k = 0.1613 0.0931 0.0658 ( 14827 PWs) bands (ev): -44.6796 -44.6796 -17.1150 -17.1150 -16.9627 -16.9627 -16.8928 -16.8928 -16.8609 -16.8609 -16.7407 -16.7407 -16.7335 -16.7335 -16.4917 -16.4917 -16.3745 -16.3745 -16.3675 -16.3675 -13.1782 -13.1782 -13.1632 -13.1632 -5.9605 -5.9605 -5.9604 -5.9604 -4.0514 -4.0514 -4.0454 -4.0454 -3.9804 -3.9804 -2.2368 -2.2368 -2.0861 -2.0861 -1.6372 -1.6372 -1.1302 -1.1302 -1.1006 -1.1006 -0.8490 -0.8490 -0.7910 -0.7910 0.6385 0.6385 1.0248 1.0248 1.0896 1.0896 2.0938 2.0938 2.1080 2.1080 2.1544 2.1544 2.2754 2.2754 2.3513 2.3513 2.4476 2.4476 2.4728 2.4728 2.5063 2.5063 2.5344 2.5344 2.5433 2.5433 2.5762 2.5762 2.6105 2.6105 3.2043 3.2043 3.2053 3.2053 7.6773 7.6773 11.0306 11.0306 11.2203 11.2203 11.2260 11.2260 11.3190 11.3190 11.4159 11.4159 12.4134 12.4134 13.6451 13.6451 k = 0.1774 0.1024 0.0724 ( 14824 PWs) bands (ev): -44.6796 -44.6796 -17.1170 -17.1170 -16.9622 -16.9622 -16.8953 -16.8953 -16.8570 -16.8570 -16.7381 -16.7381 -16.7299 -16.7299 -16.4938 -16.4938 -16.3770 -16.3770 -16.3687 -16.3687 -13.1791 -13.1791 -13.1646 -13.1646 -5.9604 -5.9604 -5.9603 -5.9603 -4.0517 -4.0517 -4.0445 -4.0445 -3.9770 -3.9770 -2.2328 -2.2328 -2.0830 -2.0830 -1.6291 -1.6291 -1.1222 -1.1222 -1.0860 -1.0860 -0.8457 -0.8457 -0.7766 -0.7766 0.6316 0.6316 1.0132 1.0132 1.0889 1.0889 2.0893 2.0893 2.1037 2.1037 2.1577 2.1577 2.2535 2.2535 2.3366 2.3366 2.4332 2.4332 2.4590 2.4590 2.4938 2.4938 2.5264 2.5264 2.5389 2.5389 2.5716 2.5716 2.6106 2.6106 3.2000 3.2000 3.2011 3.2011 7.7169 7.7169 11.0481 11.0481 11.2569 11.2569 11.2670 11.2670 11.3526 11.3526 11.4585 11.4585 12.4641 12.4641 13.6343 13.6343 k = 0.1935 0.1117 0.0790 ( 14815 PWs) bands (ev): -44.6796 -44.6796 -17.1191 -17.1191 -16.9619 -16.9619 -16.8978 -16.8978 -16.8527 -16.8527 -16.7354 -16.7354 -16.7261 -16.7261 -16.4961 -16.4961 -16.3797 -16.3797 -16.3700 -16.3700 -13.1799 -13.1799 -13.1661 -13.1661 -5.9603 -5.9603 -5.9601 -5.9601 -4.0519 -4.0519 -4.0437 -4.0437 -3.9734 -3.9734 -2.2284 -2.2284 -2.0800 -2.0800 -1.6204 -1.6204 -1.1137 -1.1137 -1.0700 -1.0700 -0.8424 -0.8424 -0.7614 -0.7614 0.6236 0.6236 1.0013 1.0013 1.0881 1.0881 2.0847 2.0847 2.0991 2.0991 2.1614 2.1614 2.2291 2.2291 2.3201 2.3201 2.4193 2.4193 2.4443 2.4443 2.4797 2.4797 2.5199 2.5199 2.5346 2.5346 2.5668 2.5668 2.6106 2.6106 3.1956 3.1956 3.1967 3.1967 7.7585 7.7585 11.0647 11.0647 11.2959 11.2959 11.3113 11.3113 11.3917 11.3917 11.5042 11.5042 12.5183 12.5183 13.6227 13.6227 k = 0.2097 0.1211 0.0856 ( 14821 PWs) bands (ev): -44.6796 -44.6796 -17.1211 -17.1211 -16.9618 -16.9618 -16.9004 -16.9004 -16.8480 -16.8480 -16.7326 -16.7326 -16.7223 -16.7223 -16.4985 -16.4985 -16.3825 -16.3825 -16.3714 -16.3714 -13.1808 -13.1808 -13.1676 -13.1676 -5.9601 -5.9601 -5.9600 -5.9600 -4.0522 -4.0522 -4.0428 -4.0428 -3.9697 -3.9697 -2.2236 -2.2236 -2.0770 -2.0770 -1.6114 -1.6114 -1.1046 -1.1046 -1.0527 -1.0527 -0.8391 -0.8391 -0.7457 -0.7457 0.6143 0.6143 0.9895 0.9895 1.0872 1.0872 2.0803 2.0803 2.0943 2.0943 2.1654 2.1654 2.2025 2.2025 2.3015 2.3015 2.4059 2.4059 2.4288 2.4288 2.4652 2.4652 2.5140 2.5140 2.5302 2.5302 2.5618 2.5618 2.6105 2.6105 3.1913 3.1913 3.1923 3.1923 7.8017 7.8017 11.0804 11.0804 11.3374 11.3374 11.3589 11.3589 11.4359 11.4359 11.5527 11.5527 12.5756 12.5756 13.6104 13.6104 k = 0.2258 0.1304 0.0922 ( 14806 PWs) bands (ev): -44.6796 -44.6796 -17.1231 -17.1231 -16.9618 -16.9618 -16.9029 -16.9029 -16.8429 -16.8429 -16.7298 -16.7298 -16.7185 -16.7185 -16.5012 -16.5012 -16.3854 -16.3854 -16.3728 -16.3728 -13.1817 -13.1817 -13.1692 -13.1692 -5.9600 -5.9600 -5.9598 -5.9598 -4.0525 -4.0525 -4.0418 -4.0418 -3.9659 -3.9659 -2.2185 -2.2185 -2.0740 -2.0740 -1.6020 -1.6020 -1.0951 -1.0951 -1.0341 -1.0341 -0.8358 -0.8358 -0.7297 -0.7297 0.6038 0.6038 0.9779 0.9779 1.0861 1.0861 2.0760 2.0760 2.0893 2.0893 2.1690 2.1690 2.1752 2.1752 2.2811 2.2811 2.3928 2.3928 2.4127 2.4127 2.4513 2.4513 2.5085 2.5085 2.5258 2.5258 2.5569 2.5569 2.6102 2.6102 3.1869 3.1869 3.1878 3.1878 7.8461 7.8461 11.0950 11.0950 11.3816 11.3816 11.4094 11.4094 11.4845 11.4845 11.6040 11.6040 12.6358 12.6358 13.5972 13.5972 k = 0.2419 0.1397 0.0988 ( 14818 PWs) bands (ev): -44.6796 -44.6796 -17.1251 -17.1251 -16.9620 -16.9620 -16.9053 -16.9053 -16.8376 -16.8376 -16.7269 -16.7269 -16.7146 -16.7146 -16.5040 -16.5040 -16.3884 -16.3884 -16.3742 -16.3742 -13.1826 -13.1826 -13.1708 -13.1708 -5.9599 -5.9599 -5.9596 -5.9596 -4.0528 -4.0528 -4.0409 -4.0409 -3.9621 -3.9621 -2.2131 -2.2131 -2.0712 -2.0712 -1.5924 -1.5924 -1.0851 -1.0851 -1.0143 -1.0143 -0.8328 -0.8328 -0.7135 -0.7135 0.5919 0.5919 0.9667 0.9667 1.0850 1.0850 2.0720 2.0720 2.0843 2.0843 2.1448 2.1448 2.1749 2.1749 2.2590 2.2590 2.3796 2.3796 2.3960 2.3960 2.4385 2.4385 2.5030 2.5030 2.5214 2.5214 2.5521 2.5521 2.6096 2.6096 3.1826 3.1826 3.1834 3.1834 7.8912 7.8912 11.1087 11.1087 11.4284 11.4284 11.4628 11.4628 11.5371 11.5371 11.6576 11.6576 12.6983 12.6983 13.5827 13.5827 k = 0.2581 0.1490 0.1054 ( 14815 PWs) bands (ev): -44.6796 -44.6796 -17.1270 -17.1270 -16.9623 -16.9623 -16.9077 -16.9077 -16.8320 -16.8320 -16.7240 -16.7240 -16.7108 -16.7108 -16.5069 -16.5069 -16.3914 -16.3914 -16.3757 -16.3757 -13.1835 -13.1835 -13.1724 -13.1724 -5.9597 -5.9597 -5.9594 -5.9594 -4.0530 -4.0530 -4.0400 -4.0400 -3.9582 -3.9582 -2.2075 -2.2075 -2.0686 -2.0686 -1.5826 -1.5826 -1.0748 -1.0748 -0.9934 -0.9934 -0.8299 -0.8299 -0.6974 -0.6974 0.5788 0.5788 0.9561 0.9561 1.0837 1.0837 2.0684 2.0684 2.0790 2.0790 2.1154 2.1154 2.1798 2.1798 2.2355 2.2355 2.3662 2.3662 2.3788 2.3788 2.4271 2.4271 2.4975 2.4975 2.5169 2.5169 2.5474 2.5474 2.6089 2.6089 3.1785 3.1785 3.1790 3.1790 7.9366 7.9366 11.1215 11.1215 11.4779 11.4779 11.5188 11.5188 11.5930 11.5930 11.7132 11.7132 12.7628 12.7628 13.5666 13.5666 k = 0.2742 0.1583 0.1119 ( 14818 PWs) bands (ev): -44.6796 -44.6796 -17.1288 -17.1288 -16.9628 -16.9628 -16.9100 -16.9100 -16.8263 -16.8263 -16.7211 -16.7211 -16.7071 -16.7071 -16.5100 -16.5100 -16.3944 -16.3944 -16.3771 -16.3771 -13.1844 -13.1844 -13.1740 -13.1740 -5.9596 -5.9596 -5.9593 -5.9593 -4.0533 -4.0533 -4.0391 -4.0391 -3.9544 -3.9544 -2.2016 -2.2016 -2.0662 -2.0662 -1.5728 -1.5728 -1.0642 -1.0642 -0.9715 -0.9715 -0.8274 -0.8274 -0.6816 -0.6816 0.5644 0.5644 0.9462 0.9462 1.0823 1.0823 2.0652 2.0652 2.0725 2.0725 2.0873 2.0873 2.1848 2.1848 2.2110 2.2110 2.3525 2.3525 2.3614 2.3614 2.4172 2.4172 2.4920 2.4920 2.5125 2.5125 2.5430 2.5430 2.6079 2.6079 3.1745 3.1745 3.1748 3.1748 7.9818 7.9818 11.1337 11.1337 11.5296 11.5296 11.5771 11.5771 11.6518 11.6518 11.7706 11.7706 12.8289 12.8289 13.5480 13.5480 k = 0.2903 0.1676 0.1185 ( 14806 PWs) bands (ev): -44.6796 -44.6796 -17.1305 -17.1305 -16.9633 -16.9633 -16.9122 -16.9122 -16.8204 -16.8204 -16.7183 -16.7183 -16.7035 -16.7035 -16.5131 -16.5131 -16.3973 -16.3973 -16.3786 -16.3786 -13.1853 -13.1853 -13.1756 -13.1756 -5.9595 -5.9595 -5.9591 -5.9591 -4.0536 -4.0536 -4.0382 -4.0382 -3.9507 -3.9507 -2.1956 -2.1956 -2.0641 -2.0641 -1.5630 -1.5630 -1.0534 -1.0534 -0.9487 -0.9487 -0.8252 -0.8252 -0.6664 -0.6664 0.5488 0.5488 0.9370 0.9370 1.0809 1.0809 2.0538 2.0538 2.0625 2.0625 2.0717 2.0717 2.1842 2.1842 2.1917 2.1917 2.3387 2.3387 2.3438 2.3438 2.4087 2.4087 2.4863 2.4863 2.5082 2.5082 2.5388 2.5388 2.6068 2.6068 3.1707 3.1707 3.1708 3.1708 8.0264 8.0264 11.1452 11.1452 11.5834 11.5834 11.6376 11.6376 11.7130 11.7130 11.8294 11.8294 12.8960 12.8960 13.5263 13.5263 k = 0.3065 0.1769 0.1251 ( 14830 PWs) bands (ev): -44.6796 -44.6796 -17.1321 -17.1321 -16.9638 -16.9638 -16.9143 -16.9143 -16.8145 -16.8145 -16.7155 -16.7155 -16.7001 -16.7001 -16.5163 -16.5163 -16.4003 -16.4003 -16.3801 -16.3801 -13.1862 -13.1862 -13.1772 -13.1772 -5.9594 -5.9594 -5.9589 -5.9589 -4.0539 -4.0539 -4.0374 -4.0374 -3.9471 -3.9471 -2.1895 -2.1895 -2.0622 -2.0622 -1.5534 -1.5534 -1.0425 -1.0425 -0.9251 -0.9251 -0.8233 -0.8233 -0.6519 -0.6519 0.5324 0.5324 0.9287 0.9287 1.0794 1.0794 2.0268 2.0268 2.0604 2.0604 2.0654 2.0654 2.1601 2.1601 2.1960 2.1960 2.3249 2.3249 2.3262 2.3262 2.4014 2.4014 2.4806 2.4806 2.5039 2.5039 2.5349 2.5349 2.6055 2.6055 3.1669 3.1669 3.1672 3.1672 8.0700 8.0700 11.1562 11.1562 11.6387 11.6387 11.6999 11.6999 11.7763 11.7763 11.8892 11.8892 12.9636 12.9636 13.5010 13.5010 k = 0.3226 0.1862 0.1317 ( 14833 PWs) bands (ev): -44.6796 -44.6796 -17.1336 -17.1336 -16.9644 -16.9644 -16.9162 -16.9162 -16.8087 -16.8087 -16.7129 -16.7129 -16.6967 -16.6967 -16.5196 -16.5196 -16.4031 -16.4031 -16.3815 -16.3815 -13.1870 -13.1870 -13.1787 -13.1787 -5.9592 -5.9592 -5.9588 -5.9588 -4.0541 -4.0541 -4.0365 -4.0365 -3.9436 -3.9436 -2.1833 -2.1833 -2.0607 -2.0607 -1.5441 -1.5441 -1.0316 -1.0316 -0.9010 -0.9010 -0.8219 -0.8219 -0.6384 -0.6384 0.5152 0.5152 0.9213 0.9213 1.0778 1.0778 2.0003 2.0003 2.0589 2.0589 2.0591 2.0591 2.1359 2.1359 2.2014 2.2014 2.3088 2.3088 2.3113 2.3113 2.3951 2.3951 2.4749 2.4749 2.4998 2.4998 2.5313 2.5313 2.6041 2.6041 3.1632 3.1632 3.1638 3.1638 8.1121 8.1121 11.1667 11.1667 11.6951 11.6951 11.7637 11.7637 11.8413 11.8413 11.9495 11.9495 13.0311 13.0311 13.4719 13.4719 k = 0.3387 0.1956 0.1383 ( 14839 PWs) bands (ev): -44.6796 -44.6796 -17.1350 -17.1350 -16.9650 -16.9650 -16.9180 -16.9180 -16.8030 -16.8030 -16.7103 -16.7103 -16.6936 -16.6936 -16.5229 -16.5229 -16.4058 -16.4058 -16.3829 -16.3829 -13.1877 -13.1877 -13.1802 -13.1802 -5.9591 -5.9591 -5.9586 -5.9586 -4.0544 -4.0544 -4.0358 -4.0358 -3.9403 -3.9403 -2.1772 -2.1772 -2.0595 -2.0595 -1.5351 -1.5351 -1.0207 -1.0207 -0.8764 -0.8764 -0.8210 -0.8210 -0.6262 -0.6262 0.4977 0.4977 0.9147 0.9147 1.0763 1.0763 1.9756 1.9756 2.0514 2.0514 2.0580 2.0580 2.1139 2.1139 2.2068 2.2068 2.2917 2.2917 2.2981 2.2981 2.3896 2.3896 2.4693 2.4693 2.4959 2.4959 2.5279 2.5279 2.6027 2.6027 3.1598 3.1598 3.1608 3.1608 8.1523 8.1523 11.1766 11.1766 11.7519 11.7519 11.8285 11.8285 11.9076 11.9076 12.0099 12.0099 13.0980 13.0980 13.4387 13.4387 k = 0.3548 0.2049 0.1449 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1363 -17.1363 -16.9656 -16.9656 -16.9197 -16.9197 -16.7974 -16.7974 -16.7080 -16.7080 -16.6907 -16.6907 -16.5261 -16.5261 -16.4084 -16.4084 -16.3842 -16.3842 -13.1884 -13.1884 -13.1815 -13.1815 -5.9590 -5.9590 -5.9585 -5.9585 -4.0546 -4.0546 -4.0350 -4.0350 -3.9372 -3.9372 -2.1712 -2.1712 -2.0586 -2.0586 -1.5266 -1.5266 -1.0101 -1.0101 -0.8518 -0.8518 -0.8205 -0.8205 -0.6155 -0.6155 0.4801 0.4801 0.9088 0.9088 1.0748 1.0748 1.9528 1.9528 2.0407 2.0407 2.0578 2.0578 2.0960 2.0960 2.2122 2.2122 2.2750 2.2750 2.2855 2.2855 2.3848 2.3848 2.4637 2.4637 2.4921 2.4921 2.5249 2.5249 2.6011 2.6011 3.1567 3.1567 3.1580 3.1580 8.1901 8.1901 11.1859 11.1859 11.8087 11.8087 11.8939 11.8939 11.9748 11.9748 12.0698 12.0698 13.1635 13.1635 13.4018 13.4018 k = 0.3710 0.2142 0.1514 ( 14836 PWs) bands (ev): -44.6796 -44.6796 -17.1374 -17.1374 -16.9662 -16.9662 -16.9212 -16.9212 -16.7922 -16.7922 -16.7057 -16.7057 -16.6880 -16.6880 -16.5293 -16.5293 -16.4107 -16.4107 -16.3854 -16.3854 -13.1890 -13.1890 -13.1828 -13.1828 -5.9590 -5.9590 -5.9583 -5.9583 -4.0548 -4.0548 -4.0344 -4.0344 -3.9343 -3.9343 -2.1653 -2.1653 -2.0580 -2.0580 -1.5187 -1.5187 -0.9999 -0.9999 -0.8272 -0.8272 -0.8205 -0.8205 -0.6065 -0.6065 0.4629 0.4629 0.9038 0.9038 1.0733 1.0733 1.9325 1.9325 2.0259 2.0259 2.0582 2.0582 2.0835 2.0835 2.2173 2.2173 2.2591 2.2591 2.2736 2.2736 2.3807 2.3807 2.4583 2.4583 2.4887 2.4887 2.5221 2.5221 2.5996 2.5996 3.1539 3.1539 3.1556 3.1556 8.2252 8.2252 11.1946 11.1946 11.8644 11.8644 11.9593 11.9593 12.0425 12.0425 12.1286 12.1286 13.2271 13.2271 13.3611 13.3611 k = 0.3871 0.2235 0.1580 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1384 -17.1384 -16.9667 -16.9667 -16.9225 -16.9225 -16.7873 -16.7873 -16.7037 -16.7037 -16.6856 -16.6856 -16.5323 -16.5323 -16.4129 -16.4129 -16.3865 -16.3865 -13.1895 -13.1895 -13.1840 -13.1840 -5.9589 -5.9589 -5.9582 -5.9582 -4.0550 -4.0550 -4.0338 -4.0338 -3.9317 -3.9317 -2.1597 -2.1597 -2.0578 -2.0578 -1.5114 -1.5114 -0.9901 -0.9901 -0.8209 -0.8209 -0.8031 -0.8031 -0.5995 -0.5995 0.4464 0.4464 0.8995 0.8995 1.0719 1.0719 1.9147 1.9147 2.0080 2.0080 2.0592 2.0592 2.0759 2.0759 2.2222 2.2222 2.2440 2.2440 2.2626 2.2626 2.3772 2.3772 2.4532 2.4532 2.4855 2.4855 2.5197 2.5197 2.5982 2.5982 3.1513 3.1513 3.1534 3.1534 8.2571 8.2571 11.2025 11.2025 11.9183 11.9183 12.0237 12.0237 12.1100 12.1100 12.1855 12.1855 13.2876 13.2876 13.3174 13.3174 k = 0.4032 0.2328 0.1646 ( 14863 PWs) bands (ev): -44.6796 -44.6796 -17.1393 -17.1393 -16.9672 -16.9672 -16.9237 -16.9237 -16.7828 -16.7828 -16.7019 -16.7019 -16.6835 -16.6835 -16.5350 -16.5350 -16.4148 -16.4148 -16.3875 -16.3875 -13.1900 -13.1900 -13.1851 -13.1851 -5.9588 -5.9588 -5.9581 -5.9581 -4.0552 -4.0552 -4.0333 -4.0333 -3.9294 -3.9294 -2.1545 -2.1545 -2.0578 -2.0578 -1.5049 -1.5049 -0.9810 -0.9810 -0.8216 -0.8216 -0.7799 -0.7799 -0.5944 -0.5944 0.4310 0.4310 0.8958 0.8958 1.0707 1.0707 1.8997 1.8997 1.9891 1.9891 2.0608 2.0608 2.0713 2.0713 2.2268 2.2268 2.2300 2.2300 2.2527 2.2527 2.3742 2.3742 2.4485 2.4485 2.4826 2.4826 2.5176 2.5176 2.5968 2.5968 3.1491 3.1491 3.1515 3.1515 8.2856 8.2856 11.2097 11.2097 11.9693 11.9693 12.0861 12.0861 12.1767 12.1767 12.2396 12.2396 13.2689 13.2689 13.3465 13.3465 k = 0.4194 0.2421 0.1712 ( 14851 PWs) bands (ev): -44.6796 -44.6796 -17.1401 -17.1401 -16.9676 -16.9676 -16.9247 -16.9247 -16.7788 -16.7788 -16.7003 -16.7003 -16.6816 -16.6816 -16.5376 -16.5376 -16.4165 -16.4165 -16.3884 -16.3884 -13.1903 -13.1903 -13.1861 -13.1861 -5.9588 -5.9588 -5.9580 -5.9580 -4.0553 -4.0553 -4.0328 -4.0328 -3.9274 -3.9274 -2.1498 -2.1498 -2.0580 -2.0580 -1.4993 -1.4993 -0.9727 -0.9727 -0.8226 -0.8226 -0.7579 -0.7579 -0.5914 -0.5914 0.4172 0.4172 0.8928 0.8928 1.0696 1.0696 1.8875 1.8875 1.9710 1.9710 2.0628 2.0628 2.0685 2.0685 2.2172 2.2172 2.2309 2.2309 2.2439 2.2439 2.3718 2.3718 2.4442 2.4442 2.4801 2.4801 2.5158 2.5158 2.5956 2.5956 3.1472 3.1472 3.1499 3.1499 8.3102 8.3102 11.2160 11.2160 12.0161 12.0161 12.1452 12.1452 12.2414 12.2414 12.2899 12.2899 13.2193 13.2193 13.3100 13.3100 k = 0.4355 0.2514 0.1778 ( 14854 PWs) bands (ev): -44.6796 -44.6796 -17.1407 -17.1407 -16.9680 -16.9680 -16.9255 -16.9255 -16.7755 -16.7755 -16.6990 -16.6990 -16.6801 -16.6801 -16.5397 -16.5397 -16.4179 -16.4179 -16.3892 -16.3892 -13.1906 -13.1906 -13.1869 -13.1869 -5.9587 -5.9587 -5.9579 -5.9579 -4.0555 -4.0555 -4.0324 -4.0324 -3.9258 -3.9258 -2.1457 -2.1457 -2.0584 -2.0584 -1.4945 -1.4945 -0.9655 -0.9655 -0.8238 -0.8238 -0.7379 -0.7379 -0.5903 -0.5903 0.4052 0.4052 0.8904 0.8904 1.0686 1.0686 1.8781 1.8781 1.9547 1.9547 2.0650 2.0650 2.0667 2.0667 2.2061 2.2061 2.2345 2.2345 2.2365 2.2365 2.3698 2.3698 2.4406 2.4406 2.4781 2.4781 2.5143 2.5143 2.5945 2.5945 3.1457 3.1457 3.1486 3.1486 8.3308 8.3308 11.2212 11.2212 12.0573 12.0573 12.1989 12.1989 12.3025 12.3025 12.3350 12.3350 13.1689 13.1689 13.2710 13.2710 k = 0.4516 0.2607 0.1844 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1412 -17.1412 -16.9683 -16.9683 -16.9262 -16.9262 -16.7728 -16.7728 -16.6980 -16.6980 -16.6789 -16.6789 -16.5415 -16.5415 -16.4190 -16.4190 -16.3897 -16.3897 -13.1908 -13.1908 -13.1876 -13.1876 -5.9587 -5.9587 -5.9579 -5.9579 -4.0556 -4.0556 -4.0321 -4.0321 -3.9245 -3.9245 -2.1423 -2.1423 -2.0588 -2.0588 -1.4908 -1.4908 -0.9596 -0.9596 -0.8250 -0.8250 -0.7204 -0.7204 -0.5909 -0.5909 0.3956 0.3956 0.8885 0.8885 1.0679 1.0679 1.8713 1.8713 1.9409 1.9409 2.0656 2.0656 2.0672 2.0672 2.1968 2.1968 2.2306 2.2306 2.2374 2.2374 2.3682 2.3682 2.4376 2.4376 2.4764 2.4764 2.5132 2.5132 2.5937 2.5937 3.1445 3.1445 3.1475 3.1475 8.3471 8.3471 11.2254 11.2254 12.0916 12.0916 12.2450 12.2450 12.3575 12.3575 12.3735 12.3735 13.1209 13.1209 13.2345 13.2345 k = 0.4677 0.2701 0.1910 ( 14872 PWs) bands (ev): -44.6796 -44.6796 -17.1415 -17.1415 -16.9685 -16.9685 -16.9267 -16.9267 -16.7708 -16.7708 -16.6972 -16.6972 -16.6780 -16.6780 -16.5428 -16.5428 -16.4198 -16.4198 -16.3902 -16.3902 -13.1909 -13.1909 -13.1882 -13.1882 -5.9587 -5.9587 -5.9578 -5.9578 -4.0556 -4.0556 -4.0319 -4.0319 -3.9236 -3.9236 -2.1398 -2.1398 -2.0592 -2.0592 -1.4881 -1.4881 -0.9551 -0.9551 -0.8260 -0.8260 -0.7064 -0.7064 -0.5925 -0.5925 0.3884 0.3884 0.8872 0.8872 1.0673 1.0673 1.8669 1.8669 1.9304 1.9304 2.0649 2.0649 2.0692 2.0692 2.1898 2.1898 2.2262 2.2262 2.2395 2.2395 2.3671 2.3671 2.4353 2.4353 2.4752 2.4752 2.5124 2.5124 2.5930 2.5930 3.1436 3.1436 3.1468 3.1468 8.3588 8.3588 11.2285 11.2285 12.1174 12.1174 12.2808 12.2808 12.4028 12.4028 12.4034 12.4034 13.0797 13.0797 13.2040 13.2040 k = 0.4839 0.2794 0.1975 ( 14890 PWs) bands (ev): -44.6796 -44.6796 -17.1417 -17.1417 -16.9686 -16.9686 -16.9269 -16.9269 -16.7696 -16.7696 -16.6968 -16.6968 -16.6775 -16.6775 -16.5436 -16.5436 -16.4203 -16.4203 -16.3904 -16.3904 -13.1909 -13.1909 -13.1885 -13.1885 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9230 -3.9230 -2.1383 -2.1383 -2.0594 -2.0594 -1.4864 -1.4864 -0.9524 -0.9524 -0.8266 -0.8266 -0.6972 -0.6972 -0.5942 -0.5942 0.3841 0.3841 0.8864 0.8864 1.0670 1.0670 1.8645 1.8645 1.9237 1.9237 2.0646 2.0646 2.0705 2.0705 2.1854 2.1854 2.2236 2.2236 2.2409 2.2409 2.3665 2.3665 2.4340 2.4340 2.4745 2.4745 2.5119 2.5119 2.5926 2.5926 3.1431 3.1431 3.1464 3.1464 8.3660 8.3660 11.2304 11.2304 12.1334 12.1334 12.3036 12.3036 12.4226 12.4226 12.4334 12.4334 13.0513 13.0513 13.1834 13.1834 k = 0.5000 0.2887 0.2041 ( 14902 PWs) bands (ev): -44.6796 -44.6796 -17.1418 -17.1418 -16.9687 -16.9687 -16.9270 -16.9270 -16.7692 -16.7692 -16.6966 -16.6966 -16.6773 -16.6773 -16.5439 -16.5439 -16.4205 -16.4205 -16.3905 -16.3905 -13.1909 -13.1909 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9228 -3.9228 -2.1377 -2.1377 -2.0595 -2.0595 -1.4859 -1.4859 -0.9515 -0.9515 -0.8269 -0.8269 -0.6940 -0.6940 -0.5949 -0.5949 0.3826 0.3826 0.8862 0.8862 1.0669 1.0669 1.8637 1.8637 1.9214 1.9214 2.0645 2.0645 2.0710 2.0710 2.1839 2.1839 2.2227 2.2227 2.2413 2.2413 2.3662 2.3662 2.4335 2.4335 2.4742 2.4742 2.5117 2.5117 2.5925 2.5925 3.1429 3.1429 3.1462 3.1462 8.3683 8.3683 11.2310 11.2310 12.1389 12.1389 12.3114 12.3114 12.4292 12.4292 12.4444 12.4444 13.0410 13.0410 13.1761 13.1761 k = 0.5000 0.2887 0.2041 ( 14902 PWs) bands (ev): -44.6796 -44.6796 -17.1418 -17.1418 -16.9687 -16.9687 -16.9270 -16.9270 -16.7692 -16.7692 -16.6966 -16.6966 -16.6773 -16.6773 -16.5439 -16.5439 -16.4205 -16.4205 -16.3905 -16.3905 -13.1909 -13.1909 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9228 -3.9228 -2.1377 -2.1377 -2.0595 -2.0595 -1.4859 -1.4859 -0.9515 -0.9515 -0.8269 -0.8269 -0.6940 -0.6940 -0.5949 -0.5949 0.3826 0.3826 0.8862 0.8862 1.0669 1.0669 1.8637 1.8637 1.9214 1.9214 2.0645 2.0645 2.0710 2.0710 2.1839 2.1839 2.2227 2.2227 2.2413 2.2413 2.3662 2.3662 2.4335 2.4335 2.4742 2.4742 2.5117 2.5117 2.5925 2.5925 3.1429 3.1429 3.1462 3.1462 8.3683 8.3683 11.2310 11.2310 12.1389 12.1389 12.3114 12.3114 12.4292 12.4292 12.4444 12.4444 13.0410 13.0410 13.1761 13.1761 k = 0.5057 0.2723 0.2134 ( 14872 PWs) bands (ev): -44.6796 -44.6796 -17.1416 -17.1416 -16.9686 -16.9686 -16.9270 -16.9270 -16.7693 -16.7693 -16.6970 -16.6970 -16.6777 -16.6777 -16.5435 -16.5435 -16.4203 -16.4203 -16.3905 -16.3905 -13.1910 -13.1910 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9227 -3.9227 -2.1375 -2.1375 -2.0596 -2.0596 -1.4857 -1.4857 -0.9507 -0.9507 -0.8270 -0.8270 -0.6933 -0.6933 -0.5949 -0.5949 0.3833 0.3833 0.8858 0.8858 1.0664 1.0664 1.8636 1.8636 1.9211 1.9211 2.0646 2.0646 2.0711 2.0711 2.1838 2.1838 2.2225 2.2225 2.2415 2.2415 2.3654 2.3654 2.4333 2.4333 2.4734 2.4734 2.5118 2.5118 2.5920 2.5920 3.1424 3.1424 3.1459 3.1459 8.3690 8.3690 11.2331 11.2331 12.1387 12.1387 12.3091 12.3091 12.4298 12.4298 12.4473 12.4473 13.0376 13.0376 13.1691 13.1691 k = 0.5114 0.2559 0.2227 ( 14874 PWs) bands (ev): -44.6796 -44.6796 -17.1410 -17.1410 -16.9684 -16.9684 -16.9268 -16.9268 -16.7695 -16.7695 -16.6982 -16.6982 -16.6790 -16.6790 -16.5423 -16.5423 -16.4199 -16.4199 -16.3903 -16.3903 -13.1911 -13.1911 -13.1888 -13.1888 -5.9587 -5.9587 -5.9578 -5.9578 -4.0556 -4.0556 -4.0319 -4.0319 -3.9225 -3.9225 -2.1368 -2.1368 -2.0598 -2.0598 -1.4854 -1.4854 -0.9486 -0.9486 -0.8275 -0.8275 -0.6912 -0.6912 -0.5948 -0.5948 0.3854 0.3854 0.8849 0.8849 1.0650 1.0650 1.8632 1.8632 1.9202 1.9202 2.0649 2.0649 2.0716 2.0716 2.1836 2.1836 2.2220 2.2220 2.2421 2.2421 2.3630 2.3630 2.4326 2.4326 2.4709 2.4709 2.5118 2.5118 2.5904 2.5904 3.1404 3.1404 3.1455 3.1455 8.3711 8.3711 11.2394 11.2394 12.1382 12.1382 12.3028 12.3028 12.4306 12.4306 12.4564 12.4564 13.0279 13.0279 13.1513 13.1513 k = 0.5170 0.2395 0.2320 ( 14853 PWs) bands (ev): -44.6796 -44.6796 -17.1400 -17.1400 -16.9681 -16.9681 -16.9265 -16.9265 -16.7700 -16.7700 -16.7003 -16.7003 -16.6807 -16.6807 -16.5403 -16.5403 -16.4192 -16.4192 -16.3900 -16.3900 -13.1912 -13.1912 -13.1889 -13.1889 -5.9587 -5.9587 -5.9578 -5.9578 -4.0555 -4.0555 -4.0321 -4.0321 -3.9221 -3.9221 -2.1356 -2.1356 -2.0602 -2.0602 -1.4847 -1.4847 -0.9450 -0.9450 -0.8282 -0.8282 -0.6878 -0.6878 -0.5946 -0.5946 0.3888 0.3888 0.8832 0.8832 1.0627 1.0627 1.8624 1.8624 1.9188 1.9188 2.0653 2.0653 2.0724 2.0724 2.1831 2.1831 2.2212 2.2212 2.2428 2.2428 2.3591 2.3591 2.4312 2.4312 2.4672 2.4672 2.5117 2.5117 2.5878 2.5878 3.1362 3.1362 3.1456 3.1456 8.3746 8.3746 11.2499 11.2499 12.1368 12.1368 12.2946 12.2946 12.4308 12.4308 12.4711 12.4711 13.0138 13.0138 13.1285 13.1285 k = 0.5227 0.2231 0.2412 ( 14855 PWs) bands (ev): -44.6796 -44.6796 -17.1386 -17.1386 -16.9677 -16.9677 -16.9261 -16.9261 -16.7707 -16.7707 -16.7036 -16.7036 -16.6827 -16.6827 -16.5378 -16.5378 -16.4182 -16.4182 -16.3896 -16.3896 -13.1914 -13.1914 -13.1892 -13.1892 -5.9588 -5.9588 -5.9578 -5.9578 -4.0555 -4.0555 -4.0324 -4.0324 -3.9215 -3.9215 -2.1340 -2.1340 -2.0607 -2.0607 -1.4839 -1.4839 -0.9402 -0.9402 -0.8292 -0.8292 -0.6831 -0.6831 -0.5943 -0.5943 0.3935 0.3935 0.8810 0.8810 1.0595 1.0595 1.8614 1.8614 1.9169 1.9169 2.0657 2.0657 2.0738 2.0738 2.1822 2.1822 2.2205 2.2205 2.2437 2.2437 2.3539 2.3539 2.4288 2.4288 2.4625 2.4625 2.5114 2.5114 2.5844 2.5844 3.1302 3.1302 3.1460 3.1460 8.3794 8.3794 11.2644 11.2644 12.1342 12.1342 12.2862 12.2862 12.4297 12.4297 12.4903 12.4903 12.9971 12.9971 13.1043 13.1043 k = 0.5284 0.2067 0.2505 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.1369 -17.1369 -16.9672 -16.9672 -16.9256 -16.9256 -16.7716 -16.7716 -16.7080 -16.7080 -16.6847 -16.6847 -16.5349 -16.5349 -16.4170 -16.4170 -16.3891 -16.3891 -13.1916 -13.1916 -13.1895 -13.1895 -5.9590 -5.9590 -5.9577 -5.9577 -4.0554 -4.0554 -4.0328 -4.0328 -3.9207 -3.9207 -2.1320 -2.1320 -2.0613 -2.0613 -1.4828 -1.4828 -0.9341 -0.9341 -0.8303 -0.8303 -0.6773 -0.6773 -0.5938 -0.5938 0.3995 0.3995 0.8782 0.8782 1.0555 1.0555 1.8599 1.8599 1.9143 1.9143 2.0660 2.0660 2.0759 2.0759 2.1808 2.1808 2.2200 2.2200 2.2444 2.2444 2.3476 2.3476 2.4250 2.4250 2.4576 2.4576 2.5108 2.5108 2.5803 2.5803 3.1225 3.1225 3.1467 3.1467 8.3854 8.3854 11.2827 11.2827 12.1298 12.1298 12.2795 12.2795 12.4267 12.4267 12.5131 12.5131 12.9799 12.9799 13.0809 13.0809 k = 0.5341 0.1903 0.2598 ( 14836 PWs) bands (ev): -44.6796 -44.6796 -17.1347 -17.1347 -16.9666 -16.9666 -16.9249 -16.9249 -16.7726 -16.7726 -16.7135 -16.7135 -16.6866 -16.6866 -16.5317 -16.5317 -16.4156 -16.4156 -16.3885 -16.3885 -13.1919 -13.1919 -13.1899 -13.1899 -5.9593 -5.9593 -5.9575 -5.9575 -4.0553 -4.0553 -4.0331 -4.0331 -3.9199 -3.9199 -2.1296 -2.1296 -2.0620 -2.0620 -1.4815 -1.4815 -0.9271 -0.9271 -0.8314 -0.8314 -0.6705 -0.6705 -0.5930 -0.5930 0.4066 0.4066 0.8748 0.8748 1.0505 1.0505 1.8582 1.8582 1.9112 1.9112 2.0661 2.0661 2.0786 2.0786 2.1787 2.1787 2.2198 2.2198 2.2449 2.2449 2.3404 2.3404 2.4194 2.4194 2.4527 2.4527 2.5099 2.5099 2.5757 2.5757 3.1133 3.1133 3.1476 3.1476 8.3926 8.3926 11.3047 11.3047 12.1231 12.1231 12.2755 12.2755 12.4214 12.4214 12.5388 12.5388 12.9636 12.9636 13.0597 13.0597 k = 0.5398 0.1739 0.2691 ( 14838 PWs) bands (ev): -44.6796 -44.6796 -17.1323 -17.1323 -16.9659 -16.9659 -16.9242 -16.9242 -16.7739 -16.7739 -16.7199 -16.7199 -16.6884 -16.6884 -16.5282 -16.5282 -16.4140 -16.4140 -16.3878 -16.3878 -13.1922 -13.1922 -13.1903 -13.1903 -5.9596 -5.9596 -5.9574 -5.9574 -4.0552 -4.0552 -4.0335 -4.0335 -3.9189 -3.9189 -2.1270 -2.1270 -2.0628 -2.0628 -1.4800 -1.4800 -0.9192 -0.9192 -0.8323 -0.8323 -0.6628 -0.6628 -0.5919 -0.5919 0.4149 0.4149 0.8709 0.8709 1.0447 1.0447 1.8560 1.8560 1.9077 1.9077 2.0662 2.0662 2.0819 2.0819 2.1760 2.1760 2.2199 2.2199 2.2449 2.2449 2.3326 2.3326 2.4121 2.4121 2.4481 2.4481 2.5086 2.5086 2.5708 2.5708 3.1026 3.1026 3.1487 3.1487 8.4008 8.4008 11.3301 11.3301 12.1143 12.1143 12.2747 12.2747 12.4132 12.4132 12.5664 12.5664 12.9500 12.9500 13.0417 13.0417 k = 0.5455 0.1575 0.2784 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1295 -17.1295 -16.9650 -16.9650 -16.9233 -16.9233 -16.7754 -16.7754 -16.7271 -16.7271 -16.6901 -16.6901 -16.5247 -16.5247 -16.4122 -16.4122 -16.3871 -16.3871 -13.1925 -13.1925 -13.1907 -13.1907 -5.9600 -5.9600 -5.9571 -5.9571 -4.0552 -4.0552 -4.0339 -4.0339 -3.9178 -3.9178 -2.1240 -2.1240 -2.0636 -2.0636 -1.4783 -1.4783 -0.9110 -0.9110 -0.8329 -0.8329 -0.6545 -0.6545 -0.5904 -0.5904 0.4241 0.4241 0.8666 0.8666 1.0382 1.0382 1.8533 1.8533 1.9036 1.9036 2.0661 2.0661 2.0858 2.0858 2.1728 2.1728 2.2201 2.2201 2.2442 2.2442 2.3244 2.3244 2.4035 2.4035 2.4437 2.4437 2.5068 2.5068 2.5659 2.5659 3.0907 3.0907 3.1499 3.1499 8.4098 8.4098 11.3586 11.3586 12.1040 12.1040 12.2766 12.2766 12.4018 12.4018 12.5947 12.5947 12.9407 12.9407 13.0279 13.0279 k = 0.5511 0.1411 0.2876 ( 14846 PWs) bands (ev): -44.6796 -44.6796 -17.1264 -17.1264 -16.9641 -16.9641 -16.9224 -16.9224 -16.7772 -16.7772 -16.7346 -16.7346 -16.6918 -16.6918 -16.5212 -16.5212 -16.4103 -16.4103 -16.3862 -16.3862 -13.1929 -13.1929 -13.1912 -13.1912 -5.9604 -5.9604 -5.9569 -5.9569 -4.0552 -4.0552 -4.0343 -4.0343 -3.9166 -3.9166 -2.1209 -2.1209 -2.0645 -2.0645 -1.4765 -1.4765 -0.9029 -0.9029 -0.8327 -0.8327 -0.6456 -0.6456 -0.5882 -0.5882 0.4342 0.4342 0.8619 0.8619 1.0309 1.0309 1.8500 1.8500 1.8992 1.8992 2.0660 2.0660 2.0902 2.0902 2.1690 2.1690 2.2202 2.2202 2.2426 2.2426 2.3163 2.3163 2.3941 2.3941 2.4391 2.4391 2.5047 2.5047 2.5612 2.5612 3.0776 3.0776 3.1513 3.1513 8.4197 8.4197 11.3898 11.3898 12.0928 12.0928 12.2803 12.2803 12.3868 12.3868 12.6223 12.6223 12.9374 12.9374 13.0195 13.0195 k = 0.5568 0.1247 0.2969 ( 14837 PWs) bands (ev): -44.6796 -44.6796 -17.1230 -17.1230 -16.9631 -16.9631 -16.9213 -16.9213 -16.7793 -16.7793 -16.7425 -16.7425 -16.6935 -16.6935 -16.5177 -16.5177 -16.4082 -16.4082 -16.3853 -16.3853 -13.1933 -13.1933 -13.1918 -13.1918 -5.9608 -5.9608 -5.9566 -5.9566 -4.0553 -4.0553 -4.0346 -4.0346 -3.9153 -3.9153 -2.1177 -2.1177 -2.0652 -2.0652 -1.4745 -1.4745 -0.8956 -0.8956 -0.8312 -0.8312 -0.6363 -0.6363 -0.5854 -0.5854 0.4449 0.4449 0.8569 0.8569 1.0230 1.0230 1.8462 1.8462 1.8945 1.8945 2.0659 2.0659 2.0951 2.0951 2.1650 2.1650 2.2199 2.2199 2.2399 2.2399 2.3086 2.3086 2.3847 2.3847 2.4341 2.4341 2.5022 2.5022 2.5569 2.5569 3.0637 3.0637 3.1529 3.1529 8.4301 8.4301 11.4234 11.4234 12.0817 12.0817 12.2845 12.2845 12.3683 12.3683 12.6475 12.6475 12.9413 12.9413 13.0179 13.0179 k = 0.5625 0.1083 0.3062 ( 14838 PWs) bands (ev): -44.6796 -44.6796 -17.1194 -17.1194 -16.9620 -16.9620 -16.9201 -16.9201 -16.7817 -16.7817 -16.7504 -16.7504 -16.6953 -16.6953 -16.5143 -16.5143 -16.4062 -16.4062 -16.3844 -16.3844 -13.1937 -13.1937 -13.1923 -13.1923 -5.9612 -5.9612 -5.9564 -5.9564 -4.0555 -4.0555 -4.0348 -4.0348 -3.9140 -3.9140 -2.1146 -2.1146 -2.0657 -2.0657 -1.4724 -1.4724 -0.8900 -0.8900 -0.8276 -0.8276 -0.6270 -0.6270 -0.5816 -0.5816 0.4562 0.4562 0.8517 0.8517 1.0145 1.0145 1.8416 1.8416 1.8896 1.8896 2.0656 2.0656 2.1003 2.1003 2.1608 2.1608 2.2185 2.2185 2.2363 2.2363 2.3015 2.3015 2.3759 2.3759 2.4286 2.4286 2.4996 2.4996 2.5532 2.5532 3.0489 3.0489 3.1547 3.1547 8.4409 8.4409 11.4589 11.4589 12.0712 12.0712 12.2872 12.2872 12.3468 12.3468 12.6692 12.6692 12.9525 12.9525 13.0253 13.0253 k = 0.5682 0.0919 0.3155 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1156 -17.1156 -16.9609 -16.9609 -16.9188 -16.9188 -16.7847 -16.7847 -16.7580 -16.7580 -16.6971 -16.6971 -16.5111 -16.5111 -16.4040 -16.4040 -16.3834 -16.3834 -13.1942 -13.1942 -13.1929 -13.1929 -5.9617 -5.9617 -5.9561 -5.9561 -4.0558 -4.0558 -4.0350 -4.0350 -3.9126 -3.9126 -2.1118 -2.1118 -2.0660 -2.0660 -1.4702 -1.4702 -0.8868 -0.8868 -0.8215 -0.8215 -0.6179 -0.6179 -0.5769 -0.5769 0.4679 0.4679 0.8465 0.8465 1.0056 1.0056 1.8362 1.8362 1.8847 1.8847 2.0652 2.0652 2.1056 2.1056 2.1567 2.1567 2.2153 2.2153 2.2322 2.2322 2.2952 2.2952 2.3682 2.3682 2.4225 2.4225 2.4969 2.4969 2.5501 2.5501 3.0337 3.0337 3.1566 3.1566 8.4520 8.4520 11.4959 11.4959 12.0619 12.0619 12.2846 12.2846 12.3250 12.3250 12.6877 12.6877 12.9691 12.9691 13.0444 13.0444 k = 0.5739 0.0754 0.3247 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.1116 -17.1116 -16.9597 -16.9597 -16.9175 -16.9175 -16.7883 -16.7883 -16.7651 -16.7651 -16.6990 -16.6990 -16.5079 -16.5079 -16.4019 -16.4019 -16.3824 -16.3824 -13.1946 -13.1946 -13.1935 -13.1935 -5.9622 -5.9622 -5.9558 -5.9558 -4.0562 -4.0562 -4.0350 -4.0350 -3.9112 -3.9112 -2.1095 -2.1095 -2.0657 -2.0657 -1.4681 -1.4681 -0.8860 -0.8860 -0.8130 -0.8130 -0.6092 -0.6092 -0.5710 -0.5710 0.4796 0.4796 0.8413 0.8413 0.9962 0.9962 1.8300 1.8300 1.8799 1.8799 2.0647 2.0647 2.1110 2.1110 2.1528 2.1528 2.2098 2.2098 2.2283 2.2283 2.2895 2.2895 2.3620 2.3620 2.4161 2.4161 2.4942 2.4942 2.5476 2.5476 3.0180 3.0180 3.1586 3.1586 8.4631 8.4631 11.5338 11.5338 12.0541 12.0541 12.2689 12.2689 12.3103 12.3103 12.7042 12.7042 12.9890 12.9890 13.0767 13.0767 k = 0.5795 0.0590 0.3340 ( 14837 PWs) bands (ev): -44.6796 -44.6796 -17.1074 -17.1074 -16.9584 -16.9584 -16.9161 -16.9161 -16.7928 -16.7928 -16.7713 -16.7713 -16.7009 -16.7009 -16.5049 -16.5049 -16.3998 -16.3998 -16.3814 -16.3814 -13.1950 -13.1950 -13.1941 -13.1941 -5.9627 -5.9627 -5.9554 -5.9554 -4.0567 -4.0567 -4.0350 -4.0350 -3.9098 -3.9098 -2.1078 -2.1078 -2.0649 -2.0649 -1.4659 -1.4659 -0.8874 -0.8874 -0.8026 -0.8026 -0.6009 -0.6009 -0.5641 -0.5641 0.4913 0.4913 0.8364 0.8364 0.9866 0.9866 1.8230 1.8230 1.8752 1.8752 2.0639 2.0639 2.1160 2.1160 2.1495 2.1495 2.2023 2.2023 2.2244 2.2244 2.2843 2.2843 2.3576 2.3576 2.4095 2.4095 2.4917 2.4917 2.5456 2.5456 3.0022 3.0022 3.1609 3.1609 8.4741 8.4741 11.5720 11.5720 12.0478 12.0478 12.2400 12.2400 12.3022 12.3022 12.7206 12.7206 13.0118 13.0118 13.1211 13.1211 k = 0.5852 0.0426 0.3433 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.1032 -17.1032 -16.9572 -16.9572 -16.9146 -16.9146 -16.7981 -16.7981 -16.7764 -16.7764 -16.7029 -16.7029 -16.5021 -16.5021 -16.3977 -16.3977 -16.3805 -16.3805 -13.1954 -13.1954 -13.1946 -13.1946 -5.9632 -5.9632 -5.9551 -5.9551 -4.0573 -4.0573 -4.0348 -4.0348 -3.9085 -3.9085 -2.1069 -2.1069 -2.0632 -2.0632 -1.4638 -1.4638 -0.8905 -0.8905 -0.7910 -0.7910 -0.5930 -0.5930 -0.5563 -0.5563 0.5026 0.5026 0.8318 0.8318 0.9770 0.9770 1.8154 1.8154 1.8708 1.8708 2.0629 2.0629 2.1201 2.1201 2.1470 2.1470 2.1937 2.1937 2.2201 2.2201 2.2798 2.2798 2.3550 2.3550 2.4030 2.4030 2.4894 2.4894 2.5441 2.5441 2.9865 2.9865 3.1632 3.1632 8.4848 8.4848 11.6100 11.6100 12.0426 12.0426 12.2057 12.2057 12.2939 12.2939 12.7384 12.7384 13.0384 13.0384 13.1747 13.1747 k = 0.5909 0.0262 0.3526 ( 14854 PWs) bands (ev): -44.6796 -44.6796 -17.0989 -17.0989 -16.9559 -16.9559 -16.9132 -16.9132 -16.8042 -16.8042 -16.7807 -16.7807 -16.7050 -16.7050 -16.4995 -16.4995 -16.3956 -16.3956 -16.3796 -16.3796 -13.1958 -13.1958 -13.1951 -13.1951 -5.9637 -5.9637 -5.9548 -5.9548 -4.0580 -4.0580 -4.0346 -4.0346 -3.9072 -3.9072 -2.1069 -2.1069 -2.0609 -2.0609 -1.4617 -1.4617 -0.8947 -0.8947 -0.7789 -0.7789 -0.5853 -0.5853 -0.5482 -0.5482 0.5133 0.5133 0.8277 0.8277 0.9674 0.9674 1.8073 1.8073 1.8666 1.8666 2.0616 2.0616 2.1229 2.1229 2.1456 2.1456 2.1847 2.1847 2.2154 2.2154 2.2760 2.2760 2.3541 2.3541 2.3969 2.3969 2.4874 2.4874 2.5429 2.5429 2.9711 2.9711 3.1657 3.1657 8.4949 8.4949 11.6472 11.6472 12.0373 12.0373 12.1704 12.1704 12.2825 12.2825 12.7586 12.7586 13.0692 13.0692 13.2353 13.2353 k = 0.5966 0.0098 0.3619 ( 14858 PWs) bands (ev): -44.6796 -44.6796 -17.0947 -17.0947 -16.9547 -16.9547 -16.9118 -16.9118 -16.8104 -16.8104 -16.7842 -16.7842 -16.7072 -16.7072 -16.4970 -16.4970 -16.3937 -16.3937 -16.3788 -16.3788 -13.1962 -13.1962 -13.1956 -13.1956 -5.9642 -5.9642 -5.9545 -5.9545 -4.0587 -4.0587 -4.0342 -4.0342 -3.9060 -3.9060 -2.1078 -2.1078 -2.0579 -2.0579 -1.4598 -1.4598 -0.8999 -0.8999 -0.7666 -0.7666 -0.5778 -0.5778 -0.5400 -0.5400 0.5231 0.5231 0.8243 0.8243 0.9582 0.9582 1.7991 1.7991 1.8626 1.8626 2.0600 2.0600 2.1240 2.1240 2.1452 2.1452 2.1761 2.1761 2.2102 2.2102 2.2731 2.2731 2.3546 2.3546 2.3914 2.3914 2.4856 2.4856 2.5421 2.5421 2.9561 2.9561 3.1683 3.1683 8.5042 8.5042 11.6827 11.6827 12.0286 12.0286 12.1389 12.1389 12.2677 12.2677 12.7816 12.7816 13.1043 13.1043 13.3010 13.3010 k = 0.6023-0.0066 0.3711 ( 14853 PWs) bands (ev): -44.6796 -44.6796 -17.0905 -17.0905 -16.9535 -16.9535 -16.9105 -16.9105 -16.8165 -16.8165 -16.7873 -16.7873 -16.7093 -16.7093 -16.4946 -16.4946 -16.3917 -16.3917 -16.3781 -16.3781 -13.1965 -13.1965 -13.1961 -13.1961 -5.9647 -5.9647 -5.9542 -5.9542 -4.0595 -4.0595 -4.0338 -4.0338 -3.9049 -3.9049 -2.1094 -2.1094 -2.0544 -2.0544 -1.4581 -1.4581 -0.9058 -0.9058 -0.7545 -0.7545 -0.5702 -0.5702 -0.5323 -0.5323 0.5318 0.5318 0.8216 0.8216 0.9495 0.9495 1.7909 1.7909 1.8590 1.8590 2.0580 2.0580 2.1238 2.1238 2.1446 2.1446 2.1687 2.1687 2.2051 2.2051 2.2712 2.2712 2.3562 2.3562 2.3866 2.3866 2.4841 2.4841 2.5416 2.5416 2.9418 2.9418 3.1710 3.1710 8.5127 8.5127 11.7156 11.7156 12.0108 12.0108 12.1183 12.1183 12.2496 12.2496 12.8071 12.8071 13.1431 13.1431 13.3702 13.3702 k = 0.6080-0.0230 0.3804 ( 14855 PWs) bands (ev): -44.6796 -44.6796 -17.0865 -17.0865 -16.9524 -16.9524 -16.9094 -16.9094 -16.8221 -16.8221 -16.7902 -16.7902 -16.7116 -16.7116 -16.4925 -16.4925 -16.3899 -16.3899 -16.3775 -16.3775 -13.1968 -13.1968 -13.1965 -13.1965 -5.9651 -5.9651 -5.9539 -5.9539 -4.0603 -4.0603 -4.0334 -4.0334 -3.9040 -3.9040 -2.1116 -2.1116 -2.0506 -2.0506 -1.4567 -1.4567 -0.9124 -0.9124 -0.7429 -0.7429 -0.5625 -0.5625 -0.5254 -0.5254 0.5393 0.5393 0.8197 0.8197 0.9417 0.9417 1.7832 1.7832 1.8558 1.8558 2.0557 2.0557 2.1228 2.1228 2.1425 2.1425 2.1631 2.1631 2.2004 2.2004 2.2707 2.2707 2.3587 2.3587 2.3825 2.3825 2.4828 2.4828 2.5414 2.5414 2.9283 2.9283 3.1739 3.1739 8.5199 8.5199 11.7443 11.7443 11.9818 11.9818 12.1125 12.1125 12.2284 12.2284 12.8347 12.8347 13.1845 13.1845 13.4407 13.4407 k = 0.6136-0.0394 0.3897 ( 14847 PWs) bands (ev): -44.6796 -44.6796 -17.0826 -17.0826 -16.9515 -16.9515 -16.9086 -16.9086 -16.8269 -16.8269 -16.7927 -16.7927 -16.7138 -16.7138 -16.4905 -16.4905 -16.3882 -16.3882 -16.3770 -16.3770 -13.1971 -13.1971 -13.1968 -13.1968 -5.9655 -5.9655 -5.9536 -5.9536 -4.0611 -4.0611 -4.0330 -4.0330 -3.9031 -3.9031 -2.1143 -2.1143 -2.0466 -2.0466 -1.4555 -1.4555 -0.9196 -0.9196 -0.7319 -0.7319 -0.5548 -0.5548 -0.5196 -0.5196 0.5455 0.5455 0.8184 0.8184 0.9349 0.9349 1.7762 1.7762 1.8529 1.8529 2.0531 2.0531 2.1215 2.1215 2.1386 2.1386 2.1592 2.1592 2.1965 2.1965 2.2717 2.2717 2.3620 2.3620 2.3793 2.3793 2.4819 2.4819 2.5414 2.5414 2.9159 2.9159 3.1767 3.1767 8.5258 8.5258 11.7660 11.7660 11.9481 11.9481 12.1181 12.1181 12.2047 12.2047 12.8634 12.8634 13.2266 13.2266 13.5083 13.5083 k = 0.6193-0.0558 0.3990 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.0791 -17.0791 -16.9507 -16.9507 -16.9080 -16.9080 -16.8309 -16.8309 -16.7951 -16.7951 -16.7161 -16.7161 -16.4886 -16.4886 -16.3865 -16.3865 -16.3767 -16.3767 -13.1973 -13.1973 -13.1970 -13.1970 -5.9659 -5.9659 -5.9533 -5.9533 -4.0618 -4.0618 -4.0325 -4.0325 -3.9025 -3.9025 -2.1174 -2.1174 -2.0426 -2.0426 -1.4546 -1.4546 -0.9272 -0.9272 -0.7217 -0.7217 -0.5472 -0.5472 -0.5153 -0.5153 0.5505 0.5505 0.8177 0.8177 0.9296 0.9296 1.7704 1.7704 1.8505 1.8505 2.0502 2.0502 2.1197 2.1197 2.1342 2.1342 2.1560 2.1560 2.1933 2.1933 2.2743 2.2743 2.3657 2.3657 2.3768 2.3768 2.4814 2.4814 2.5415 2.5415 2.9047 2.9047 3.1797 3.1797 8.5302 8.5302 11.7741 11.7741 11.9204 11.9204 12.1310 12.1310 12.1787 12.1787 12.8926 12.8926 13.2664 13.2664 13.5607 13.5607 k = 0.6250-0.0722 0.4082 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0758 -17.0758 -16.9501 -16.9501 -16.9078 -16.9078 -16.8340 -16.8340 -16.7971 -16.7971 -16.7185 -16.7185 -16.4870 -16.4870 -16.3851 -16.3851 -16.3764 -16.3764 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1208 -2.1208 -2.0387 -2.0387 -1.4541 -1.4541 -0.9352 -0.9352 -0.7125 -0.7125 -0.5399 -0.5399 -0.5127 -0.5127 0.5542 0.5542 0.8173 0.8173 0.9259 0.9259 1.7661 1.7661 1.8488 1.8488 2.0471 2.0471 2.1174 2.1174 2.1305 2.1305 2.1529 2.1529 2.1908 2.1908 2.2786 2.2786 2.3697 2.3697 2.3754 2.3754 2.4812 2.4812 2.5419 2.5419 2.8949 2.8949 3.1826 3.1826 8.5329 8.5329 11.7604 11.7604 11.9092 11.9092 12.1486 12.1486 12.1514 12.1514 12.9209 12.9209 13.2998 13.2998 13.5809 13.5809 k = 0.6250-0.0722 0.4082 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0758 -17.0758 -16.9501 -16.9501 -16.9078 -16.9078 -16.8340 -16.8340 -16.7971 -16.7971 -16.7185 -16.7185 -16.4870 -16.4870 -16.3851 -16.3851 -16.3764 -16.3764 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1208 -2.1208 -2.0387 -2.0387 -1.4541 -1.4541 -0.9352 -0.9352 -0.7125 -0.7125 -0.5399 -0.5399 -0.5127 -0.5127 0.5542 0.5542 0.8173 0.8173 0.9259 0.9259 1.7661 1.7661 1.8488 1.8488 2.0471 2.0471 2.1174 2.1174 2.1305 2.1305 2.1529 2.1529 2.1908 2.1908 2.2786 2.2786 2.3697 2.3697 2.3754 2.3754 2.4812 2.4812 2.5419 2.5419 2.8949 2.8949 3.1826 3.1826 8.5329 8.5329 11.7604 11.7604 11.9092 11.9092 12.1486 12.1486 12.1514 12.1514 12.9209 12.9209 13.2998 13.2998 13.5809 13.5809 k = 0.6154-0.0666 0.4240 ( 14870 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9500 -16.9500 -16.9077 -16.9077 -16.8342 -16.8342 -16.7972 -16.7972 -16.7182 -16.7182 -16.4871 -16.4871 -16.3851 -16.3851 -16.3763 -16.3763 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1205 -2.1205 -2.0390 -2.0390 -1.4541 -1.4541 -0.9345 -0.9345 -0.7134 -0.7134 -0.5394 -0.5394 -0.5127 -0.5127 0.5544 0.5544 0.8173 0.8173 0.9254 0.9254 1.7662 1.7662 1.8482 1.8482 2.0477 2.0477 2.1170 2.1170 2.1305 2.1305 2.1537 2.1537 2.1910 2.1910 2.2785 2.2785 2.3689 2.3689 2.3745 2.3745 2.4816 2.4816 2.5416 2.5416 2.8950 2.8950 3.1824 3.1824 8.5331 8.5331 11.7614 11.7614 11.9101 11.9101 12.1463 12.1463 12.1562 12.1562 12.9226 12.9226 13.2980 13.2980 13.5683 13.5683 k = 0.6058-0.0611 0.4397 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9497 -16.9497 -16.9076 -16.9076 -16.8349 -16.8349 -16.7977 -16.7977 -16.7173 -16.7173 -16.4873 -16.4873 -16.3853 -16.3853 -16.3761 -16.3761 -13.1976 -13.1976 -13.1972 -13.1972 -5.9663 -5.9663 -5.9531 -5.9531 -4.0624 -4.0624 -4.0322 -4.0322 -3.9019 -3.9019 -2.1195 -2.1195 -2.0397 -2.0397 -1.4539 -1.4539 -0.9325 -0.9325 -0.7161 -0.7161 -0.5379 -0.5379 -0.5125 -0.5125 0.5552 0.5552 0.8171 0.8171 0.9242 0.9242 1.7666 1.7666 1.8465 1.8465 2.0495 2.0495 2.1160 2.1160 2.1308 2.1308 2.1558 2.1558 2.1918 2.1918 2.2784 2.2784 2.3666 2.3666 2.3721 2.3721 2.4825 2.4825 2.5407 2.5407 2.8956 2.8956 3.1817 3.1817 8.5338 8.5338 11.7643 11.7643 11.9126 11.9126 12.1430 12.1430 12.1671 12.1671 12.9278 12.9278 13.2926 13.2926 13.5349 13.5349 k = 0.5962-0.0555 0.4554 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9491 -16.9491 -16.9073 -16.9073 -16.8361 -16.8361 -16.7983 -16.7983 -16.7159 -16.7159 -16.4877 -16.4877 -16.3855 -16.3855 -16.3757 -16.3757 -13.1976 -13.1976 -13.1972 -13.1972 -5.9662 -5.9662 -5.9532 -5.9532 -4.0623 -4.0623 -4.0323 -4.0323 -3.9018 -3.9018 -2.1180 -2.1180 -2.0409 -2.0409 -1.4537 -1.4537 -0.9292 -0.9292 -0.7204 -0.7204 -0.5355 -0.5355 -0.5123 -0.5123 0.5564 0.5564 0.8170 0.8170 0.9221 0.9221 1.7672 1.7672 1.8438 1.8438 2.0524 2.0524 2.1143 2.1143 2.1316 2.1316 2.1589 2.1589 2.1931 2.1931 2.2782 2.2782 2.3628 2.3628 2.3683 2.3683 2.4841 2.4841 2.5393 2.5393 2.8964 2.8964 3.1805 3.1805 8.5349 8.5349 11.7691 11.7691 11.9168 11.9168 12.1385 12.1385 12.1841 12.1841 12.9358 12.9358 13.2831 13.2831 13.4890 13.4890 k = 0.5865-0.0500 0.4711 ( 14852 PWs) bands (ev): -44.6796 -44.6796 -17.0759 -17.0759 -16.9483 -16.9483 -16.9069 -16.9069 -16.8378 -16.8378 -16.7992 -16.7992 -16.7142 -16.7142 -16.4882 -16.4882 -16.3859 -16.3859 -16.3753 -16.3753 -13.1977 -13.1977 -13.1973 -13.1973 -5.9662 -5.9662 -5.9532 -5.9532 -4.0621 -4.0621 -4.0325 -4.0325 -3.9017 -3.9017 -2.1158 -2.1158 -2.0426 -2.0426 -1.4533 -1.4533 -0.9246 -0.9246 -0.7263 -0.7263 -0.5325 -0.5325 -0.5120 -0.5120 0.5580 0.5580 0.8169 0.8169 0.9194 0.9194 1.7680 1.7680 1.8401 1.8401 2.0561 2.0561 2.1121 2.1121 2.1331 2.1331 2.1626 2.1626 2.1950 2.1950 2.2780 2.2780 2.3575 2.3575 2.3633 2.3633 2.4860 2.4860 2.5375 2.5375 2.8975 2.8975 3.1790 3.1790 8.5364 8.5364 11.7760 11.7760 11.9225 11.9225 12.1323 12.1323 12.2074 12.2074 12.9458 12.9458 13.2687 13.2687 13.4378 13.4378 k = 0.5769-0.0444 0.4868 ( 14858 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9474 -16.9474 -16.9064 -16.9064 -16.8398 -16.8398 -16.8000 -16.8000 -16.7122 -16.7122 -16.4887 -16.4887 -16.3862 -16.3862 -16.3748 -16.3748 -13.1977 -13.1977 -13.1974 -13.1974 -5.9661 -5.9661 -5.9533 -5.9533 -4.0619 -4.0619 -4.0327 -4.0327 -3.9015 -3.9015 -2.1131 -2.1131 -2.0448 -2.0448 -1.4529 -1.4529 -0.9189 -0.9189 -0.7334 -0.7334 -0.5291 -0.5291 -0.5115 -0.5115 0.5599 0.5599 0.8168 0.8168 0.9159 0.9159 1.7691 1.7691 1.8358 1.8358 2.0603 2.0603 2.1096 2.1096 2.1354 2.1354 2.1665 2.1665 2.1975 2.1975 2.2777 2.2777 2.3508 2.3508 2.3573 2.3573 2.4883 2.4883 2.5352 2.5352 2.8988 2.8988 3.1772 3.1772 8.5382 8.5382 11.7850 11.7850 11.9295 11.9295 12.1244 12.1244 12.2368 12.2368 12.9560 12.9560 13.2477 13.2477 13.3886 13.3886 k = 0.5673-0.0389 0.5025 ( 14863 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9464 -16.9464 -16.9058 -16.9058 -16.8421 -16.8421 -16.8009 -16.8009 -16.7101 -16.7101 -16.4894 -16.4894 -16.3865 -16.3865 -16.3744 -16.3744 -13.1978 -13.1978 -13.1974 -13.1974 -5.9660 -5.9660 -5.9534 -5.9534 -4.0617 -4.0617 -4.0329 -4.0329 -3.9013 -3.9013 -2.1098 -2.1098 -2.0474 -2.0474 -1.4525 -1.4525 -0.9120 -0.9120 -0.7416 -0.7416 -0.5255 -0.5255 -0.5110 -0.5110 0.5620 0.5620 0.8169 0.8169 0.9120 0.9120 1.7703 1.7703 1.8310 1.8310 2.0649 2.0649 2.1070 2.1070 2.1384 2.1384 2.1705 2.1705 2.2007 2.2007 2.2775 2.2775 2.3427 2.3427 2.3508 2.3508 2.4908 2.4908 2.5327 2.5327 2.9002 2.9002 3.1751 3.1751 8.5402 8.5402 11.7961 11.7961 11.9376 11.9376 12.1146 12.1146 12.2719 12.2719 12.9632 12.9632 13.2181 13.2181 13.3486 13.3486 k = 0.5577-0.0333 0.5182 ( 14867 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9453 -16.9453 -16.9052 -16.9052 -16.8445 -16.8445 -16.8017 -16.8017 -16.7080 -16.7080 -16.4901 -16.4901 -16.3868 -16.3868 -16.3739 -16.3739 -13.1979 -13.1979 -13.1975 -13.1975 -5.9659 -5.9659 -5.9535 -5.9535 -4.0615 -4.0615 -4.0331 -4.0331 -3.9011 -3.9011 -2.1061 -2.1061 -2.0504 -2.0504 -1.4520 -1.4520 -0.9041 -0.9041 -0.7507 -0.7507 -0.5219 -0.5219 -0.5102 -0.5102 0.5642 0.5642 0.8173 0.8173 0.9076 0.9076 1.7717 1.7717 1.8258 1.8258 2.0694 2.0694 2.1043 2.1043 2.1422 2.1422 2.1741 2.1741 2.2045 2.2045 2.2772 2.2772 2.3336 2.3336 2.3438 2.3438 2.4935 2.4935 2.5299 2.5299 2.9016 2.9016 3.1730 3.1730 8.5424 8.5424 11.8092 11.8092 11.9465 11.9465 12.1028 12.1028 12.3125 12.3125 12.9616 12.9616 13.1838 13.1838 13.3219 13.3219 k = 0.5481-0.0278 0.5339 ( 14865 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9442 -16.9442 -16.9044 -16.9044 -16.8470 -16.8470 -16.8024 -16.8024 -16.7061 -16.7061 -16.4907 -16.4907 -16.3871 -16.3871 -16.3735 -16.3735 -13.1979 -13.1979 -13.1976 -13.1976 -5.9659 -5.9659 -5.9536 -5.9536 -4.0613 -4.0613 -4.0334 -4.0334 -3.9009 -3.9009 -2.1020 -2.1020 -2.0539 -2.0539 -1.4514 -1.4514 -0.8953 -0.8953 -0.7603 -0.7603 -0.5188 -0.5188 -0.5093 -0.5093 0.5663 0.5663 0.8178 0.8178 0.9030 0.9030 1.7733 1.7733 1.8207 1.8207 2.0738 2.0738 2.1018 2.1018 2.1467 2.1467 2.1772 2.1772 2.2091 2.2091 2.2768 2.2768 2.3239 2.3239 2.3368 2.3368 2.4962 2.4962 2.5270 2.5270 2.9030 2.9030 3.1709 3.1709 8.5446 8.5446 11.8243 11.8243 11.9559 11.9559 12.0888 12.0888 12.3580 12.3580 12.9434 12.9434 13.1557 13.1557 13.3070 13.3070 k = 0.5385-0.0222 0.5496 ( 14851 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9432 -16.9432 -16.9037 -16.9037 -16.8494 -16.8494 -16.8030 -16.8030 -16.7043 -16.7043 -16.4913 -16.4913 -16.3873 -16.3873 -16.3732 -16.3732 -13.1980 -13.1980 -13.1977 -13.1977 -5.9658 -5.9658 -5.9536 -5.9536 -4.0611 -4.0611 -4.0336 -4.0336 -3.9007 -3.9007 -2.0976 -2.0976 -2.0577 -2.0577 -1.4509 -1.4509 -0.8860 -0.8860 -0.7703 -0.7703 -0.5162 -0.5162 -0.5081 -0.5081 0.5683 0.5683 0.8186 0.8186 0.8985 0.8985 1.7750 1.7750 1.8156 1.8156 2.0778 2.0778 2.0993 2.0993 2.1518 2.1518 2.1793 2.1793 2.2143 2.2143 2.2760 2.2760 2.3144 2.3144 2.3300 2.3300 2.4989 2.4989 2.5241 2.5241 2.9042 2.9042 3.1689 3.1689 8.5468 8.5468 11.8413 11.8413 11.9654 11.9654 12.0725 12.0725 12.4079 12.4079 12.9048 12.9048 13.1408 13.1408 13.3012 13.3012 k = 0.5288-0.0167 0.5653 ( 14839 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9423 -16.9423 -16.9031 -16.9031 -16.8515 -16.8515 -16.8035 -16.8035 -16.7028 -16.7028 -16.4918 -16.4918 -16.3874 -16.3874 -16.3729 -16.3729 -13.1980 -13.1980 -13.1978 -13.1978 -5.9657 -5.9657 -5.9537 -5.9537 -4.0609 -4.0609 -4.0338 -4.0338 -3.9005 -3.9005 -2.0928 -2.0928 -2.0619 -2.0619 -1.4505 -1.4505 -0.8765 -0.8765 -0.7802 -0.7802 -0.5144 -0.5144 -0.5067 -0.5067 0.5699 0.5699 0.8196 0.8196 0.8943 0.8943 1.7766 1.7766 1.8111 1.8111 2.0812 2.0812 2.0970 2.0970 2.1572 2.1572 2.1803 2.1803 2.2199 2.2199 2.2743 2.2743 2.3063 2.3063 2.3237 2.3237 2.5015 2.5015 2.5213 2.5213 2.9052 2.9052 3.1673 3.1673 8.5487 8.5487 11.8597 11.8597 11.9747 11.9747 12.0539 12.0539 12.4613 12.4613 12.8518 12.8518 13.1354 13.1354 13.3030 13.3030 k = 0.5192-0.0111 0.5810 ( 14829 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9417 -16.9417 -16.9026 -16.9026 -16.8531 -16.8531 -16.8039 -16.8039 -16.7017 -16.7017 -16.4922 -16.4922 -16.3875 -16.3875 -16.3727 -16.3727 -13.1981 -13.1981 -13.1979 -13.1979 -5.9657 -5.9657 -5.9537 -5.9537 -4.0608 -4.0608 -4.0339 -4.0339 -3.9004 -3.9004 -2.0879 -2.0879 -2.0663 -2.0663 -1.4501 -1.4501 -0.8676 -0.8676 -0.7893 -0.7893 -0.5132 -0.5132 -0.5054 -0.5054 0.5712 0.5712 0.8206 0.8206 0.8908 0.8908 1.7780 1.7780 1.8073 1.8073 2.0840 2.0840 2.0950 2.0950 2.1629 2.1629 2.1800 2.1800 2.2256 2.2256 2.2708 2.2708 2.3008 2.3008 2.3185 2.3185 2.5040 2.5040 2.5186 2.5186 2.9060 2.9060 3.1660 3.1660 8.5503 8.5503 11.8788 11.8788 11.9832 11.9832 12.0338 12.0338 12.5166 12.5166 12.7929 12.7929 13.1336 13.1336 13.3098 13.3098 k = 0.5096-0.0056 0.5967 ( 14833 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9412 -16.9412 -16.9022 -16.9022 -16.8541 -16.8541 -16.8041 -16.8041 -16.7010 -16.7010 -16.4925 -16.4925 -16.3876 -16.3876 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0607 -4.0607 -4.0340 -4.0340 -3.9003 -3.9003 -2.0831 -2.0831 -2.0708 -2.0708 -1.4499 -1.4499 -0.8606 -0.8606 -0.7964 -0.7964 -0.5126 -0.5126 -0.5045 -0.5045 0.5719 0.5719 0.8214 0.8214 0.8884 0.8884 1.7790 1.7790 1.8048 1.8048 2.0860 2.0860 2.0935 2.0935 2.1682 2.1682 2.1782 2.1782 2.2304 2.2304 2.2665 2.2665 2.2984 2.2984 2.3148 2.3148 2.5060 2.5060 2.5164 2.5164 2.9064 2.9064 3.1652 3.1652 8.5513 8.5513 11.8960 11.8960 11.9898 11.9898 12.0149 12.0149 12.5692 12.5692 12.7369 12.7369 13.1326 13.1326 13.3173 13.3173 k = 0.5000-0.0000 0.6124 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9411 -16.9411 -16.9021 -16.9021 -16.8544 -16.8544 -16.8042 -16.8042 -16.7008 -16.7008 -16.4926 -16.4926 -16.3876 -16.3876 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0607 -4.0607 -4.0340 -4.0340 -3.9002 -3.9002 -2.0801 -2.0801 -2.0737 -2.0737 -1.4498 -1.4498 -0.8578 -0.8578 -0.7992 -0.7992 -0.5123 -0.5123 -0.5041 -0.5041 0.5722 0.5722 0.8217 0.8217 0.8875 0.8875 1.7793 1.7793 1.8040 1.8040 2.0867 2.0867 2.0929 2.0929 2.1717 2.1717 2.1760 2.1760 2.2324 2.2324 2.2643 2.2643 2.2979 2.2979 2.3135 2.3135 2.5069 2.5069 2.5155 2.5155 2.9066 2.9066 3.1649 3.1649 8.5517 8.5517 11.9044 11.9044 11.9912 11.9912 12.0068 12.0068 12.5982 12.5982 12.7067 12.7067 13.1321 13.1321 13.3207 13.3207 k = 0.5000-0.0000 0.6124 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0760 -17.0760 -16.9411 -16.9411 -16.9021 -16.9021 -16.8544 -16.8544 -16.8042 -16.8042 -16.7008 -16.7008 -16.4926 -16.4926 -16.3876 -16.3876 -16.3726 -16.3726 -13.1981 -13.1981 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0607 -4.0607 -4.0340 -4.0340 -3.9002 -3.9002 -2.0801 -2.0801 -2.0737 -2.0737 -1.4498 -1.4498 -0.8578 -0.8578 -0.7992 -0.7992 -0.5123 -0.5123 -0.5041 -0.5041 0.5722 0.5722 0.8217 0.8217 0.8875 0.8875 1.7793 1.7793 1.8040 1.8040 2.0867 2.0867 2.0929 2.0929 2.1717 2.1717 2.1760 2.1760 2.2324 2.2324 2.2643 2.2643 2.2979 2.2979 2.3135 2.3135 2.5069 2.5069 2.5155 2.5155 2.9066 2.9066 3.1649 3.1649 8.5517 8.5517 11.9044 11.9044 11.9912 11.9912 12.0068 12.0068 12.5982 12.5982 12.7067 12.7067 13.1321 13.1321 13.3207 13.3207 k = 0.5000 0.0115 0.5960 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0763 -17.0763 -16.9413 -16.9413 -16.9023 -16.9023 -16.8535 -16.8535 -16.8040 -16.8040 -16.7008 -16.7008 -16.4926 -16.4926 -16.3877 -16.3877 -16.3727 -16.3727 -13.1980 -13.1980 -13.1980 -13.1980 -5.9656 -5.9656 -5.9538 -5.9538 -4.0606 -4.0606 -4.0340 -4.0340 -3.9003 -3.9003 -2.0802 -2.0802 -2.0738 -2.0738 -1.4499 -1.4499 -0.8577 -0.8577 -0.7994 -0.7994 -0.5130 -0.5130 -0.5051 -0.5051 0.5716 0.5716 0.8211 0.8211 0.8891 0.8891 1.7799 1.7799 1.8046 1.8046 2.0868 2.0868 2.0931 2.0931 2.1711 2.1711 2.1758 2.1758 2.2329 2.2329 2.2646 2.2646 2.2983 2.2983 2.3143 2.3143 2.5069 2.5069 2.5156 2.5156 2.9075 2.9075 3.1648 3.1648 8.5510 8.5510 11.9007 11.9007 11.9834 11.9834 12.0168 12.0168 12.5988 12.5988 12.7070 12.7070 13.1295 13.1295 13.3089 13.3089 k = 0.5000 0.0231 0.5797 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.0773 -17.0773 -16.9422 -16.9422 -16.9030 -16.9030 -16.8509 -16.8509 -16.8034 -16.8034 -16.7007 -16.7007 -16.4930 -16.4930 -16.3880 -16.3880 -16.3729 -16.3729 -13.1979 -13.1979 -13.1979 -13.1979 -5.9655 -5.9655 -5.9538 -5.9538 -4.0605 -4.0605 -4.0341 -4.0341 -3.9006 -3.9006 -2.0804 -2.0804 -2.0741 -2.0741 -1.4504 -1.4504 -0.8576 -0.8576 -0.8003 -0.8003 -0.5151 -0.5151 -0.5078 -0.5078 0.5696 0.5696 0.8198 0.8198 0.8936 0.8936 1.7817 1.7817 1.8066 1.8066 2.0870 2.0870 2.0936 2.0936 2.1694 2.1694 2.1756 2.1756 2.2342 2.2342 2.2653 2.2653 2.2995 2.2995 2.3168 2.3168 2.5070 2.5070 2.5159 2.5159 2.9104 2.9104 3.1646 3.1646 8.5488 8.5488 11.8892 11.8892 11.9750 11.9750 12.0322 12.0322 12.6004 12.6004 12.7081 12.7081 13.1217 13.1217 13.2772 13.2772 k = 0.5000 0.0346 0.5634 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.0790 -17.0790 -16.9434 -16.9434 -16.9039 -16.9039 -16.8468 -16.8468 -16.8024 -16.8024 -16.7005 -16.7005 -16.4935 -16.4935 -16.3885 -16.3885 -16.3734 -16.3734 -13.1978 -13.1978 -13.1977 -13.1977 -5.9654 -5.9654 -5.9539 -5.9539 -4.0602 -4.0602 -4.0342 -4.0342 -3.9010 -3.9010 -2.0810 -2.0810 -2.0744 -2.0744 -1.4512 -1.4512 -0.8573 -0.8573 -0.8017 -0.8017 -0.5185 -0.5185 -0.5123 -0.5123 0.5664 0.5664 0.8182 0.8182 0.9003 0.9003 1.7846 1.7846 1.8099 1.8099 2.0870 2.0870 2.0947 2.0947 2.1665 2.1665 2.1755 2.1755 2.2361 2.2361 2.2665 2.2665 2.3012 2.3012 2.3210 2.3210 2.5070 2.5070 2.5165 2.5165 2.9150 2.9150 3.1642 3.1642 8.5453 8.5453 11.8699 11.8699 11.9714 11.9714 12.0480 12.0480 12.6027 12.6027 12.7099 12.7099 13.1089 13.1089 13.2337 13.2337 k = 0.5000 0.0462 0.5471 ( 14846 PWs) bands (ev): -44.6796 -44.6796 -17.0812 -17.0812 -16.9450 -16.9450 -16.9051 -16.9051 -16.8414 -16.8414 -16.8011 -16.8011 -16.7003 -16.7003 -16.4942 -16.4942 -16.3893 -16.3893 -16.3740 -16.3740 -13.1976 -13.1976 -13.1975 -13.1975 -5.9652 -5.9652 -5.9540 -5.9540 -4.0599 -4.0599 -4.0344 -4.0344 -3.9016 -3.9016 -2.0820 -2.0820 -2.0746 -2.0746 -1.4522 -1.4522 -0.8570 -0.8570 -0.8037 -0.8037 -0.5233 -0.5233 -0.5181 -0.5181 0.5617 0.5617 0.8169 0.8169 0.9087 0.9087 1.7885 1.7885 1.8143 1.8143 2.0865 2.0865 2.0966 2.0966 2.1627 2.1627 2.1760 2.1760 2.2384 2.2384 2.2681 2.2681 2.3034 2.3034 2.3269 2.3269 2.5070 2.5070 2.5173 2.5173 2.9214 2.9214 3.1637 3.1637 8.5404 8.5404 11.8443 11.8443 11.9721 11.9721 12.0633 12.0633 12.6053 12.6053 12.7125 12.7125 13.0907 13.0907 13.1858 13.1858 k = 0.5000 0.0577 0.5307 ( 14864 PWs) bands (ev): -44.6796 -44.6796 -17.0839 -17.0839 -16.9468 -16.9468 -16.9065 -16.9065 -16.8350 -16.8350 -16.7995 -16.7995 -16.6999 -16.6999 -16.4952 -16.4952 -16.3902 -16.3902 -16.3747 -16.3747 -13.1974 -13.1974 -13.1971 -13.1971 -5.9649 -5.9649 -5.9542 -5.9542 -4.0595 -4.0595 -4.0345 -4.0345 -3.9024 -3.9024 -2.0835 -2.0835 -2.0745 -2.0745 -1.4535 -1.4535 -0.8566 -0.8566 -0.8063 -0.8063 -0.5297 -0.5297 -0.5247 -0.5247 0.5556 0.5556 0.8165 0.8165 0.9182 0.9182 1.7932 1.7932 1.8198 1.8198 2.0857 2.0857 2.0991 2.0991 2.1585 2.1585 2.1771 2.1771 2.2406 2.2406 2.2701 2.2701 2.3060 2.3060 2.3343 2.3343 2.5069 2.5069 2.5186 2.5186 2.9295 2.9295 3.1630 3.1630 8.5343 8.5343 11.8140 11.8140 11.9759 11.9759 12.0782 12.0782 12.6076 12.6076 12.7158 12.7158 13.0657 13.0657 13.1403 13.1403 k = 0.5000 0.0693 0.5144 ( 14858 PWs) bands (ev): -44.6796 -44.6796 -17.0871 -17.0871 -16.9487 -16.9487 -16.9080 -16.9080 -16.8278 -16.8278 -16.7976 -16.7976 -16.6995 -16.6995 -16.4964 -16.4964 -16.3913 -16.3913 -16.3755 -16.3755 -13.1971 -13.1971 -13.1968 -13.1968 -5.9646 -5.9646 -5.9544 -5.9544 -4.0590 -4.0590 -4.0347 -4.0347 -3.9033 -3.9033 -2.0856 -2.0856 -2.0742 -2.0742 -1.4550 -1.4550 -0.8563 -0.8563 -0.8096 -0.8096 -0.5377 -0.5377 -0.5316 -0.5316 0.5482 0.5482 0.8171 0.8171 0.9284 0.9284 1.7985 1.7985 1.8261 1.8261 2.0845 2.0845 2.1021 2.1021 2.1541 2.1541 2.1790 2.1790 2.2426 2.2426 2.2725 2.2725 2.3093 2.3093 2.3429 2.3429 2.5067 2.5067 2.5203 2.5203 2.9391 2.9391 3.1623 3.1623 8.5269 8.5269 11.7803 11.7803 11.9820 11.9820 12.0927 12.0927 12.6089 12.6089 12.7196 12.7196 13.0316 13.0316 13.1030 13.1030 k = 0.5000 0.0808 0.4981 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0907 -17.0907 -16.9506 -16.9506 -16.9095 -16.9095 -16.8199 -16.8199 -16.7954 -16.7954 -16.6991 -16.6991 -16.4978 -16.4978 -16.3926 -16.3926 -16.3765 -16.3765 -13.1968 -13.1968 -13.1963 -13.1963 -5.9643 -5.9643 -5.9546 -5.9546 -4.0585 -4.0585 -4.0349 -4.0349 -3.9044 -3.9044 -2.0882 -2.0882 -2.0737 -2.0737 -1.4568 -1.4568 -0.8560 -0.8560 -0.8136 -0.8136 -0.5470 -0.5470 -0.5387 -0.5387 0.5395 0.5395 0.8188 0.8188 0.9391 0.9391 1.8042 1.8042 1.8332 1.8332 2.0830 2.0830 2.1053 2.1053 2.1500 2.1500 2.1817 2.1817 2.2443 2.2443 2.2750 2.2750 2.3136 2.3136 2.3523 2.3523 2.5065 2.5065 2.5224 2.5224 2.9500 2.9500 3.1614 3.1614 8.5186 8.5186 11.7440 11.7440 11.9898 11.9898 12.1070 12.1070 12.6087 12.6087 12.7231 12.7231 12.9908 12.9908 13.0749 13.0749 k = 0.5000 0.0924 0.4817 ( 14856 PWs) bands (ev): -44.6796 -44.6796 -17.0945 -17.0945 -16.9525 -16.9525 -16.9111 -16.9111 -16.8116 -16.8116 -16.7931 -16.7931 -16.6985 -16.6985 -16.4995 -16.4995 -16.3942 -16.3942 -16.3775 -16.3775 -13.1964 -13.1964 -13.1959 -13.1959 -5.9639 -5.9639 -5.9548 -5.9548 -4.0580 -4.0580 -4.0351 -4.0351 -3.9055 -3.9055 -2.0911 -2.0911 -2.0730 -2.0730 -1.4587 -1.4587 -0.8560 -0.8560 -0.8181 -0.8181 -0.5571 -0.5571 -0.5459 -0.5459 0.5296 0.5296 0.8215 0.8215 0.9500 0.9500 1.8102 1.8102 1.8407 1.8407 2.0812 2.0812 2.1081 2.1081 2.1467 2.1467 2.1854 2.1854 2.2455 2.2455 2.2775 2.2775 2.3189 2.3189 2.3623 2.3623 2.5063 2.5063 2.5249 2.5249 2.9622 2.9622 3.1604 3.1604 8.5093 8.5093 11.7058 11.7058 11.9989 11.9989 12.1212 12.1212 12.6064 12.6064 12.7252 12.7252 12.9500 12.9500 13.0524 13.0524 k = 0.5000 0.1039 0.4654 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.0985 -17.0985 -16.9542 -16.9542 -16.9127 -16.9127 -16.8032 -16.8032 -16.7903 -16.7903 -16.6979 -16.6979 -16.5013 -16.5013 -16.3958 -16.3958 -16.3786 -16.3786 -13.1960 -13.1960 -13.1953 -13.1953 -5.9635 -5.9635 -5.9550 -5.9550 -4.0574 -4.0574 -4.0352 -4.0352 -3.9068 -3.9068 -2.0943 -2.0943 -2.0721 -2.0721 -1.4608 -1.4608 -0.8565 -0.8565 -0.8230 -0.8230 -0.5678 -0.5678 -0.5531 -0.5531 0.5188 0.5188 0.8251 0.8251 0.9610 0.9610 1.8162 1.8162 1.8485 1.8485 2.0794 2.0794 2.1099 2.1099 2.1447 2.1447 2.1898 2.1898 2.2464 2.2464 2.2802 2.2802 2.3254 2.3254 2.3725 2.3725 2.5061 2.5061 2.5278 2.5278 2.9753 2.9753 3.1593 3.1593 8.4992 8.4992 11.6662 11.6662 12.0092 12.0092 12.1353 12.1353 12.6016 12.6016 12.7236 12.7236 12.9148 12.9148 13.0336 13.0336 k = 0.5000 0.1155 0.4491 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.1026 -17.1026 -16.9559 -16.9559 -16.9142 -16.9142 -16.7954 -16.7954 -16.7867 -16.7867 -16.6972 -16.6972 -16.5035 -16.5035 -16.3976 -16.3976 -16.3797 -16.3797 -13.1956 -13.1956 -13.1948 -13.1948 -5.9631 -5.9631 -5.9553 -5.9553 -4.0569 -4.0569 -4.0353 -4.0353 -3.9081 -3.9081 -2.0978 -2.0978 -2.0712 -2.0712 -1.4630 -1.4630 -0.8578 -0.8578 -0.8279 -0.8279 -0.5787 -0.5787 -0.5601 -0.5601 0.5073 0.5073 0.8294 0.8294 0.9720 0.9720 1.8221 1.8221 1.8564 1.8564 2.0774 2.0774 2.1099 2.1099 2.1447 2.1447 2.1949 2.1949 2.2470 2.2470 2.2831 2.2831 2.3331 2.3331 2.3827 2.3827 2.5059 2.5059 2.5311 2.5311 2.9892 2.9892 3.1581 3.1581 8.4885 8.4885 11.6258 11.6258 12.0205 12.0205 12.1495 12.1495 12.5937 12.5937 12.7158 12.7158 12.8897 12.8897 13.0178 13.0178 k = 0.5000 0.1270 0.4327 ( 14846 PWs) bands (ev): -44.6796 -44.6796 -17.1068 -17.1068 -16.9575 -16.9575 -16.9157 -16.9157 -16.7897 -16.7897 -16.7807 -16.7807 -16.6963 -16.6963 -16.5058 -16.5058 -16.3996 -16.3996 -16.3808 -16.3808 -13.1952 -13.1952 -13.1942 -13.1942 -5.9626 -5.9626 -5.9556 -5.9556 -4.0564 -4.0564 -4.0353 -4.0353 -3.9095 -3.9095 -2.1014 -2.1014 -2.0702 -2.0702 -1.4652 -1.4652 -0.8608 -0.8608 -0.8320 -0.8320 -0.5899 -0.5899 -0.5666 -0.5666 0.4953 0.4953 0.8343 0.8343 0.9827 0.9827 1.8278 1.8278 1.8642 1.8642 2.0755 2.0755 2.1081 2.1081 2.1468 2.1468 2.2002 2.2002 2.2472 2.2472 2.2863 2.2863 2.3417 2.3417 2.3927 2.3927 2.5059 2.5059 2.5348 2.5348 3.0037 3.0037 3.1569 3.1569 8.4774 8.4774 11.5852 11.5852 12.0325 12.0325 12.1636 12.1636 12.5824 12.5824 12.7007 12.7007 12.8768 12.8768 13.0053 13.0053 k = 0.5000 0.1386 0.4164 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.1109 -17.1109 -16.9590 -16.9590 -16.9172 -16.9172 -16.7862 -16.7862 -16.7725 -16.7725 -16.6954 -16.6954 -16.5084 -16.5084 -16.4016 -16.4016 -16.3820 -16.3820 -13.1947 -13.1947 -13.1936 -13.1936 -5.9622 -5.9622 -5.9558 -5.9558 -4.0560 -4.0560 -4.0353 -4.0353 -3.9109 -3.9109 -2.1052 -2.1052 -2.0692 -2.0692 -1.4675 -1.4675 -0.8657 -0.8657 -0.8348 -0.8348 -0.6010 -0.6010 -0.5724 -0.5724 0.4830 0.4830 0.8395 0.8395 0.9931 0.9931 1.8331 1.8331 1.8718 1.8718 2.0737 2.0737 2.1050 2.1050 2.1504 2.1504 2.2054 2.2054 2.2472 2.2472 2.2902 2.2902 2.3512 2.3512 2.4023 2.4023 2.5060 2.5060 2.5389 2.5389 3.0186 3.0186 3.1556 3.1556 8.4660 8.4660 11.5448 11.5448 12.0450 12.0450 12.1776 12.1776 12.5676 12.5676 12.6803 12.6803 12.8744 12.8744 12.9965 12.9965 k = 0.5000 0.1501 0.4001 ( 14830 PWs) bands (ev): -44.6796 -44.6796 -17.1149 -17.1149 -16.9604 -16.9604 -16.9186 -16.9186 -16.7835 -16.7835 -16.7636 -16.7636 -16.6945 -16.6945 -16.5112 -16.5112 -16.4037 -16.4037 -16.3830 -16.3830 -13.1943 -13.1943 -13.1930 -13.1930 -5.9617 -5.9617 -5.9561 -5.9561 -4.0557 -4.0557 -4.0352 -4.0352 -3.9123 -3.9123 -2.1090 -2.1090 -2.0681 -2.0681 -1.4698 -1.4698 -0.8727 -0.8727 -0.8362 -0.8362 -0.6120 -0.6120 -0.5775 -0.5775 0.4707 0.4707 0.8450 0.8450 1.0031 1.0031 1.8381 1.8381 1.8790 1.8790 2.0721 2.0721 2.1012 2.1012 2.1547 2.1547 2.2100 2.2100 2.2472 2.2472 2.2950 2.2950 2.3614 2.3614 2.4114 2.4114 2.5063 2.5063 2.5434 2.5434 3.0335 3.0335 3.1544 3.1544 8.4545 8.4545 11.5051 11.5051 12.0578 12.0578 12.1915 12.1915 12.5494 12.5494 12.6579 12.6579 12.8791 12.8791 12.9918 12.9918 k = 0.5000 0.1617 0.3838 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.1188 -17.1188 -16.9617 -16.9617 -16.9199 -16.9199 -16.7812 -16.7812 -16.7545 -16.7545 -16.6934 -16.6934 -16.5143 -16.5143 -16.4058 -16.4058 -16.3841 -16.3841 -13.1938 -13.1938 -13.1924 -13.1924 -5.9612 -5.9612 -5.9564 -5.9564 -4.0554 -4.0554 -4.0350 -4.0350 -3.9137 -3.9137 -2.1128 -2.1128 -2.0670 -2.0670 -1.4720 -1.4720 -0.8810 -0.8810 -0.8364 -0.8364 -0.6229 -0.6229 -0.5818 -0.5818 0.4586 0.4586 0.8505 0.8505 1.0126 1.0126 1.8426 1.8426 1.8857 1.8857 2.0707 2.0707 2.0970 2.0970 2.1594 2.1594 2.2137 2.2137 2.2470 2.2470 2.3008 2.3008 2.3719 2.3719 2.4197 2.4197 2.5067 2.5067 2.5482 2.5482 3.0483 3.0483 3.1531 3.1531 8.4431 8.4431 11.4666 11.4666 12.0706 12.0706 12.2050 12.2050 12.5291 12.5291 12.6354 12.6354 12.8880 12.8880 12.9917 12.9917 k = 0.5000 0.1732 0.3674 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.1225 -17.1225 -16.9628 -16.9628 -16.9211 -16.9211 -16.7791 -16.7791 -16.7456 -16.7456 -16.6922 -16.6922 -16.5175 -16.5175 -16.4079 -16.4079 -16.3851 -16.3851 -13.1934 -13.1934 -13.1919 -13.1919 -5.9608 -5.9608 -5.9566 -5.9566 -4.0552 -4.0552 -4.0347 -4.0347 -3.9151 -3.9151 -2.1165 -2.1165 -2.0660 -2.0660 -1.4741 -1.4741 -0.8902 -0.8902 -0.8360 -0.8360 -0.6334 -0.6334 -0.5853 -0.5853 0.4469 0.4469 0.8559 0.8559 1.0215 1.0215 1.8466 1.8466 1.8919 1.8919 2.0695 2.0695 2.0928 2.0928 2.1640 2.1640 2.2162 2.2162 2.2469 2.2469 2.3076 2.3076 2.3826 2.3826 2.4273 2.4273 2.5073 2.5073 2.5534 2.5534 3.0628 3.0628 3.1518 3.1518 8.4319 8.4319 11.4297 11.4297 12.0832 12.0832 12.2181 12.2181 12.5083 12.5083 12.6135 12.6135 12.8993 12.8993 12.9963 12.9963 k = 0.5000 0.1848 0.3511 ( 14834 PWs) bands (ev): -44.6796 -44.6796 -17.1259 -17.1259 -16.9639 -16.9639 -16.9222 -16.9222 -16.7772 -16.7772 -16.7369 -16.7369 -16.6910 -16.6910 -16.5209 -16.5209 -16.4100 -16.4100 -16.3861 -16.3861 -13.1930 -13.1930 -13.1913 -13.1913 -5.9604 -5.9604 -5.9569 -5.9569 -4.0552 -4.0552 -4.0344 -4.0344 -3.9164 -3.9164 -2.1201 -2.1201 -2.0649 -2.0649 -1.4762 -1.4762 -0.8997 -0.8997 -0.8352 -0.8352 -0.6435 -0.6435 -0.5881 -0.5881 0.4358 0.4358 0.8611 0.8611 1.0297 1.0297 1.8501 1.8501 1.8975 1.8975 2.0685 2.0685 2.0888 2.0888 2.1684 2.1684 2.2178 2.2178 2.2467 2.2467 2.3153 2.3153 2.3931 2.3931 2.4341 2.4341 2.5080 2.5080 2.5588 2.5588 3.0766 3.0766 3.1506 3.1506 8.4212 8.4212 11.3949 11.3949 12.0952 12.0952 12.2304 12.2304 12.4886 12.4886 12.5920 12.5920 12.9124 12.9124 13.0055 13.0055 k = 0.5000 0.1963 0.3348 ( 14830 PWs) bands (ev): -44.6796 -44.6796 -17.1291 -17.1291 -16.9649 -16.9649 -16.9232 -16.9232 -16.7755 -16.7755 -16.7287 -16.7287 -16.6897 -16.6897 -16.5244 -16.5244 -16.4119 -16.4119 -16.3870 -16.3870 -13.1926 -13.1926 -13.1908 -13.1908 -5.9600 -5.9600 -5.9571 -5.9571 -4.0551 -4.0551 -4.0340 -4.0340 -3.9176 -3.9176 -2.1234 -2.1234 -2.0639 -2.0639 -1.4781 -1.4781 -0.9090 -0.9090 -0.8341 -0.8341 -0.6529 -0.6529 -0.5902 -0.5902 0.4254 0.4254 0.8659 0.8659 1.0372 1.0372 1.8532 1.8532 1.9026 1.9026 2.0677 2.0677 2.0849 2.0849 2.1723 2.1723 2.2187 2.2187 2.2465 2.2465 2.3234 2.3234 2.4029 2.4029 2.4402 2.4402 2.5088 2.5088 2.5643 2.5643 3.0896 3.0896 3.1495 3.1495 8.4111 8.4111 11.3627 11.3627 12.1063 12.1063 12.2421 12.2421 12.4712 12.4712 12.5706 12.5706 12.9268 12.9268 13.0189 13.0189 k = 0.5000 0.2078 0.3184 ( 14832 PWs) bands (ev): -44.6796 -44.6796 -17.1320 -17.1320 -16.9658 -16.9658 -16.9241 -16.9241 -16.7740 -16.7740 -16.7211 -16.7211 -16.6882 -16.6882 -16.5279 -16.5279 -16.4138 -16.4138 -16.3878 -16.3878 -13.1922 -13.1922 -13.1903 -13.1903 -5.9596 -5.9596 -5.9573 -5.9573 -4.0552 -4.0552 -4.0336 -4.0336 -3.9188 -3.9188 -2.1266 -2.1266 -2.0630 -2.0630 -1.4798 -1.4798 -0.9179 -0.9179 -0.8329 -0.8329 -0.6618 -0.6618 -0.5918 -0.5918 0.4159 0.4159 0.8704 0.8704 1.0440 1.0440 1.8558 1.8558 1.9070 1.9070 2.0671 2.0671 2.0815 2.0815 2.1757 2.1757 2.2191 2.2191 2.2460 2.2460 2.3317 2.3317 2.4118 2.4118 2.4458 2.4458 2.5096 2.5096 2.5697 2.5697 3.1017 3.1017 3.1484 3.1484 8.4017 8.4017 11.3333 11.3333 12.1160 12.1160 12.2531 12.2531 12.4571 12.4571 12.5493 12.5493 12.9426 12.9426 13.0359 13.0359 k = 0.5000 0.2194 0.3021 ( 14838 PWs) bands (ev): -44.6796 -44.6796 -17.1345 -17.1345 -16.9665 -16.9665 -16.9249 -16.9249 -16.7727 -16.7727 -16.7143 -16.7143 -16.6866 -16.6866 -16.5314 -16.5314 -16.4154 -16.4154 -16.3885 -16.3885 -13.1919 -13.1919 -13.1899 -13.1899 -5.9593 -5.9593 -5.9575 -5.9575 -4.0553 -4.0553 -4.0332 -4.0332 -3.9198 -3.9198 -2.1294 -2.1294 -2.0621 -2.0621 -1.4814 -1.4814 -0.9262 -0.9262 -0.8317 -0.8317 -0.6697 -0.6697 -0.5930 -0.5930 0.4074 0.4074 0.8744 0.8744 1.0500 1.0500 1.8580 1.8580 1.9108 1.9108 2.0666 2.0666 2.0784 2.0784 2.1785 2.1785 2.2194 2.2194 2.2454 2.2454 2.3396 2.3396 2.4191 2.4191 2.4513 2.4513 2.5104 2.5104 2.5750 2.5750 3.1125 3.1125 3.1475 3.1475 8.3933 8.3933 11.3071 11.3071 12.1240 12.1240 12.2635 12.2635 12.4465 12.4465 12.5282 12.5282 12.9596 12.9596 13.0559 13.0559 k = 0.5000 0.2309 0.2858 ( 14836 PWs) bands (ev): -44.6796 -44.6796 -17.1367 -17.1367 -16.9671 -16.9671 -16.9255 -16.9255 -16.7716 -16.7716 -16.7085 -16.7085 -16.6848 -16.6848 -16.5347 -16.5347 -16.4169 -16.4169 -16.3891 -16.3891 -13.1916 -13.1916 -13.1895 -13.1895 -5.9590 -5.9590 -5.9577 -5.9577 -4.0553 -4.0553 -4.0328 -4.0328 -3.9207 -3.9207 -2.1318 -2.1318 -2.0613 -2.0613 -1.4827 -1.4827 -0.9335 -0.9335 -0.8304 -0.8304 -0.6768 -0.6768 -0.5937 -0.5937 0.4000 0.4000 0.8779 0.8779 1.0551 1.0551 1.8598 1.8598 1.9141 1.9141 2.0662 2.0662 2.0759 2.0759 2.1806 2.1806 2.2199 2.2199 2.2446 2.2446 2.3470 2.3470 2.4248 2.4248 2.4568 2.4568 2.5110 2.5110 2.5799 2.5799 3.1219 3.1219 3.1467 3.1467 8.3860 8.3860 11.2844 11.2844 12.1301 12.1301 12.2737 12.2737 12.4392 12.4392 12.5076 12.5076 12.9776 12.9776 13.0784 13.0784 k = 0.5000 0.2425 0.2694 ( 14844 PWs) bands (ev): -44.6796 -44.6796 -17.1385 -17.1385 -16.9677 -16.9677 -16.9261 -16.9261 -16.7708 -16.7708 -16.7038 -16.7038 -16.6828 -16.6828 -16.5377 -16.5377 -16.4181 -16.4181 -16.3896 -16.3896 -13.1914 -13.1914 -13.1892 -13.1892 -5.9589 -5.9589 -5.9578 -5.9578 -4.0555 -4.0555 -4.0324 -4.0324 -3.9214 -3.9214 -2.1339 -2.1339 -2.0607 -2.0607 -1.4838 -1.4838 -0.9398 -0.9398 -0.8293 -0.8293 -0.6828 -0.6828 -0.5943 -0.5943 0.3938 0.3938 0.8808 0.8808 1.0593 1.0593 1.8613 1.8613 1.9167 1.9167 2.0658 2.0658 2.0739 2.0739 2.1821 2.1821 2.2205 2.2205 2.2438 2.2438 2.3535 2.3535 2.4287 2.4287 2.4621 2.4621 2.5115 2.5115 2.5842 2.5842 3.1298 3.1298 3.1460 3.1460 8.3797 8.3797 11.2654 11.2654 12.1342 12.1342 12.2838 12.2838 12.4348 12.4348 12.4882 12.4882 12.9958 12.9958 13.1025 13.1025 k = 0.5000 0.2540 0.2531 ( 14846 PWs) bands (ev): -44.6796 -44.6796 -17.1399 -17.1399 -16.9681 -16.9681 -16.9265 -16.9265 -16.7701 -16.7701 -16.7005 -16.7005 -16.6808 -16.6808 -16.5402 -16.5402 -16.4191 -16.4191 -16.3900 -16.3900 -13.1912 -13.1912 -13.1889 -13.1889 -5.9587 -5.9587 -5.9578 -5.9578 -4.0555 -4.0555 -4.0321 -4.0321 -3.9220 -3.9220 -2.1356 -2.1356 -2.0602 -2.0602 -1.4847 -1.4847 -0.9448 -0.9448 -0.8283 -0.8283 -0.6876 -0.6876 -0.5946 -0.5946 0.3890 0.3890 0.8832 0.8832 1.0626 1.0626 1.8624 1.8624 1.9187 1.9187 2.0653 2.0653 2.0725 2.0725 2.1830 2.1830 2.2212 2.2212 2.2429 2.2429 2.3589 2.3589 2.4312 2.4312 2.4669 2.4669 2.5117 2.5117 2.5877 2.5877 3.1360 3.1360 3.1456 3.1456 8.3748 8.3748 11.2505 11.2505 12.1368 12.1368 12.2937 12.2937 12.4323 12.4323 12.4708 12.4708 13.0130 13.0130 13.1273 13.1273 k = 0.5000 0.2656 0.2368 ( 14868 PWs) bands (ev): -44.6796 -44.6796 -17.1410 -17.1410 -16.9684 -16.9684 -16.9268 -16.9268 -16.7696 -16.7696 -16.6982 -16.6982 -16.6790 -16.6790 -16.5422 -16.5422 -16.4199 -16.4199 -16.3903 -16.3903 -13.1911 -13.1911 -13.1888 -13.1888 -5.9587 -5.9587 -5.9578 -5.9578 -4.0556 -4.0556 -4.0319 -4.0319 -3.9225 -3.9225 -2.1368 -2.1368 -2.0598 -2.0598 -1.4853 -1.4853 -0.9485 -0.9485 -0.8275 -0.8275 -0.6911 -0.6911 -0.5948 -0.5948 0.3854 0.3854 0.8848 0.8848 1.0650 1.0650 1.8631 1.8631 1.9202 1.9202 2.0649 2.0649 2.0716 2.0716 2.1836 2.1836 2.2219 2.2219 2.2421 2.2421 2.3629 2.3629 2.4326 2.4326 2.4708 2.4708 2.5118 2.5118 2.5903 2.5903 3.1403 3.1403 3.1455 3.1455 8.3712 8.3712 11.2397 11.2397 12.1381 12.1381 12.3025 12.3025 12.4309 12.4309 12.4566 12.4566 13.0275 13.0275 13.1507 13.1507 k = 0.5000 0.2771 0.2205 ( 14872 PWs) bands (ev): -44.6796 -44.6796 -17.1416 -17.1416 -16.9686 -16.9686 -16.9270 -16.9270 -16.7693 -16.7693 -16.6970 -16.6970 -16.6778 -16.6778 -16.5435 -16.5435 -16.4203 -16.4203 -16.3905 -16.3905 -13.1910 -13.1910 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9227 -3.9227 -2.1375 -2.1375 -2.0596 -2.0596 -1.4857 -1.4857 -0.9507 -0.9507 -0.8270 -0.8270 -0.6932 -0.6932 -0.5949 -0.5949 0.3833 0.3833 0.8858 0.8858 1.0664 1.0664 1.8636 1.8636 1.9211 1.9211 2.0646 2.0646 2.0711 2.0711 2.1838 2.1838 2.2225 2.2225 2.2415 2.2415 2.3654 2.3654 2.4333 2.4333 2.4734 2.4734 2.5118 2.5118 2.5920 2.5920 3.1424 3.1424 3.1459 3.1459 8.3691 8.3691 11.2332 11.2332 12.1387 12.1387 12.3090 12.3090 12.4298 12.4298 12.4474 12.4474 13.0374 13.0374 13.1689 13.1689 k = 0.5000 0.2887 0.2041 ( 14902 PWs) bands (ev): -44.6796 -44.6796 -17.1418 -17.1418 -16.9687 -16.9687 -16.9270 -16.9270 -16.7692 -16.7692 -16.6966 -16.6966 -16.6773 -16.6773 -16.5439 -16.5439 -16.4205 -16.4205 -16.3905 -16.3905 -13.1909 -13.1909 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9228 -3.9228 -2.1377 -2.1377 -2.0595 -2.0595 -1.4859 -1.4859 -0.9515 -0.9515 -0.8269 -0.8269 -0.6940 -0.6940 -0.5949 -0.5949 0.3826 0.3826 0.8862 0.8862 1.0669 1.0669 1.8637 1.8637 1.9214 1.9214 2.0645 2.0645 2.0710 2.0710 2.1839 2.1839 2.2227 2.2227 2.2413 2.2413 2.3662 2.3662 2.4335 2.4335 2.4742 2.4742 2.5117 2.5117 2.5925 2.5925 3.1429 3.1429 3.1462 3.1462 8.3683 8.3683 11.2310 11.2310 12.1389 12.1389 12.3114 12.3114 12.4292 12.4292 12.4444 12.4444 13.0410 13.0410 13.1761 13.1761 k = 0.5000 0.2887 0.2041 ( 14902 PWs) bands (ev): -44.6796 -44.6796 -17.1418 -17.1418 -16.9687 -16.9687 -16.9270 -16.9270 -16.7692 -16.7692 -16.6966 -16.6966 -16.6773 -16.6773 -16.5439 -16.5439 -16.4205 -16.4205 -16.3905 -16.3905 -13.1909 -13.1909 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9228 -3.9228 -2.1377 -2.1377 -2.0595 -2.0595 -1.4859 -1.4859 -0.9515 -0.9515 -0.8269 -0.8269 -0.6940 -0.6940 -0.5949 -0.5949 0.3826 0.3826 0.8862 0.8862 1.0669 1.0669 1.8637 1.8637 1.9214 1.9214 2.0645 2.0645 2.0710 2.0710 2.1839 2.1839 2.2227 2.2227 2.2413 2.2413 2.3662 2.3662 2.4335 2.4335 2.4742 2.4742 2.5117 2.5117 2.5925 2.5925 3.1429 3.1429 3.1462 3.1462 8.3683 8.3683 11.2310 11.2310 12.1389 12.1389 12.3114 12.3114 12.4292 12.4292 12.4444 12.4444 13.0410 13.0410 13.1761 13.1761 k = 0.4943 0.2854 0.2227 ( 14872 PWs) bands (ev): -44.6796 -44.6796 -17.1416 -17.1416 -16.9686 -16.9686 -16.9270 -16.9270 -16.7693 -16.7693 -16.6970 -16.6970 -16.6777 -16.6777 -16.5435 -16.5435 -16.4203 -16.4203 -16.3905 -16.3905 -13.1910 -13.1910 -13.1886 -13.1886 -5.9586 -5.9586 -5.9578 -5.9578 -4.0557 -4.0557 -4.0318 -4.0318 -3.9227 -3.9227 -2.1375 -2.1375 -2.0596 -2.0596 -1.4857 -1.4857 -0.9507 -0.9507 -0.8270 -0.8270 -0.6933 -0.6933 -0.5949 -0.5949 0.3833 0.3833 0.8858 0.8858 1.0664 1.0664 1.8636 1.8636 1.9211 1.9211 2.0646 2.0646 2.0711 2.0711 2.1838 2.1838 2.2225 2.2225 2.2415 2.2415 2.3654 2.3654 2.4333 2.4333 2.4734 2.4734 2.5118 2.5118 2.5920 2.5920 3.1424 3.1424 3.1459 3.1459 8.3690 8.3690 11.2331 11.2331 12.1387 12.1387 12.3091 12.3091 12.4298 12.4298 12.4473 12.4473 13.0376 13.0376 13.1691 13.1691 k = 0.4886 0.2821 0.2412 ( 14874 PWs) bands (ev): -44.6796 -44.6796 -17.1410 -17.1410 -16.9684 -16.9684 -16.9268 -16.9268 -16.7695 -16.7695 -16.6982 -16.6982 -16.6790 -16.6790 -16.5423 -16.5423 -16.4199 -16.4199 -16.3903 -16.3903 -13.1911 -13.1911 -13.1888 -13.1888 -5.9587 -5.9587 -5.9578 -5.9578 -4.0556 -4.0556 -4.0319 -4.0319 -3.9225 -3.9225 -2.1368 -2.1368 -2.0598 -2.0598 -1.4854 -1.4854 -0.9486 -0.9486 -0.8275 -0.8275 -0.6912 -0.6912 -0.5948 -0.5948 0.3854 0.3854 0.8849 0.8849 1.0650 1.0650 1.8632 1.8632 1.9202 1.9202 2.0649 2.0649 2.0716 2.0716 2.1836 2.1836 2.2220 2.2220 2.2421 2.2421 2.3630 2.3630 2.4326 2.4326 2.4709 2.4709 2.5118 2.5118 2.5904 2.5904 3.1404 3.1404 3.1455 3.1455 8.3711 8.3711 11.2394 11.2394 12.1382 12.1382 12.3028 12.3028 12.4306 12.4306 12.4564 12.4564 13.0279 13.0279 13.1513 13.1513 k = 0.4830 0.2788 0.2598 ( 14853 PWs) bands (ev): -44.6796 -44.6796 -17.1400 -17.1400 -16.9681 -16.9681 -16.9265 -16.9265 -16.7700 -16.7700 -16.7003 -16.7003 -16.6807 -16.6807 -16.5403 -16.5403 -16.4192 -16.4192 -16.3900 -16.3900 -13.1912 -13.1912 -13.1889 -13.1889 -5.9587 -5.9587 -5.9578 -5.9578 -4.0555 -4.0555 -4.0321 -4.0321 -3.9221 -3.9221 -2.1356 -2.1356 -2.0602 -2.0602 -1.4847 -1.4847 -0.9450 -0.9450 -0.8282 -0.8282 -0.6878 -0.6878 -0.5946 -0.5946 0.3888 0.3888 0.8832 0.8832 1.0627 1.0627 1.8624 1.8624 1.9188 1.9188 2.0653 2.0653 2.0724 2.0724 2.1831 2.1831 2.2212 2.2212 2.2428 2.2428 2.3591 2.3591 2.4312 2.4312 2.4672 2.4672 2.5117 2.5117 2.5878 2.5878 3.1362 3.1362 3.1456 3.1456 8.3746 8.3746 11.2499 11.2499 12.1368 12.1368 12.2946 12.2946 12.4308 12.4308 12.4711 12.4711 13.0138 13.0138 13.1285 13.1285 k = 0.4773 0.2756 0.2784 ( 14855 PWs) bands (ev): -44.6796 -44.6796 -17.1386 -17.1386 -16.9677 -16.9677 -16.9261 -16.9261 -16.7707 -16.7707 -16.7036 -16.7036 -16.6827 -16.6827 -16.5378 -16.5378 -16.4182 -16.4182 -16.3896 -16.3896 -13.1914 -13.1914 -13.1892 -13.1892 -5.9588 -5.9588 -5.9578 -5.9578 -4.0555 -4.0555 -4.0324 -4.0324 -3.9215 -3.9215 -2.1340 -2.1340 -2.0607 -2.0607 -1.4839 -1.4839 -0.9402 -0.9402 -0.8292 -0.8292 -0.6831 -0.6831 -0.5943 -0.5943 0.3935 0.3935 0.8810 0.8810 1.0595 1.0595 1.8614 1.8614 1.9169 1.9169 2.0657 2.0657 2.0738 2.0738 2.1822 2.1822 2.2205 2.2205 2.2437 2.2437 2.3539 2.3539 2.4288 2.4288 2.4625 2.4625 2.5114 2.5114 2.5844 2.5844 3.1302 3.1302 3.1460 3.1460 8.3794 8.3794 11.2644 11.2644 12.1342 12.1342 12.2862 12.2862 12.4297 12.4297 12.4903 12.4903 12.9971 12.9971 13.1043 13.1043 k = 0.4716 0.2723 0.2969 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.1369 -17.1369 -16.9672 -16.9672 -16.9256 -16.9256 -16.7716 -16.7716 -16.7080 -16.7080 -16.6847 -16.6847 -16.5349 -16.5349 -16.4170 -16.4170 -16.3891 -16.3891 -13.1916 -13.1916 -13.1895 -13.1895 -5.9590 -5.9590 -5.9577 -5.9577 -4.0554 -4.0554 -4.0328 -4.0328 -3.9207 -3.9207 -2.1320 -2.1320 -2.0613 -2.0613 -1.4828 -1.4828 -0.9341 -0.9341 -0.8303 -0.8303 -0.6773 -0.6773 -0.5938 -0.5938 0.3995 0.3995 0.8782 0.8782 1.0555 1.0555 1.8599 1.8599 1.9143 1.9143 2.0660 2.0660 2.0759 2.0759 2.1808 2.1808 2.2200 2.2200 2.2444 2.2444 2.3476 2.3476 2.4250 2.4250 2.4576 2.4576 2.5108 2.5108 2.5803 2.5803 3.1225 3.1225 3.1467 3.1467 8.3854 8.3854 11.2827 11.2827 12.1298 12.1298 12.2795 12.2795 12.4267 12.4267 12.5131 12.5131 12.9799 12.9799 13.0809 13.0809 k = 0.4659 0.2690 0.3155 ( 14836 PWs) bands (ev): -44.6796 -44.6796 -17.1347 -17.1347 -16.9666 -16.9666 -16.9249 -16.9249 -16.7726 -16.7726 -16.7135 -16.7135 -16.6866 -16.6866 -16.5317 -16.5317 -16.4156 -16.4156 -16.3885 -16.3885 -13.1919 -13.1919 -13.1899 -13.1899 -5.9593 -5.9593 -5.9575 -5.9575 -4.0553 -4.0553 -4.0331 -4.0331 -3.9199 -3.9199 -2.1296 -2.1296 -2.0620 -2.0620 -1.4815 -1.4815 -0.9271 -0.9271 -0.8314 -0.8314 -0.6705 -0.6705 -0.5930 -0.5930 0.4066 0.4066 0.8748 0.8748 1.0505 1.0505 1.8582 1.8582 1.9112 1.9112 2.0661 2.0661 2.0786 2.0786 2.1787 2.1787 2.2198 2.2198 2.2449 2.2449 2.3404 2.3404 2.4194 2.4194 2.4527 2.4527 2.5099 2.5099 2.5757 2.5757 3.1133 3.1133 3.1476 3.1476 8.3926 8.3926 11.3047 11.3047 12.1231 12.1231 12.2755 12.2755 12.4214 12.4214 12.5388 12.5388 12.9636 12.9636 13.0597 13.0597 k = 0.4602 0.2657 0.3340 ( 14838 PWs) bands (ev): -44.6796 -44.6796 -17.1323 -17.1323 -16.9659 -16.9659 -16.9242 -16.9242 -16.7739 -16.7739 -16.7199 -16.7199 -16.6884 -16.6884 -16.5282 -16.5282 -16.4140 -16.4140 -16.3878 -16.3878 -13.1922 -13.1922 -13.1903 -13.1903 -5.9596 -5.9596 -5.9574 -5.9574 -4.0552 -4.0552 -4.0335 -4.0335 -3.9189 -3.9189 -2.1270 -2.1270 -2.0628 -2.0628 -1.4800 -1.4800 -0.9192 -0.9192 -0.8323 -0.8323 -0.6628 -0.6628 -0.5919 -0.5919 0.4149 0.4149 0.8709 0.8709 1.0447 1.0447 1.8560 1.8560 1.9077 1.9077 2.0662 2.0662 2.0819 2.0819 2.1760 2.1760 2.2199 2.2199 2.2449 2.2449 2.3326 2.3326 2.4121 2.4121 2.4481 2.4481 2.5086 2.5086 2.5708 2.5708 3.1026 3.1026 3.1487 3.1487 8.4008 8.4008 11.3301 11.3301 12.1143 12.1143 12.2747 12.2747 12.4132 12.4132 12.5664 12.5664 12.9500 12.9500 13.0417 13.0417 k = 0.4545 0.2624 0.3526 ( 14841 PWs) bands (ev): -44.6796 -44.6796 -17.1295 -17.1295 -16.9650 -16.9650 -16.9233 -16.9233 -16.7754 -16.7754 -16.7271 -16.7271 -16.6901 -16.6901 -16.5247 -16.5247 -16.4122 -16.4122 -16.3871 -16.3871 -13.1925 -13.1925 -13.1907 -13.1907 -5.9600 -5.9600 -5.9571 -5.9571 -4.0552 -4.0552 -4.0339 -4.0339 -3.9178 -3.9178 -2.1240 -2.1240 -2.0636 -2.0636 -1.4783 -1.4783 -0.9110 -0.9110 -0.8329 -0.8329 -0.6545 -0.6545 -0.5904 -0.5904 0.4241 0.4241 0.8666 0.8666 1.0382 1.0382 1.8533 1.8533 1.9036 1.9036 2.0661 2.0661 2.0858 2.0858 2.1728 2.1728 2.2201 2.2201 2.2442 2.2442 2.3244 2.3244 2.4035 2.4035 2.4437 2.4437 2.5068 2.5068 2.5659 2.5659 3.0907 3.0907 3.1499 3.1499 8.4098 8.4098 11.3586 11.3586 12.1040 12.1040 12.2766 12.2766 12.4018 12.4018 12.5947 12.5947 12.9407 12.9407 13.0279 13.0279 k = 0.4489 0.2592 0.3711 ( 14846 PWs) bands (ev): -44.6796 -44.6796 -17.1264 -17.1264 -16.9641 -16.9641 -16.9224 -16.9224 -16.7772 -16.7772 -16.7346 -16.7346 -16.6918 -16.6918 -16.5212 -16.5212 -16.4103 -16.4103 -16.3862 -16.3862 -13.1929 -13.1929 -13.1912 -13.1912 -5.9604 -5.9604 -5.9569 -5.9569 -4.0552 -4.0552 -4.0343 -4.0343 -3.9166 -3.9166 -2.1209 -2.1209 -2.0645 -2.0645 -1.4765 -1.4765 -0.9029 -0.9029 -0.8327 -0.8327 -0.6456 -0.6456 -0.5882 -0.5882 0.4342 0.4342 0.8619 0.8619 1.0309 1.0309 1.8500 1.8500 1.8992 1.8992 2.0660 2.0660 2.0902 2.0902 2.1690 2.1690 2.2202 2.2202 2.2426 2.2426 2.3163 2.3163 2.3941 2.3941 2.4391 2.4391 2.5047 2.5047 2.5612 2.5612 3.0776 3.0776 3.1513 3.1513 8.4197 8.4197 11.3898 11.3898 12.0928 12.0928 12.2803 12.2803 12.3868 12.3868 12.6223 12.6223 12.9374 12.9374 13.0195 13.0195 k = 0.4432 0.2559 0.3897 ( 14837 PWs) bands (ev): -44.6796 -44.6796 -17.1230 -17.1230 -16.9631 -16.9631 -16.9213 -16.9213 -16.7793 -16.7793 -16.7425 -16.7425 -16.6935 -16.6935 -16.5177 -16.5177 -16.4082 -16.4082 -16.3853 -16.3853 -13.1933 -13.1933 -13.1918 -13.1918 -5.9608 -5.9608 -5.9566 -5.9566 -4.0553 -4.0553 -4.0346 -4.0346 -3.9153 -3.9153 -2.1177 -2.1177 -2.0652 -2.0652 -1.4745 -1.4745 -0.8956 -0.8956 -0.8312 -0.8312 -0.6363 -0.6363 -0.5854 -0.5854 0.4449 0.4449 0.8569 0.8569 1.0230 1.0230 1.8462 1.8462 1.8945 1.8945 2.0659 2.0659 2.0951 2.0951 2.1650 2.1650 2.2199 2.2199 2.2399 2.2399 2.3086 2.3086 2.3847 2.3847 2.4341 2.4341 2.5022 2.5022 2.5569 2.5569 3.0637 3.0637 3.1529 3.1529 8.4301 8.4301 11.4234 11.4234 12.0817 12.0817 12.2845 12.2845 12.3683 12.3683 12.6475 12.6475 12.9413 12.9413 13.0179 13.0179 k = 0.4375 0.2526 0.4082 ( 14838 PWs) bands (ev): -44.6796 -44.6796 -17.1194 -17.1194 -16.9620 -16.9620 -16.9201 -16.9201 -16.7817 -16.7817 -16.7504 -16.7504 -16.6953 -16.6953 -16.5143 -16.5143 -16.4062 -16.4062 -16.3844 -16.3844 -13.1937 -13.1937 -13.1923 -13.1923 -5.9612 -5.9612 -5.9564 -5.9564 -4.0555 -4.0555 -4.0348 -4.0348 -3.9140 -3.9140 -2.1146 -2.1146 -2.0657 -2.0657 -1.4724 -1.4724 -0.8900 -0.8900 -0.8276 -0.8276 -0.6270 -0.6270 -0.5816 -0.5816 0.4562 0.4562 0.8517 0.8517 1.0145 1.0145 1.8416 1.8416 1.8896 1.8896 2.0656 2.0656 2.1003 2.1003 2.1608 2.1608 2.2185 2.2185 2.2363 2.2363 2.3015 2.3015 2.3759 2.3759 2.4286 2.4286 2.4996 2.4996 2.5532 2.5532 3.0489 3.0489 3.1547 3.1547 8.4409 8.4409 11.4589 11.4589 12.0712 12.0712 12.2872 12.2872 12.3468 12.3468 12.6692 12.6692 12.9525 12.9525 13.0253 13.0253 k = 0.4318 0.2493 0.4268 ( 14842 PWs) bands (ev): -44.6796 -44.6796 -17.1156 -17.1156 -16.9609 -16.9609 -16.9188 -16.9188 -16.7847 -16.7847 -16.7580 -16.7580 -16.6971 -16.6971 -16.5111 -16.5111 -16.4040 -16.4040 -16.3834 -16.3834 -13.1942 -13.1942 -13.1929 -13.1929 -5.9617 -5.9617 -5.9561 -5.9561 -4.0558 -4.0558 -4.0350 -4.0350 -3.9126 -3.9126 -2.1118 -2.1118 -2.0660 -2.0660 -1.4702 -1.4702 -0.8868 -0.8868 -0.8215 -0.8215 -0.6179 -0.6179 -0.5769 -0.5769 0.4679 0.4679 0.8465 0.8465 1.0056 1.0056 1.8362 1.8362 1.8847 1.8847 2.0652 2.0652 2.1056 2.1056 2.1567 2.1567 2.2153 2.2153 2.2322 2.2322 2.2952 2.2952 2.3682 2.3682 2.4225 2.4225 2.4969 2.4969 2.5501 2.5501 3.0337 3.0337 3.1566 3.1566 8.4520 8.4520 11.4959 11.4959 12.0619 12.0619 12.2846 12.2846 12.3250 12.3250 12.6877 12.6877 12.9691 12.9691 13.0444 13.0444 k = 0.4261 0.2460 0.4454 ( 14848 PWs) bands (ev): -44.6796 -44.6796 -17.1116 -17.1116 -16.9597 -16.9597 -16.9175 -16.9175 -16.7883 -16.7883 -16.7651 -16.7651 -16.6990 -16.6990 -16.5079 -16.5079 -16.4019 -16.4019 -16.3824 -16.3824 -13.1946 -13.1946 -13.1935 -13.1935 -5.9622 -5.9622 -5.9558 -5.9558 -4.0562 -4.0562 -4.0350 -4.0350 -3.9112 -3.9112 -2.1095 -2.1095 -2.0657 -2.0657 -1.4681 -1.4681 -0.8860 -0.8860 -0.8130 -0.8130 -0.6092 -0.6092 -0.5710 -0.5710 0.4796 0.4796 0.8413 0.8413 0.9962 0.9962 1.8300 1.8300 1.8799 1.8799 2.0647 2.0647 2.1110 2.1110 2.1528 2.1528 2.2098 2.2098 2.2283 2.2283 2.2895 2.2895 2.3620 2.3620 2.4161 2.4161 2.4942 2.4942 2.5476 2.5476 3.0180 3.0180 3.1586 3.1586 8.4631 8.4631 11.5338 11.5338 12.0541 12.0541 12.2689 12.2689 12.3103 12.3103 12.7042 12.7042 12.9890 12.9890 13.0767 13.0767 k = 0.4205 0.2427 0.4639 ( 14837 PWs) bands (ev): -44.6796 -44.6796 -17.1074 -17.1074 -16.9584 -16.9584 -16.9161 -16.9161 -16.7928 -16.7928 -16.7713 -16.7713 -16.7009 -16.7009 -16.5049 -16.5049 -16.3998 -16.3998 -16.3814 -16.3814 -13.1950 -13.1950 -13.1941 -13.1941 -5.9627 -5.9627 -5.9554 -5.9554 -4.0567 -4.0567 -4.0350 -4.0350 -3.9098 -3.9098 -2.1078 -2.1078 -2.0649 -2.0649 -1.4659 -1.4659 -0.8874 -0.8874 -0.8026 -0.8026 -0.6009 -0.6009 -0.5641 -0.5641 0.4913 0.4913 0.8364 0.8364 0.9866 0.9866 1.8230 1.8230 1.8752 1.8752 2.0639 2.0639 2.1160 2.1160 2.1495 2.1495 2.2023 2.2023 2.2244 2.2244 2.2843 2.2843 2.3576 2.3576 2.4095 2.4095 2.4917 2.4917 2.5456 2.5456 3.0022 3.0022 3.1609 3.1609 8.4741 8.4741 11.5720 11.5720 12.0478 12.0478 12.2400 12.2400 12.3022 12.3022 12.7206 12.7206 13.0118 13.0118 13.1211 13.1211 k = 0.4148 0.2395 0.4825 ( 14840 PWs) bands (ev): -44.6796 -44.6796 -17.1032 -17.1032 -16.9572 -16.9572 -16.9146 -16.9146 -16.7981 -16.7981 -16.7764 -16.7764 -16.7029 -16.7029 -16.5021 -16.5021 -16.3977 -16.3977 -16.3805 -16.3805 -13.1954 -13.1954 -13.1946 -13.1946 -5.9632 -5.9632 -5.9551 -5.9551 -4.0573 -4.0573 -4.0348 -4.0348 -3.9085 -3.9085 -2.1069 -2.1069 -2.0632 -2.0632 -1.4638 -1.4638 -0.8905 -0.8905 -0.7910 -0.7910 -0.5930 -0.5930 -0.5563 -0.5563 0.5026 0.5026 0.8318 0.8318 0.9770 0.9770 1.8154 1.8154 1.8708 1.8708 2.0629 2.0629 2.1201 2.1201 2.1470 2.1470 2.1937 2.1937 2.2201 2.2201 2.2798 2.2798 2.3550 2.3550 2.4030 2.4030 2.4894 2.4894 2.5441 2.5441 2.9865 2.9865 3.1632 3.1632 8.4848 8.4848 11.6100 11.6100 12.0426 12.0426 12.2057 12.2057 12.2939 12.2939 12.7384 12.7384 13.0384 13.0384 13.1747 13.1747 k = 0.4091 0.2362 0.5010 ( 14854 PWs) bands (ev): -44.6796 -44.6796 -17.0989 -17.0989 -16.9559 -16.9559 -16.9132 -16.9132 -16.8042 -16.8042 -16.7807 -16.7807 -16.7050 -16.7050 -16.4995 -16.4995 -16.3956 -16.3956 -16.3796 -16.3796 -13.1958 -13.1958 -13.1951 -13.1951 -5.9637 -5.9637 -5.9548 -5.9548 -4.0580 -4.0580 -4.0346 -4.0346 -3.9072 -3.9072 -2.1069 -2.1069 -2.0609 -2.0609 -1.4617 -1.4617 -0.8947 -0.8947 -0.7789 -0.7789 -0.5853 -0.5853 -0.5482 -0.5482 0.5133 0.5133 0.8277 0.8277 0.9674 0.9674 1.8073 1.8073 1.8666 1.8666 2.0616 2.0616 2.1229 2.1229 2.1456 2.1456 2.1847 2.1847 2.2154 2.2154 2.2760 2.2760 2.3541 2.3541 2.3969 2.3969 2.4874 2.4874 2.5429 2.5429 2.9711 2.9711 3.1657 3.1657 8.4949 8.4949 11.6472 11.6472 12.0373 12.0373 12.1704 12.1704 12.2825 12.2825 12.7586 12.7586 13.0692 13.0692 13.2353 13.2353 k = 0.4034 0.2329 0.5196 ( 14858 PWs) bands (ev): -44.6796 -44.6796 -17.0947 -17.0947 -16.9547 -16.9547 -16.9118 -16.9118 -16.8104 -16.8104 -16.7842 -16.7842 -16.7072 -16.7072 -16.4970 -16.4970 -16.3937 -16.3937 -16.3788 -16.3788 -13.1962 -13.1962 -13.1956 -13.1956 -5.9642 -5.9642 -5.9545 -5.9545 -4.0587 -4.0587 -4.0342 -4.0342 -3.9060 -3.9060 -2.1078 -2.1078 -2.0579 -2.0579 -1.4598 -1.4598 -0.8999 -0.8999 -0.7666 -0.7666 -0.5778 -0.5778 -0.5400 -0.5400 0.5231 0.5231 0.8243 0.8243 0.9582 0.9582 1.7991 1.7991 1.8626 1.8626 2.0600 2.0600 2.1240 2.1240 2.1452 2.1452 2.1761 2.1761 2.2102 2.2102 2.2731 2.2731 2.3546 2.3546 2.3914 2.3914 2.4856 2.4856 2.5421 2.5421 2.9561 2.9561 3.1683 3.1683 8.5042 8.5042 11.6827 11.6827 12.0286 12.0286 12.1389 12.1389 12.2677 12.2677 12.7816 12.7816 13.1043 13.1043 13.3010 13.3010 k = 0.3977 0.2296 0.5381 ( 14853 PWs) bands (ev): -44.6796 -44.6796 -17.0905 -17.0905 -16.9535 -16.9535 -16.9105 -16.9105 -16.8165 -16.8165 -16.7873 -16.7873 -16.7093 -16.7093 -16.4946 -16.4946 -16.3917 -16.3917 -16.3781 -16.3781 -13.1965 -13.1965 -13.1961 -13.1961 -5.9647 -5.9647 -5.9542 -5.9542 -4.0595 -4.0595 -4.0338 -4.0338 -3.9049 -3.9049 -2.1094 -2.1094 -2.0544 -2.0544 -1.4581 -1.4581 -0.9058 -0.9058 -0.7545 -0.7545 -0.5702 -0.5702 -0.5323 -0.5323 0.5318 0.5318 0.8216 0.8216 0.9495 0.9495 1.7909 1.7909 1.8590 1.8590 2.0580 2.0580 2.1238 2.1238 2.1446 2.1446 2.1687 2.1687 2.2051 2.2051 2.2712 2.2712 2.3562 2.3562 2.3866 2.3866 2.4841 2.4841 2.5416 2.5416 2.9418 2.9418 3.1710 3.1710 8.5127 8.5127 11.7156 11.7156 12.0108 12.0108 12.1183 12.1183 12.2496 12.2496 12.8071 12.8071 13.1431 13.1431 13.3702 13.3702 k = 0.3920 0.2263 0.5567 ( 14855 PWs) bands (ev): -44.6796 -44.6796 -17.0865 -17.0865 -16.9524 -16.9524 -16.9094 -16.9094 -16.8221 -16.8221 -16.7902 -16.7902 -16.7116 -16.7116 -16.4925 -16.4925 -16.3899 -16.3899 -16.3775 -16.3775 -13.1968 -13.1968 -13.1965 -13.1965 -5.9651 -5.9651 -5.9539 -5.9539 -4.0603 -4.0603 -4.0334 -4.0334 -3.9040 -3.9040 -2.1116 -2.1116 -2.0506 -2.0506 -1.4567 -1.4567 -0.9124 -0.9124 -0.7429 -0.7429 -0.5625 -0.5625 -0.5254 -0.5254 0.5393 0.5393 0.8197 0.8197 0.9417 0.9417 1.7832 1.7832 1.8558 1.8558 2.0557 2.0557 2.1228 2.1228 2.1425 2.1425 2.1631 2.1631 2.2004 2.2004 2.2707 2.2707 2.3587 2.3587 2.3825 2.3825 2.4828 2.4828 2.5414 2.5414 2.9283 2.9283 3.1739 3.1739 8.5199 8.5199 11.7443 11.7443 11.9818 11.9818 12.1125 12.1125 12.2284 12.2284 12.8347 12.8347 13.1845 13.1845 13.4407 13.4407 k = 0.3864 0.2231 0.5753 ( 14847 PWs) bands (ev): -44.6796 -44.6796 -17.0826 -17.0826 -16.9515 -16.9515 -16.9086 -16.9086 -16.8269 -16.8269 -16.7927 -16.7927 -16.7138 -16.7138 -16.4905 -16.4905 -16.3882 -16.3882 -16.3770 -16.3770 -13.1971 -13.1971 -13.1968 -13.1968 -5.9655 -5.9655 -5.9536 -5.9536 -4.0611 -4.0611 -4.0330 -4.0330 -3.9031 -3.9031 -2.1143 -2.1143 -2.0466 -2.0466 -1.4555 -1.4555 -0.9196 -0.9196 -0.7319 -0.7319 -0.5548 -0.5548 -0.5196 -0.5196 0.5455 0.5455 0.8184 0.8184 0.9349 0.9349 1.7762 1.7762 1.8529 1.8529 2.0531 2.0531 2.1215 2.1215 2.1386 2.1386 2.1592 2.1592 2.1965 2.1965 2.2717 2.2717 2.3620 2.3620 2.3793 2.3793 2.4819 2.4819 2.5414 2.5414 2.9159 2.9159 3.1767 3.1767 8.5258 8.5258 11.7660 11.7660 11.9481 11.9481 12.1181 12.1181 12.2047 12.2047 12.8634 12.8634 13.2266 13.2266 13.5083 13.5083 k = 0.3807 0.2198 0.5938 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.0791 -17.0791 -16.9507 -16.9507 -16.9080 -16.9080 -16.8309 -16.8309 -16.7951 -16.7951 -16.7161 -16.7161 -16.4886 -16.4886 -16.3865 -16.3865 -16.3767 -16.3767 -13.1973 -13.1973 -13.1970 -13.1970 -5.9659 -5.9659 -5.9533 -5.9533 -4.0618 -4.0618 -4.0325 -4.0325 -3.9025 -3.9025 -2.1174 -2.1174 -2.0426 -2.0426 -1.4546 -1.4546 -0.9272 -0.9272 -0.7217 -0.7217 -0.5472 -0.5472 -0.5153 -0.5153 0.5505 0.5505 0.8177 0.8177 0.9296 0.9296 1.7704 1.7704 1.8505 1.8505 2.0502 2.0502 2.1197 2.1197 2.1342 2.1342 2.1560 2.1560 2.1933 2.1933 2.2743 2.2743 2.3657 2.3657 2.3768 2.3768 2.4814 2.4814 2.5415 2.5415 2.9047 2.9047 3.1797 3.1797 8.5302 8.5302 11.7741 11.7741 11.9204 11.9204 12.1310 12.1310 12.1787 12.1787 12.8926 12.8926 13.2664 13.2664 13.5607 13.5607 k = 0.3750 0.2165 0.6124 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0758 -17.0758 -16.9501 -16.9501 -16.9078 -16.9078 -16.8340 -16.8340 -16.7971 -16.7971 -16.7185 -16.7185 -16.4870 -16.4870 -16.3851 -16.3851 -16.3764 -16.3764 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1208 -2.1208 -2.0387 -2.0387 -1.4541 -1.4541 -0.9352 -0.9352 -0.7125 -0.7125 -0.5399 -0.5399 -0.5127 -0.5127 0.5542 0.5542 0.8173 0.8173 0.9259 0.9259 1.7661 1.7661 1.8488 1.8488 2.0471 2.0471 2.1174 2.1174 2.1305 2.1305 2.1529 2.1529 2.1908 2.1908 2.2786 2.2786 2.3697 2.3697 2.3754 2.3754 2.4812 2.4812 2.5419 2.5419 2.8949 2.8949 3.1826 3.1826 8.5329 8.5329 11.7604 11.7604 11.9092 11.9092 12.1486 12.1486 12.1514 12.1514 12.9209 12.9209 13.2998 13.2998 13.5809 13.5809 k = 0.6250-0.0722 0.4082 ( 14861 PWs) bands (ev): -44.6796 -44.6796 -17.0758 -17.0758 -16.9501 -16.9501 -16.9078 -16.9078 -16.8340 -16.8340 -16.7971 -16.7971 -16.7185 -16.7185 -16.4870 -16.4870 -16.3851 -16.3851 -16.3764 -16.3764 -13.1975 -13.1975 -13.1971 -13.1971 -5.9663 -5.9663 -5.9531 -5.9531 -4.0625 -4.0625 -4.0321 -4.0321 -3.9020 -3.9020 -2.1208 -2.1208 -2.0387 -2.0387 -1.4541 -1.4541 -0.9352 -0.9352 -0.7125 -0.7125 -0.5399 -0.5399 -0.5127 -0.5127 0.5542 0.5542 0.8173 0.8173 0.9259 0.9259 1.7661 1.7661 1.8488 1.8488 2.0471 2.0471 2.1174 2.1174 2.1305 2.1305 2.1529 2.1529 2.1908 2.1908 2.2786 2.2786 2.3697 2.3697 2.3754 2.3754 2.4812 2.4812 2.5419 2.5419 2.8949 2.8949 3.1826 3.1826 8.5329 8.5329 11.7604 11.7604 11.9092 11.9092 12.1486 12.1486 12.1514 12.1514 12.9209 12.9209 13.2998 13.2998 13.5809 13.5809 k = 0.6154-0.0888 0.4082 ( 14851 PWs) bands (ev): -44.6796 -44.6796 -17.0706 -17.0706 -16.9495 -16.9495 -16.9075 -16.9075 -16.8388 -16.8388 -16.7996 -16.7996 -16.7224 -16.7224 -16.4844 -16.4844 -16.3828 -16.3828 -16.3758 -16.3758 -13.1978 -13.1978 -13.1972 -13.1972 -5.9669 -5.9669 -5.9527 -5.9527 -4.0636 -4.0636 -4.0314 -4.0314 -3.9015 -3.9015 -2.1268 -2.1268 -2.0324 -2.0324 -1.4538 -1.4538 -0.9489 -0.9489 -0.6980 -0.6980 -0.5284 -0.5284 -0.5100 -0.5100 0.5593 0.5593 0.8169 0.8169 0.9216 0.9216 1.7604 1.7604 1.8469 1.8469 2.0414 2.0414 2.1129 2.1129 2.1251 2.1251 2.1479 2.1479 2.1864 2.1864 2.2882 2.2882 2.3714 2.3714 2.3791 2.3791 2.4815 2.4815 2.5425 2.5425 2.8795 2.8795 3.1877 3.1877 8.5353 8.5353 11.7169 11.7169 11.9035 11.9035 12.1041 12.1041 12.1856 12.1856 12.9658 12.9658 13.3507 13.3507 13.5777 13.5777 k = 0.6058-0.1055 0.4082 ( 14871 PWs) bands (ev): -44.6796 -44.6796 -17.0652 -17.0652 -16.9490 -16.9490 -16.9072 -16.9072 -16.8442 -16.8442 -16.8015 -16.8015 -16.7263 -16.7263 -16.4820 -16.4820 -16.3809 -16.3809 -16.3750 -16.3750 -13.1981 -13.1981 -13.1973 -13.1973 -5.9674 -5.9674 -5.9524 -5.9524 -4.0648 -4.0648 -4.0307 -4.0307 -3.9010 -3.9010 -2.1327 -2.1327 -2.0265 -2.0265 -1.4537 -1.4537 -0.9622 -0.9622 -0.6844 -0.6844 -0.5179 -0.5179 -0.5073 -0.5073 0.5639 0.5639 0.8164 0.8164 0.9187 0.9187 1.7553 1.7553 1.8455 1.8455 2.0354 2.0354 2.1084 2.1084 2.1200 2.1200 2.1436 2.1436 2.1813 2.1813 2.2994 2.2994 2.3696 2.3696 2.3869 2.3869 2.4822 2.4822 2.5430 2.5430 2.8646 2.8646 3.1927 3.1927 8.5366 8.5366 11.6733 11.6733 11.8933 11.8933 12.0609 12.0609 12.2242 12.2242 13.0072 13.0072 13.4058 13.4058 13.5628 13.5628 k = 0.5962-0.1221 0.4082 ( 14867 PWs) bands (ev): -44.6796 -44.6796 -17.0596 -17.0596 -16.9489 -16.9489 -16.9069 -16.9069 -16.8500 -16.8500 -16.8027 -16.8027 -16.7301 -16.7301 -16.4798 -16.4798 -16.3795 -16.3795 -16.3738 -16.3738 -13.1982 -13.1982 -13.1973 -13.1973 -5.9679 -5.9679 -5.9520 -5.9520 -4.0658 -4.0658 -4.0300 -4.0300 -3.9006 -3.9006 -2.1383 -2.1383 -2.0210 -2.0210 -1.4538 -1.4538 -0.9749 -0.9749 -0.6717 -0.6717 -0.5091 -0.5091 -0.5042 -0.5042 0.5679 0.5679 0.8158 0.8158 0.9169 0.9169 1.7506 1.7506 1.8447 1.8447 2.0292 2.0292 2.1040 2.1040 2.1153 2.1153 2.1400 2.1400 2.1757 2.1757 2.3111 2.3111 2.3680 2.3680 2.3951 2.3951 2.4832 2.4832 2.5435 2.5435 2.8503 2.8503 3.1977 3.1977 8.5371 8.5371 11.6312 11.6312 11.8801 11.8801 12.0213 12.0213 12.2628 12.2628 13.0444 13.0444 13.4639 13.4639 13.5448 13.5448 k = 0.5865-0.1388 0.4082 ( 14849 PWs) bands (ev): -44.6796 -44.6796 -17.0539 -17.0539 -16.9490 -16.9490 -16.9065 -16.9065 -16.8559 -16.8559 -16.8035 -16.8035 -16.7338 -16.7338 -16.4777 -16.4777 -16.3785 -16.3785 -16.3722 -16.3722 -13.1984 -13.1984 -13.1973 -13.1973 -5.9684 -5.9684 -5.9517 -5.9517 -4.0669 -4.0669 -4.0293 -4.0293 -3.9003 -3.9003 -2.1437 -2.1437 -2.0159 -2.0159 -1.4540 -1.4540 -0.9868 -0.9868 -0.6601 -0.6601 -0.5043 -0.5043 -0.4982 -0.4982 0.5713 0.5713 0.8151 0.8151 0.9162 0.9162 1.7464 1.7464 1.8444 1.8444 2.0229 2.0229 2.0998 2.0998 2.1111 2.1111 2.1373 2.1373 2.1699 2.1699 2.3226 2.3226 2.3665 2.3665 2.4037 2.4037 2.4845 2.4845 2.5437 2.5437 2.8366 2.8366 3.2024 3.2024 8.5370 8.5370 11.5913 11.5913 11.8653 11.8653 11.9854 11.9854 12.3002 12.3002 13.0767 13.0767 13.5218 13.5218 13.5292 13.5292 k = 0.5769-0.1554 0.4082 ( 14835 PWs) bands (ev): -44.6796 -44.6796 -17.0481 -17.0481 -16.9495 -16.9495 -16.9063 -16.9063 -16.8614 -16.8614 -16.8041 -16.8041 -16.7374 -16.7374 -16.4759 -16.4759 -16.3778 -16.3778 -16.3705 -16.3705 -13.1985 -13.1985 -13.1973 -13.1973 -5.9689 -5.9689 -5.9514 -5.9514 -4.0678 -4.0678 -4.0287 -4.0287 -3.9001 -3.9001 -2.1488 -2.1488 -2.0114 -2.0114 -1.4543 -1.4543 -0.9978 -0.9978 -0.6496 -0.6496 -0.5021 -0.5021 -0.4908 -0.4908 0.5740 0.5740 0.8145 0.8145 0.9164 0.9164 1.7427 1.7427 1.8443 1.8443 2.0167 2.0167 2.0958 2.0958 2.1075 2.1075 2.1352 2.1352 2.1643 2.1643 2.3333 2.3333 2.3652 2.3652 2.4125 2.4125 2.4861 2.4861 2.5438 2.5438 2.8238 2.8238 3.2069 3.2069 8.5364 8.5364 11.5543 11.5543 11.8499 11.8499 11.9531 11.9531 12.3354 12.3354 13.1034 13.1034 13.5117 13.5117 13.5841 13.5841 k = 0.5673-0.1721 0.4082 ( 14829 PWs) bands (ev): -44.6796 -44.6796 -17.0423 -17.0423 -16.9504 -16.9504 -16.9061 -16.9061 -16.8665 -16.8665 -16.8045 -16.8045 -16.7406 -16.7406 -16.4742 -16.4742 -16.3774 -16.3774 -16.3688 -16.3688 -13.1986 -13.1986 -13.1973 -13.1973 -5.9693 -5.9693 -5.9511 -5.9511 -4.0687 -4.0687 -4.0281 -4.0281 -3.8999 -3.8999 -2.1534 -2.1534 -2.0073 -2.0073 -1.4547 -1.4547 -1.0077 -1.0077 -0.6402 -0.6402 -0.5003 -0.5003 -0.4840 -0.4840 0.5761 0.5761 0.8139 0.8139 0.9172 0.9172 1.7395 1.7395 1.8444 1.8444 2.0108 2.0108 2.0920 2.0920 2.1046 2.1046 2.1337 2.1337 2.1590 2.1590 2.3428 2.3428 2.3640 2.3640 2.4212 2.4212 2.4878 2.4878 2.5437 2.5437 2.8120 2.8120 3.2111 3.2111 8.5355 8.5355 11.5207 11.5207 11.8349 11.8349 11.9246 11.9246 12.3677 12.3677 13.1242 13.1242 13.5002 13.5002 13.6416 13.6416 k = 0.5577-0.1887 0.4082 ( 14813 PWs) bands (ev): -44.6796 -44.6796 -17.0366 -17.0366 -16.9518 -16.9518 -16.9061 -16.9061 -16.8709 -16.8709 -16.8047 -16.8047 -16.7436 -16.7436 -16.4728 -16.4728 -16.3770 -16.3770 -16.3672 -16.3672 -13.1987 -13.1987 -13.1973 -13.1973 -5.9697 -5.9697 -5.9509 -5.9509 -4.0695 -4.0695 -4.0276 -4.0276 -3.8998 -3.8998 -2.1575 -2.1575 -2.0037 -2.0037 -1.4551 -1.4551 -1.0166 -1.0166 -0.6320 -0.6320 -0.4988 -0.4988 -0.4780 -0.4780 0.5777 0.5777 0.8134 0.8134 0.9184 0.9184 1.7366 1.7366 1.8446 1.8446 2.0053 2.0053 2.0886 2.0886 2.1023 2.1023 2.1326 2.1326 2.1541 2.1541 2.3510 2.3510 2.3631 2.3631 2.4298 2.4298 2.4895 2.4895 2.5435 2.5435 2.8014 2.8014 3.2148 3.2148 8.5344 8.5344 11.4908 11.4908 11.8208 11.8208 11.8998 11.8998 12.3967 12.3967 13.1389 13.1389 13.4925 13.4925 13.6929 13.6929 k = 0.5481-0.2054 0.4082 ( 14826 PWs) bands (ev): -44.6796 -44.6796 -17.0310 -17.0310 -16.9536 -16.9536 -16.9063 -16.9063 -16.8745 -16.8745 -16.8049 -16.8049 -16.7463 -16.7463 -16.4716 -16.4716 -16.3767 -16.3767 -16.3657 -16.3657 -13.1987 -13.1987 -13.1973 -13.1973 -5.9700 -5.9700 -5.9507 -5.9507 -4.0702 -4.0702 -4.0271 -4.0271 -3.8997 -3.8997 -2.1611 -2.1611 -2.0006 -2.0006 -1.4554 -1.4554 -1.0242 -1.0242 -0.6251 -0.6251 -0.4976 -0.4976 -0.4729 -0.4729 0.5788 0.5788 0.8130 0.8130 0.9199 0.9199 1.7342 1.7342 1.8449 1.8449 2.0004 2.0004 2.0856 2.0856 2.1004 2.1004 2.1319 2.1319 2.1499 2.1499 2.3575 2.3575 2.3625 2.3625 2.4379 2.4379 2.4912 2.4912 2.5431 2.5431 2.7920 2.7920 3.2181 3.2181 8.5332 8.5332 11.4650 11.4650 11.8081 11.8081 11.8788 11.8788 12.4220 12.4220 13.1482 13.1482 13.4886 13.4886 13.7322 13.7322 k = 0.5385-0.2221 0.4082 ( 14822 PWs) bands (ev): -44.6796 -44.6796 -17.0258 -17.0258 -16.9557 -16.9557 -16.9067 -16.9067 -16.8772 -16.8772 -16.8050 -16.8050 -16.7486 -16.7486 -16.4706 -16.4706 -16.3765 -16.3765 -16.3645 -16.3645 -13.1988 -13.1988 -13.1973 -13.1973 -5.9702 -5.9702 -5.9505 -5.9505 -4.0708 -4.0708 -4.0268 -4.0268 -3.8996 -3.8996 -2.1642 -2.1642 -1.9981 -1.9981 -1.4558 -1.4558 -1.0305 -1.0305 -0.6194 -0.6194 -0.4966 -0.4966 -0.4687 -0.4687 0.5796 0.5796 0.8127 0.8127 0.9213 0.9213 1.7323 1.7323 1.8453 1.8453 1.9962 1.9962 2.0831 2.0831 2.0991 2.0991 2.1315 2.1315 2.1463 2.1463 2.3604 2.3604 2.3644 2.3644 2.4451 2.4451 2.4927 2.4927 2.5426 2.5426 2.7841 2.7841 3.2209 3.2209 8.5321 8.5321 11.4435 11.4435 11.7972 11.7972 11.8615 11.8615 12.4432 12.4432 13.1531 13.1531 13.4875 13.4875 13.7568 13.7568 k = 0.5288-0.2387 0.4082 ( 14828 PWs) bands (ev): -44.6796 -44.6796 -17.0212 -17.0212 -16.9579 -16.9579 -16.9071 -16.9071 -16.8791 -16.8791 -16.8051 -16.8051 -16.7504 -16.7504 -16.4698 -16.4698 -16.3764 -16.3764 -16.3636 -16.3636 -13.1988 -13.1988 -13.1973 -13.1973 -5.9705 -5.9705 -5.9504 -5.9504 -4.0712 -4.0712 -4.0265 -4.0265 -3.8996 -3.8996 -2.1666 -2.1666 -1.9962 -1.9962 -1.4561 -1.4561 -1.0355 -1.0355 -0.6149 -0.6149 -0.4958 -0.4958 -0.4655 -0.4655 0.5800 0.5800 0.8125 0.8125 0.9226 0.9226 1.7308 1.7308 1.8455 1.8455 1.9929 1.9929 2.0810 2.0810 2.0981 2.0981 2.1314 2.1314 2.1434 2.1434 2.3602 2.3602 2.3682 2.3682 2.4512 2.4512 2.4939 2.4939 2.5421 2.5421 2.7778 2.7778 3.2231 3.2231 8.5311 8.5311 11.4266 11.4266 11.7884 11.7884 11.8481 11.8481 12.4601 12.4601 13.1550 13.1550 13.4883 13.4883 13.7709 13.7709 k = 0.5192-0.2554 0.4082 ( 14826 PWs) bands (ev): -44.6796 -44.6796 -17.0174 -17.0174 -16.9600 -16.9600 -16.9076 -16.9076 -16.8804 -16.8804 -16.8052 -16.8052 -16.7517 -16.7517 -16.4693 -16.4693 -16.3762 -16.3762 -16.3629 -16.3629 -13.1988 -13.1988 -13.1973 -13.1973 -5.9706 -5.9706 -5.9503 -5.9503 -4.0716 -4.0716 -4.0262 -4.0262 -3.8996 -3.8996 -2.1683 -2.1683 -1.9948 -1.9948 -1.4563 -1.4563 -1.0391 -1.0391 -0.6117 -0.6117 -0.4953 -0.4953 -0.4631 -0.4631 0.5803 0.5803 0.8124 0.8124 0.9237 0.9237 1.7297 1.7297 1.8458 1.8458 1.9904 1.9904 2.0795 2.0795 2.0975 2.0975 2.1315 2.1315 2.1411 2.1411 2.3598 2.3598 2.3711 2.3711 2.4559 2.4559 2.4949 2.4949 2.5417 2.5417 2.7733 2.7733 3.2247 3.2247 8.5304 8.5304 11.4144 11.4144 11.7820 11.7820 11.8385 11.8385 12.4724 12.4724 13.1552 13.1552 13.4897 13.4897 13.7786 13.7786 k = 0.5096-0.2720 0.4082 ( 14834 PWs) bands (ev): -44.6796 -44.6796 -17.0150 -17.0150 -16.9615 -16.9615 -16.9079 -16.9079 -16.8810 -16.8810 -16.8052 -16.8052 -16.7525 -16.7525 -16.4690 -16.4690 -16.3762 -16.3762 -16.3624 -16.3624 -13.1988 -13.1988 -13.1973 -13.1973 -5.9707 -5.9707 -5.9502 -5.9502 -4.0718 -4.0718 -4.0261 -4.0261 -3.8996 -3.8996 -2.1694 -2.1694 -1.9939 -1.9939 -1.4564 -1.4564 -1.0413 -1.0413 -0.6098 -0.6098 -0.4949 -0.4949 -0.4617 -0.4617 0.5805 0.5805 0.8123 0.8123 0.9243 0.9243 1.7290 1.7290 1.8459 1.8459 1.9889 1.9889 2.0786 2.0786 2.0971 2.0971 2.1316 2.1316 2.1397 2.1397 2.3596 2.3596 2.3729 2.3729 2.4587 2.4587 2.4955 2.4955 2.5414 2.5414 2.7705 2.7705 3.2257 3.2257 8.5299 8.5299 11.4070 11.4070 11.7781 11.7781 11.8327 11.8327 12.4799 12.4799 13.1549 13.1549 13.4910 13.4910 13.7824 13.7824 k = 0.5000-0.2887 0.4082 ( 14844 PWs) bands (ev): -44.6796 -44.6796 -17.0141 -17.0141 -16.9620 -16.9620 -16.9080 -16.9080 -16.8812 -16.8812 -16.8052 -16.8052 -16.7528 -16.7528 -16.4689 -16.4689 -16.3761 -16.3761 -16.3623 -16.3623 -13.1988 -13.1988 -13.1973 -13.1973 -5.9707 -5.9707 -5.9502 -5.9502 -4.0718 -4.0718 -4.0261 -4.0261 -3.8995 -3.8995 -2.1697 -2.1697 -1.9936 -1.9936 -1.4565 -1.4565 -1.0420 -1.0420 -0.6092 -0.6092 -0.4948 -0.4948 -0.4612 -0.4612 0.5805 0.5805 0.8123 0.8123 0.9245 0.9245 1.7288 1.7288 1.8460 1.8460 1.9884 1.9884 2.0783 2.0783 2.0970 2.0970 2.1317 2.1317 2.1392 2.1392 2.3595 2.3595 2.3734 2.3734 2.4597 2.4597 2.4957 2.4957 2.5412 2.5412 2.7695 2.7695 3.2260 3.2260 8.5298 8.5298 11.4045 11.4045 11.7768 11.7768 11.8308 11.8308 12.4824 12.4824 13.1547 13.1547 13.4914 13.4914 13.7835 13.7835 Writing output data file Cs2NaTlF6.save init_run : 0.84s CPU 1.04s WALL ( 1 calls) electrons : 653.40s CPU 659.34s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 653.38s CPU 659.32s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.22s CPU 0.26s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.28s CPU 0.35s WALL ( 240 calls) cegterg : 609.58s CPU 613.54s WALL ( 462 calls) Called by sum_band: Called by *egterg: h_psi : 349.16s CPU 351.42s WALL ( 7037 calls) s_psi : 32.33s CPU 32.44s WALL ( 7037 calls) g_psi : 1.22s CPU 1.22s WALL ( 6335 calls) cdiaghg : 150.08s CPU 151.67s WALL ( 6575 calls) cegterg:over : 41.02s CPU 41.22s WALL ( 6335 calls) cegterg:upda : 36.86s CPU 36.99s WALL ( 6335 calls) cegterg:last : 19.28s CPU 19.29s WALL ( 942 calls) cdiaghg:chol : 9.24s CPU 9.22s WALL ( 6575 calls) cdiaghg:inve : 6.80s CPU 6.95s WALL ( 6575 calls) cdiaghg:para : 12.46s CPU 12.47s WALL ( 13150 calls) Called by h_psi: h_psi:vloc : 287.03s CPU 289.35s WALL ( 7037 calls) h_psi:vnl : 60.43s CPU 60.33s WALL ( 7037 calls) add_vuspsi : 33.52s CPU 33.06s WALL ( 7037 calls) General routines calbec : 26.89s CPU 27.25s WALL ( 7037 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 271.04s CPU 273.17s WALL ( 1159312 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.21s CPU 0.98s WALL ( 480 calls) Parallel routines fft_scatter : 83.92s CPU 83.82s WALL ( 1159335 calls) PWSCF : 11m44.11s CPU 12m12.32s WALL This run was terminated on: 17:51: 7 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=