Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19:16:45 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: ./Sr2H6Ru.save/ 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 62 62 17 1982 1982 290 Max 63 63 18 1988 1988 293 Sum 2263 2263 637 71441 71441 10489 bravais-lattice index = 14 lattice parameter (alat) = 10.1554 a.u. unit-cell volume = 740.5891 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 42.00 number of Kohn-Sham states= 50 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.155409 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 H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ru read from file: /users/gautes/Pseudo/Ru.rel-pbe-oncvpsp.UPF MD5 check sum: 58833c0d2965a9b0fe5de673113ce18e Pseudo is Norm-conserving, Zval = 16.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1584 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 PseudoPot. # 3 for Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1221 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) Ru 16.00 101.07000 Ru( 1.00) Sr 10.00 87.62000 Sr( 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= 280 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 2) = ( 0.0119048 -0.0068732 0.0097202), wk = 0.0035714 k( 3) = ( 0.0238095 -0.0137464 0.0194404), wk = 0.0035714 k( 4) = ( 0.0357143 -0.0206197 0.0291606), wk = 0.0035714 k( 5) = ( 0.0476191 -0.0274929 0.0388808), wk = 0.0035714 k( 6) = ( 0.0595238 -0.0343661 0.0486010), wk = 0.0035714 k( 7) = ( 0.0714286 -0.0412393 0.0583212), wk = 0.0035714 k( 8) = ( 0.0833333 -0.0481125 0.0680414), wk = 0.0035714 k( 9) = ( 0.0952381 -0.0549857 0.0777616), wk = 0.0035714 k( 10) = ( 0.1071429 -0.0618590 0.0874818), wk = 0.0035714 k( 11) = ( 0.1190476 -0.0687322 0.0972020), wk = 0.0035714 k( 12) = ( 0.1309524 -0.0756054 0.1069222), wk = 0.0035714 k( 13) = ( 0.1428571 -0.0824786 0.1166424), wk = 0.0035714 k( 14) = ( 0.1547619 -0.0893518 0.1263626), wk = 0.0035714 k( 15) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0035714 k( 16) = ( 0.1785714 -0.1030983 0.1458030), wk = 0.0035714 k( 17) = ( 0.1904762 -0.1099715 0.1555232), wk = 0.0035714 k( 18) = ( 0.2023810 -0.1168447 0.1652434), wk = 0.0035714 k( 19) = ( 0.2142857 -0.1237179 0.1749635), wk = 0.0035714 k( 20) = ( 0.2261905 -0.1305911 0.1846838), wk = 0.0035714 k( 21) = ( 0.2380952 -0.1374644 0.1944039), wk = 0.0035714 k( 22) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0035714 k( 23) = ( 0.2619048 -0.1512108 0.2138443), wk = 0.0035714 k( 24) = ( 0.2738095 -0.1580840 0.2235645), wk = 0.0035714 k( 25) = ( 0.2857143 -0.1649572 0.2332847), wk = 0.0035714 k( 26) = ( 0.2976190 -0.1718304 0.2430049), wk = 0.0035714 k( 27) = ( 0.3095238 -0.1787037 0.2527251), wk = 0.0035714 k( 28) = ( 0.3214286 -0.1855769 0.2624453), wk = 0.0035714 k( 29) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0035714 k( 30) = ( 0.3452381 -0.1993233 0.2818857), wk = 0.0035714 k( 31) = ( 0.3571429 -0.2061965 0.2916059), wk = 0.0035714 k( 32) = ( 0.3690476 -0.2130697 0.3013261), wk = 0.0035714 k( 33) = ( 0.3809524 -0.2199430 0.3110463), wk = 0.0035714 k( 34) = ( 0.3928571 -0.2268162 0.3207665), wk = 0.0035714 k( 35) = ( 0.4047619 -0.2336894 0.3304867), wk = 0.0035714 k( 36) = ( 0.4166667 -0.2405626 0.3402069), wk = 0.0035714 k( 37) = ( 0.4285714 -0.2474358 0.3499271), wk = 0.0035714 k( 38) = ( 0.4404762 -0.2543090 0.3596473), wk = 0.0035714 k( 39) = ( 0.4523810 -0.2611823 0.3693675), wk = 0.0035714 k( 40) = ( 0.4642857 -0.2680555 0.3790877), wk = 0.0035714 k( 41) = ( 0.4761905 -0.2749287 0.3888079), wk = 0.0035714 k( 42) = ( 0.4880952 -0.2818019 0.3985281), wk = 0.0035714 k( 43) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0035714 k( 44) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0035714 k( 45) = ( 0.5000000 -0.2749287 0.4179685), wk = 0.0035714 k( 46) = ( 0.5000000 -0.2611823 0.4276887), wk = 0.0035714 k( 47) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0035714 k( 48) = ( 0.5000000 -0.2336894 0.4471291), wk = 0.0035714 k( 49) = ( 0.5000000 -0.2199430 0.4568493), wk = 0.0035714 k( 50) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0035714 k( 51) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0035714 k( 52) = ( 0.5000000 -0.1787036 0.4860099), wk = 0.0035714 k( 53) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0035714 k( 54) = ( 0.5000000 -0.1512108 0.5054503), wk = 0.0035714 k( 55) = ( 0.5000000 -0.1374644 0.5151705), wk = 0.0035714 k( 56) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0035714 k( 57) = ( 0.5000000 -0.1099715 0.5346109), wk = 0.0035714 k( 58) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0035714 k( 59) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0035714 k( 60) = ( 0.5000000 -0.0687322 0.5637714), wk = 0.0035714 k( 61) = ( 0.5000000 -0.0549857 0.5734916), wk = 0.0035714 k( 62) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0035714 k( 63) = ( 0.5000000 -0.0274929 0.5929320), wk = 0.0035714 k( 64) = ( 0.5000000 -0.0137464 0.6026522), wk = 0.0035714 k( 65) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0035714 k( 66) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0035714 k( 67) = ( 0.4916667 0.0144338 0.6123724), wk = 0.0035714 k( 68) = ( 0.4833333 0.0288675 0.6123724), wk = 0.0035714 k( 69) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0035714 k( 70) = ( 0.4666667 0.0577350 0.6123724), wk = 0.0035714 k( 71) = ( 0.4583333 0.0721688 0.6123724), wk = 0.0035714 k( 72) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0035714 k( 73) = ( 0.4416667 0.1010363 0.6123724), wk = 0.0035714 k( 74) = ( 0.4333333 0.1154701 0.6123724), wk = 0.0035714 k( 75) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0035714 k( 76) = ( 0.4166667 0.1443376 0.6123724), wk = 0.0035714 k( 77) = ( 0.4083333 0.1587713 0.6123724), wk = 0.0035714 k( 78) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0035714 k( 79) = ( 0.3916667 0.1876388 0.6123724), wk = 0.0035714 k( 80) = ( 0.3833333 0.2020726 0.6123724), wk = 0.0035714 k( 81) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0035714 k( 82) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0035714 k( 83) = ( 0.3664773 0.2115858 0.5984549), wk = 0.0035714 k( 84) = ( 0.3579545 0.2066652 0.5845373), wk = 0.0035714 k( 85) = ( 0.3494318 0.2017446 0.5706198), wk = 0.0035714 k( 86) = ( 0.3409091 0.1968240 0.5567022), wk = 0.0035714 k( 87) = ( 0.3323864 0.1919034 0.5427847), wk = 0.0035714 k( 88) = ( 0.3238636 0.1869828 0.5288671), wk = 0.0035714 k( 89) = ( 0.3153409 0.1820622 0.5149495), wk = 0.0035714 k( 90) = ( 0.3068182 0.1771416 0.5010320), wk = 0.0035714 k( 91) = ( 0.2982955 0.1722210 0.4871144), wk = 0.0035714 k( 92) = ( 0.2897727 0.1673004 0.4731969), wk = 0.0035714 k( 93) = ( 0.2812500 0.1623798 0.4592793), wk = 0.0035714 k( 94) = ( 0.2727273 0.1574592 0.4453618), wk = 0.0035714 k( 95) = ( 0.2642045 0.1525386 0.4314442), wk = 0.0035714 k( 96) = ( 0.2556818 0.1476180 0.4175267), wk = 0.0035714 k( 97) = ( 0.2471591 0.1426974 0.4036091), wk = 0.0035714 k( 98) = ( 0.2386364 0.1377768 0.3896916), wk = 0.0035714 k( 99) = ( 0.2301136 0.1328562 0.3757740), wk = 0.0035714 k( 100) = ( 0.2215909 0.1279356 0.3618564), wk = 0.0035714 k( 101) = ( 0.2130682 0.1230150 0.3479389), wk = 0.0035714 k( 102) = ( 0.2045454 0.1180944 0.3340213), wk = 0.0035714 k( 103) = ( 0.1960227 0.1131738 0.3201038), wk = 0.0035714 k( 104) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0035714 k( 105) = ( 0.1789773 0.1033326 0.2922687), wk = 0.0035714 k( 106) = ( 0.1704546 0.0984120 0.2783511), wk = 0.0035714 k( 107) = ( 0.1619318 0.0934914 0.2644336), wk = 0.0035714 k( 108) = ( 0.1534091 0.0885708 0.2505160), wk = 0.0035714 k( 109) = ( 0.1448864 0.0836502 0.2365984), wk = 0.0035714 k( 110) = ( 0.1363636 0.0787296 0.2226809), wk = 0.0035714 k( 111) = ( 0.1278409 0.0738090 0.2087633), wk = 0.0035714 k( 112) = ( 0.1193182 0.0688884 0.1948458), wk = 0.0035714 k( 113) = ( 0.1107955 0.0639678 0.1809282), wk = 0.0035714 k( 114) = ( 0.1022727 0.0590472 0.1670107), wk = 0.0035714 k( 115) = ( 0.0937500 0.0541266 0.1530931), wk = 0.0035714 k( 116) = ( 0.0852273 0.0492060 0.1391756), wk = 0.0035714 k( 117) = ( 0.0767045 0.0442854 0.1252580), wk = 0.0035714 k( 118) = ( 0.0681818 0.0393648 0.1113404), wk = 0.0035714 k( 119) = ( 0.0596591 0.0344442 0.0974229), wk = 0.0035714 k( 120) = ( 0.0511364 0.0295236 0.0835053), wk = 0.0035714 k( 121) = ( 0.0426136 0.0246030 0.0695878), wk = 0.0035714 k( 122) = ( 0.0340909 0.0196824 0.0556702), wk = 0.0035714 k( 123) = ( 0.0255682 0.0147618 0.0417527), wk = 0.0035714 k( 124) = ( 0.0170455 0.0098412 0.0278351), wk = 0.0035714 k( 125) = ( 0.0085227 0.0049206 0.0139175), wk = 0.0035714 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 128) = ( 0.0138889 0.0080188 0.0056701), wk = 0.0035714 k( 129) = ( 0.0277778 0.0160375 0.0113402), wk = 0.0035714 k( 130) = ( 0.0416667 0.0240563 0.0170103), wk = 0.0035714 k( 131) = ( 0.0555556 0.0320750 0.0226805), wk = 0.0035714 k( 132) = ( 0.0694444 0.0400938 0.0283506), wk = 0.0035714 k( 133) = ( 0.0833333 0.0481125 0.0340207), wk = 0.0035714 k( 134) = ( 0.0972222 0.0561313 0.0396908), wk = 0.0035714 k( 135) = ( 0.1111111 0.0641500 0.0453609), wk = 0.0035714 k( 136) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0035714 k( 137) = ( 0.1388889 0.0801875 0.0567012), wk = 0.0035714 k( 138) = ( 0.1527778 0.0882063 0.0623713), wk = 0.0035714 k( 139) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0035714 k( 140) = ( 0.1805556 0.1042438 0.0737115), wk = 0.0035714 k( 141) = ( 0.1944444 0.1122625 0.0793816), wk = 0.0035714 k( 142) = ( 0.2083333 0.1202813 0.0850517), wk = 0.0035714 k( 143) = ( 0.2222222 0.1283001 0.0907218), wk = 0.0035714 k( 144) = ( 0.2361111 0.1363188 0.0963920), wk = 0.0035714 k( 145) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0035714 k( 146) = ( 0.2638889 0.1523563 0.1077322), wk = 0.0035714 k( 147) = ( 0.2777778 0.1603751 0.1134023), wk = 0.0035714 k( 148) = ( 0.2916667 0.1683938 0.1190724), wk = 0.0035714 k( 149) = ( 0.3055556 0.1764126 0.1247425), wk = 0.0035714 k( 150) = ( 0.3194444 0.1844313 0.1304126), wk = 0.0035714 k( 151) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0035714 k( 152) = ( 0.3472222 0.2004688 0.1417529), wk = 0.0035714 k( 153) = ( 0.3611111 0.2084876 0.1474230), wk = 0.0035714 k( 154) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0035714 k( 155) = ( 0.3888889 0.2245251 0.1587632), wk = 0.0035714 k( 156) = ( 0.4027778 0.2325439 0.1644333), wk = 0.0035714 k( 157) = ( 0.4166667 0.2405626 0.1701035), wk = 0.0035714 k( 158) = ( 0.4305556 0.2485814 0.1757736), wk = 0.0035714 k( 159) = ( 0.4444444 0.2566001 0.1814437), wk = 0.0035714 k( 160) = ( 0.4583333 0.2646189 0.1871138), wk = 0.0035714 k( 161) = ( 0.4722222 0.2726376 0.1927839), wk = 0.0035714 k( 162) = ( 0.4861111 0.2806564 0.1984540), wk = 0.0035714 k( 163) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0035714 k( 164) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0035714 k( 165) = ( 0.5048077 0.2747965 0.2119751), wk = 0.0035714 k( 166) = ( 0.5096154 0.2609179 0.2198260), wk = 0.0035714 k( 167) = ( 0.5144231 0.2470393 0.2276769), wk = 0.0035714 k( 168) = ( 0.5192308 0.2331607 0.2355279), wk = 0.0035714 k( 169) = ( 0.5240385 0.2192821 0.2433788), wk = 0.0035714 k( 170) = ( 0.5288462 0.2054035 0.2512297), wk = 0.0035714 k( 171) = ( 0.5336538 0.1915248 0.2590806), wk = 0.0035714 k( 172) = ( 0.5384615 0.1776462 0.2669316), wk = 0.0035714 k( 173) = ( 0.5432692 0.1637676 0.2747825), wk = 0.0035714 k( 174) = ( 0.5480769 0.1498890 0.2826334), wk = 0.0035714 k( 175) = ( 0.5528846 0.1360104 0.2904844), wk = 0.0035714 k( 176) = ( 0.5576923 0.1221318 0.2983353), wk = 0.0035714 k( 177) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0035714 k( 178) = ( 0.5673077 0.0943746 0.3140371), wk = 0.0035714 k( 179) = ( 0.5721154 0.0804960 0.3218881), wk = 0.0035714 k( 180) = ( 0.5769231 0.0666173 0.3297390), wk = 0.0035714 k( 181) = ( 0.5817308 0.0527387 0.3375899), wk = 0.0035714 k( 182) = ( 0.5865385 0.0388601 0.3454409), wk = 0.0035714 k( 183) = ( 0.5913462 0.0249815 0.3532918), wk = 0.0035714 k( 184) = ( 0.5961538 0.0111029 0.3611427), wk = 0.0035714 k( 185) = ( 0.6009615 -0.0027757 0.3689936), wk = 0.0035714 k( 186) = ( 0.6057692 -0.0166543 0.3768446), wk = 0.0035714 k( 187) = ( 0.6105769 -0.0305329 0.3846955), wk = 0.0035714 k( 188) = ( 0.6153846 -0.0444116 0.3925464), wk = 0.0035714 k( 189) = ( 0.6201923 -0.0582902 0.4003974), wk = 0.0035714 k( 190) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0035714 k( 191) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0035714 k( 192) = ( 0.6166667 -0.0673575 0.4218566), wk = 0.0035714 k( 193) = ( 0.6083333 -0.0625463 0.4354648), wk = 0.0035714 k( 194) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0035714 k( 195) = ( 0.5916667 -0.0529238 0.4626814), wk = 0.0035714 k( 196) = ( 0.5833333 -0.0481125 0.4762897), wk = 0.0035714 k( 197) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0035714 k( 198) = ( 0.5666667 -0.0384900 0.5035062), wk = 0.0035714 k( 199) = ( 0.5583333 -0.0336788 0.5171145), wk = 0.0035714 k( 200) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0035714 k( 201) = ( 0.5416667 -0.0240563 0.5443310), wk = 0.0035714 k( 202) = ( 0.5333333 -0.0192450 0.5579393), wk = 0.0035714 k( 203) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0035714 k( 204) = ( 0.5166667 -0.0096225 0.5851559), wk = 0.0035714 k( 205) = ( 0.5083333 -0.0048113 0.5987642), wk = 0.0035714 k( 206) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0035714 k( 207) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0035714 k( 208) = ( 0.5000000 0.0096225 0.5987642), wk = 0.0035714 k( 209) = ( 0.5000000 0.0192450 0.5851559), wk = 0.0035714 k( 210) = ( 0.5000000 0.0288675 0.5715476), wk = 0.0035714 k( 211) = ( 0.5000000 0.0384900 0.5579393), wk = 0.0035714 k( 212) = ( 0.5000000 0.0481125 0.5443310), wk = 0.0035714 k( 213) = ( 0.5000000 0.0577350 0.5307228), wk = 0.0035714 k( 214) = ( 0.5000000 0.0673575 0.5171145), wk = 0.0035714 k( 215) = ( 0.5000000 0.0769800 0.5035062), wk = 0.0035714 k( 216) = ( 0.5000000 0.0866025 0.4898979), wk = 0.0035714 k( 217) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0035714 k( 218) = ( 0.5000000 0.1058476 0.4626814), wk = 0.0035714 k( 219) = ( 0.5000000 0.1154701 0.4490731), wk = 0.0035714 k( 220) = ( 0.5000000 0.1250926 0.4354648), wk = 0.0035714 k( 221) = ( 0.5000000 0.1347151 0.4218566), wk = 0.0035714 k( 222) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0035714 k( 223) = ( 0.5000000 0.1539601 0.3946400), wk = 0.0035714 k( 224) = ( 0.5000000 0.1635826 0.3810317), wk = 0.0035714 k( 225) = ( 0.5000000 0.1732051 0.3674235), wk = 0.0035714 k( 226) = ( 0.5000000 0.1828276 0.3538152), wk = 0.0035714 k( 227) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0035714 k( 228) = ( 0.5000000 0.2020726 0.3265986), wk = 0.0035714 k( 229) = ( 0.5000000 0.2116951 0.3129904), wk = 0.0035714 k( 230) = ( 0.5000000 0.2213176 0.2993821), wk = 0.0035714 k( 231) = ( 0.5000000 0.2309401 0.2857738), wk = 0.0035714 k( 232) = ( 0.5000000 0.2405626 0.2721655), wk = 0.0035714 k( 233) = ( 0.5000000 0.2501851 0.2585572), wk = 0.0035714 k( 234) = ( 0.5000000 0.2598076 0.2449490), wk = 0.0035714 k( 235) = ( 0.5000000 0.2694301 0.2313407), wk = 0.0035714 k( 236) = ( 0.5000000 0.2790526 0.2177324), wk = 0.0035714 k( 237) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0035714 k( 238) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0035714 k( 239) = ( 0.4951923 0.2858994 0.2198260), wk = 0.0035714 k( 240) = ( 0.4903846 0.2831237 0.2355279), wk = 0.0035714 k( 241) = ( 0.4855769 0.2803480 0.2512297), wk = 0.0035714 k( 242) = ( 0.4807692 0.2775722 0.2669316), wk = 0.0035714 k( 243) = ( 0.4759615 0.2747965 0.2826334), wk = 0.0035714 k( 244) = ( 0.4711538 0.2720208 0.2983353), wk = 0.0035714 k( 245) = ( 0.4663462 0.2692451 0.3140371), wk = 0.0035714 k( 246) = ( 0.4615385 0.2664694 0.3297390), wk = 0.0035714 k( 247) = ( 0.4567308 0.2636936 0.3454409), wk = 0.0035714 k( 248) = ( 0.4519231 0.2609179 0.3611427), wk = 0.0035714 k( 249) = ( 0.4471154 0.2581422 0.3768446), wk = 0.0035714 k( 250) = ( 0.4423077 0.2553665 0.3925464), wk = 0.0035714 k( 251) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0035714 k( 252) = ( 0.4326923 0.2498150 0.4239501), wk = 0.0035714 k( 253) = ( 0.4278846 0.2470393 0.4396520), wk = 0.0035714 k( 254) = ( 0.4230769 0.2442636 0.4553539), wk = 0.0035714 k( 255) = ( 0.4182692 0.2414879 0.4710557), wk = 0.0035714 k( 256) = ( 0.4134615 0.2387121 0.4867576), wk = 0.0035714 k( 257) = ( 0.4086538 0.2359364 0.5024594), wk = 0.0035714 k( 258) = ( 0.4038462 0.2331607 0.5181613), wk = 0.0035714 k( 259) = ( 0.3990385 0.2303850 0.5338632), wk = 0.0035714 k( 260) = ( 0.3942308 0.2276092 0.5495650), wk = 0.0035714 k( 261) = ( 0.3894231 0.2248335 0.5652669), wk = 0.0035714 k( 262) = ( 0.3846154 0.2220578 0.5809687), wk = 0.0035714 k( 263) = ( 0.3798077 0.2192821 0.5966706), wk = 0.0035714 k( 264) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0035714 k( 265) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0035714 k( 266) = ( 0.6166667 -0.0866025 0.4082483), wk = 0.0035714 k( 267) = ( 0.6083333 -0.1010363 0.4082483), wk = 0.0035714 k( 268) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0035714 k( 269) = ( 0.5916667 -0.1299038 0.4082483), wk = 0.0035714 k( 270) = ( 0.5833333 -0.1443376 0.4082483), wk = 0.0035714 k( 271) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0035714 k( 272) = ( 0.5666667 -0.1732051 0.4082483), wk = 0.0035714 k( 273) = ( 0.5583333 -0.1876388 0.4082483), wk = 0.0035714 k( 274) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0035714 k( 275) = ( 0.5416667 -0.2165064 0.4082483), wk = 0.0035714 k( 276) = ( 0.5333333 -0.2309401 0.4082483), wk = 0.0035714 k( 277) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0035714 k( 278) = ( 0.5166667 -0.2598076 0.4082483), wk = 0.0035714 k( 279) = ( 0.5083333 -0.2742414 0.4082483), wk = 0.0035714 k( 280) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0035714 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 2) = ( 0.0119048 0.0000000 0.0119048), wk = 0.0035714 k( 3) = ( 0.0238095 0.0000000 0.0238095), wk = 0.0035714 k( 4) = ( 0.0357143 -0.0000000 0.0357143), wk = 0.0035714 k( 5) = ( 0.0476191 0.0000000 0.0476191), wk = 0.0035714 k( 6) = ( 0.0595238 -0.0000000 0.0595238), wk = 0.0035714 k( 7) = ( 0.0714286 -0.0000000 0.0714286), wk = 0.0035714 k( 8) = ( 0.0833333 -0.0000000 0.0833333), wk = 0.0035714 k( 9) = ( 0.0952381 0.0000000 0.0952381), wk = 0.0035714 k( 10) = ( 0.1071429 -0.0000000 0.1071429), wk = 0.0035714 k( 11) = ( 0.1190476 -0.0000000 0.1190476), wk = 0.0035714 k( 12) = ( 0.1309524 0.0000000 0.1309524), wk = 0.0035714 k( 13) = ( 0.1428571 -0.0000000 0.1428571), wk = 0.0035714 k( 14) = ( 0.1547619 -0.0000000 0.1547619), wk = 0.0035714 k( 15) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0035714 k( 16) = ( 0.1785714 -0.0000000 0.1785714), wk = 0.0035714 k( 17) = ( 0.1904762 -0.0000000 0.1904762), wk = 0.0035714 k( 18) = ( 0.2023810 -0.0000000 0.2023810), wk = 0.0035714 k( 19) = ( 0.2142857 -0.0000000 0.2142857), wk = 0.0035714 k( 20) = ( 0.2261905 -0.0000000 0.2261905), wk = 0.0035714 k( 21) = ( 0.2380952 -0.0000000 0.2380952), wk = 0.0035714 k( 22) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0035714 k( 23) = ( 0.2619048 0.0000000 0.2619048), wk = 0.0035714 k( 24) = ( 0.2738095 0.0000000 0.2738095), wk = 0.0035714 k( 25) = ( 0.2857143 -0.0000000 0.2857143), wk = 0.0035714 k( 26) = ( 0.2976190 -0.0000000 0.2976190), wk = 0.0035714 k( 27) = ( 0.3095238 -0.0000000 0.3095238), wk = 0.0035714 k( 28) = ( 0.3214286 -0.0000000 0.3214286), wk = 0.0035714 k( 29) = ( 0.3333333 -0.0000000 0.3333333), wk = 0.0035714 k( 30) = ( 0.3452381 -0.0000000 0.3452381), wk = 0.0035714 k( 31) = ( 0.3571429 -0.0000000 0.3571429), wk = 0.0035714 k( 32) = ( 0.3690476 -0.0000000 0.3690476), wk = 0.0035714 k( 33) = ( 0.3809524 -0.0000000 0.3809524), wk = 0.0035714 k( 34) = ( 0.3928571 0.0000000 0.3928571), wk = 0.0035714 k( 35) = ( 0.4047619 -0.0000000 0.4047619), wk = 0.0035714 k( 36) = ( 0.4166667 -0.0000000 0.4166667), wk = 0.0035714 k( 37) = ( 0.4285714 -0.0000000 0.4285714), wk = 0.0035714 k( 38) = ( 0.4404762 -0.0000000 0.4404762), wk = 0.0035714 k( 39) = ( 0.4523810 -0.0000000 0.4523810), wk = 0.0035714 k( 40) = ( 0.4642857 -0.0000000 0.4642857), wk = 0.0035714 k( 41) = ( 0.4761905 -0.0000000 0.4761905), wk = 0.0035714 k( 42) = ( 0.4880952 -0.0000000 0.4880952), wk = 0.0035714 k( 43) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 44) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 k( 45) = ( 0.5000000 0.0119048 0.5119048), wk = 0.0035714 k( 46) = ( 0.5000000 0.0238095 0.5238095), wk = 0.0035714 k( 47) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0035714 k( 48) = ( 0.5000000 0.0476190 0.5476190), wk = 0.0035714 k( 49) = ( 0.5000000 0.0595238 0.5595238), wk = 0.0035714 k( 50) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0035714 k( 51) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0035714 k( 52) = ( 0.5000000 0.0952381 0.5952381), wk = 0.0035714 k( 53) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0035714 k( 54) = ( 0.5000000 0.1190476 0.6190476), wk = 0.0035714 k( 55) = ( 0.5000000 0.1309524 0.6309524), wk = 0.0035714 k( 56) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0035714 k( 57) = ( 0.5000000 0.1547619 0.6547619), wk = 0.0035714 k( 58) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0035714 k( 59) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0035714 k( 60) = ( 0.5000000 0.1904762 0.6904762), wk = 0.0035714 k( 61) = ( 0.5000000 0.2023810 0.7023810), wk = 0.0035714 k( 62) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0035714 k( 63) = ( 0.5000000 0.2261905 0.7261905), wk = 0.0035714 k( 64) = ( 0.5000000 0.2380952 0.7380952), wk = 0.0035714 k( 65) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0035714 k( 66) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0035714 k( 67) = ( 0.4916667 0.2583333 0.7500000), wk = 0.0035714 k( 68) = ( 0.4833333 0.2666667 0.7500000), wk = 0.0035714 k( 69) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0035714 k( 70) = ( 0.4666667 0.2833333 0.7500000), wk = 0.0035714 k( 71) = ( 0.4583333 0.2916667 0.7500000), wk = 0.0035714 k( 72) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0035714 k( 73) = ( 0.4416667 0.3083333 0.7500000), wk = 0.0035714 k( 74) = ( 0.4333333 0.3166667 0.7500000), wk = 0.0035714 k( 75) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0035714 k( 76) = ( 0.4166667 0.3333333 0.7500000), wk = 0.0035714 k( 77) = ( 0.4083333 0.3416667 0.7500000), wk = 0.0035714 k( 78) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0035714 k( 79) = ( 0.3916667 0.3583333 0.7500000), wk = 0.0035714 k( 80) = ( 0.3833333 0.3666667 0.7500000), wk = 0.0035714 k( 81) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0035714 k( 82) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0035714 k( 83) = ( 0.3664773 0.3664773 0.7329545), wk = 0.0035714 k( 84) = ( 0.3579545 0.3579545 0.7159091), wk = 0.0035714 k( 85) = ( 0.3494318 0.3494318 0.6988636), wk = 0.0035714 k( 86) = ( 0.3409091 0.3409091 0.6818182), wk = 0.0035714 k( 87) = ( 0.3323864 0.3323864 0.6647727), wk = 0.0035714 k( 88) = ( 0.3238636 0.3238636 0.6477273), wk = 0.0035714 k( 89) = ( 0.3153409 0.3153409 0.6306818), wk = 0.0035714 k( 90) = ( 0.3068182 0.3068182 0.6136364), wk = 0.0035714 k( 91) = ( 0.2982955 0.2982955 0.5965909), wk = 0.0035714 k( 92) = ( 0.2897727 0.2897727 0.5795455), wk = 0.0035714 k( 93) = ( 0.2812500 0.2812500 0.5625000), wk = 0.0035714 k( 94) = ( 0.2727273 0.2727273 0.5454545), wk = 0.0035714 k( 95) = ( 0.2642045 0.2642046 0.5284091), wk = 0.0035714 k( 96) = ( 0.2556818 0.2556818 0.5113636), wk = 0.0035714 k( 97) = ( 0.2471591 0.2471591 0.4943182), wk = 0.0035714 k( 98) = ( 0.2386364 0.2386364 0.4772727), wk = 0.0035714 k( 99) = ( 0.2301136 0.2301136 0.4602273), wk = 0.0035714 k( 100) = ( 0.2215909 0.2215909 0.4431818), wk = 0.0035714 k( 101) = ( 0.2130682 0.2130682 0.4261364), wk = 0.0035714 k( 102) = ( 0.2045454 0.2045455 0.4090909), wk = 0.0035714 k( 103) = ( 0.1960227 0.1960227 0.3920455), wk = 0.0035714 k( 104) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0035714 k( 105) = ( 0.1789773 0.1789773 0.3579545), wk = 0.0035714 k( 106) = ( 0.1704546 0.1704546 0.3409091), wk = 0.0035714 k( 107) = ( 0.1619318 0.1619318 0.3238636), wk = 0.0035714 k( 108) = ( 0.1534091 0.1534091 0.3068182), wk = 0.0035714 k( 109) = ( 0.1448864 0.1448864 0.2897727), wk = 0.0035714 k( 110) = ( 0.1363636 0.1363636 0.2727273), wk = 0.0035714 k( 111) = ( 0.1278409 0.1278409 0.2556818), wk = 0.0035714 k( 112) = ( 0.1193182 0.1193182 0.2386364), wk = 0.0035714 k( 113) = ( 0.1107955 0.1107955 0.2215909), wk = 0.0035714 k( 114) = ( 0.1022727 0.1022727 0.2045455), wk = 0.0035714 k( 115) = ( 0.0937500 0.0937500 0.1875000), wk = 0.0035714 k( 116) = ( 0.0852273 0.0852273 0.1704546), wk = 0.0035714 k( 117) = ( 0.0767045 0.0767045 0.1534091), wk = 0.0035714 k( 118) = ( 0.0681818 0.0681818 0.1363636), wk = 0.0035714 k( 119) = ( 0.0596591 0.0596591 0.1193182), wk = 0.0035714 k( 120) = ( 0.0511364 0.0511364 0.1022727), wk = 0.0035714 k( 121) = ( 0.0426136 0.0426136 0.0852273), wk = 0.0035714 k( 122) = ( 0.0340909 0.0340909 0.0681818), wk = 0.0035714 k( 123) = ( 0.0255682 0.0255682 0.0511364), wk = 0.0035714 k( 124) = ( 0.0170455 0.0170455 0.0340909), wk = 0.0035714 k( 125) = ( 0.0085227 0.0085227 0.0170455), wk = 0.0035714 k( 126) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 127) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035714 k( 128) = ( 0.0138889 0.0138889 0.0138889), wk = 0.0035714 k( 129) = ( 0.0277778 0.0277778 0.0277778), wk = 0.0035714 k( 130) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0035714 k( 131) = ( 0.0555556 0.0555556 0.0555556), wk = 0.0035714 k( 132) = ( 0.0694444 0.0694444 0.0694444), wk = 0.0035714 k( 133) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0035714 k( 134) = ( 0.0972222 0.0972222 0.0972222), wk = 0.0035714 k( 135) = ( 0.1111111 0.1111111 0.1111111), wk = 0.0035714 k( 136) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0035714 k( 137) = ( 0.1388889 0.1388889 0.1388889), wk = 0.0035714 k( 138) = ( 0.1527778 0.1527778 0.1527778), wk = 0.0035714 k( 139) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0035714 k( 140) = ( 0.1805556 0.1805556 0.1805556), wk = 0.0035714 k( 141) = ( 0.1944444 0.1944444 0.1944444), wk = 0.0035714 k( 142) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0035714 k( 143) = ( 0.2222222 0.2222222 0.2222222), wk = 0.0035714 k( 144) = ( 0.2361111 0.2361111 0.2361111), wk = 0.0035714 k( 145) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0035714 k( 146) = ( 0.2638889 0.2638889 0.2638889), wk = 0.0035714 k( 147) = ( 0.2777778 0.2777778 0.2777778), wk = 0.0035714 k( 148) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0035714 k( 149) = ( 0.3055556 0.3055556 0.3055556), wk = 0.0035714 k( 150) = ( 0.3194444 0.3194444 0.3194444), wk = 0.0035714 k( 151) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0035714 k( 152) = ( 0.3472222 0.3472222 0.3472222), wk = 0.0035714 k( 153) = ( 0.3611111 0.3611111 0.3611111), wk = 0.0035714 k( 154) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0035714 k( 155) = ( 0.3888889 0.3888889 0.3888889), wk = 0.0035714 k( 156) = ( 0.4027778 0.4027778 0.4027778), wk = 0.0035714 k( 157) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0035714 k( 158) = ( 0.4305556 0.4305556 0.4305556), wk = 0.0035714 k( 159) = ( 0.4444444 0.4444444 0.4444444), wk = 0.0035714 k( 160) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0035714 k( 161) = ( 0.4722222 0.4722222 0.4722222), wk = 0.0035714 k( 162) = ( 0.4861111 0.4861111 0.4861111), wk = 0.0035714 k( 163) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035714 k( 164) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035714 k( 165) = ( 0.5048077 0.4903846 0.5048077), wk = 0.0035714 k( 166) = ( 0.5096154 0.4807692 0.5096154), wk = 0.0035714 k( 167) = ( 0.5144231 0.4711539 0.5144231), wk = 0.0035714 k( 168) = ( 0.5192308 0.4615385 0.5192308), wk = 0.0035714 k( 169) = ( 0.5240385 0.4519231 0.5240385), wk = 0.0035714 k( 170) = ( 0.5288462 0.4423077 0.5288462), wk = 0.0035714 k( 171) = ( 0.5336538 0.4326923 0.5336538), wk = 0.0035714 k( 172) = ( 0.5384615 0.4230769 0.5384615), wk = 0.0035714 k( 173) = ( 0.5432692 0.4134615 0.5432692), wk = 0.0035714 k( 174) = ( 0.5480769 0.4038462 0.5480769), wk = 0.0035714 k( 175) = ( 0.5528846 0.3942308 0.5528846), wk = 0.0035714 k( 176) = ( 0.5576923 0.3846154 0.5576923), wk = 0.0035714 k( 177) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0035714 k( 178) = ( 0.5673077 0.3653846 0.5673077), wk = 0.0035714 k( 179) = ( 0.5721154 0.3557692 0.5721154), wk = 0.0035714 k( 180) = ( 0.5769231 0.3461538 0.5769231), wk = 0.0035714 k( 181) = ( 0.5817308 0.3365385 0.5817308), wk = 0.0035714 k( 182) = ( 0.5865385 0.3269231 0.5865385), wk = 0.0035714 k( 183) = ( 0.5913462 0.3173077 0.5913462), wk = 0.0035714 k( 184) = ( 0.5961538 0.3076923 0.5961539), wk = 0.0035714 k( 185) = ( 0.6009615 0.2980769 0.6009615), wk = 0.0035714 k( 186) = ( 0.6057692 0.2884615 0.6057692), wk = 0.0035714 k( 187) = ( 0.6105769 0.2788462 0.6105769), wk = 0.0035714 k( 188) = ( 0.6153846 0.2692308 0.6153846), wk = 0.0035714 k( 189) = ( 0.6201923 0.2596154 0.6201923), wk = 0.0035714 k( 190) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0035714 k( 191) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0035714 k( 192) = ( 0.6166667 0.2500000 0.6333333), wk = 0.0035714 k( 193) = ( 0.6083333 0.2500000 0.6416667), wk = 0.0035714 k( 194) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0035714 k( 195) = ( 0.5916667 0.2500000 0.6583333), wk = 0.0035714 k( 196) = ( 0.5833333 0.2500000 0.6666667), wk = 0.0035714 k( 197) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0035714 k( 198) = ( 0.5666667 0.2500000 0.6833333), wk = 0.0035714 k( 199) = ( 0.5583333 0.2500000 0.6916667), wk = 0.0035714 k( 200) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0035714 k( 201) = ( 0.5416667 0.2500000 0.7083333), wk = 0.0035714 k( 202) = ( 0.5333333 0.2500000 0.7166667), wk = 0.0035714 k( 203) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0035714 k( 204) = ( 0.5166667 0.2500000 0.7333333), wk = 0.0035714 k( 205) = ( 0.5083333 0.2500000 0.7416667), wk = 0.0035714 k( 206) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0035714 k( 207) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0035714 k( 208) = ( 0.5000000 0.2583333 0.7416667), wk = 0.0035714 k( 209) = ( 0.5000000 0.2666667 0.7333333), wk = 0.0035714 k( 210) = ( 0.5000000 0.2750000 0.7250000), wk = 0.0035714 k( 211) = ( 0.5000000 0.2833333 0.7166667), wk = 0.0035714 k( 212) = ( 0.5000000 0.2916667 0.7083333), wk = 0.0035714 k( 213) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0035714 k( 214) = ( 0.5000000 0.3083333 0.6916667), wk = 0.0035714 k( 215) = ( 0.5000000 0.3166667 0.6833333), wk = 0.0035714 k( 216) = ( 0.5000000 0.3250000 0.6750000), wk = 0.0035714 k( 217) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0035714 k( 218) = ( 0.5000000 0.3416667 0.6583333), wk = 0.0035714 k( 219) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0035714 k( 220) = ( 0.5000000 0.3583333 0.6416667), wk = 0.0035714 k( 221) = ( 0.5000000 0.3666667 0.6333333), wk = 0.0035714 k( 222) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0035714 k( 223) = ( 0.5000000 0.3833333 0.6166667), wk = 0.0035714 k( 224) = ( 0.5000000 0.3916667 0.6083333), wk = 0.0035714 k( 225) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0035714 k( 226) = ( 0.5000000 0.4083333 0.5916667), wk = 0.0035714 k( 227) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0035714 k( 228) = ( 0.5000000 0.4250000 0.5750000), wk = 0.0035714 k( 229) = ( 0.5000000 0.4333333 0.5666667), wk = 0.0035714 k( 230) = ( 0.5000000 0.4416667 0.5583333), wk = 0.0035714 k( 231) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0035714 k( 232) = ( 0.5000000 0.4583333 0.5416667), wk = 0.0035714 k( 233) = ( 0.5000000 0.4666667 0.5333333), wk = 0.0035714 k( 234) = ( 0.5000000 0.4750000 0.5250000), wk = 0.0035714 k( 235) = ( 0.5000000 0.4833333 0.5166667), wk = 0.0035714 k( 236) = ( 0.5000000 0.4916667 0.5083333), wk = 0.0035714 k( 237) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035714 k( 238) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035714 k( 239) = ( 0.4951923 0.4951923 0.5096154), wk = 0.0035714 k( 240) = ( 0.4903846 0.4903846 0.5192308), wk = 0.0035714 k( 241) = ( 0.4855769 0.4855769 0.5288462), wk = 0.0035714 k( 242) = ( 0.4807692 0.4807692 0.5384615), wk = 0.0035714 k( 243) = ( 0.4759615 0.4759615 0.5480769), wk = 0.0035714 k( 244) = ( 0.4711538 0.4711538 0.5576923), wk = 0.0035714 k( 245) = ( 0.4663462 0.4663462 0.5673077), wk = 0.0035714 k( 246) = ( 0.4615385 0.4615385 0.5769231), wk = 0.0035714 k( 247) = ( 0.4567308 0.4567308 0.5865385), wk = 0.0035714 k( 248) = ( 0.4519231 0.4519231 0.5961539), wk = 0.0035714 k( 249) = ( 0.4471154 0.4471154 0.6057692), wk = 0.0035714 k( 250) = ( 0.4423077 0.4423077 0.6153846), wk = 0.0035714 k( 251) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0035714 k( 252) = ( 0.4326923 0.4326923 0.6346154), wk = 0.0035714 k( 253) = ( 0.4278846 0.4278846 0.6442308), wk = 0.0035714 k( 254) = ( 0.4230769 0.4230769 0.6538462), wk = 0.0035714 k( 255) = ( 0.4182692 0.4182692 0.6634615), wk = 0.0035714 k( 256) = ( 0.4134615 0.4134615 0.6730769), wk = 0.0035714 k( 257) = ( 0.4086538 0.4086538 0.6826923), wk = 0.0035714 k( 258) = ( 0.4038462 0.4038462 0.6923077), wk = 0.0035714 k( 259) = ( 0.3990385 0.3990385 0.7019231), wk = 0.0035714 k( 260) = ( 0.3942308 0.3942308 0.7115385), wk = 0.0035714 k( 261) = ( 0.3894231 0.3894231 0.7211538), wk = 0.0035714 k( 262) = ( 0.3846154 0.3846154 0.7307692), wk = 0.0035714 k( 263) = ( 0.3798077 0.3798077 0.7403846), wk = 0.0035714 k( 264) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0035714 k( 265) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0035714 k( 266) = ( 0.6166667 0.2333333 0.6166667), wk = 0.0035714 k( 267) = ( 0.6083333 0.2166667 0.6083333), wk = 0.0035714 k( 268) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0035714 k( 269) = ( 0.5916667 0.1833333 0.5916667), wk = 0.0035714 k( 270) = ( 0.5833333 0.1666667 0.5833333), wk = 0.0035714 k( 271) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0035714 k( 272) = ( 0.5666667 0.1333333 0.5666667), wk = 0.0035714 k( 273) = ( 0.5583333 0.1166667 0.5583333), wk = 0.0035714 k( 274) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0035714 k( 275) = ( 0.5416667 0.0833333 0.5416667), wk = 0.0035714 k( 276) = ( 0.5333333 0.0666667 0.5333333), wk = 0.0035714 k( 277) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0035714 k( 278) = ( 0.5166667 0.0333333 0.5166667), wk = 0.0035714 k( 279) = ( 0.5083333 0.0166667 0.5083333), wk = 0.0035714 k( 280) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0035714 Dense grid: 71441 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.39 Mb ( 516, 50) NL pseudopotentials 0.45 Mb ( 258, 114) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 1984) G-vector shells 0.00 Mb ( 490) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.57 Mb ( 516, 200) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.17 Mb ( 114, 2, 50) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./Sr2H6Ru.save/charge-density.dat Starting wfc are 64 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.6 secs Computing kpt #: 2 total cpu time spent up to now is 3.9 secs Computing kpt #: 3 total cpu time spent up to now is 5.3 secs Computing kpt #: 4 total cpu time spent up to now is 6.5 secs Computing kpt #: 5 total cpu time spent up to now is 7.9 secs Computing kpt #: 6 total cpu time spent up to now is 9.4 secs Computing kpt #: 7 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 11.4 secs Computing kpt #: 8 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 13.3 secs Computing kpt #: 9 total cpu time spent up to now is 14.6 secs Computing kpt #: 10 total cpu time spent up to now is 15.5 secs Computing kpt #: 11 total cpu time spent up to now is 16.4 secs Computing kpt #: 12 total cpu time spent up to now is 17.2 secs Computing kpt #: 13 total cpu time spent up to now is 18.0 secs Computing kpt #: 14 total cpu time spent up to now is 18.7 secs Computing kpt #: 15 total cpu time spent up to now is 19.4 secs Computing kpt #: 16 total cpu time spent up to now is 20.2 secs Computing kpt #: 17 total cpu time spent up to now is 20.9 secs Computing kpt #: 18 total cpu time spent up to now is 21.9 secs Computing kpt #: 19 total cpu time spent up to now is 22.7 secs Computing kpt #: 20 total cpu time spent up to now is 23.5 secs Computing kpt #: 21 total cpu time spent up to now is 24.6 secs Computing kpt #: 22 total cpu time spent up to now is 25.7 secs Computing kpt #: 23 total cpu time spent up to now is 26.5 secs Computing kpt #: 24 total cpu time spent up to now is 27.5 secs Computing kpt #: 25 total cpu time spent up to now is 28.5 secs Computing kpt #: 26 total cpu time spent up to now is 29.6 secs Computing kpt #: 27 total cpu time spent up to now is 30.7 secs Computing kpt #: 28 total cpu time spent up to now is 31.5 secs Computing kpt #: 29 total cpu time spent up to now is 32.5 secs Computing kpt #: 30 total cpu time spent up to now is 33.5 secs Computing kpt #: 31 total cpu time spent up to now is 34.6 secs Computing kpt #: 32 total cpu time spent up to now is 35.4 secs Computing kpt #: 33 total cpu time spent up to now is 36.2 secs Computing kpt #: 34 total cpu time spent up to now is 37.2 secs Computing kpt #: 35 total cpu time spent up to now is 38.0 secs Computing kpt #: 36 total cpu time spent up to now is 39.0 secs Computing kpt #: 37 total cpu time spent up to now is 40.0 secs Computing kpt #: 38 total cpu time spent up to now is 41.1 secs Computing kpt #: 39 total cpu time spent up to now is 42.1 secs Computing kpt #: 40 total cpu time spent up to now is 42.9 secs Computing kpt #: 41 total cpu time spent up to now is 43.7 secs Computing kpt #: 42 total cpu time spent up to now is 44.5 secs Computing kpt #: 43 total cpu time spent up to now is 45.2 secs Computing kpt #: 44 total cpu time spent up to now is 46.0 secs Computing kpt #: 45 total cpu time spent up to now is 46.8 secs Computing kpt #: 46 total cpu time spent up to now is 47.6 secs Computing kpt #: 47 total cpu time spent up to now is 48.3 secs Computing kpt #: 48 total cpu time spent up to now is 48.9 secs Computing kpt #: 49 total cpu time spent up to now is 49.6 secs Computing kpt #: 50 total cpu time spent up to now is 50.3 secs Computing kpt #: 51 total cpu time spent up to now is 50.9 secs Computing kpt #: 52 total cpu time spent up to now is 51.6 secs Computing kpt #: 53 total cpu time spent up to now is 52.3 secs Computing kpt #: 54 total cpu time spent up to now is 52.9 secs Computing kpt #: 55 total cpu time spent up to now is 53.6 secs Computing kpt #: 56 total cpu time spent up to now is 54.2 secs Computing kpt #: 57 total cpu time spent up to now is 54.8 secs Computing kpt #: 58 total cpu time spent up to now is 55.4 secs Computing kpt #: 59 total cpu time spent up to now is 56.0 secs Computing kpt #: 60 total cpu time spent up to now is 56.6 secs Computing kpt #: 61 total cpu time spent up to now is 57.3 secs Computing kpt #: 62 total cpu time spent up to now is 57.9 secs Computing kpt #: 63 total cpu time spent up to now is 58.5 secs Computing kpt #: 64 total cpu time spent up to now is 59.1 secs Computing kpt #: 65 total cpu time spent up to now is 59.7 secs Computing kpt #: 66 total cpu time spent up to now is 60.3 secs Computing kpt #: 67 total cpu time spent up to now is 60.9 secs Computing kpt #: 68 total cpu time spent up to now is 61.6 secs Computing kpt #: 69 total cpu time spent up to now is 62.2 secs Computing kpt #: 70 total cpu time spent up to now is 62.8 secs Computing kpt #: 71 total cpu time spent up to now is 63.4 secs Computing kpt #: 72 total cpu time spent up to now is 64.0 secs Computing kpt #: 73 total cpu time spent up to now is 64.7 secs Computing kpt #: 74 total cpu time spent up to now is 65.3 secs Computing kpt #: 75 total cpu time spent up to now is 66.0 secs Computing kpt #: 76 total cpu time spent up to now is 66.6 secs Computing kpt #: 77 total cpu time spent up to now is 67.2 secs Computing kpt #: 78 total cpu time spent up to now is 67.9 secs Computing kpt #: 79 total cpu time spent up to now is 68.6 secs Computing kpt #: 80 total cpu time spent up to now is 69.2 secs Computing kpt #: 81 total cpu time spent up to now is 69.9 secs Computing kpt #: 82 total cpu time spent up to now is 70.6 secs Computing kpt #: 83 total cpu time spent up to now is 71.2 secs Computing kpt #: 84 total cpu time spent up to now is 71.9 secs Computing kpt #: 85 total cpu time spent up to now is 72.6 secs Computing kpt #: 86 total cpu time spent up to now is 73.2 secs Computing kpt #: 87 total cpu time spent up to now is 73.9 secs Computing kpt #: 88 total cpu time spent up to now is 74.6 secs Computing kpt #: 89 total cpu time spent up to now is 75.2 secs Computing kpt #: 90 total cpu time spent up to now is 75.9 secs Computing kpt #: 91 total cpu time spent up to now is 76.5 secs Computing kpt #: 92 total cpu time spent up to now is 77.2 secs Computing kpt #: 93 total cpu time spent up to now is 77.9 secs Computing kpt #: 94 total cpu time spent up to now is 78.6 secs Computing kpt #: 95 total cpu time spent up to now is 79.3 secs Computing kpt #: 96 total cpu time spent up to now is 80.0 secs Computing kpt #: 97 total cpu time spent up to now is 80.8 secs Computing kpt #: 98 total cpu time spent up to now is 81.5 secs Computing kpt #: 99 total cpu time spent up to now is 82.3 secs Computing kpt #: 100 total cpu time spent up to now is 83.1 secs Computing kpt #: 101 total cpu time spent up to now is 83.9 secs Computing kpt #: 102 total cpu time spent up to now is 84.7 secs Computing kpt #: 103 total cpu time spent up to now is 85.5 secs Computing kpt #: 104 total cpu time spent up to now is 86.3 secs Computing kpt #: 105 total cpu time spent up to now is 87.0 secs Computing kpt #: 106 total cpu time spent up to now is 87.9 secs Computing kpt #: 107 total cpu time spent up to now is 88.7 secs Computing kpt #: 108 total cpu time spent up to now is 89.5 secs Computing kpt #: 109 total cpu time spent up to now is 90.2 secs Computing kpt #: 110 total cpu time spent up to now is 90.9 secs Computing kpt #: 111 total cpu time spent up to now is 91.7 secs Computing kpt #: 112 total cpu time spent up to now is 92.5 secs Computing kpt #: 113 total cpu time spent up to now is 93.3 secs Computing kpt #: 114 total cpu time spent up to now is 94.1 secs Computing kpt #: 115 total cpu time spent up to now is 94.9 secs Computing kpt #: 116 total cpu time spent up to now is 95.8 secs Computing kpt #: 117 total cpu time spent up to now is 96.6 secs Computing kpt #: 118 total cpu time spent up to now is 97.5 secs Computing kpt #: 119 total cpu time spent up to now is 98.6 secs Computing kpt #: 120 total cpu time spent up to now is 99.6 secs Computing kpt #: 121 total cpu time spent up to now is 100.9 secs Computing kpt #: 122 total cpu time spent up to now is 102.4 secs Computing kpt #: 123 total cpu time spent up to now is 104.0 secs Computing kpt #: 124 total cpu time spent up to now is 105.4 secs Computing kpt #: 125 total cpu time spent up to now is 106.7 secs Computing kpt #: 126 total cpu time spent up to now is 107.8 secs Computing kpt #: 127 total cpu time spent up to now is 109.0 secs Computing kpt #: 128 total cpu time spent up to now is 110.2 secs Computing kpt #: 129 total cpu time spent up to now is 111.6 secs Computing kpt #: 130 total cpu time spent up to now is 112.8 secs Computing kpt #: 131 total cpu time spent up to now is 113.9 secs Computing kpt #: 132 total cpu time spent up to now is 114.9 secs Computing kpt #: 133 total cpu time spent up to now is 116.0 secs Computing kpt #: 134 total cpu time spent up to now is 116.9 secs Computing kpt #: 135 total cpu time spent up to now is 117.8 secs Computing kpt #: 136 total cpu time spent up to now is 118.5 secs Computing kpt #: 137 total cpu time spent up to now is 119.3 secs Computing kpt #: 138 total cpu time spent up to now is 120.1 secs Computing kpt #: 139 total cpu time spent up to now is 120.9 secs Computing kpt #: 140 total cpu time spent up to now is 121.7 secs Computing kpt #: 141 total cpu time spent up to now is 122.4 secs Computing kpt #: 142 total cpu time spent up to now is 123.1 secs Computing kpt #: 143 total cpu time spent up to now is 123.7 secs Computing kpt #: 144 total cpu time spent up to now is 124.4 secs Computing kpt #: 145 total cpu time spent up to now is 125.1 secs Computing kpt #: 146 total cpu time spent up to now is 125.7 secs Computing kpt #: 147 total cpu time spent up to now is 126.4 secs Computing kpt #: 148 total cpu time spent up to now is 127.1 secs Computing kpt #: 149 total cpu time spent up to now is 127.9 secs Computing kpt #: 150 total cpu time spent up to now is 128.6 secs Computing kpt #: 151 total cpu time spent up to now is 129.4 secs Computing kpt #: 152 total cpu time spent up to now is 130.1 secs Computing kpt #: 153 total cpu time spent up to now is 130.9 secs Computing kpt #: 154 total cpu time spent up to now is 131.7 secs Computing kpt #: 155 total cpu time spent up to now is 132.4 secs Computing kpt #: 156 total cpu time spent up to now is 133.1 secs Computing kpt #: 157 total cpu time spent up to now is 133.8 secs Computing kpt #: 158 total cpu time spent up to now is 134.5 secs Computing kpt #: 159 total cpu time spent up to now is 135.2 secs Computing kpt #: 160 total cpu time spent up to now is 135.9 secs Computing kpt #: 161 total cpu time spent up to now is 136.6 secs Computing kpt #: 162 total cpu time spent up to now is 137.3 secs Computing kpt #: 163 total cpu time spent up to now is 137.9 secs Computing kpt #: 164 total cpu time spent up to now is 138.6 secs Computing kpt #: 165 total cpu time spent up to now is 139.3 secs Computing kpt #: 166 total cpu time spent up to now is 140.0 secs Computing kpt #: 167 total cpu time spent up to now is 140.7 secs Computing kpt #: 168 total cpu time spent up to now is 141.4 secs Computing kpt #: 169 total cpu time spent up to now is 142.1 secs Computing kpt #: 170 total cpu time spent up to now is 142.7 secs Computing kpt #: 171 total cpu time spent up to now is 143.4 secs Computing kpt #: 172 total cpu time spent up to now is 144.1 secs Computing kpt #: 173 total cpu time spent up to now is 144.8 secs Computing kpt #: 174 total cpu time spent up to now is 145.5 secs Computing kpt #: 175 total cpu time spent up to now is 146.2 secs Computing kpt #: 176 total cpu time spent up to now is 146.9 secs Computing kpt #: 177 total cpu time spent up to now is 147.6 secs Computing kpt #: 178 total cpu time spent up to now is 148.3 secs Computing kpt #: 179 total cpu time spent up to now is 149.0 secs Computing kpt #: 180 total cpu time spent up to now is 149.6 secs Computing kpt #: 181 total cpu time spent up to now is 150.3 secs Computing kpt #: 182 total cpu time spent up to now is 151.0 secs Computing kpt #: 183 total cpu time spent up to now is 151.6 secs Computing kpt #: 184 total cpu time spent up to now is 152.3 secs Computing kpt #: 185 total cpu time spent up to now is 153.0 secs Computing kpt #: 186 total cpu time spent up to now is 153.6 secs Computing kpt #: 187 total cpu time spent up to now is 154.3 secs Computing kpt #: 188 total cpu time spent up to now is 155.0 secs Computing kpt #: 189 total cpu time spent up to now is 155.6 secs Computing kpt #: 190 total cpu time spent up to now is 156.3 secs Computing kpt #: 191 total cpu time spent up to now is 156.9 secs Computing kpt #: 192 total cpu time spent up to now is 157.6 secs Computing kpt #: 193 total cpu time spent up to now is 158.3 secs Computing kpt #: 194 total cpu time spent up to now is 158.9 secs Computing kpt #: 195 total cpu time spent up to now is 159.6 secs Computing kpt #: 196 total cpu time spent up to now is 160.2 secs Computing kpt #: 197 total cpu time spent up to now is 160.8 secs Computing kpt #: 198 total cpu time spent up to now is 161.5 secs Computing kpt #: 199 total cpu time spent up to now is 162.1 secs Computing kpt #: 200 total cpu time spent up to now is 162.7 secs Computing kpt #: 201 total cpu time spent up to now is 163.4 secs Computing kpt #: 202 total cpu time spent up to now is 164.0 secs Computing kpt #: 203 total cpu time spent up to now is 164.6 secs Computing kpt #: 204 total cpu time spent up to now is 165.2 secs Computing kpt #: 205 total cpu time spent up to now is 165.8 secs Computing kpt #: 206 total cpu time spent up to now is 166.4 secs Computing kpt #: 207 total cpu time spent up to now is 167.0 secs Computing kpt #: 208 total cpu time spent up to now is 167.6 secs Computing kpt #: 209 total cpu time spent up to now is 168.3 secs Computing kpt #: 210 total cpu time spent up to now is 168.9 secs Computing kpt #: 211 total cpu time spent up to now is 169.5 secs Computing kpt #: 212 total cpu time spent up to now is 170.1 secs Computing kpt #: 213 total cpu time spent up to now is 170.7 secs Computing kpt #: 214 total cpu time spent up to now is 171.4 secs Computing kpt #: 215 total cpu time spent up to now is 172.0 secs Computing kpt #: 216 total cpu time spent up to now is 172.6 secs Computing kpt #: 217 total cpu time spent up to now is 173.3 secs Computing kpt #: 218 total cpu time spent up to now is 173.9 secs Computing kpt #: 219 total cpu time spent up to now is 174.5 secs Computing kpt #: 220 total cpu time spent up to now is 175.2 secs Computing kpt #: 221 total cpu time spent up to now is 175.8 secs Computing kpt #: 222 total cpu time spent up to now is 176.5 secs Computing kpt #: 223 total cpu time spent up to now is 177.1 secs Computing kpt #: 224 total cpu time spent up to now is 177.8 secs Computing kpt #: 225 total cpu time spent up to now is 178.5 secs Computing kpt #: 226 total cpu time spent up to now is 179.2 secs Computing kpt #: 227 total cpu time spent up to now is 179.8 secs Computing kpt #: 228 total cpu time spent up to now is 180.5 secs Computing kpt #: 229 total cpu time spent up to now is 181.2 secs Computing kpt #: 230 total cpu time spent up to now is 181.9 secs Computing kpt #: 231 total cpu time spent up to now is 182.6 secs Computing kpt #: 232 total cpu time spent up to now is 183.3 secs Computing kpt #: 233 total cpu time spent up to now is 183.9 secs Computing kpt #: 234 total cpu time spent up to now is 184.6 secs Computing kpt #: 235 total cpu time spent up to now is 185.3 secs Computing kpt #: 236 total cpu time spent up to now is 186.0 secs Computing kpt #: 237 total cpu time spent up to now is 186.7 secs Computing kpt #: 238 total cpu time spent up to now is 187.4 secs Computing kpt #: 239 total cpu time spent up to now is 188.1 secs Computing kpt #: 240 total cpu time spent up to now is 188.8 secs Computing kpt #: 241 total cpu time spent up to now is 189.4 secs Computing kpt #: 242 total cpu time spent up to now is 190.1 secs Computing kpt #: 243 total cpu time spent up to now is 190.8 secs Computing kpt #: 244 total cpu time spent up to now is 191.5 secs Computing kpt #: 245 total cpu time spent up to now is 192.2 secs Computing kpt #: 246 total cpu time spent up to now is 192.9 secs Computing kpt #: 247 total cpu time spent up to now is 193.6 secs Computing kpt #: 248 total cpu time spent up to now is 194.3 secs Computing kpt #: 249 total cpu time spent up to now is 194.9 secs Computing kpt #: 250 total cpu time spent up to now is 195.6 secs Computing kpt #: 251 total cpu time spent up to now is 196.3 secs Computing kpt #: 252 total cpu time spent up to now is 197.0 secs Computing kpt #: 253 total cpu time spent up to now is 197.7 secs Computing kpt #: 254 total cpu time spent up to now is 198.4 secs Computing kpt #: 255 total cpu time spent up to now is 199.0 secs Computing kpt #: 256 total cpu time spent up to now is 199.7 secs Computing kpt #: 257 total cpu time spent up to now is 200.4 secs Computing kpt #: 258 total cpu time spent up to now is 201.0 secs Computing kpt #: 259 total cpu time spent up to now is 201.7 secs Computing kpt #: 260 total cpu time spent up to now is 202.3 secs Computing kpt #: 261 total cpu time spent up to now is 203.0 secs Computing kpt #: 262 total cpu time spent up to now is 203.7 secs Computing kpt #: 263 total cpu time spent up to now is 204.3 secs Computing kpt #: 264 total cpu time spent up to now is 205.0 secs Computing kpt #: 265 total cpu time spent up to now is 205.7 secs Computing kpt #: 266 total cpu time spent up to now is 206.3 secs Computing kpt #: 267 total cpu time spent up to now is 207.0 secs Computing kpt #: 268 total cpu time spent up to now is 207.6 secs Computing kpt #: 269 total cpu time spent up to now is 208.3 secs Computing kpt #: 270 total cpu time spent up to now is 209.0 secs Computing kpt #: 271 total cpu time spent up to now is 209.6 secs Computing kpt #: 272 total cpu time spent up to now is 210.3 secs Computing kpt #: 273 total cpu time spent up to now is 211.0 secs Computing kpt #: 274 total cpu time spent up to now is 211.6 secs Computing kpt #: 275 total cpu time spent up to now is 212.3 secs Computing kpt #: 276 total cpu time spent up to now is 213.0 secs Computing kpt #: 277 total cpu time spent up to now is 213.6 secs Computing kpt #: 278 total cpu time spent up to now is 214.4 secs Computing kpt #: 279 total cpu time spent up to now is 215.2 secs Computing kpt #: 280 total cpu time spent up to now is 216.0 secs ethr = 2.38E-08, avg # of iterations = 25.1 total cpu time spent up to now is 216.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8873 PWs) bands (ev): -62.7469 -62.7469 -35.3716 -35.3716 -32.2082 -32.2082 -32.2082 -32.2082 -27.0296 -27.0296 -26.9607 -26.9607 -9.9531 -9.9531 -9.7170 -9.7170 -8.8388 -8.8388 -8.8388 -8.8388 -8.5593 -8.5593 -8.5593 -8.5593 0.8128 0.8128 2.8779 2.8779 2.8779 2.8779 4.5155 4.5155 4.6514 4.6514 4.6514 4.6514 6.6757 6.6757 6.6757 6.6757 6.7881 6.7881 10.5912 10.5912 10.5912 10.5912 11.7787 11.7787 14.2211 14.2211 k = 0.0119-0.0069 0.0097 ( 8873 PWs) bands (ev): -62.7469 -62.7469 -35.3716 -35.3716 -32.2082 -32.2082 -32.2082 -32.2082 -27.0295 -27.0295 -26.9607 -26.9607 -9.9530 -9.9530 -9.7172 -9.7172 -8.8389 -8.8389 -8.8385 -8.8385 -8.5597 -8.5597 -8.5592 -8.5592 0.8145 0.8145 2.8774 2.8774 2.8783 2.8783 4.5159 4.5159 4.6513 4.6513 4.6523 4.6523 6.6753 6.6753 6.6756 6.6756 6.7879 6.7879 10.5909 10.5909 10.5911 10.5911 11.7824 11.7824 14.2125 14.2125 k = 0.0238-0.0137 0.0194 ( 8929 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0294 -27.0294 -26.9608 -26.9608 -9.9527 -9.9527 -9.7176 -9.7176 -8.8392 -8.8392 -8.8377 -8.8377 -8.5610 -8.5610 -8.5591 -8.5591 0.8194 0.8194 2.8759 2.8759 2.8794 2.8794 4.5171 4.5171 4.6509 4.6509 4.6548 4.6548 6.6740 6.6740 6.6754 6.6754 6.7872 6.7872 10.5899 10.5899 10.5908 10.5908 11.7932 11.7932 14.1868 14.1868 k = 0.0357-0.0206 0.0292 ( 8945 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0292 -27.0292 -26.9610 -26.9610 -9.9523 -9.9523 -9.7184 -9.7184 -8.8396 -8.8396 -8.8363 -8.8363 -8.5631 -8.5631 -8.5589 -8.5589 0.8276 0.8276 2.8733 2.8733 2.8813 2.8813 4.5188 4.5188 4.6505 4.6505 4.6591 4.6591 6.6719 6.6719 6.6751 6.6751 6.7862 6.7862 10.5883 10.5883 10.5901 10.5901 11.8114 11.8114 14.1441 14.1441 k = 0.0476-0.0275 0.0389 ( 8953 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0290 -27.0290 -26.9612 -26.9612 -9.9517 -9.9517 -9.7195 -9.7195 -8.8402 -8.8402 -8.8343 -8.8343 -8.5660 -8.5660 -8.5586 -8.5586 0.8390 0.8390 2.8697 2.8697 2.8840 2.8840 4.5210 4.5210 4.6503 4.6503 4.6650 4.6650 6.6688 6.6688 6.6746 6.6746 6.7848 6.7848 10.5860 10.5860 10.5886 10.5886 11.8368 11.8368 14.0850 14.0850 k = 0.0595-0.0344 0.0486 ( 8969 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0287 -27.0287 -26.9615 -26.9615 -9.9509 -9.9509 -9.7208 -9.7208 -8.8410 -8.8410 -8.8318 -8.8318 -8.5697 -8.5697 -8.5582 -8.5582 0.8537 0.8537 2.8650 2.8650 2.8874 2.8874 4.5231 4.5231 4.6507 4.6507 4.6726 4.6726 6.6648 6.6648 6.6740 6.6740 6.7831 6.7831 10.5831 10.5831 10.5859 10.5859 11.8695 11.8695 14.0015 14.0104 k = 0.0714-0.0412 0.0583 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0283 -27.0283 -26.9618 -26.9618 -9.9500 -9.9500 -9.7225 -9.7225 -8.8419 -8.8419 -8.8287 -8.8287 -8.5741 -8.5741 -8.5578 -8.5578 0.8715 0.8715 2.8593 2.8593 2.8915 2.8915 4.5248 4.5248 4.6523 4.6523 4.6818 4.6818 6.6598 6.6598 6.6733 6.6733 6.7811 6.7811 10.5795 10.5795 10.5815 10.5815 11.9095 11.9095 13.9053 13.9094 k = 0.0833-0.0481 0.0680 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0279 -27.0279 -26.9622 -26.9622 -9.9489 -9.9489 -9.7245 -9.7245 -8.8429 -8.8429 -8.8251 -8.8251 -8.5793 -8.5793 -8.5572 -8.5572 0.8925 0.8925 2.8526 2.8526 2.8963 2.8963 4.5254 4.5254 4.6554 4.6554 4.6925 4.6925 6.6538 6.6538 6.6725 6.6725 6.7790 6.7790 10.5748 10.5748 10.5753 10.5753 11.9568 11.9568 13.8067 13.8144 k = 0.0952-0.0550 0.0778 ( 8993 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2084 -32.2084 -27.0274 -27.0274 -26.9626 -26.9626 -9.9477 -9.9477 -9.7267 -9.7267 -8.8442 -8.8442 -8.8209 -8.8209 -8.5851 -8.5851 -8.5566 -8.5566 0.9165 0.9165 2.8448 2.8448 2.9018 2.9018 4.5246 4.5246 4.6607 4.6607 4.7048 4.7048 6.6466 6.6466 6.6715 6.6715 6.7767 6.7767 10.5650 10.5650 10.5704 10.5704 12.0113 12.0113 13.6944 13.6944 k = 0.1071-0.0619 0.0875 ( 8985 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2084 -32.2084 -27.0268 -27.0268 -26.9631 -26.9631 -9.9464 -9.9464 -9.7293 -9.7293 -8.8455 -8.8455 -8.8163 -8.8163 -8.5916 -8.5916 -8.5559 -8.5559 0.9436 0.9436 2.8361 2.8361 2.9079 2.9079 4.5220 4.5220 4.6684 4.6684 4.7186 4.7186 6.6383 6.6383 6.6704 6.6704 6.7743 6.7743 10.5516 10.5516 10.5649 10.5649 12.0728 12.0728 13.5652 13.5652 k = 0.1190-0.0687 0.0972 ( 8985 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2084 -32.2084 -27.0262 -27.0262 -26.9637 -26.9637 -9.9450 -9.9450 -9.7321 -9.7321 -8.8470 -8.8470 -8.8111 -8.8111 -8.5986 -8.5986 -8.5552 -8.5552 0.9735 0.9735 2.8264 2.8264 2.9147 2.9147 4.5175 4.5175 4.6788 4.6788 4.7339 4.7339 6.6289 6.6289 6.6691 6.6691 6.7719 6.7719 10.5339 10.5339 10.5588 10.5588 12.1414 12.1414 13.4312 13.4312 k = 0.1310-0.0756 0.1069 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0255 -27.0255 -26.9642 -26.9642 -9.9435 -9.9435 -9.7352 -9.7352 -8.8486 -8.8486 -8.8055 -8.8055 -8.6062 -8.6062 -8.5544 -8.5544 1.0063 1.0063 2.8157 2.8157 2.9221 2.9221 4.5111 4.5111 4.6917 4.6917 4.7505 4.7505 6.6182 6.6182 6.6677 6.6677 6.7695 6.7695 10.5112 10.5112 10.5520 10.5520 12.2166 12.2166 13.2948 13.2948 k = 0.1429-0.0825 0.1166 ( 8981 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0248 -27.0248 -26.9649 -26.9649 -9.9419 -9.9419 -9.7386 -9.7386 -8.8504 -8.8504 -8.7994 -8.7994 -8.6141 -8.6141 -8.5535 -8.5535 1.0418 1.0418 2.8040 2.8040 2.9300 2.9300 4.5030 4.5030 4.7069 4.7069 4.7683 4.7683 6.6063 6.6063 6.6662 6.6662 6.7672 6.7672 10.4832 10.4832 10.5447 10.5447 12.2984 12.2984 13.1582 13.1582 k = 0.1548-0.0894 0.1264 ( 8993 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0240 -27.0240 -26.9655 -26.9655 -9.9403 -9.9403 -9.7423 -9.7423 -8.8522 -8.8522 -8.7929 -8.7929 -8.6225 -8.6225 -8.5526 -8.5526 1.0800 1.0800 2.7915 2.7915 2.9384 2.9384 4.4934 4.4934 4.7241 4.7241 4.7874 4.7874 6.5933 6.5933 6.6646 6.6646 6.7648 6.7648 10.4495 10.4495 10.5368 10.5368 12.3863 12.3863 13.0225 13.0225 k = 0.1667-0.0962 0.1361 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0232 -27.0232 -26.9662 -26.9662 -9.9386 -9.9386 -9.7462 -9.7462 -8.8541 -8.8541 -8.7859 -8.7859 -8.6312 -8.6312 -8.5516 -8.5516 1.1207 1.1207 2.7782 2.7782 2.9474 2.9474 4.4825 4.4825 4.7432 4.7432 4.8076 4.8076 6.5791 6.5791 6.6628 6.6628 6.7626 6.7626 10.4100 10.4100 10.5283 10.5283 12.4800 12.4800 12.8888 12.8888 k = 0.1786-0.1031 0.1458 ( 8969 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0224 -27.0224 -26.9670 -26.9670 -9.9369 -9.9369 -9.7504 -9.7504 -8.8562 -8.8562 -8.7786 -8.7786 -8.6401 -8.6401 -8.5506 -8.5506 1.1639 1.1639 2.7641 2.7641 2.9568 2.9568 4.4703 4.4703 4.7639 4.7639 4.8289 4.8289 6.5638 6.5638 6.6609 6.6609 6.7604 6.7604 10.3646 10.3646 10.5193 10.5193 12.5788 12.5788 12.7577 12.7577 k = 0.1905-0.1100 0.1555 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0215 -27.0215 -26.9677 -26.9677 -9.9351 -9.9351 -9.7548 -9.7548 -8.8582 -8.8582 -8.7710 -8.7710 -8.6493 -8.6493 -8.5496 -8.5496 1.2093 1.2093 2.7493 2.7493 2.9665 2.9665 4.4571 4.4571 4.7860 4.7860 4.8510 4.8510 6.5474 6.5474 6.6589 6.6589 6.7583 6.7583 10.3137 10.3137 10.5097 10.5097 12.6300 12.6300 12.6819 12.6819 k = 0.2024-0.1168 0.1652 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0206 -27.0206 -26.9685 -26.9685 -9.9334 -9.9334 -9.7594 -9.7594 -8.8604 -8.8604 -8.7630 -8.7630 -8.6586 -8.6586 -8.5485 -8.5485 1.2569 1.2569 2.7338 2.7338 2.9766 2.9766 4.4428 4.4428 4.8093 4.8093 4.8740 4.8740 6.5301 6.5301 6.6567 6.6567 6.7562 6.7562 10.2576 10.2576 10.4996 10.4996 12.5061 12.5061 12.7838 12.7838 k = 0.2143-0.1237 0.1750 ( 8985 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0197 -27.0197 -26.9693 -26.9693 -9.9317 -9.9317 -9.7642 -9.7642 -8.8626 -8.8626 -8.7547 -8.7547 -8.6679 -8.6679 -8.5474 -8.5474 1.3066 1.3066 2.7179 2.7179 2.9871 2.9871 4.4275 4.4275 4.8336 4.8336 4.8978 4.8978 6.5118 6.5118 6.6544 6.6544 6.7542 6.7542 10.1968 10.1968 10.4891 10.4891 12.3862 12.3862 12.7653 12.7653 k = 0.2262-0.1306 0.1847 ( 8976 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0188 -27.0188 -26.9701 -26.9701 -9.9300 -9.9300 -9.7691 -9.7691 -8.8648 -8.8648 -8.7463 -8.7463 -8.6772 -8.6772 -8.5463 -8.5463 1.3581 1.3581 2.7015 2.7015 2.9977 2.9977 4.4112 4.4112 4.8588 4.8588 4.9221 4.9221 6.4928 6.4928 6.6520 6.6520 6.7522 6.7522 10.1322 10.1322 10.4782 10.4782 12.2707 12.2707 12.6855 12.6855 k = 0.2381-0.1375 0.1944 ( 8988 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2087 -32.2087 -32.2084 -32.2084 -27.0178 -27.0178 -26.9709 -26.9709 -9.9283 -9.9283 -9.7742 -9.7742 -8.8671 -8.8671 -8.7376 -8.7376 -8.6865 -8.6865 -8.5451 -8.5451 1.4113 1.4113 2.6848 2.6848 3.0085 3.0085 4.3937 4.3937 4.8846 4.8846 4.9469 4.9469 6.4731 6.4731 6.6495 6.6495 6.7502 6.7502 10.0644 10.0644 10.4668 10.4668 12.1598 12.1598 12.6066 12.6066 k = 0.2500-0.1443 0.2041 ( 8964 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0169 -27.0169 -26.9718 -26.9718 -9.9267 -9.9267 -9.7795 -9.7795 -8.8693 -8.8693 -8.7288 -8.7288 -8.6956 -8.6956 -8.5440 -8.5440 1.4661 1.4661 2.6679 2.6679 3.0195 3.0195 4.3752 4.3752 4.9110 4.9110 4.9721 4.9721 6.4527 6.4527 6.6469 6.6469 6.7483 6.7483 9.9942 9.9942 10.4552 10.4552 12.0538 12.0538 12.5301 12.5301 k = 0.2619-0.1512 0.2138 ( 8988 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2087 -32.2087 -32.2085 -32.2085 -27.0159 -27.0159 -26.9726 -26.9726 -9.9251 -9.9251 -9.7848 -9.7848 -8.8716 -8.8716 -8.7199 -8.7199 -8.7046 -8.7046 -8.5428 -8.5428 1.5223 1.5223 2.6509 2.6509 3.0305 3.0305 4.3556 4.3556 4.9378 4.9378 4.9975 4.9975 6.4319 6.4319 6.6441 6.6441 6.7464 6.7464 9.9224 9.9224 10.4433 10.4433 11.9526 11.9526 12.4564 12.4564 k = 0.2738-0.1581 0.2236 ( 8996 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2087 -32.2087 -32.2085 -32.2085 -27.0150 -27.0150 -26.9734 -26.9734 -9.9236 -9.9236 -9.7902 -9.7902 -8.8739 -8.8739 -8.7134 -8.7134 -8.7110 -8.7110 -8.5417 -8.5417 1.5796 1.5796 2.6340 2.6340 3.0415 3.0415 4.3348 4.3348 4.9647 4.9647 5.0230 5.0230 6.4107 6.4107 6.6413 6.6413 6.7445 6.7445 9.8498 9.8498 10.4311 10.4311 11.8564 11.8564 12.3858 12.3858 k = 0.2857-0.1650 0.2333 ( 8976 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2087 -32.2087 -32.2085 -32.2085 -27.0140 -27.0140 -26.9742 -26.9742 -9.9221 -9.9221 -9.7956 -9.7956 -8.8761 -8.8761 -8.7220 -8.7220 -8.7020 -8.7020 -8.5406 -8.5406 1.6379 1.6379 2.6171 2.6171 3.0525 3.0525 4.3128 4.3128 4.9917 4.9917 5.0484 5.0484 6.3894 6.3894 6.6384 6.6384 6.7426 6.7426 9.7772 9.7772 10.4189 10.4189 11.7654 11.7654 12.3182 12.3182 k = 0.2976-0.1718 0.2430 ( 8992 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0131 -27.0131 -26.9750 -26.9750 -9.9208 -9.9208 -9.8010 -9.8010 -8.8783 -8.8783 -8.7302 -8.7302 -8.6932 -8.6932 -8.5394 -8.5394 1.6969 1.6969 2.6005 2.6005 3.0633 3.0633 4.2896 4.2896 5.0186 5.0186 5.0736 5.0736 6.3679 6.3679 6.6354 6.6354 6.7407 6.7407 9.7053 9.7053 10.4066 10.4066 11.6795 11.6795 12.2538 12.2538 k = 0.3095-0.1787 0.2527 ( 8988 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0122 -27.0122 -26.9758 -26.9758 -9.9195 -9.9195 -9.8064 -9.8064 -8.8804 -8.8804 -8.7381 -8.7381 -8.6844 -8.6844 -8.5384 -8.5384 1.7563 1.7563 2.5844 2.5844 3.0740 3.0740 4.2651 4.2651 5.0452 5.0452 5.0985 5.0985 6.3466 6.3466 6.6324 6.6324 6.7388 6.7388 9.6348 9.6348 10.3943 10.3943 11.5987 11.5987 12.1928 12.1928 k = 0.3214-0.1856 0.2624 ( 8996 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0113 -27.0113 -26.9766 -26.9766 -9.9183 -9.9183 -9.8117 -9.8117 -8.8825 -8.8825 -8.7456 -8.7456 -8.6759 -8.6759 -8.5373 -8.5373 1.8159 1.8159 2.5687 2.5687 3.0844 3.0844 4.2395 4.2395 5.0713 5.0713 5.1229 5.1229 6.3255 6.3255 6.6293 6.6293 6.7369 6.7369 9.5661 9.5661 10.3820 10.3820 11.5231 11.5231 12.1351 12.1351 k = 0.3333-0.1925 0.2722 ( 8980 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0105 -27.0105 -26.9773 -26.9773 -9.9171 -9.9171 -9.8169 -9.8169 -8.8844 -8.8844 -8.7528 -8.7528 -8.6675 -8.6675 -8.5363 -8.5363 1.8753 1.8753 2.5536 2.5536 3.0945 3.0945 4.2128 4.2128 5.0968 5.0968 5.1466 5.1466 6.3047 6.3047 6.6262 6.6262 6.7351 6.7351 9.4999 9.4999 10.3700 10.3700 11.4527 11.4527 12.0808 12.0808 k = 0.3452-0.1993 0.2819 ( 8988 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0097 -27.0097 -26.9780 -26.9780 -9.9161 -9.9161 -9.8219 -9.8219 -8.8863 -8.8863 -8.7595 -8.7595 -8.6595 -8.6595 -8.5353 -8.5353 1.9342 1.9342 2.5393 2.5393 3.1042 3.1042 4.1851 4.1851 5.1215 5.1215 5.1695 5.1695 6.2846 6.2846 6.6231 6.6231 6.7332 6.7332 9.4366 9.4366 10.3583 10.3583 11.3874 11.3874 12.0300 12.0300 k = 0.3571-0.2062 0.2916 ( 8980 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0089 -27.0089 -26.9786 -26.9786 -9.9151 -9.9151 -9.8267 -9.8267 -8.8882 -8.8882 -8.7658 -8.7658 -8.6518 -8.6518 -8.5344 -8.5344 1.9922 1.9922 2.5260 2.5260 3.1135 3.1135 4.1566 4.1566 5.1452 5.1452 5.1915 5.1915 6.2651 6.2651 6.6200 6.6200 6.7315 6.7315 9.3766 9.3766 10.3469 10.3469 11.3273 11.3273 11.9828 11.9828 k = 0.3690-0.2131 0.3013 ( 8976 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0082 -27.0082 -26.9793 -26.9793 -9.9142 -9.9142 -9.8313 -9.8313 -8.8899 -8.8899 -8.7716 -8.7716 -8.6445 -8.6445 -8.5335 -8.5335 2.0487 2.0487 2.5137 2.5137 3.1223 3.1223 4.1275 4.1275 5.1678 5.1678 5.2124 5.2124 6.2465 6.2465 6.6170 6.6170 6.7297 6.7297 9.3204 9.3204 10.3360 10.3360 11.2721 11.2721 11.9392 11.9392 k = 0.3810-0.2199 0.3110 ( 8960 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0075 -27.0075 -26.9799 -26.9799 -9.9134 -9.9134 -9.8357 -9.8357 -8.8914 -8.8914 -8.7770 -8.7770 -8.6376 -8.6376 -8.5327 -8.5327 2.1033 2.1033 2.5026 2.5026 3.1306 3.1306 4.0980 4.0980 5.1891 5.1891 5.2321 5.2321 6.2289 6.2289 6.6141 6.6141 6.7281 6.7281 9.2681 9.2681 10.3257 10.3257 11.2220 11.2220 11.8992 11.8992 k = 0.3929-0.2268 0.3208 ( 8956 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0069 -27.0069 -26.9804 -26.9804 -9.9127 -9.9127 -9.8397 -9.8397 -8.8929 -8.8929 -8.7819 -8.7819 -8.6312 -8.6312 -8.5320 -8.5320 2.1551 2.1551 2.4930 2.4930 3.1382 3.1382 4.0687 4.0687 5.2089 5.2089 5.2504 5.2504 6.2125 6.2125 6.6113 6.6113 6.7265 6.7265 9.2202 9.2202 10.3160 10.3160 11.1769 11.1769 11.8629 11.8629 k = 0.4048-0.2337 0.3305 ( 8956 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0063 -27.0063 -26.9809 -26.9809 -9.9121 -9.9121 -9.8435 -9.8435 -8.8942 -8.8942 -8.7863 -8.7863 -8.6254 -8.6254 -8.5313 -8.5313 2.2035 2.2035 2.4853 2.4853 3.1452 3.1452 4.0398 4.0398 5.2271 5.2271 5.2672 5.2672 6.1974 6.1974 6.6087 6.6087 6.7250 6.7250 9.1768 9.1768 10.3071 10.3071 11.1367 11.1367 11.8303 11.8303 k = 0.4167-0.2406 0.3402 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0058 -27.0058 -26.9813 -26.9813 -9.9115 -9.9115 -9.8468 -9.8468 -8.8954 -8.8954 -8.7902 -8.7902 -8.6201 -8.6201 -8.5307 -8.5307 2.2474 2.2474 2.4797 2.4797 3.1515 3.1515 4.0119 4.0119 5.2436 5.2436 5.2823 5.2823 6.1838 6.1838 6.6063 6.6063 6.7237 6.7237 9.1381 9.1381 10.2990 10.2990 11.1013 11.1013 11.8015 11.8015 k = 0.4286-0.2474 0.3499 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0054 -27.0054 -26.9817 -26.9817 -9.9110 -9.9110 -9.8498 -9.8498 -8.8965 -8.8965 -8.7935 -8.7935 -8.6155 -8.6155 -8.5301 -8.5301 2.2857 2.2857 2.4768 2.4768 3.1570 3.1570 3.9857 3.9857 5.2581 5.2581 5.2957 5.2957 6.1717 6.1717 6.6041 6.6041 6.7224 6.7224 9.1043 9.1043 10.2918 10.2918 11.0708 11.0708 11.7765 11.7765 k = 0.4405-0.2543 0.3596 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0050 -27.0050 -26.9820 -26.9820 -9.9106 -9.9106 -9.8524 -9.8524 -8.8974 -8.8974 -8.7964 -8.7964 -8.6115 -8.6115 -8.5297 -8.5297 2.3170 2.3170 2.4772 2.4772 3.1617 3.1617 3.9617 3.9617 5.2707 5.2707 5.3072 5.3072 6.1613 6.1613 6.6022 6.6022 6.7214 6.7214 9.0755 9.0755 10.2856 10.2856 11.0451 11.0451 11.7553 11.7553 k = 0.4524-0.2612 0.3694 ( 8956 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0047 -27.0047 -26.9823 -26.9823 -9.9103 -9.9103 -9.8545 -9.8545 -8.8981 -8.8981 -8.7988 -8.7988 -8.6082 -8.6082 -8.5293 -8.5293 2.3405 2.3405 2.4810 2.4810 3.1657 3.1657 3.9408 3.9408 5.2811 5.2811 5.3167 5.3167 6.1526 6.1526 6.6006 6.6006 6.7205 6.7205 9.0518 9.0518 10.2804 10.2804 11.0241 11.0241 11.7379 11.7379 k = 0.4643-0.2681 0.3791 ( 8956 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0044 -27.0044 -26.9825 -26.9825 -9.9100 -9.9100 -9.8562 -9.8562 -8.8987 -8.8987 -8.8006 -8.8006 -8.6056 -8.6056 -8.5290 -8.5290 2.3562 2.3562 2.4875 2.4875 3.1688 3.1688 3.9236 3.9236 5.2893 5.2893 5.3242 5.3242 6.1458 6.1458 6.5993 6.5993 6.7198 6.7198 9.0332 9.0332 10.2764 10.2764 11.0078 11.0078 11.7244 11.7244 k = 0.4762-0.2749 0.3888 ( 8956 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0042 -27.0042 -26.9827 -26.9827 -9.9099 -9.9099 -9.8574 -9.8574 -8.8991 -8.8991 -8.8019 -8.8019 -8.6038 -8.6038 -8.5288 -8.5288 2.3655 2.3655 2.4946 2.4946 3.1710 3.1710 3.9107 3.9107 5.2952 5.2952 5.3297 5.3297 6.1408 6.1408 6.5984 6.5984 6.7192 6.7192 9.0200 9.0200 10.2734 10.2734 10.9961 10.9961 11.7147 11.7147 k = 0.4881-0.2818 0.3985 ( 8968 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0041 -27.0041 -26.9828 -26.9828 -9.9098 -9.9098 -9.8581 -9.8581 -8.8993 -8.8993 -8.8027 -8.8027 -8.6026 -8.6026 -8.5286 -8.5286 2.3703 2.3703 2.5000 2.5000 3.1723 3.1723 3.9028 3.9028 5.2988 5.2988 5.3329 5.3329 6.1379 6.1379 6.5978 6.5978 6.7189 6.7189 9.0120 9.0120 10.2716 10.2716 10.9892 10.9892 11.7089 11.7089 k = 0.5000-0.2887 0.4082 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0041 -27.0041 -26.9828 -26.9828 -9.9097 -9.9097 -9.8583 -9.8583 -8.8994 -8.8994 -8.8029 -8.8029 -8.6023 -8.6023 -8.5286 -8.5286 2.3717 2.3717 2.5020 2.5020 3.1728 3.1728 3.9001 3.9001 5.3000 5.3000 5.3340 5.3340 6.1369 6.1369 6.5976 6.5976 6.7188 6.7188 9.0093 9.0093 10.2710 10.2710 10.9868 10.9868 11.7069 11.7069 k = 0.5000-0.2887 0.4082 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0041 -27.0041 -26.9828 -26.9828 -9.9097 -9.9097 -9.8583 -9.8583 -8.8994 -8.8994 -8.8029 -8.8029 -8.6023 -8.6023 -8.5286 -8.5286 2.3717 2.3717 2.5020 2.5020 3.1728 3.1728 3.9001 3.9001 5.3000 5.3000 5.3340 5.3340 6.1369 6.1369 6.5976 6.5976 6.7188 6.7188 9.0093 9.0093 10.2710 10.2710 10.9868 10.9868 11.7069 11.7069 k = 0.5000-0.2749 0.4180 ( 8968 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0041 -27.0041 -26.9828 -26.9828 -9.9096 -9.9096 -9.8584 -9.8584 -8.8993 -8.8993 -8.8030 -8.8030 -8.6023 -8.6023 -8.5288 -8.5288 2.3721 2.3721 2.5022 2.5022 3.1720 3.1720 3.9016 3.9016 5.2978 5.2978 5.3321 5.3321 6.1395 6.1395 6.5975 6.5975 6.7188 6.7188 9.0111 9.0111 10.2729 10.2729 10.9864 10.9864 11.7058 11.7058 k = 0.5000-0.2612 0.4277 ( 8956 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0040 -27.0040 -26.9829 -26.9829 -9.9093 -9.9093 -9.8585 -9.8585 -8.8987 -8.8987 -8.8032 -8.8032 -8.6023 -8.6023 -8.5296 -8.5296 2.3732 2.3732 2.5030 2.5030 3.1699 3.1699 3.9060 3.9060 5.2903 5.2903 5.3274 5.3274 6.1470 6.1470 6.5974 6.5974 6.7186 6.7186 9.0163 9.0163 10.2786 10.2786 10.9852 10.9852 11.6986 11.6986 k = 0.5000-0.2474 0.4374 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0038 -27.0038 -26.9831 -26.9831 -9.9087 -9.9087 -9.8586 -9.8586 -8.8979 -8.8979 -8.8034 -8.8034 -8.6023 -8.6023 -8.5308 -8.5308 2.3750 2.3750 2.5044 2.5044 3.1663 3.1663 3.9133 3.9133 5.2757 5.2757 5.3222 5.3222 6.1592 6.1592 6.5971 6.5971 6.7184 6.7184 9.0249 9.0249 10.2880 10.2880 10.9832 10.9832 11.6798 11.6798 k = 0.5000-0.2337 0.4471 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0036 -27.0036 -26.9833 -26.9833 -9.9080 -9.9080 -9.8589 -9.8589 -8.8966 -8.8966 -8.8038 -8.8038 -8.6023 -8.6023 -8.5324 -8.5324 2.3774 2.3774 2.5063 2.5063 3.1614 3.1614 3.9235 3.9235 5.2537 5.2537 5.3176 5.3176 6.1751 6.1751 6.5966 6.5966 6.7181 6.7181 9.0368 9.0368 10.3011 10.3011 10.9807 10.9807 11.6502 11.6502 k = 0.5000-0.2199 0.4568 ( 8950 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0034 -27.0034 -26.9835 -26.9835 -9.9070 -9.9070 -9.8592 -9.8592 -8.8951 -8.8951 -8.8043 -8.8043 -8.6023 -8.6023 -8.5345 -8.5345 2.3804 2.3804 2.5087 2.5087 3.1553 3.1553 3.9365 3.9365 5.2252 5.2252 5.3135 5.3135 6.1941 6.1941 6.5960 6.5960 6.7177 6.7177 9.0518 9.0518 10.3177 10.3177 10.9777 10.9777 11.6126 11.6126 k = 0.5000-0.2062 0.4666 ( 8946 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0030 -27.0030 -26.9839 -26.9839 -9.9059 -9.9059 -9.8596 -9.8596 -8.8932 -8.8932 -8.8050 -8.8050 -8.6023 -8.6023 -8.5370 -8.5370 2.3839 2.3839 2.5118 2.5118 3.1479 3.1479 3.9523 3.9523 5.1915 5.1915 5.3096 5.3096 6.2154 6.2154 6.5952 6.5952 6.7173 6.7173 9.0697 9.0697 10.3377 10.3377 10.9744 10.9744 11.5693 11.5693 k = 0.5000-0.1925 0.4763 ( 8938 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0027 -27.0027 -26.9842 -26.9842 -9.9046 -9.9046 -9.8601 -9.8601 -8.8910 -8.8910 -8.8058 -8.8058 -8.6022 -8.6022 -8.5398 -8.5398 2.3878 2.3878 2.5154 2.5154 3.1394 3.1394 3.9709 3.9709 5.1536 5.1536 5.3056 5.3056 6.2383 6.2383 6.5942 6.5942 6.7167 6.7167 9.0901 9.0901 10.3609 10.3609 10.9709 10.9709 11.5220 11.5220 k = 0.5000-0.1787 0.4860 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0022 -27.0022 -26.9847 -26.9847 -9.9031 -9.9031 -9.8606 -9.8606 -8.8885 -8.8885 -8.8068 -8.8068 -8.6021 -8.6021 -8.5430 -8.5430 2.3920 2.3920 2.5197 2.5197 3.1299 3.1299 3.9922 3.9922 5.1124 5.1124 5.3016 5.3016 6.2621 6.2621 6.5929 6.5929 6.7161 6.7161 9.1128 9.1128 10.3870 10.3870 10.9672 10.9672 11.4719 11.4719 k = 0.5000-0.1650 0.4957 ( 8946 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0018 -27.0018 -26.9851 -26.9851 -9.9015 -9.9015 -9.8612 -9.8612 -8.8858 -8.8858 -8.8079 -8.8079 -8.6020 -8.6020 -8.5464 -8.5464 2.3963 2.3963 2.5246 2.5246 3.1197 3.1197 4.0161 4.0161 5.0685 5.0685 5.2974 5.2974 6.2863 6.2863 6.5912 6.5912 6.7155 6.7155 9.1374 9.1374 10.4159 10.4159 10.9634 10.9634 11.4203 11.4203 k = 0.5000-0.1512 0.5055 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0013 -27.0013 -26.9856 -26.9856 -9.8997 -9.8997 -9.8619 -9.8619 -8.8827 -8.8827 -8.8092 -8.8092 -8.6018 -8.6018 -8.5500 -8.5500 2.4006 2.4006 2.5300 2.5300 3.1088 3.1088 4.0425 4.0425 5.0225 5.0225 5.2932 5.2932 6.3105 6.3105 6.5892 6.5892 6.7148 6.7148 9.1635 9.1635 10.4472 10.4472 10.9593 10.9593 11.3683 11.3683 k = 0.5000-0.1375 0.5152 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0007 -27.0007 -26.9862 -26.9862 -9.8979 -9.8979 -9.8627 -9.8627 -8.8795 -8.8795 -8.8107 -8.8107 -8.6015 -8.6015 -8.5538 -8.5538 2.4048 2.4048 2.5360 2.5360 3.0974 3.0974 4.0713 4.0713 4.9749 4.9749 5.2891 5.2891 6.3343 6.3343 6.5868 6.5868 6.7141 6.7141 9.1905 9.1905 10.4805 10.4805 10.9548 10.9548 11.3168 11.3168 k = 0.5000-0.1237 0.5249 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0001 -27.0001 -26.9868 -26.9868 -9.8960 -9.8960 -9.8636 -9.8636 -8.8760 -8.8760 -8.8125 -8.8125 -8.6010 -8.6010 -8.5576 -8.5576 2.4087 2.4087 2.5425 2.5425 3.0858 3.0858 4.1024 4.1024 4.9261 4.9261 5.2850 5.2850 6.3574 6.3574 6.5839 6.5839 6.7134 6.7134 9.2180 9.2180 10.5155 10.5155 10.9497 10.9497 11.2667 11.2667 k = 0.5000-0.1100 0.5346 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -26.9995 -26.9995 -26.9875 -26.9875 -9.8940 -9.8940 -9.8646 -9.8646 -8.8723 -8.8723 -8.8144 -8.8144 -8.6005 -8.6005 -8.5615 -8.5615 2.4125 2.4125 2.5493 2.5493 3.0743 3.0743 4.1358 4.1358 4.8764 4.8764 5.2812 5.2812 6.3796 6.3796 6.5804 6.5804 6.7127 6.7127 9.2453 9.2453 10.5517 10.5517 10.9437 10.9437 11.2188 11.2188 k = 0.5000-0.0962 0.5443 ( 8920 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9988 -26.9988 -26.9881 -26.9881 -9.8920 -9.8920 -9.8657 -9.8657 -8.8685 -8.8685 -8.8166 -8.8166 -8.5998 -8.5998 -8.5654 -8.5654 2.4158 2.4158 2.5562 2.5562 3.0630 3.0630 4.1712 4.1712 4.8262 4.8262 5.2776 5.2776 6.4006 6.4006 6.5763 6.5763 6.7120 6.7120 9.2718 9.2718 10.5886 10.5886 10.9364 10.9364 11.1738 11.1738 k = 0.5000-0.0825 0.5541 ( 8912 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9981 -26.9981 -26.9888 -26.9888 -9.8900 -9.8900 -9.8668 -9.8668 -8.8646 -8.8646 -8.8190 -8.8190 -8.5989 -8.5989 -8.5692 -8.5692 2.4188 2.4188 2.5630 2.5630 3.0523 3.0523 4.2085 4.2085 4.7759 4.7759 5.2743 5.2743 6.4205 6.4205 6.5716 6.5716 6.7113 6.7113 9.2968 9.2968 10.6257 10.6257 10.9276 10.9276 11.1327 11.1327 k = 0.5000-0.0687 0.5638 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9974 -26.9974 -26.9896 -26.9896 -9.8880 -9.8880 -9.8681 -9.8681 -8.8606 -8.8606 -8.8216 -8.8216 -8.5978 -8.5978 -8.5729 -8.5729 2.4213 2.4213 2.5695 2.5695 3.0424 3.0424 4.2475 4.2475 4.7256 4.7256 5.2714 5.2714 6.4389 6.4389 6.5662 6.5662 6.7108 6.7108 9.3196 9.3196 10.6625 10.6625 10.9169 10.9169 11.0960 11.0960 k = 0.5000-0.0550 0.5735 ( 8912 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9966 -26.9966 -26.9903 -26.9903 -9.8861 -9.8861 -9.8694 -9.8694 -8.8567 -8.8567 -8.8244 -8.8244 -8.5965 -8.5965 -8.5764 -8.5764 2.4233 2.4233 2.5753 2.5753 3.0338 3.0338 4.2880 4.2880 4.6758 4.6758 5.2689 5.2689 6.4559 6.4559 6.5601 6.5601 6.7103 6.7103 9.3396 9.3396 10.6984 10.6984 10.9040 10.9040 11.0646 11.0646 k = 0.5000-0.0412 0.5832 ( 8926 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9958 -26.9958 -26.9911 -26.9911 -9.8843 -9.8843 -9.8706 -9.8706 -8.8528 -8.8528 -8.8273 -8.8273 -8.5950 -8.5950 -8.5797 -8.5797 2.4250 2.4250 2.5802 2.5802 3.0267 3.0267 4.3296 4.3296 4.6269 4.6269 5.2670 5.2670 6.4710 6.4710 6.5535 6.5535 6.7099 6.7099 9.3559 9.3559 10.7327 10.7327 10.8887 10.8887 11.0391 11.0391 k = 0.5000-0.0275 0.5929 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9951 -26.9951 -26.9919 -26.9919 -9.8827 -9.8827 -9.8718 -9.8718 -8.8492 -8.8492 -8.8302 -8.8302 -8.5933 -8.5933 -8.5827 -8.5827 2.4261 2.4261 2.5840 2.5840 3.0214 3.0214 4.3713 4.3713 4.5799 4.5799 5.2656 5.2656 6.4840 6.4840 6.5467 6.5467 6.7096 6.7096 9.3681 9.3681 10.7649 10.7649 10.8708 10.8708 11.0203 11.0203 k = 0.5000-0.0137 0.6027 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9943 -26.9943 -26.9927 -26.9927 -9.8815 -9.8815 -9.8728 -9.8728 -8.8463 -8.8463 -8.8328 -8.8328 -8.5916 -8.5916 -8.5853 -8.5853 2.4268 2.4268 2.5863 2.5863 3.0181 3.0181 4.4101 4.4101 4.5380 4.5380 5.2647 5.2647 6.4935 6.4935 6.5408 6.5408 6.7094 6.7094 9.3756 9.3756 10.7939 10.7939 10.8507 10.8507 11.0087 11.0087 k = 0.5000-0.0000 0.6124 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8811 -9.8811 -9.8732 -9.8732 -8.8450 -8.8450 -8.8339 -8.8339 -8.5905 -8.5905 -8.5866 -8.5866 2.4270 2.4270 2.5871 2.5871 3.0170 3.0170 4.4309 4.4309 4.5161 4.5161 5.2644 5.2644 6.4974 6.4974 6.5382 6.5382 6.7093 6.7093 9.3781 9.3781 10.8122 10.8122 10.8355 10.8355 11.0048 11.0048 k = 0.5000-0.0000 0.6124 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8811 -9.8811 -9.8732 -9.8732 -8.8450 -8.8450 -8.8339 -8.8339 -8.5905 -8.5905 -8.5866 -8.5866 2.4270 2.4270 2.5871 2.5871 3.0170 3.0170 4.4309 4.4309 4.5161 4.5161 5.2644 5.2644 6.4974 6.4974 6.5382 6.5382 6.7093 6.7093 9.3781 9.3781 10.8122 10.8122 10.8355 10.8355 11.0048 11.0048 k = 0.4917 0.0144 0.6124 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9940 -26.9940 -26.9929 -26.9929 -9.8812 -9.8812 -9.8730 -9.8730 -8.8455 -8.8455 -8.8333 -8.8333 -8.5911 -8.5911 -8.5860 -8.5860 2.4263 2.4263 2.5870 2.5870 3.0173 3.0173 4.4199 4.4199 4.5271 4.5271 5.2654 5.2654 6.4955 6.4955 6.5396 6.5396 6.7093 6.7093 9.3775 9.3775 10.8026 10.8026 10.8442 10.8442 11.0074 11.0074 k = 0.4833 0.0289 0.6124 ( 8929 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9945 -26.9945 -26.9924 -26.9924 -9.8817 -9.8817 -9.8725 -9.8725 -8.8469 -8.8469 -8.8317 -8.8317 -8.5924 -8.5924 -8.5849 -8.5849 2.4241 2.4241 2.5867 2.5867 3.0183 3.0183 4.3968 4.3968 4.5498 4.5498 5.2684 5.2684 6.4905 6.4905 6.5431 6.5431 6.7092 6.7092 9.3757 9.3757 10.7873 10.7873 10.8569 10.8569 11.0150 11.0150 k = 0.4750 0.0433 0.6124 ( 8917 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9950 -26.9950 -26.9919 -26.9919 -9.8822 -9.8822 -9.8718 -9.8718 -8.8486 -8.8486 -8.8297 -8.8297 -8.5937 -8.5937 -8.5838 -8.5838 2.4208 2.4208 2.5863 2.5863 3.0198 3.0198 4.3710 4.3710 4.5744 4.5744 5.2740 5.2740 6.4836 6.4836 6.5475 6.5475 6.7090 6.7090 9.3726 9.3726 10.7720 10.7720 10.8688 10.8688 11.0261 11.0261 k = 0.4667 0.0577 0.6124 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9954 -26.9954 -26.9915 -26.9915 -9.8828 -9.8828 -9.8710 -9.8710 -8.8504 -8.8504 -8.8275 -8.8275 -8.5950 -8.5950 -8.5829 -8.5829 2.4166 2.4166 2.5859 2.5859 3.0218 3.0218 4.3453 4.3453 4.5976 4.5976 5.2821 5.2821 6.4755 6.4755 6.5522 6.5522 6.7087 6.7087 9.3683 9.3683 10.7574 10.7574 10.8804 10.8804 11.0394 11.0394 k = 0.4583 0.0722 0.6124 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9959 -26.9959 -26.9911 -26.9911 -9.8834 -9.8834 -9.8703 -9.8703 -8.8521 -8.8521 -8.8254 -8.8254 -8.5962 -8.5962 -8.5820 -8.5820 2.4118 2.4118 2.5853 2.5853 3.0242 3.0242 4.3209 4.3209 4.6182 4.6182 5.2929 5.2929 6.4668 6.4668 6.5569 6.5569 6.7084 6.7084 9.3628 9.3628 10.7438 10.7438 10.8922 10.8922 11.0534 11.0534 k = 0.4500 0.0866 0.6124 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9962 -26.9962 -26.9907 -26.9907 -9.8839 -9.8839 -9.8696 -9.8696 -8.8538 -8.8538 -8.8233 -8.8233 -8.5973 -8.5973 -8.5813 -8.5813 2.4066 2.4066 2.5848 2.5848 3.0268 3.0268 4.2981 4.2981 4.6357 4.6357 5.3060 5.3060 6.4577 6.4577 6.5613 6.5613 6.7080 6.7080 9.3565 9.3565 10.7311 10.7311 10.9051 10.9051 11.0668 11.0668 k = 0.4417 0.1010 0.6124 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9966 -26.9966 -26.9904 -26.9904 -9.8843 -9.8843 -9.8690 -9.8690 -8.8553 -8.8553 -8.8213 -8.8213 -8.5983 -8.5983 -8.5807 -8.5807 2.4013 2.4013 2.5842 2.5842 3.0297 3.0297 4.2773 4.2773 4.6499 4.6499 5.3209 5.3209 6.4485 6.4485 6.5653 6.5653 6.7076 6.7076 9.3494 9.3494 10.7196 10.7196 10.9191 10.9191 11.0786 11.0786 k = 0.4333 0.1155 0.6124 ( 8938 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9969 -26.9969 -26.9901 -26.9901 -9.8847 -9.8847 -9.8684 -9.8684 -8.8566 -8.8566 -8.8194 -8.8194 -8.5992 -8.5992 -8.5802 -8.5802 2.3962 2.3962 2.5836 2.5836 3.0325 3.0325 4.2586 4.2586 4.6612 4.6612 5.3370 5.3370 6.4395 6.4395 6.5689 6.5689 6.7071 6.7071 9.3420 9.3420 10.7093 10.7093 10.9343 10.9343 11.0881 11.0881 k = 0.4250 0.1299 0.6124 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9971 -26.9971 -26.9899 -26.9899 -9.8851 -9.8851 -9.8679 -9.8679 -8.8578 -8.8578 -8.8177 -8.8177 -8.6000 -8.6000 -8.5798 -8.5798 2.3913 2.3913 2.5831 2.5831 3.0353 3.0353 4.2422 4.2422 4.6698 4.6698 5.3534 5.3534 6.4309 6.4309 6.5720 6.5720 6.7067 6.7067 9.3346 9.3346 10.7002 10.7002 10.9506 10.9506 11.0948 11.0948 k = 0.4167 0.1443 0.6124 ( 8949 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9973 -26.9973 -26.9896 -26.9896 -9.8853 -9.8853 -9.8674 -9.8674 -8.8588 -8.8588 -8.8163 -8.8163 -8.6007 -8.6007 -8.5795 -8.5795 2.3868 2.3868 2.5826 2.5826 3.0379 3.0379 4.2282 4.2282 4.6761 4.6761 5.3693 5.3693 6.4230 6.4230 6.5747 6.5747 6.7063 6.7063 9.3276 9.3276 10.6925 10.6925 10.9676 10.9676 11.0984 11.0984 k = 0.4083 0.1588 0.6124 ( 8941 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9975 -26.9975 -26.9895 -26.9895 -9.8856 -9.8856 -9.8671 -9.8671 -8.8597 -8.8597 -8.8151 -8.8151 -8.6012 -8.6012 -8.5792 -8.5792 2.3830 2.3830 2.5822 2.5822 3.0402 3.0402 4.2166 4.2166 4.6806 4.6806 5.3837 5.3837 6.4160 6.4160 6.5769 6.5769 6.7059 6.7059 9.3214 9.3214 10.6861 10.6861 10.9848 10.9848 11.0989 11.0989 k = 0.4000 0.1732 0.6124 ( 8949 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9977 -26.9977 -26.9893 -26.9893 -9.8857 -9.8857 -9.8668 -9.8668 -8.8603 -8.8603 -8.8141 -8.8141 -8.6016 -8.6016 -8.5791 -8.5791 2.3799 2.3799 2.5819 2.5819 3.0420 3.0420 4.2076 4.2076 4.6836 4.6836 5.3959 5.3959 6.4102 6.4102 6.5786 6.5786 6.7056 6.7056 9.3161 9.3161 10.6810 10.6810 11.0014 11.0014 11.0965 11.0965 k = 0.3917 0.1876 0.6124 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -26.9978 -26.9978 -26.9892 -26.9892 -9.8859 -9.8859 -9.8666 -9.8666 -8.8608 -8.8608 -8.8134 -8.8134 -8.6020 -8.6020 -8.5789 -8.5789 2.3777 2.3777 2.5816 2.5816 3.0434 3.0434 4.2011 4.2011 4.6855 4.6855 5.4051 5.4051 6.4059 6.4059 6.5799 6.5799 6.7054 6.7054 9.3122 9.3122 10.6774 10.6774 11.0164 11.0164 11.0919 11.0919 k = 0.3833 0.2021 0.6124 ( 8946 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9978 -26.9978 -26.9892 -26.9892 -9.8859 -9.8859 -9.8664 -9.8664 -8.8611 -8.8611 -8.8130 -8.8130 -8.6021 -8.6021 -8.5789 -8.5789 2.3763 2.3763 2.5815 2.5815 3.0443 3.0443 4.1971 4.1971 4.6865 4.6865 5.4109 5.4109 6.4032 6.4032 6.5806 6.5806 6.7052 6.7052 9.3097 9.3097 10.6753 10.6753 11.0278 11.0278 11.0869 11.0869 k = 0.3750 0.2165 0.6124 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9979 -26.9979 -26.9891 -26.9891 -9.8859 -9.8859 -9.8664 -9.8664 -8.8612 -8.8612 -8.8128 -8.8128 -8.6022 -8.6022 -8.5789 -8.5789 2.3758 2.3758 2.5814 2.5814 3.0446 3.0446 4.1958 4.1958 4.6869 4.6869 5.4129 5.4129 6.4023 6.4023 6.5808 6.5808 6.7052 6.7052 9.3089 9.3089 10.6745 10.6745 11.0323 11.0323 11.0845 11.0845 k = 0.3750 0.2165 0.6124 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9979 -26.9979 -26.9891 -26.9891 -9.8859 -9.8859 -9.8664 -9.8664 -8.8612 -8.8612 -8.8128 -8.8128 -8.6022 -8.6022 -8.5789 -8.5789 2.3758 2.3758 2.5814 2.5814 3.0446 3.0446 4.1958 4.1958 4.6869 4.6869 5.4129 5.4129 6.4023 6.4023 6.5808 6.5808 6.7052 6.7052 9.3089 9.3089 10.6745 10.6745 11.0323 11.0323 11.0845 11.0845 k = 0.3665 0.2116 0.5985 ( 8942 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9970 -26.9970 -26.9900 -26.9900 -9.8828 -9.8828 -9.8675 -9.8675 -8.8559 -8.8559 -8.8139 -8.8139 -8.6021 -8.6021 -8.5854 -8.5854 2.3660 2.3660 2.5942 2.5942 3.0305 3.0305 4.2328 4.2328 4.6336 4.6336 5.4191 5.4191 6.4208 6.4208 6.5780 6.5780 6.7030 6.7030 9.3433 9.3433 10.7292 10.7292 11.0044 11.0044 11.0761 11.0761 k = 0.3580 0.2067 0.5845 ( 8938 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9962 -26.9962 -26.9909 -26.9909 -9.8796 -9.8796 -9.8686 -9.8686 -8.8503 -8.8503 -8.8150 -8.8150 -8.6020 -8.6020 -8.5921 -8.5921 2.3534 2.3534 2.6078 2.6078 3.0164 3.0164 4.2706 4.2706 4.5829 4.5829 5.4240 5.4240 6.4381 6.4381 6.5750 6.5750 6.7007 6.7007 9.3790 9.3790 10.7869 10.7869 10.9588 10.9588 11.0886 11.0886 k = 0.3494 0.2017 0.5706 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9952 -26.9952 -26.9918 -26.9918 -9.8767 -9.8767 -9.8693 -9.8693 -8.8445 -8.8445 -8.8160 -8.8160 -8.6023 -8.6023 -8.5986 -8.5986 2.3378 2.3378 2.6220 2.6220 3.0023 3.0023 4.3089 4.3089 4.5354 4.5354 5.4276 5.4276 6.4543 6.4543 6.5718 6.5718 6.6984 6.6984 9.4162 9.4162 10.8476 10.8476 10.9125 10.9125 11.1049 11.1049 k = 0.3409 0.1968 0.5567 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9943 -26.9943 -26.9928 -26.9928 -9.8752 -9.8752 -9.8685 -9.8685 -8.8385 -8.8385 -8.8169 -8.8169 -8.6071 -8.6071 -8.6008 -8.6008 2.3192 2.3192 2.6367 2.6367 2.9884 2.9884 4.3463 4.3463 4.4924 4.4924 5.4296 5.4296 6.4692 6.4692 6.5684 6.5684 6.6962 6.6962 9.4549 9.4549 10.8679 10.8679 10.9113 10.9113 11.1222 11.1222 k = 0.3324 0.1919 0.5428 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9939 -26.9939 -26.9933 -26.9933 -9.8757 -9.8757 -9.8657 -9.8657 -8.8325 -8.8325 -8.8174 -8.8174 -8.6144 -8.6144 -8.6007 -8.6007 2.2972 2.2972 2.6517 2.6517 2.9746 2.9746 4.3782 4.3782 4.4587 4.4587 5.4299 5.4299 6.4825 6.4825 6.5652 6.5652 6.6943 6.6943 9.4954 9.4954 10.8261 10.8261 10.9776 10.9776 11.1397 11.1397 k = 0.3239 0.1870 0.5289 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9949 -26.9949 -26.9923 -26.9923 -9.8770 -9.8770 -9.8620 -9.8620 -8.8274 -8.8274 -8.8168 -8.8168 -8.6221 -8.6221 -8.6003 -8.6003 2.2719 2.2719 2.6670 2.6670 2.9613 2.9613 4.3833 4.3833 4.4555 4.4555 5.4282 5.4282 6.4938 6.4938 6.5623 6.5623 6.6926 6.6926 9.5376 9.5376 10.7871 10.7871 11.0465 11.0465 11.1571 11.1571 k = 0.3153 0.1821 0.5149 ( 8912 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9960 -26.9960 -26.9913 -26.9913 -9.8788 -9.8788 -9.8578 -9.8578 -8.8248 -8.8248 -8.8133 -8.8133 -8.6300 -8.6300 -8.5998 -8.5998 2.2432 2.2432 2.6825 2.6825 2.9483 2.9483 4.3595 4.3595 4.4848 4.4848 5.4246 5.4246 6.5027 6.5027 6.5606 6.5606 6.6914 6.6914 9.5818 9.5818 10.7511 10.7511 11.1175 11.1175 11.1747 11.1747 k = 0.3068 0.1771 0.5010 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9971 -26.9971 -26.9902 -26.9902 -9.8807 -9.8807 -9.8534 -9.8534 -8.8245 -8.8245 -8.8072 -8.8072 -8.6380 -8.6380 -8.5993 -8.5993 2.2111 2.2111 2.6980 2.6980 2.9357 2.9357 4.3317 4.3317 4.5213 4.5213 5.4188 5.4188 6.5082 6.5082 6.5608 6.5608 6.6908 6.6908 9.6279 9.6279 10.7182 10.7182 11.1814 11.1814 11.2015 11.2015 k = 0.2983 0.1722 0.4871 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9983 -26.9983 -26.9891 -26.9891 -9.8827 -9.8827 -9.8488 -9.8488 -8.8251 -8.8251 -8.8000 -8.8000 -8.6461 -8.6461 -8.5987 -8.5987 2.1757 2.1757 2.7135 2.7135 2.9237 2.9237 4.3061 4.3061 4.5588 4.5588 5.4109 5.4109 6.5100 6.5100 6.5634 6.5634 6.6907 6.6907 9.6760 9.6760 10.6885 10.6885 11.2037 11.2037 11.2720 11.2720 k = 0.2898 0.1673 0.4732 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9995 -26.9995 -26.9880 -26.9880 -9.8849 -9.8849 -9.8441 -9.8441 -8.8259 -8.8259 -8.7923 -8.7923 -8.6543 -8.6543 -8.5980 -8.5980 2.1370 2.1370 2.7288 2.7288 2.9123 2.9123 4.2839 4.2839 4.5955 4.5955 5.4007 5.4007 6.5087 6.5087 6.5680 6.5680 6.6912 6.6912 9.7260 9.7260 10.6619 10.6619 11.2203 11.2203 11.3507 11.3507 k = 0.2812 0.1624 0.4593 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0007 -27.0007 -26.9869 -26.9869 -9.8872 -9.8872 -9.8393 -9.8393 -8.8267 -8.8267 -8.7842 -8.7842 -8.6626 -8.6626 -8.5972 -8.5972 2.0954 2.0954 2.7438 2.7438 2.9015 2.9015 4.2652 4.2652 4.6308 4.6308 5.3883 5.3883 6.5054 6.5054 6.5737 6.5737 6.6924 6.6924 9.7778 9.7778 10.6384 10.6384 11.2368 11.2368 11.4321 11.4321 k = 0.2727 0.1575 0.4454 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -27.0019 -27.0019 -26.9857 -26.9857 -9.8896 -9.8896 -9.8343 -9.8343 -8.8276 -8.8276 -8.7759 -8.7759 -8.6709 -8.6709 -8.5964 -8.5964 2.0510 2.0510 2.7586 2.7586 2.8914 2.8914 4.2503 4.2503 4.6642 4.6642 5.3737 5.3737 6.5013 6.5013 6.5798 6.5798 6.6941 6.6941 9.8311 9.8311 10.6179 10.6179 11.2543 11.2543 11.5159 11.5159 k = 0.2642 0.1525 0.4314 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0031 -27.0031 -26.9846 -26.9846 -9.8920 -9.8920 -9.8293 -9.8293 -8.8285 -8.8285 -8.7673 -8.7673 -8.6793 -8.6793 -8.5954 -8.5954 2.0040 2.0040 2.7729 2.7729 2.8820 2.8820 4.2388 4.2388 4.6953 4.6953 5.3569 5.3569 6.4969 6.4969 6.5858 6.5858 6.6964 6.6964 9.8857 9.8857 10.6003 10.6003 11.2735 11.2735 11.6020 11.6020 k = 0.2557 0.1476 0.4175 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2085 -32.2085 -27.0044 -27.0044 -26.9834 -26.9834 -9.8945 -9.8945 -9.8241 -9.8241 -8.8294 -8.8294 -8.7586 -8.7586 -8.6876 -8.6876 -8.5944 -8.5944 1.9549 1.9549 2.7867 2.7867 2.8734 2.8734 4.2308 4.2308 4.7236 4.7236 5.3380 5.3380 6.4929 6.4929 6.5916 6.5916 6.6992 6.6992 9.9410 9.9410 10.5855 10.5855 11.2952 11.2952 11.6901 11.6901 k = 0.2472 0.1427 0.4036 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2085 -32.2085 -27.0056 -27.0056 -26.9822 -26.9822 -9.8971 -9.8971 -9.8190 -9.8190 -8.8302 -8.8302 -8.7496 -8.7496 -8.6959 -8.6959 -8.5933 -8.5933 1.9038 1.9038 2.7998 2.7998 2.8656 2.8656 4.2261 4.2261 4.7488 4.7488 5.3170 5.3170 6.4898 6.4898 6.5971 6.5971 6.7023 6.7023 9.9965 9.9965 10.5732 10.5732 11.3206 11.3206 11.7803 11.7803 k = 0.2386 0.1378 0.3897 ( 8960 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -27.0069 -27.0069 -26.9811 -26.9811 -9.8998 -9.8998 -9.8137 -9.8137 -8.8309 -8.8309 -8.7406 -8.7406 -8.7041 -8.7041 -8.5922 -8.5922 1.8513 1.8513 2.8123 2.8123 2.8585 2.8585 4.2244 4.2244 4.7707 4.7707 5.2942 5.2942 6.4877 6.4877 6.6022 6.6022 6.7058 6.7058 10.0516 10.0516 10.5633 10.5633 11.3506 11.3506 11.8724 11.8724 k = 0.2301 0.1329 0.3758 ( 8960 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2087 -32.2087 -32.2085 -32.2085 -27.0081 -27.0081 -26.9799 -26.9799 -9.9025 -9.9025 -9.8085 -9.8085 -8.8317 -8.8317 -8.7314 -8.7314 -8.7122 -8.7122 -8.5910 -8.5910 1.7975 1.7975 2.8239 2.8239 2.8524 2.8524 4.2255 4.2255 4.7890 4.7890 5.2696 5.2696 6.4870 6.4870 6.6071 6.6071 6.7094 6.7094 10.1056 10.1056 10.5557 10.5557 11.3864 11.3864 11.9663 11.9663 k = 0.2216 0.1279 0.3619 ( 8961 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2087 -32.2087 -32.2085 -32.2085 -27.0094 -27.0094 -26.9788 -26.9788 -9.9052 -9.9052 -9.8032 -9.8032 -8.8324 -8.8324 -8.7223 -8.7223 -8.7202 -8.7202 -8.5897 -8.5897 1.7429 1.7429 2.8345 2.8345 2.8473 2.8473 4.2293 4.2293 4.8036 4.8036 5.2434 5.2434 6.4878 6.4878 6.6117 6.6117 6.7131 6.7131 10.1577 10.1577 10.5500 10.5500 11.4289 11.4289 12.0620 12.0620 k = 0.2131 0.1230 0.3479 ( 8959 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2085 -32.2085 -27.0106 -27.0106 -26.9776 -26.9776 -9.9080 -9.9080 -9.7980 -9.7980 -8.8330 -8.8330 -8.7282 -8.7282 -8.7129 -8.7129 -8.5883 -8.5883 1.6877 1.6877 2.8406 2.8406 2.8467 2.8467 4.2356 4.2356 4.8145 4.8145 5.2157 5.2157 6.4903 6.4903 6.6161 6.6161 6.7170 6.7170 10.2071 10.2071 10.5461 10.5461 11.4792 11.4792 12.1593 12.1593 k = 0.2045 0.1181 0.3340 ( 8959 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0119 -27.0119 -26.9765 -26.9765 -9.9107 -9.9107 -9.7928 -9.7928 -8.8336 -8.8336 -8.7359 -8.7359 -8.7036 -8.7036 -8.5869 -8.5869 1.6323 1.6323 2.8379 2.8379 2.8546 2.8546 4.2441 4.2441 4.8216 4.8216 5.1868 5.1868 6.4944 6.4944 6.6203 6.6203 6.7208 6.7208 10.2534 10.2534 10.5438 10.5438 11.5381 11.5381 12.2581 12.2581 k = 0.1960 0.1132 0.3201 ( 8957 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0131 -27.0131 -26.9754 -26.9754 -9.9135 -9.9135 -9.7876 -9.7876 -8.8342 -8.8342 -8.7435 -8.7435 -8.6943 -8.6943 -8.5854 -8.5854 1.5771 1.5771 2.8351 2.8351 2.8626 2.8626 4.2546 4.2546 4.8251 4.8251 5.1568 5.1568 6.5001 6.5001 6.6244 6.6244 6.7246 6.7246 10.2959 10.2959 10.5428 10.5428 11.6060 11.6060 12.3584 12.3584 k = 0.1875 0.1083 0.3062 ( 8965 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0143 -27.0143 -26.9743 -26.9743 -9.9162 -9.9162 -9.7825 -9.7825 -8.8347 -8.8347 -8.7509 -8.7509 -8.6851 -8.6851 -8.5839 -8.5839 1.5221 1.5221 2.8330 2.8330 2.8696 2.8696 4.2671 4.2671 4.8251 4.8251 5.1259 5.1259 6.5074 6.5074 6.6284 6.6284 6.7283 6.7283 10.3345 10.3345 10.5430 10.5430 11.6833 11.6833 12.4599 12.4599 k = 0.1790 0.1033 0.2923 ( 8961 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0155 -27.0155 -26.9732 -26.9732 -9.9190 -9.9190 -9.7775 -9.7775 -8.8351 -8.8351 -8.7581 -8.7581 -8.6759 -8.6759 -8.5824 -8.5824 1.4679 1.4679 2.8317 2.8317 2.8757 2.8757 4.2812 4.2812 4.8219 4.8219 5.0944 5.0944 6.5160 6.5160 6.6322 6.6322 6.7320 6.7320 10.3691 10.3691 10.5441 10.5441 11.7701 11.7701 12.5625 12.5625 k = 0.1705 0.0984 0.2784 ( 8967 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0166 -27.0166 -26.9722 -26.9722 -9.9217 -9.9217 -9.7725 -9.7725 -8.8356 -8.8356 -8.7651 -8.7651 -8.6668 -8.6668 -8.5808 -8.5808 1.4145 1.4145 2.8310 2.8310 2.8808 2.8808 4.2968 4.2968 4.8159 4.8159 5.0625 5.0625 6.5257 6.5257 6.6359 6.6359 6.7357 6.7357 10.3997 10.3997 10.5460 10.5460 11.8660 11.8660 12.6658 12.6658 k = 0.1619 0.0935 0.2644 ( 8965 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0178 -27.0178 -26.9712 -26.9712 -9.9243 -9.9243 -9.7677 -9.7677 -8.8360 -8.8360 -8.7718 -8.7718 -8.6579 -8.6579 -8.5793 -8.5793 1.3623 1.3623 2.8311 2.8311 2.8850 2.8850 4.3137 4.3137 4.8072 4.8072 5.0303 5.0303 6.5363 6.5363 6.6395 6.6395 6.7393 6.7393 10.4267 10.4267 10.5484 10.5484 11.9705 11.9705 12.7590 12.7590 k = 0.1534 0.0886 0.2505 ( 8961 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0188 -27.0188 -26.9702 -26.9702 -9.9269 -9.9269 -9.7630 -9.7630 -8.8363 -8.8363 -8.7783 -8.7783 -8.6492 -8.6492 -8.5777 -8.5777 1.3115 1.3115 2.8318 2.8318 2.8882 2.8882 4.3315 4.3315 4.7964 4.7964 4.9982 4.9982 6.5476 6.5476 6.6430 6.6430 6.7428 6.7428 10.4503 10.4503 10.5513 10.5513 12.0830 12.0830 12.7105 12.7105 k = 0.1449 0.0837 0.2366 ( 8947 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0199 -27.0199 -26.9692 -26.9692 -9.9294 -9.9294 -9.7585 -9.7585 -8.8367 -8.8367 -8.7845 -8.7845 -8.6406 -8.6406 -8.5761 -8.5761 1.2622 1.2622 2.8331 2.8331 2.8906 2.8906 4.3502 4.3502 4.7837 4.7837 4.9664 4.9664 6.5592 6.5592 6.6464 6.6464 6.7463 6.7463 10.4710 10.4710 10.5545 10.5545 12.2022 12.2022 12.6454 12.6454 k = 0.1364 0.0787 0.2227 ( 8963 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0209 -27.0209 -26.9683 -26.9683 -9.9319 -9.9319 -9.7541 -9.7541 -8.8370 -8.8370 -8.7905 -8.7905 -8.6324 -8.6324 -8.5745 -8.5745 1.2148 1.2148 2.8350 2.8350 2.8922 2.8922 4.3695 4.3695 4.7697 4.7697 4.9350 4.9350 6.5710 6.5710 6.6496 6.6496 6.7497 6.7497 10.4891 10.4891 10.5579 10.5579 12.3252 12.3252 12.5787 12.5787 k = 0.1278 0.0738 0.2088 ( 8971 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0219 -27.0219 -26.9675 -26.9675 -9.9342 -9.9342 -9.7499 -9.7499 -8.8372 -8.8372 -8.7961 -8.7961 -8.6244 -8.6244 -8.5729 -8.5729 1.1693 1.1693 2.8373 2.8373 2.8930 2.8930 4.3890 4.3890 4.7547 4.7547 4.9044 4.9044 6.5828 6.5828 6.6526 6.6526 6.7531 6.7531 10.5049 10.5049 10.5614 10.5614 12.4284 12.4284 12.5352 12.5352 k = 0.1193 0.0689 0.1948 ( 8971 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0228 -27.0228 -26.9666 -26.9666 -9.9365 -9.9365 -9.7459 -9.7459 -8.8375 -8.8375 -8.8014 -8.8014 -8.6167 -8.6167 -8.5714 -8.5714 1.1259 1.1259 2.8401 2.8401 2.8933 2.8933 4.4086 4.4086 4.7390 4.7390 4.8747 4.8747 6.5942 6.5942 6.6555 6.6555 6.7565 6.7565 10.5187 10.5187 10.5648 10.5648 12.4041 12.4041 12.6236 12.6236 k = 0.1108 0.0640 0.1809 ( 8979 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0237 -27.0237 -26.9658 -26.9658 -9.9386 -9.9386 -9.7421 -9.7421 -8.8377 -8.8377 -8.8064 -8.8064 -8.6094 -8.6094 -8.5699 -8.5699 1.0848 1.0848 2.8433 2.8433 2.8929 2.8929 4.4278 4.4278 4.7232 4.7232 4.8461 4.8461 6.6052 6.6052 6.6583 6.6583 6.7599 6.7599 10.5308 10.5308 10.5682 10.5682 12.3356 12.3356 12.7611 12.7611 k = 0.1023 0.0590 0.1670 ( 8979 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0245 -27.0245 -26.9651 -26.9651 -9.9406 -9.9406 -9.7386 -9.7386 -8.8379 -8.8379 -8.8111 -8.8111 -8.6024 -8.6024 -8.5685 -8.5685 1.0462 1.0462 2.8467 2.8467 2.8922 2.8922 4.4463 4.4463 4.7077 4.7077 4.8190 4.8190 6.6156 6.6156 6.6608 6.6608 6.7632 6.7632 10.5414 10.5414 10.5714 10.5714 12.2642 12.2642 12.9070 12.9070 k = 0.0938 0.0541 0.1531 ( 8983 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0253 -27.0253 -26.9644 -26.9644 -9.9425 -9.9425 -9.7353 -9.7353 -8.8380 -8.8380 -8.8155 -8.8155 -8.5959 -8.5959 -8.5672 -8.5672 1.0102 1.0102 2.8503 2.8503 2.8910 2.8910 4.4637 4.4637 4.6928 4.6928 4.7934 4.7934 6.6253 6.6253 6.6632 6.6632 6.7664 6.7664 10.5506 10.5506 10.5745 10.5745 12.1944 12.1944 13.0567 13.0567 k = 0.0852 0.0492 0.1392 ( 8971 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2084 -32.2084 -27.0260 -27.0260 -26.9638 -26.9638 -9.9443 -9.9443 -9.7322 -9.7322 -8.8382 -8.8382 -8.8194 -8.8194 -8.5898 -8.5898 -8.5659 -8.5659 0.9769 0.9769 2.8540 2.8540 2.8896 2.8896 4.4796 4.4796 4.6791 4.6791 4.7696 4.7696 6.6342 6.6342 6.6653 6.6653 6.7696 6.7696 10.5587 10.5587 10.5773 10.5773 12.1277 12.1277 13.2087 13.2087 k = 0.0767 0.0443 0.1253 ( 8969 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0267 -27.0267 -26.9632 -26.9632 -9.9459 -9.9459 -9.7294 -9.7294 -8.8383 -8.8383 -8.8231 -8.8231 -8.5842 -8.5842 -8.5647 -8.5647 0.9464 0.9464 2.8577 2.8577 2.8881 2.8881 4.4934 4.4934 4.6672 4.6672 4.7477 4.7477 6.6423 6.6423 6.6673 6.6673 6.7726 6.7726 10.5656 10.5656 10.5800 10.5800 12.0652 12.0652 13.3612 13.3612 k = 0.0682 0.0394 0.1113 ( 8977 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0273 -27.0273 -26.9627 -26.9627 -9.9474 -9.9474 -9.7268 -9.7268 -8.8384 -8.8384 -8.8264 -8.8264 -8.5791 -8.5791 -8.5636 -8.5636 0.9189 0.9189 2.8613 2.8613 2.8864 2.8864 4.5046 4.5046 4.6576 4.6576 4.7278 4.7278 6.6495 6.6495 6.6691 6.6691 6.7755 6.7755 10.5715 10.5715 10.5823 10.5823 12.0077 12.0077 13.5127 13.5127 k = 0.0597 0.0344 0.0974 ( 8973 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0278 -27.0278 -26.9622 -26.9622 -9.9487 -9.9487 -9.7246 -9.7246 -8.8385 -8.8385 -8.8293 -8.8293 -8.5746 -8.5746 -8.5626 -8.5626 0.8944 0.8944 2.8648 2.8648 2.8847 2.8847 4.5127 4.5127 4.6507 4.6507 4.7101 4.7101 6.6557 6.6557 6.6706 6.6706 6.7782 6.7782 10.5765 10.5765 10.5844 10.5844 11.9557 11.9557 13.6611 13.6611 k = 0.0511 0.0295 0.0835 ( 8967 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0283 -27.0283 -26.9618 -26.9618 -9.9498 -9.9498 -9.7226 -9.7226 -8.8386 -8.8386 -8.8318 -8.8318 -8.5706 -8.5706 -8.5618 -8.5618 0.8729 0.8729 2.8680 2.8680 2.8831 2.8831 4.5176 4.5176 4.6469 4.6469 4.6946 4.6946 6.6611 6.6611 6.6720 6.6720 6.7806 6.7806 10.5807 10.5807 10.5862 10.5862 11.9098 11.9098 13.8034 13.8034 k = 0.0426 0.0246 0.0696 ( 8963 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2084 -32.2084 -32.2083 -32.2083 -27.0287 -27.0287 -26.9615 -26.9615 -9.9508 -9.9508 -9.7209 -9.7209 -8.8387 -8.8387 -8.8339 -8.8339 -8.5672 -8.5672 -8.5610 -8.5610 0.8547 0.8547 2.8708 2.8708 2.8817 2.8817 4.5197 4.5197 4.6456 4.6456 4.6815 4.6815 6.6656 6.6656 6.6731 6.6731 6.7828 6.7828 10.5841 10.5841 10.5877 10.5877 11.8703 11.8703 13.9363 13.9363 k = 0.0341 0.0197 0.0557 ( 8967 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2084 -32.2084 -32.2083 -32.2083 -27.0290 -27.0290 -26.9612 -26.9612 -9.9516 -9.9516 -9.7195 -9.7195 -8.8387 -8.8387 -8.8357 -8.8357 -8.5643 -8.5643 -8.5604 -8.5604 0.8397 0.8397 2.8733 2.8733 2.8804 2.8804 4.5196 4.5196 4.6463 4.6463 4.6707 4.6707 6.6693 6.6693 6.6740 6.6740 6.7847 6.7847 10.5867 10.5867 10.5890 10.5890 11.8377 11.8377 14.0554 14.0554 k = 0.0256 0.0148 0.0418 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0292 -27.0292 -26.9610 -26.9610 -9.9523 -9.9523 -9.7184 -9.7184 -8.8388 -8.8388 -8.8371 -8.8371 -8.5621 -8.5621 -8.5599 -8.5599 0.8280 0.8280 2.8753 2.8753 2.8793 2.8793 4.5185 4.5185 4.6479 4.6479 4.6623 4.6623 6.6721 6.6721 6.6748 6.6748 6.7861 6.7861 10.5887 10.5887 10.5900 10.5900 11.8120 11.8120 14.1390 14.1390 k = 0.0170 0.0098 0.0278 ( 8923 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2082 -32.2082 -27.0294 -27.0294 -26.9608 -26.9608 -9.9527 -9.9527 -9.7176 -9.7176 -8.8388 -8.8388 -8.8380 -8.8380 -8.5605 -8.5605 -8.5595 -8.5595 0.8196 0.8196 2.8767 2.8767 2.8786 2.8786 4.5170 4.5170 4.6497 4.6497 4.6562 4.6562 6.6741 6.6741 6.6753 6.6753 6.7872 6.7872 10.5901 10.5901 10.5907 10.5907 11.7936 11.7936 14.1852 14.1852 k = 0.0085 0.0049 0.0139 ( 8873 PWs) bands (ev): -62.7469 -62.7469 -35.3716 -35.3716 -32.2082 -32.2082 -32.2082 -32.2082 -27.0295 -27.0295 -26.9607 -26.9607 -9.9530 -9.9530 -9.7172 -9.7172 -8.8388 -8.8388 -8.8386 -8.8386 -8.5596 -8.5596 -8.5593 -8.5593 0.8145 0.8145 2.8776 2.8776 2.8781 2.8781 4.5159 4.5159 4.6510 4.6510 4.6526 4.6526 6.6753 6.6753 6.6756 6.6756 6.7879 6.7879 10.5909 10.5909 10.5911 10.5911 11.7824 11.7824 14.2123 14.2123 k = 0.0000 0.0000 0.0000 ( 8873 PWs) bands (ev): -62.7469 -62.7469 -35.3716 -35.3716 -32.2082 -32.2082 -32.2082 -32.2082 -27.0296 -27.0296 -26.9607 -26.9607 -9.9531 -9.9531 -9.7170 -9.7170 -8.8388 -8.8388 -8.8388 -8.8388 -8.5593 -8.5593 -8.5593 -8.5593 0.8128 0.8128 2.8779 2.8779 2.8779 2.8779 4.5155 4.5155 4.6514 4.6514 4.6514 4.6514 6.6757 6.6757 6.6757 6.6757 6.7881 6.7881 10.5912 10.5912 10.5912 10.5912 11.7787 11.7787 14.2211 14.2211 k = 0.0000 0.0000 0.0000 ( 8873 PWs) bands (ev): -62.7469 -62.7469 -35.3716 -35.3716 -32.2082 -32.2082 -32.2082 -32.2082 -27.0296 -27.0296 -26.9607 -26.9607 -9.9531 -9.9531 -9.7170 -9.7170 -8.8388 -8.8388 -8.8388 -8.8388 -8.5593 -8.5593 -8.5593 -8.5593 0.8128 0.8128 2.8779 2.8779 2.8779 2.8779 4.5155 4.5155 4.6514 4.6514 4.6514 4.6514 6.6757 6.6757 6.6757 6.6757 6.7881 6.7881 10.5912 10.5912 10.5912 10.5912 11.7787 11.7787 14.2211 14.2211 k = 0.0139 0.0080 0.0057 ( 8873 PWs) bands (ev): -62.7469 -62.7469 -35.3716 -35.3716 -32.2082 -32.2082 -32.2082 -32.2082 -27.0295 -27.0295 -26.9607 -26.9607 -9.9530 -9.9530 -9.7172 -9.7172 -8.8387 -8.8387 -8.8387 -8.8387 -8.5595 -8.5595 -8.5594 -8.5594 0.8145 0.8145 2.8778 2.8778 2.8779 2.8779 4.5159 4.5159 4.6509 4.6509 4.6527 4.6527 6.6753 6.6753 6.6756 6.6756 6.7879 6.7879 10.5910 10.5910 10.5910 10.5910 11.7824 11.7824 14.2123 14.2123 k = 0.0278 0.0160 0.0113 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0294 -27.0294 -26.9608 -26.9608 -9.9527 -9.9527 -9.7176 -9.7176 -8.8385 -8.8385 -8.8384 -8.8384 -8.5602 -8.5602 -8.5599 -8.5599 0.8195 0.8195 2.8776 2.8776 2.8777 2.8777 4.5170 4.5170 4.6494 4.6494 4.6566 4.6566 6.6742 6.6742 6.6752 6.6752 6.7872 6.7872 10.5904 10.5904 10.5905 10.5905 11.7935 11.7935 14.1841 14.1841 k = 0.0417 0.0241 0.0170 ( 8933 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0292 -27.0292 -26.9610 -26.9610 -9.9523 -9.9523 -9.7184 -9.7184 -8.8380 -8.8380 -8.8378 -8.8378 -8.5614 -8.5614 -8.5607 -8.5607 0.8279 0.8279 2.8772 2.8772 2.8774 2.8774 4.5183 4.5183 4.6474 4.6474 4.6629 4.6629 6.6722 6.6722 6.6746 6.6746 6.7861 6.7861 10.5893 10.5893 10.5895 10.5895 11.8118 11.8118 14.1250 14.1250 k = 0.0556 0.0321 0.0227 ( 8939 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2083 -32.2083 -32.2083 -32.2083 -27.0290 -27.0290 -26.9612 -26.9612 -9.9516 -9.9516 -9.7195 -9.7195 -8.8374 -8.8374 -8.8370 -8.8370 -8.5630 -8.5630 -8.5617 -8.5617 0.8396 0.8396 2.8767 2.8767 2.8770 2.8770 4.5190 4.5190 4.6456 4.6456 4.6718 4.6718 6.6696 6.6696 6.6738 6.6738 6.7846 6.7846 10.5879 10.5879 10.5883 10.5883 11.8372 11.8372 14.0271 14.0271 k = 0.0694 0.0401 0.0284 ( 8963 PWs) bands (ev): -62.7469 -62.7469 -35.3717 -35.3717 -32.2084 -32.2084 -32.2083 -32.2083 -27.0287 -27.0287 -26.9615 -26.9615 -9.9508 -9.9508 -9.7209 -9.7209 -8.8366 -8.8366 -8.8360 -8.8360 -8.5650 -8.5650 -8.5631 -8.5631 0.8545 0.8545 2.8761 2.8761 2.8765 2.8765 4.5181 4.5181 4.6453 4.6453 4.6832 4.6832 6.6661 6.6661 6.6728 6.6728 6.7828 6.7828 10.5861 10.5861 10.5867 10.5867 11.8695 11.8695 13.9085 13.9085 k = 0.0833 0.0481 0.0340 ( 8981 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0283 -27.0283 -26.9618 -26.9618 -9.9498 -9.9498 -9.7226 -9.7226 -8.8357 -8.8357 -8.8347 -8.8347 -8.5675 -8.5675 -8.5648 -8.5648 0.8727 0.8727 2.8753 2.8753 2.8760 2.8760 4.5143 4.5143 4.6476 4.6476 4.6969 4.6969 6.6618 6.6618 6.6715 6.6715 6.7806 6.7806 10.5841 10.5841 10.5850 10.5850 11.9082 11.9082 13.7789 13.7789 k = 0.0972 0.0561 0.0397 ( 8987 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2084 -32.2084 -27.0278 -27.0278 -26.9622 -26.9622 -9.9487 -9.9487 -9.7245 -9.7245 -8.8346 -8.8346 -8.8333 -8.8333 -8.5704 -8.5704 -8.5668 -8.5668 0.8940 0.8940 2.8745 2.8745 2.8754 2.8754 4.5065 4.5065 4.6536 4.6536 4.7129 4.7129 6.6567 6.6567 6.6700 6.6700 6.7780 6.7780 10.5819 10.5819 10.5830 10.5830 11.9530 11.9530 13.6426 13.6426 k = 0.1111 0.0642 0.0454 ( 8990 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2084 -32.2084 -27.0273 -27.0273 -26.9627 -26.9627 -9.9473 -9.9473 -9.7268 -9.7268 -8.8333 -8.8333 -8.8316 -8.8316 -8.5737 -8.5737 -8.5691 -8.5691 0.9184 0.9184 2.8736 2.8736 2.8747 2.8747 4.4945 4.4945 4.6635 4.6635 4.7310 4.7310 6.6507 6.6507 6.6683 6.6683 6.7752 6.7752 10.5795 10.5795 10.5810 10.5810 12.0034 12.0034 13.5022 13.5022 k = 0.1250 0.0722 0.0510 ( 8975 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0267 -27.0267 -26.9632 -26.9632 -9.9458 -9.9458 -9.7293 -9.7293 -8.8318 -8.8318 -8.8296 -8.8296 -8.5774 -8.5774 -8.5716 -8.5716 0.9458 0.9458 2.8727 2.8727 2.8741 2.8741 4.4783 4.4783 4.6773 4.6773 4.7513 4.7513 6.6439 6.6439 6.6664 6.6664 6.7721 6.7721 10.5770 10.5770 10.5789 10.5789 12.0584 12.0584 13.3598 13.3598 k = 0.1389 0.0802 0.0567 ( 8963 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2084 -32.2084 -32.2083 -32.2083 -27.0260 -27.0260 -26.9638 -26.9638 -9.9442 -9.9442 -9.7320 -9.7320 -8.8302 -8.8302 -8.8275 -8.8275 -8.5815 -8.5815 -8.5745 -8.5745 0.9761 0.9761 2.8717 2.8717 2.8734 2.8734 4.4585 4.4585 4.6944 4.6944 4.7734 4.7734 6.6363 6.6363 6.6643 6.6643 6.7689 6.7689 10.5745 10.5745 10.5768 10.5768 12.1174 12.1174 13.2169 13.2169 k = 0.1528 0.0882 0.0624 ( 8972 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2083 -32.2083 -27.0253 -27.0253 -26.9644 -26.9644 -9.9423 -9.9423 -9.7351 -9.7351 -8.8284 -8.8284 -8.8251 -8.8251 -8.5859 -8.5859 -8.5776 -8.5776 1.0091 1.0091 2.8708 2.8708 2.8728 2.8728 4.4356 4.4356 4.7142 4.7142 4.7974 4.7974 6.6279 6.6279 6.6620 6.6620 6.7654 6.7654 10.5722 10.5722 10.5749 10.5749 12.1789 12.1789 13.0747 13.0747 k = 0.1667 0.0962 0.0680 ( 8969 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0245 -27.0245 -26.9651 -26.9651 -9.9403 -9.9403 -9.7383 -9.7383 -8.8265 -8.8265 -8.8226 -8.8226 -8.5906 -8.5906 -8.5809 -8.5809 1.0449 1.0449 2.8698 2.8698 2.8722 2.8722 4.4100 4.4100 4.7364 4.7364 4.8230 4.8230 6.6187 6.6187 6.6595 6.6595 6.7618 6.7618 10.5700 10.5700 10.5732 10.5732 12.2415 12.2415 12.9341 12.9341 k = 0.1806 0.1042 0.0737 ( 8975 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2085 -32.2085 -32.2084 -32.2084 -27.0237 -27.0237 -26.9659 -26.9659 -9.9381 -9.9381 -9.7418 -9.7418 -8.8244 -8.8244 -8.8198 -8.8198 -8.5955 -8.5955 -8.5845 -8.5845 1.0831 1.0831 2.8689 2.8689 2.8716 2.8716 4.3819 4.3819 4.7605 4.7605 4.8502 4.8502 6.6088 6.6088 6.6568 6.6568 6.7582 6.7582 10.5681 10.5681 10.5717 10.5717 12.3028 12.3028 12.7964 12.7964 k = 0.1944 0.1123 0.0794 ( 8987 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0228 -27.0228 -26.9667 -26.9667 -9.9358 -9.9358 -9.7455 -9.7455 -8.8222 -8.8222 -8.8168 -8.8168 -8.6008 -8.6008 -8.5884 -8.5884 1.1238 1.1238 2.8681 2.8681 2.8711 2.8711 4.3518 4.3518 4.7862 4.7862 4.8786 4.8786 6.5982 6.5982 6.6540 6.6540 6.7544 6.7544 10.5666 10.5666 10.5706 10.5706 12.3592 12.3592 12.6633 12.6633 k = 0.2083 0.1203 0.0851 ( 8982 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0218 -27.0218 -26.9675 -26.9675 -9.9333 -9.9333 -9.7494 -9.7494 -8.8198 -8.8198 -8.8136 -8.8136 -8.6063 -8.6063 -8.5925 -8.5925 1.1666 1.1666 2.8673 2.8673 2.8707 2.8707 4.3197 4.3197 4.8133 4.8133 4.9081 4.9081 6.5870 6.5870 6.6510 6.6510 6.7506 6.7506 10.5654 10.5654 10.5700 10.5700 12.4001 12.4001 12.5430 12.5430 k = 0.2222 0.1283 0.0907 ( 8982 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0208 -27.0208 -26.9685 -26.9685 -9.9307 -9.9307 -9.7534 -9.7534 -8.8172 -8.8172 -8.8103 -8.8103 -8.6120 -8.6120 -8.5967 -8.5967 1.2115 1.2115 2.8667 2.8667 2.8704 2.8704 4.2859 4.2859 4.8415 4.8415 4.9386 4.9386 6.5753 6.5753 6.6478 6.6478 6.7468 6.7468 10.5648 10.5648 10.5698 10.5698 12.3647 12.3647 12.4939 12.4939 k = 0.2361 0.1363 0.0964 ( 8973 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0198 -27.0198 -26.9694 -26.9694 -9.9279 -9.9279 -9.7577 -9.7577 -8.8145 -8.8145 -8.8067 -8.8067 -8.6179 -8.6179 -8.6013 -8.6013 1.2582 1.2582 2.8661 2.8661 2.8701 2.8701 4.2505 4.2505 4.8705 4.8705 4.9698 4.9698 6.5632 6.5632 6.6446 6.6446 6.7429 6.7429 10.5648 10.5648 10.5703 10.5703 12.2540 12.2540 12.5120 12.5120 k = 0.2500 0.1443 0.1021 ( 8961 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0187 -27.0187 -26.9704 -26.9704 -9.9250 -9.9250 -9.7621 -9.7621 -8.8117 -8.8117 -8.8029 -8.8029 -8.6239 -8.6239 -8.6060 -8.6060 1.3066 1.3066 2.8656 2.8656 2.8700 2.8700 4.2138 4.2138 4.9001 4.9001 5.0016 5.0016 6.5509 6.5509 6.6412 6.6412 6.7391 6.7391 10.5654 10.5654 10.5713 10.5713 12.1364 12.1364 12.5276 12.5276 k = 0.2639 0.1524 0.1077 ( 8958 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2086 -32.2086 -32.2084 -32.2084 -27.0175 -27.0175 -26.9714 -26.9714 -9.9220 -9.9220 -9.7666 -9.7666 -8.8087 -8.8087 -8.7990 -8.7990 -8.6301 -8.6301 -8.6108 -8.6108 1.3563 1.3563 2.8652 2.8652 2.8699 2.8699 4.1758 4.1758 4.9300 4.9300 5.0336 5.0336 6.5383 6.5383 6.6377 6.6377 6.7353 6.7353 10.5666 10.5666 10.5730 10.5730 12.0213 12.0213 12.5309 12.5309 k = 0.2778 0.1604 0.1134 ( 8964 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0163 -27.0163 -26.9725 -26.9725 -9.9188 -9.9188 -9.7713 -9.7713 -8.8056 -8.8056 -8.7949 -8.7949 -8.6364 -8.6364 -8.6159 -8.6159 1.4071 1.4071 2.8649 2.8649 2.8699 2.8699 4.1369 4.1369 4.9600 4.9600 5.0657 5.0657 6.5257 6.5257 6.6342 6.6342 6.7315 6.7315 10.5686 10.5686 10.5753 10.5753 11.9103 11.9103 12.5205 12.5205 k = 0.2917 0.1684 0.1191 ( 8970 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0151 -27.0151 -26.9736 -26.9736 -9.9155 -9.9155 -9.7760 -9.7760 -8.8024 -8.8024 -8.7906 -8.7906 -8.6428 -8.6428 -8.6211 -8.6211 1.4588 1.4588 2.8647 2.8647 2.8700 2.8700 4.0970 4.0970 4.9899 4.9899 5.0977 5.0977 6.5132 6.5132 6.6306 6.6306 6.7278 6.7278 10.5713 10.5713 10.5784 10.5784 11.8042 11.8042 12.4913 12.4913 k = 0.3056 0.1764 0.1247 ( 8955 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0138 -27.0138 -26.9748 -26.9748 -9.9120 -9.9120 -9.7809 -9.7809 -8.7990 -8.7990 -8.7861 -8.7861 -8.6492 -8.6492 -8.6265 -8.6265 1.5109 1.5109 2.8646 2.8646 2.8702 2.8702 4.0566 4.0566 5.0193 5.0193 5.1292 5.1292 6.5009 6.5009 6.6269 6.6269 6.7242 6.7242 10.5748 10.5748 10.5821 10.5821 11.7034 11.7034 12.4291 12.4291 k = 0.3194 0.1844 0.1304 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0126 -27.0126 -26.9760 -26.9760 -9.9084 -9.9084 -9.7858 -9.7858 -8.7954 -8.7954 -8.7815 -8.7815 -8.6556 -8.6556 -8.6320 -8.6320 1.5633 1.5633 2.8645 2.8645 2.8705 2.8705 4.0157 4.0157 5.0482 5.0482 5.1601 5.1601 6.4890 6.4890 6.6233 6.6233 6.7206 6.7206 10.5790 10.5790 10.5865 10.5865 11.6083 11.6083 12.3503 12.3503 k = 0.3333 0.1925 0.1361 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0112 -27.0112 -26.9772 -26.9772 -9.9047 -9.9047 -9.7908 -9.7908 -8.7918 -8.7918 -8.7767 -8.7767 -8.6621 -8.6621 -8.6376 -8.6376 1.6153 1.6153 2.8646 2.8646 2.8708 2.8708 3.9748 3.9748 5.0762 5.0762 5.1901 5.1901 6.4774 6.4774 6.6197 6.6197 6.7172 6.7172 10.5838 10.5838 10.5916 10.5916 11.5191 11.5191 12.2710 12.2710 k = 0.3472 0.2005 0.1418 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2087 -32.2087 -32.2084 -32.2084 -27.0099 -27.0099 -26.9785 -26.9785 -9.9009 -9.9009 -9.7959 -9.7959 -8.7880 -8.7880 -8.7717 -8.7717 -8.6685 -8.6685 -8.6433 -8.6433 1.6668 1.6668 2.8646 2.8646 2.8711 2.8711 3.9341 3.9341 5.1030 5.1030 5.2189 5.2189 6.4665 6.4665 6.6162 6.6162 6.7140 6.7140 10.5893 10.5893 10.5971 10.5971 11.4361 11.4361 12.1949 12.1949 k = 0.3611 0.2085 0.1474 ( 8946 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -27.0085 -27.0085 -26.9798 -26.9798 -9.8970 -9.8970 -9.8010 -9.8010 -8.7841 -8.7841 -8.7667 -8.7667 -8.6750 -8.6750 -8.6491 -8.6491 1.7170 1.7170 2.8648 2.8648 2.8715 2.8715 3.8939 3.8939 5.1286 5.1286 5.2464 5.2464 6.4561 6.4561 6.6128 6.6128 6.7109 6.7109 10.5953 10.5953 10.6032 10.6032 11.3594 11.3594 12.1229 12.1229 k = 0.3750 0.2165 0.1531 ( 8946 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -27.0071 -27.0071 -26.9811 -26.9811 -9.8930 -9.8930 -9.8061 -9.8061 -8.7800 -8.7800 -8.7615 -8.7615 -8.6813 -8.6813 -8.6550 -8.6550 1.7656 1.7656 2.8650 2.8650 2.8719 2.8719 3.8549 3.8549 5.1525 5.1525 5.2721 5.2721 6.4465 6.4465 6.6095 6.6095 6.7080 6.7080 10.6018 10.6018 10.6095 10.6095 11.2894 11.2894 12.0559 12.0559 k = 0.3889 0.2245 0.1588 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -27.0057 -27.0057 -26.9825 -26.9825 -9.8889 -9.8889 -9.8112 -9.8112 -8.7758 -8.7758 -8.7561 -8.7561 -8.6876 -8.6876 -8.6610 -8.6610 1.8119 1.8119 2.8652 2.8652 2.8723 2.8723 3.8173 3.8173 5.1746 5.1746 5.2959 5.2959 6.4378 6.4378 6.6064 6.6064 6.7053 6.7053 10.6085 10.6085 10.6161 10.6161 11.2261 11.2261 11.9941 11.9941 k = 0.4028 0.2325 0.1644 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -27.0042 -27.0042 -26.9838 -26.9838 -9.8846 -9.8846 -9.8163 -9.8163 -8.7716 -8.7716 -8.7507 -8.7507 -8.6938 -8.6938 -8.6670 -8.6670 1.8553 1.8553 2.8654 2.8654 2.8727 2.8727 3.7818 3.7818 5.1947 5.1947 5.3176 5.3176 6.4299 6.4299 6.6036 6.6036 6.7028 6.7028 10.6152 10.6152 10.6226 10.6226 11.1699 11.1699 11.9383 11.9383 k = 0.4167 0.2406 0.1701 ( 8925 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -27.0028 -27.0028 -26.9852 -26.9852 -9.8803 -9.8803 -9.8214 -9.8214 -8.7672 -8.7672 -8.7451 -8.7451 -8.6999 -8.6999 -8.6730 -8.6730 1.8951 1.8951 2.8656 2.8656 2.8730 2.8730 3.7491 3.7491 5.2126 5.2126 5.3369 5.3369 6.4229 6.4229 6.6010 6.6010 6.7007 6.7007 10.6219 10.6219 10.6290 10.6290 11.1208 11.1208 11.8886 11.8886 k = 0.4306 0.2486 0.1758 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -27.0013 -27.0013 -26.9866 -26.9866 -9.8759 -9.8759 -9.8265 -9.8265 -8.7627 -8.7627 -8.7395 -8.7395 -8.7058 -8.7058 -8.6791 -8.6791 1.9305 1.9305 2.8658 2.8658 2.8734 2.8734 3.7197 3.7197 5.2280 5.2280 5.3537 5.3537 6.4170 6.4170 6.5987 6.5987 6.6988 6.6988 10.6281 10.6281 10.6350 10.6350 11.0790 11.0790 11.8457 11.8457 k = 0.4444 0.2566 0.1814 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9999 -26.9999 -26.9881 -26.9881 -9.8715 -9.8715 -9.8315 -9.8315 -8.7581 -8.7581 -8.7337 -8.7337 -8.7115 -8.7115 -8.6852 -8.6852 1.9608 1.9608 2.8660 2.8660 2.8736 2.8736 3.6944 3.6944 5.2409 5.2409 5.3676 5.3676 6.4121 6.4121 6.5968 6.5968 6.6972 6.6972 10.6337 10.6337 10.6403 10.6403 11.0446 11.0446 11.8099 11.8099 k = 0.4583 0.2646 0.1871 ( 8922 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9984 -26.9984 -26.9895 -26.9895 -9.8670 -9.8670 -9.8364 -9.8364 -8.7536 -8.7536 -8.7280 -8.7280 -8.7170 -8.7170 -8.6913 -8.6913 1.9853 1.9853 2.8662 2.8662 2.8739 2.8739 3.6739 3.6739 5.2511 5.2511 5.3787 5.3787 6.4082 6.4082 6.5952 6.5952 6.6959 6.6959 10.6384 10.6384 10.6447 10.6447 11.0177 11.0177 11.7816 11.7816 k = 0.4722 0.2726 0.1928 ( 8916 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9970 -26.9970 -26.9909 -26.9909 -9.8626 -9.8626 -9.8411 -9.8411 -8.7493 -8.7493 -8.7222 -8.7222 -8.7219 -8.7219 -8.6973 -8.6973 2.0033 2.0033 2.8663 2.8663 2.8740 2.8740 3.6587 3.6587 5.2584 5.2584 5.3866 5.3866 6.4055 6.4055 6.5941 6.5941 6.6950 6.6950 10.6419 10.6419 10.6480 10.6480 10.9985 10.9985 11.7611 11.7611 k = 0.4861 0.2807 0.1985 ( 8931 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9955 -26.9955 -26.9923 -26.9923 -9.8586 -9.8586 -9.8453 -9.8453 -8.7457 -8.7457 -8.7259 -8.7259 -8.7165 -8.7165 -8.7031 -8.7031 2.0143 2.0143 2.8663 2.8663 2.8741 2.8741 3.6494 3.6494 5.2629 5.2629 5.3915 5.3915 6.4038 6.4038 6.5934 6.5934 6.6945 6.6945 10.6442 10.6442 10.6501 10.6501 10.9869 10.9869 11.7487 11.7487 k = 0.5000 0.2887 0.2041 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8475 -9.8475 -8.7442 -8.7442 -8.7276 -8.7276 -8.7127 -8.7127 -8.7069 -8.7069 2.0181 2.0181 2.8664 2.8664 2.8742 2.8742 3.6463 3.6463 5.2643 5.2643 5.3931 5.3931 6.4032 6.4032 6.5932 6.5932 6.6943 6.6943 10.6449 10.6449 10.6508 10.6508 10.9830 10.9830 11.7445 11.7445 k = 0.5000 0.2887 0.2041 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8475 -9.8475 -8.7442 -8.7442 -8.7276 -8.7276 -8.7127 -8.7127 -8.7069 -8.7069 2.0181 2.0181 2.8664 2.8664 2.8742 2.8742 3.6463 3.6463 5.2643 5.2643 5.3931 5.3931 6.4032 6.4032 6.5932 6.5932 6.6943 6.6943 10.6449 10.6449 10.6508 10.6508 10.9830 10.9830 11.7445 11.7445 k = 0.5048 0.2748 0.2120 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8476 -9.8476 -8.7453 -8.7453 -8.7300 -8.7300 -8.7103 -8.7103 -8.7057 -8.7057 2.0190 2.0190 2.8658 2.8658 2.8738 2.8738 3.6485 3.6485 5.2633 5.2633 5.3919 5.3919 6.4040 6.4040 6.5931 6.5931 6.6943 6.6943 10.6271 10.6271 10.6486 10.6486 11.0041 11.0041 11.7404 11.7404 k = 0.5096 0.2609 0.2198 ( 8926 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8567 -9.8567 -9.8478 -9.8478 -8.7484 -8.7484 -8.7351 -8.7351 -8.7051 -8.7051 -8.7025 -8.7025 2.0218 2.0218 2.8635 2.8635 2.8736 2.8736 3.6551 3.6551 5.2598 5.2598 5.3885 5.3885 6.4062 6.4062 6.5928 6.5928 6.6941 6.6941 10.5770 10.5770 10.6495 10.6495 11.0567 11.0567 11.7284 11.7284 k = 0.5144 0.2470 0.2277 ( 8921 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8570 -9.8570 -9.8482 -9.8482 -8.7526 -8.7526 -8.7408 -8.7408 -8.6991 -8.6991 -8.6980 -8.6980 2.0264 2.0264 2.8584 2.8584 2.8746 2.8746 3.6659 3.6659 5.2535 5.2535 5.3836 5.3836 6.4098 6.4098 6.5923 6.5923 6.6939 6.6939 10.5121 10.5121 10.6514 10.6514 11.1252 11.1252 11.7091 11.7091 k = 0.5192 0.2332 0.2355 ( 8921 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8574 -9.8574 -9.8487 -9.8487 -8.7576 -8.7576 -8.7467 -8.7467 -8.6930 -8.6930 -8.6925 -8.6925 2.0328 2.0328 2.8508 2.8508 2.8768 2.8768 3.6808 3.6808 5.2434 5.2434 5.3781 5.3781 6.4145 6.4145 6.5916 6.5916 6.6937 6.6937 10.4411 10.4411 10.6541 10.6541 11.2010 11.2010 11.6834 11.6834 k = 0.5240 0.2193 0.2434 ( 8919 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8580 -9.8580 -9.8494 -9.8494 -8.7629 -8.7629 -8.7526 -8.7526 -8.6872 -8.6872 -8.6863 -8.6863 2.0410 2.0410 2.8411 2.8411 2.8799 2.8799 3.6994 3.6994 5.2289 5.2289 5.3733 5.3733 6.4202 6.4202 6.5907 6.5907 6.6934 6.6934 10.3679 10.3679 10.6577 10.6577 11.2801 11.2801 11.6524 11.6524 k = 0.5288 0.2054 0.2512 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8586 -9.8586 -9.8502 -9.8502 -8.7684 -8.7684 -8.7584 -8.7584 -8.6813 -8.6813 -8.6799 -8.6799 2.0509 2.0509 2.8298 2.8298 2.8838 2.8838 3.7214 3.7214 5.2093 5.2093 5.3698 5.3698 6.4267 6.4267 6.5896 6.5896 6.6931 6.6931 10.2943 10.2943 10.6621 10.6621 11.3603 11.3603 11.6172 11.6172 k = 0.5337 0.1915 0.2591 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8593 -9.8593 -9.8511 -9.8511 -8.7740 -8.7740 -8.7640 -8.7640 -8.6753 -8.6753 -8.6735 -8.6735 2.0624 2.0624 2.8172 2.8172 2.8884 2.8884 3.7465 3.7465 5.1846 5.1846 5.3680 5.3680 6.4336 6.4336 6.5883 6.5883 6.6927 6.6927 10.2215 10.2215 10.6673 10.6673 11.4397 11.4397 11.5791 11.5791 k = 0.5385 0.1776 0.2669 ( 8925 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8602 -9.8602 -9.8521 -9.8521 -8.7796 -8.7796 -8.7694 -8.7694 -8.6693 -8.6693 -8.6672 -8.6672 2.0755 2.0755 2.8035 2.8035 2.8937 2.8937 3.7744 3.7744 5.1553 5.1553 5.3680 5.3680 6.4406 6.4406 6.5867 6.5867 6.6924 6.6924 10.1499 10.1499 10.6734 10.6734 11.5069 11.5069 11.5465 11.5465 k = 0.5433 0.1638 0.2748 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8611 -9.8611 -9.8532 -9.8532 -8.7852 -8.7852 -8.7745 -8.7745 -8.6634 -8.6634 -8.6610 -8.6610 2.0900 2.0900 2.7892 2.7892 2.8996 2.8996 3.8048 3.8048 5.1218 5.1218 5.3694 5.3694 6.4476 6.4476 6.5850 6.5850 6.6922 6.6922 10.0801 10.0801 10.6803 10.6803 11.4863 11.4863 11.5329 11.5329 k = 0.5481 0.1499 0.2826 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9944 -26.9944 -26.9933 -26.9933 -9.8621 -9.8621 -9.8544 -9.8544 -8.7907 -8.7907 -8.7794 -8.7794 -8.6574 -8.6574 -8.6550 -8.6550 2.1059 2.1059 2.7743 2.7743 2.9060 2.9060 3.8373 3.8373 5.0849 5.0849 5.3720 5.3720 6.4542 6.4542 6.5831 6.5831 6.6920 6.6920 10.0123 10.0123 10.6881 10.6881 11.4418 11.4418 11.4945 11.4945 k = 0.5529 0.1360 0.2905 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9944 -26.9944 -26.9932 -26.9932 -9.8632 -9.8632 -9.8557 -9.8557 -8.7962 -8.7962 -8.7840 -8.7840 -8.6516 -8.6516 -8.6491 -8.6491 2.1230 2.1230 2.7591 2.7591 2.9130 2.9130 3.8717 3.8717 5.0451 5.0451 5.3755 5.3755 6.4602 6.4602 6.5810 6.5810 6.6919 6.6919 9.9468 9.9468 10.6968 10.6968 11.3951 11.3951 11.4550 11.4550 k = 0.5577 0.1221 0.2983 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9944 -26.9944 -26.9931 -26.9931 -9.8644 -9.8644 -9.8570 -9.8570 -8.8016 -8.8016 -8.7883 -8.7883 -8.6459 -8.6459 -8.6433 -8.6433 2.1412 2.1412 2.7439 2.7439 2.9205 2.9205 3.9076 3.9076 5.0031 5.0031 5.3796 5.3796 6.4654 6.4654 6.5790 6.5790 6.6919 6.6919 9.8838 9.8838 10.7064 10.7064 11.3476 11.3476 11.4161 11.4161 k = 0.5625 0.1083 0.3062 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9945 -26.9945 -26.9930 -26.9930 -9.8656 -9.8656 -9.8583 -9.8583 -8.8069 -8.8069 -8.7922 -8.7922 -8.6404 -8.6404 -8.6378 -8.6378 2.1603 2.1603 2.7286 2.7286 2.9285 2.9285 3.9448 3.9448 4.9594 4.9594 5.3842 5.3842 6.4695 6.4695 6.5770 6.5770 6.6921 6.6921 9.8234 9.8234 10.7169 10.7169 11.2999 11.2999 11.3782 11.3782 k = 0.5673 0.0944 0.3140 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9945 -26.9945 -26.9929 -26.9929 -9.8669 -9.8669 -9.8596 -9.8596 -8.8121 -8.8121 -8.7959 -8.7959 -8.6350 -8.6350 -8.6326 -8.6326 2.1802 2.1802 2.7137 2.7137 2.9368 2.9368 3.9828 3.9828 4.9147 4.9147 5.3890 5.3890 6.4724 6.4724 6.5753 6.5753 6.6925 6.6925 9.7658 9.7658 10.7281 10.7281 11.2525 11.2525 11.3415 11.3415 k = 0.5721 0.0805 0.3219 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9947 -26.9947 -26.9927 -26.9927 -9.8682 -9.8682 -9.8609 -9.8609 -8.8171 -8.8171 -8.7991 -8.7991 -8.6299 -8.6299 -8.6274 -8.6274 2.2005 2.2005 2.6990 2.6990 2.9454 2.9454 4.0213 4.0213 4.8694 4.8694 5.3939 5.3939 6.4737 6.4737 6.5738 6.5738 6.6930 6.6930 9.7109 9.7109 10.7400 10.7400 11.2058 11.2058 11.3063 11.3063 k = 0.5769 0.0666 0.3297 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9948 -26.9948 -26.9925 -26.9925 -9.8696 -9.8696 -9.8621 -9.8621 -8.8220 -8.8220 -8.8021 -8.8021 -8.6251 -8.6251 -8.6224 -8.6224 2.2211 2.2211 2.6848 2.6848 2.9543 2.9543 4.0598 4.0598 4.8244 4.8244 5.3987 5.3987 6.4735 6.4735 6.5728 6.5728 6.6937 6.6937 9.6590 9.6590 10.7524 10.7524 11.1606 11.1606 11.2726 11.2726 k = 0.5817 0.0527 0.3376 ( 8933 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9950 -26.9950 -26.9923 -26.9923 -9.8711 -9.8711 -9.8633 -9.8633 -8.8268 -8.8268 -8.8047 -8.8047 -8.6208 -8.6208 -8.6175 -8.6175 2.2418 2.2418 2.6711 2.6711 2.9635 2.9635 4.0977 4.0977 4.7805 4.7805 5.4033 5.4033 6.4717 6.4717 6.5723 6.5723 6.6945 6.6945 9.6100 9.6100 10.7649 10.7649 11.1173 11.1173 11.2408 11.2408 k = 0.5865 0.0389 0.3454 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9952 -26.9952 -26.9921 -26.9921 -9.8726 -9.8726 -9.8643 -9.8643 -8.8314 -8.8314 -8.8070 -8.8070 -8.6169 -8.6169 -8.6127 -8.6127 2.2622 2.2622 2.6581 2.6581 2.9728 2.9728 4.1340 4.1340 4.7388 4.7388 5.4075 5.4075 6.4683 6.4683 6.5722 6.5722 6.6955 6.6955 9.5641 9.5641 10.7766 10.7766 11.0771 11.0771 11.2108 11.2108 k = 0.5913 0.0250 0.3533 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9954 -26.9954 -26.9918 -26.9918 -9.8741 -9.8741 -9.8653 -9.8653 -8.8358 -8.8358 -8.8089 -8.8089 -8.6134 -8.6134 -8.6080 -8.6080 2.2820 2.2820 2.6458 2.6458 2.9821 2.9821 4.1676 4.1676 4.7007 4.7007 5.4112 5.4112 6.4634 6.4634 6.5726 6.5726 6.6966 6.6966 9.5212 9.5212 10.7864 10.7864 11.0413 11.0413 11.1830 11.1830 k = 0.5962 0.0111 0.3611 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9957 -26.9957 -26.9915 -26.9915 -9.8757 -9.8757 -9.8660 -9.8660 -8.8400 -8.8400 -8.8105 -8.8105 -8.6104 -8.6104 -8.6033 -8.6033 2.3009 2.3009 2.6342 2.6342 2.9915 2.9915 4.1969 4.1969 4.6681 4.6681 5.4143 5.4143 6.4573 6.4573 6.5733 6.5733 6.6977 6.6977 9.4814 9.4814 10.7919 10.7919 11.0126 11.0126 11.1573 11.1573 k = 0.6010-0.0028 0.3690 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9960 -26.9960 -26.9912 -26.9912 -9.8774 -9.8774 -9.8666 -9.8666 -8.8440 -8.8440 -8.8117 -8.8117 -8.6079 -8.6079 -8.5989 -8.5989 2.3185 2.3185 2.6235 2.6235 3.0009 3.0009 4.2195 4.2195 4.6435 4.6435 5.4166 5.4166 6.4500 6.4500 6.5743 6.5743 6.6989 6.6989 9.4447 9.4447 10.7902 10.7902 10.9939 10.9939 11.1340 11.1340 k = 0.6058-0.0167 0.3768 ( 8949 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9963 -26.9963 -26.9908 -26.9908 -9.8790 -9.8790 -9.8670 -9.8670 -8.8479 -8.8479 -8.8126 -8.8126 -8.6058 -8.6058 -8.5945 -8.5945 2.3345 2.3345 2.6136 2.6136 3.0101 3.0101 4.2331 4.2331 4.6295 4.6295 5.4180 5.4180 6.4417 6.4417 6.5754 6.5754 6.7002 6.7002 9.4111 9.4111 10.7790 10.7790 10.9878 10.9878 11.1135 11.1135 k = 0.6106-0.0305 0.3847 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9966 -26.9966 -26.9904 -26.9904 -9.8807 -9.8807 -9.8672 -9.8672 -8.8515 -8.8515 -8.8132 -8.8132 -8.6042 -8.6042 -8.5904 -8.5904 2.3486 2.3486 2.6046 2.6046 3.0192 3.0192 4.2363 4.2363 4.6278 4.6278 5.4185 5.4185 6.4327 6.4327 6.5766 6.5766 6.7015 6.7015 9.3807 9.3807 10.7591 10.7591 10.9932 10.9932 11.0960 11.0960 k = 0.6154-0.0444 0.3925 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9970 -26.9970 -26.9900 -26.9900 -9.8825 -9.8825 -9.8672 -9.8672 -8.8549 -8.8549 -8.8134 -8.8134 -8.6030 -8.6030 -8.5864 -8.5864 2.3603 2.3603 2.5963 2.5963 3.0280 3.0280 4.2295 4.2295 4.6384 4.6384 5.4178 5.4178 6.4230 6.4230 6.5780 6.5780 6.7027 6.7027 9.3535 9.3535 10.7332 10.7332 11.0067 11.0067 11.0826 11.0826 k = 0.6202-0.0583 0.4004 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9974 -26.9974 -26.9896 -26.9896 -9.8842 -9.8842 -9.8669 -9.8669 -8.8582 -8.8582 -8.8133 -8.8133 -8.6024 -8.6024 -8.5825 -8.5825 2.3695 2.3695 2.5886 2.5886 3.0365 3.0365 4.2150 4.2150 4.6590 4.6590 5.4160 5.4160 6.4129 6.4129 6.5794 6.5794 6.7040 6.7040 9.3296 9.3296 10.7044 10.7044 11.0227 11.0227 11.0764 11.0764 k = 0.6250-0.0722 0.4082 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9979 -26.9979 -26.9891 -26.9891 -9.8859 -9.8859 -9.8664 -9.8664 -8.8612 -8.8612 -8.8128 -8.8128 -8.6022 -8.6022 -8.5789 -8.5789 2.3758 2.3758 2.5814 2.5814 3.0446 3.0446 4.1958 4.1958 4.6869 4.6869 5.4129 5.4129 6.4023 6.4023 6.5808 6.5808 6.7052 6.7052 9.3089 9.3089 10.6745 10.6745 11.0323 11.0323 11.0845 11.0845 k = 0.6250-0.0722 0.4082 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9979 -26.9979 -26.9891 -26.9891 -9.8859 -9.8859 -9.8664 -9.8664 -8.8612 -8.8612 -8.8128 -8.8128 -8.6022 -8.6022 -8.5789 -8.5789 2.3758 2.3758 2.5814 2.5814 3.0446 3.0446 4.1958 4.1958 4.6869 4.6869 5.4129 5.4129 6.4023 6.4023 6.5808 6.5808 6.7052 6.7052 9.3089 9.3089 10.6745 10.6745 11.0323 11.0323 11.0845 11.0845 k = 0.6167-0.0674 0.4219 ( 8946 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9978 -26.9978 -26.9892 -26.9892 -9.8859 -9.8859 -9.8664 -9.8664 -8.8611 -8.8611 -8.8130 -8.8130 -8.6021 -8.6021 -8.5789 -8.5789 2.3763 2.3763 2.5815 2.5815 3.0443 3.0443 4.1971 4.1971 4.6865 4.6865 5.4109 5.4109 6.4032 6.4032 6.5806 6.5806 6.7052 6.7052 9.3097 9.3097 10.6753 10.6753 11.0278 11.0278 11.0869 11.0869 k = 0.6083-0.0625 0.4355 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -26.9978 -26.9978 -26.9892 -26.9892 -9.8859 -9.8859 -9.8666 -9.8666 -8.8608 -8.8608 -8.8134 -8.8134 -8.6020 -8.6020 -8.5789 -8.5789 2.3777 2.3777 2.5816 2.5816 3.0434 3.0434 4.2011 4.2011 4.6855 4.6855 5.4051 5.4051 6.4059 6.4059 6.5799 6.5799 6.7054 6.7054 9.3122 9.3122 10.6774 10.6774 11.0164 11.0164 11.0919 11.0919 k = 0.6000-0.0577 0.4491 ( 8949 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9977 -26.9977 -26.9893 -26.9893 -9.8857 -9.8857 -9.8668 -9.8668 -8.8603 -8.8603 -8.8141 -8.8141 -8.6016 -8.6016 -8.5791 -8.5791 2.3799 2.3799 2.5819 2.5819 3.0420 3.0420 4.2076 4.2076 4.6836 4.6836 5.3959 5.3959 6.4102 6.4102 6.5786 6.5786 6.7056 6.7056 9.3161 9.3161 10.6810 10.6810 11.0014 11.0014 11.0965 11.0965 k = 0.5917-0.0529 0.4627 ( 8941 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9975 -26.9975 -26.9895 -26.9895 -9.8856 -9.8856 -9.8671 -9.8671 -8.8597 -8.8597 -8.8151 -8.8151 -8.6012 -8.6012 -8.5792 -8.5792 2.3830 2.3830 2.5822 2.5822 3.0402 3.0402 4.2166 4.2166 4.6806 4.6806 5.3837 5.3837 6.4160 6.4160 6.5769 6.5769 6.7059 6.7059 9.3214 9.3214 10.6861 10.6861 10.9848 10.9848 11.0989 11.0989 k = 0.5833-0.0481 0.4763 ( 8949 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9973 -26.9973 -26.9896 -26.9896 -9.8853 -9.8853 -9.8674 -9.8674 -8.8588 -8.8588 -8.8163 -8.8163 -8.6007 -8.6007 -8.5795 -8.5795 2.3868 2.3868 2.5826 2.5826 3.0379 3.0379 4.2282 4.2282 4.6761 4.6761 5.3693 5.3693 6.4230 6.4230 6.5747 6.5747 6.7063 6.7063 9.3276 9.3276 10.6925 10.6925 10.9676 10.9676 11.0984 11.0984 k = 0.5750-0.0433 0.4899 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9971 -26.9971 -26.9899 -26.9899 -9.8851 -9.8851 -9.8679 -9.8679 -8.8578 -8.8578 -8.8177 -8.8177 -8.6000 -8.6000 -8.5798 -8.5798 2.3913 2.3913 2.5831 2.5831 3.0353 3.0353 4.2422 4.2422 4.6698 4.6698 5.3534 5.3534 6.4309 6.4309 6.5720 6.5720 6.7067 6.7067 9.3346 9.3346 10.7002 10.7002 10.9506 10.9506 11.0948 11.0948 k = 0.5667-0.0385 0.5035 ( 8938 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9969 -26.9969 -26.9901 -26.9901 -9.8847 -9.8847 -9.8684 -9.8684 -8.8566 -8.8566 -8.8194 -8.8194 -8.5992 -8.5992 -8.5802 -8.5802 2.3962 2.3962 2.5836 2.5836 3.0325 3.0325 4.2586 4.2586 4.6612 4.6612 5.3370 5.3370 6.4395 6.4395 6.5689 6.5689 6.7071 6.7071 9.3420 9.3420 10.7093 10.7093 10.9343 10.9343 11.0881 11.0881 k = 0.5583-0.0337 0.5171 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9966 -26.9966 -26.9904 -26.9904 -9.8843 -9.8843 -9.8690 -9.8690 -8.8553 -8.8553 -8.8213 -8.8213 -8.5983 -8.5983 -8.5807 -8.5807 2.4013 2.4013 2.5842 2.5842 3.0297 3.0297 4.2773 4.2773 4.6499 4.6499 5.3209 5.3209 6.4485 6.4485 6.5653 6.5653 6.7076 6.7076 9.3494 9.3494 10.7196 10.7196 10.9191 10.9191 11.0786 11.0786 k = 0.5500-0.0289 0.5307 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9962 -26.9962 -26.9907 -26.9907 -9.8839 -9.8839 -9.8696 -9.8696 -8.8538 -8.8538 -8.8233 -8.8233 -8.5973 -8.5973 -8.5813 -8.5813 2.4066 2.4066 2.5848 2.5848 3.0268 3.0268 4.2981 4.2981 4.6357 4.6357 5.3060 5.3060 6.4577 6.4577 6.5613 6.5613 6.7080 6.7080 9.3565 9.3565 10.7311 10.7311 10.9051 10.9051 11.0668 11.0668 k = 0.5417-0.0241 0.5443 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9959 -26.9959 -26.9911 -26.9911 -9.8834 -9.8834 -9.8703 -9.8703 -8.8521 -8.8521 -8.8254 -8.8254 -8.5962 -8.5962 -8.5820 -8.5820 2.4118 2.4118 2.5853 2.5853 3.0242 3.0242 4.3209 4.3209 4.6182 4.6182 5.2929 5.2929 6.4668 6.4668 6.5569 6.5569 6.7084 6.7084 9.3628 9.3628 10.7438 10.7438 10.8922 10.8922 11.0534 11.0534 k = 0.5333-0.0192 0.5579 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9954 -26.9954 -26.9915 -26.9915 -9.8828 -9.8828 -9.8710 -9.8710 -8.8504 -8.8504 -8.8275 -8.8275 -8.5950 -8.5950 -8.5829 -8.5829 2.4166 2.4166 2.5859 2.5859 3.0218 3.0218 4.3453 4.3453 4.5976 4.5976 5.2821 5.2821 6.4755 6.4755 6.5522 6.5522 6.7087 6.7087 9.3683 9.3683 10.7574 10.7574 10.8804 10.8804 11.0394 11.0394 k = 0.5250-0.0144 0.5715 ( 8917 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9950 -26.9950 -26.9919 -26.9919 -9.8822 -9.8822 -9.8718 -9.8718 -8.8486 -8.8486 -8.8297 -8.8297 -8.5937 -8.5937 -8.5838 -8.5838 2.4208 2.4208 2.5863 2.5863 3.0198 3.0198 4.3710 4.3710 4.5744 4.5744 5.2740 5.2740 6.4836 6.4836 6.5475 6.5475 6.7090 6.7090 9.3726 9.3726 10.7720 10.7720 10.8688 10.8688 11.0261 11.0261 k = 0.5167-0.0096 0.5852 ( 8929 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9945 -26.9945 -26.9924 -26.9924 -9.8817 -9.8817 -9.8725 -9.8725 -8.8469 -8.8469 -8.8317 -8.8317 -8.5924 -8.5924 -8.5849 -8.5849 2.4241 2.4241 2.5867 2.5867 3.0183 3.0183 4.3968 4.3968 4.5498 4.5498 5.2684 5.2684 6.4905 6.4905 6.5431 6.5431 6.7092 6.7092 9.3757 9.3757 10.7873 10.7873 10.8569 10.8569 11.0150 11.0150 k = 0.5083-0.0048 0.5988 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9940 -26.9940 -26.9929 -26.9929 -9.8812 -9.8812 -9.8730 -9.8730 -8.8455 -8.8455 -8.8333 -8.8333 -8.5911 -8.5911 -8.5860 -8.5860 2.4263 2.4263 2.5870 2.5870 3.0173 3.0173 4.4199 4.4199 4.5271 4.5271 5.2654 5.2654 6.4955 6.4955 6.5396 6.5396 6.7093 6.7093 9.3775 9.3775 10.8026 10.8026 10.8442 10.8442 11.0074 11.0074 k = 0.5000-0.0000 0.6124 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8811 -9.8811 -9.8732 -9.8732 -8.8450 -8.8450 -8.8339 -8.8339 -8.5905 -8.5905 -8.5866 -8.5866 2.4270 2.4270 2.5871 2.5871 3.0170 3.0170 4.4309 4.4309 4.5161 4.5161 5.2644 5.2644 6.4974 6.4974 6.5382 6.5382 6.7093 6.7093 9.3781 9.3781 10.8122 10.8122 10.8355 10.8355 11.0048 11.0048 k = 0.5000-0.0000 0.6124 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8811 -9.8811 -9.8732 -9.8732 -8.8450 -8.8450 -8.8339 -8.8339 -8.5905 -8.5905 -8.5866 -8.5866 2.4270 2.4270 2.5871 2.5871 3.0170 3.0170 4.4309 4.4309 4.5161 4.5161 5.2644 5.2644 6.4974 6.4974 6.5382 6.5382 6.7093 6.7093 9.3781 9.3781 10.8122 10.8122 10.8355 10.8355 11.0048 11.0048 k = 0.5000 0.0096 0.5988 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8810 -9.8810 -9.8731 -9.8731 -8.8448 -8.8448 -8.8338 -8.8338 -8.5907 -8.5907 -8.5868 -8.5868 2.4256 2.4256 2.5877 2.5877 3.0165 3.0165 4.4305 4.4305 4.5156 4.5156 5.2659 5.2659 6.4974 6.4974 6.5384 6.5384 6.7092 6.7092 9.3795 9.3795 10.8126 10.8126 10.8362 10.8362 11.0064 11.0064 k = 0.5000 0.0192 0.5852 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8808 -9.8808 -9.8729 -9.8729 -8.8444 -8.8444 -8.8334 -8.8334 -8.5912 -8.5912 -8.5874 -8.5874 2.4214 2.4214 2.5893 2.5893 3.0153 3.0153 4.4283 4.4283 4.5154 4.5154 5.2701 5.2701 6.4975 6.4975 6.5388 6.5388 6.7088 6.7088 9.3837 9.3837 10.8128 10.8128 10.8392 10.8392 11.0112 11.0112 k = 0.5000 0.0289 0.5715 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9933 -26.9933 -9.8804 -9.8804 -9.8726 -9.8726 -8.8437 -8.8437 -8.8327 -8.8327 -8.5921 -8.5921 -8.5883 -8.5883 2.4146 2.4146 2.5921 2.5921 3.0131 3.0131 4.4218 4.4218 4.5181 4.5181 5.2767 5.2767 6.4976 6.4976 6.5395 6.5395 6.7083 6.7083 9.3908 9.3908 10.8111 10.8111 10.8464 10.8464 11.0190 11.0190 k = 0.5000 0.0385 0.5579 ( 8918 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9934 -26.9934 -9.8799 -9.8799 -9.8722 -9.8722 -8.8427 -8.8427 -8.8317 -8.8317 -8.5934 -8.5934 -8.5897 -8.5897 2.4051 2.4051 2.5959 2.5959 3.0102 3.0102 4.4086 4.4086 4.5265 4.5265 5.2853 5.2853 6.4978 6.4978 6.5404 6.5404 6.7075 6.7075 9.4008 9.4008 10.8070 10.8070 10.8584 10.8584 11.0298 11.0298 k = 0.5000 0.0481 0.5443 ( 8918 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9934 -26.9934 -9.8792 -9.8792 -9.8716 -9.8716 -8.8414 -8.8414 -8.8305 -8.8305 -8.5951 -8.5951 -8.5914 -8.5914 2.3933 2.3933 2.6008 2.6008 3.0065 3.0065 4.3885 4.3885 4.5412 4.5412 5.2952 5.2952 6.4979 6.4979 6.5417 6.5417 6.7065 6.7065 9.4139 9.4139 10.8011 10.8011 10.8747 10.8747 11.0434 11.0434 k = 0.5000 0.0577 0.5307 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9936 -26.9936 -26.9934 -26.9934 -9.8785 -9.8785 -9.8710 -9.8710 -8.8398 -8.8398 -8.8290 -8.8290 -8.5971 -8.5971 -8.5935 -8.5935 2.3794 2.3794 2.6067 2.6067 3.0020 3.0020 4.3626 4.3626 4.5617 4.5617 5.3058 5.3058 6.4980 6.4980 6.5432 6.5432 6.7054 6.7054 9.4300 9.4300 10.7939 10.7939 10.8950 10.8950 11.0596 11.0596 k = 0.5000 0.0674 0.5171 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9937 -26.9937 -26.9934 -26.9934 -9.8776 -9.8776 -9.8702 -9.8702 -8.8379 -8.8379 -8.8272 -8.8272 -8.5994 -8.5994 -8.5960 -8.5960 2.3635 2.3635 2.6137 2.6137 2.9969 2.9969 4.3323 4.3323 4.5868 4.5868 5.3165 5.3165 6.4979 6.4979 6.5451 6.5451 6.7041 6.7041 9.4493 9.4493 10.7859 10.7859 10.9189 10.9189 11.0783 11.0783 k = 0.5000 0.0770 0.5035 ( 8926 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9937 -26.9937 -26.9934 -26.9934 -9.8766 -9.8766 -9.8693 -9.8693 -8.8358 -8.8358 -8.8251 -8.8251 -8.6021 -8.6021 -8.5988 -8.5988 2.3461 2.3461 2.6216 2.6216 2.9912 2.9912 4.2987 4.2987 4.6159 4.6159 5.3268 5.3268 6.4977 6.4977 6.5472 6.5472 6.7027 6.7027 9.4719 9.4719 10.7774 10.7774 10.9461 10.9461 11.0993 11.0993 k = 0.5000 0.0866 0.4899 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9937 -26.9937 -26.9934 -26.9934 -9.8755 -9.8755 -9.8684 -9.8684 -8.8333 -8.8333 -8.8228 -8.8228 -8.6052 -8.6052 -8.6019 -8.6019 2.3273 2.3273 2.6306 2.6306 2.9850 2.9850 4.2626 4.2626 4.6483 4.6483 5.3365 5.3365 6.4971 6.4971 6.5497 6.5497 6.7013 6.7013 9.4979 9.4979 10.7686 10.7686 10.9764 10.9764 11.1227 11.1227 k = 0.5000 0.0962 0.4763 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9938 -26.9938 -26.9934 -26.9934 -9.8744 -9.8744 -9.8673 -9.8673 -8.8306 -8.8306 -8.8202 -8.8202 -8.6085 -8.6085 -8.6054 -8.6054 2.3075 2.3075 2.6404 2.6404 2.9783 2.9783 4.2246 4.2246 4.6835 4.6835 5.3450 5.3450 6.4962 6.4962 6.5524 6.5524 6.6998 6.6998 9.5273 9.5273 10.7596 10.7596 11.0095 11.0095 11.1483 11.1483 k = 0.5000 0.1058 0.4627 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9938 -26.9938 -26.9934 -26.9934 -9.8732 -9.8732 -9.8662 -9.8662 -8.8277 -8.8277 -8.8174 -8.8174 -8.6122 -8.6122 -8.6092 -8.6092 2.2869 2.2869 2.6511 2.6511 2.9713 2.9713 4.1854 4.1854 4.7210 4.7210 5.3524 5.3524 6.4949 6.4949 6.5553 6.5553 6.6984 6.6984 9.5604 9.5604 10.7507 10.7507 11.0453 11.0453 11.1760 11.1760 k = 0.5000 0.1155 0.4491 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9939 -26.9939 -26.9934 -26.9934 -9.8719 -9.8719 -9.8650 -9.8650 -8.8244 -8.8244 -8.8142 -8.8142 -8.6162 -8.6162 -8.6133 -8.6133 2.2657 2.2657 2.6627 2.6627 2.9640 2.9640 4.1454 4.1454 4.7604 4.7604 5.3584 5.3584 6.4930 6.4930 6.5585 6.5585 6.6970 6.6970 9.5970 9.5970 10.7419 10.7419 11.0834 11.0834 11.2056 11.2056 k = 0.5000 0.1251 0.4355 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9939 -26.9939 -26.9934 -26.9934 -9.8706 -9.8706 -9.8637 -9.8637 -8.8209 -8.8209 -8.8109 -8.8109 -8.6205 -8.6205 -8.6177 -8.6177 2.2444 2.2444 2.6750 2.6750 2.9564 2.9564 4.1050 4.1050 4.8011 4.8011 5.3630 5.3630 6.4905 6.4905 6.5617 6.5617 6.6958 6.6958 9.6372 9.6372 10.7332 10.7332 11.1236 11.1236 11.2371 11.2371 k = 0.5000 0.1347 0.4219 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9940 -26.9940 -26.9934 -26.9934 -9.8694 -9.8694 -9.8624 -9.8624 -8.8172 -8.8172 -8.8072 -8.8072 -8.6250 -8.6250 -8.6224 -8.6224 2.2230 2.2230 2.6880 2.6880 2.9488 2.9488 4.0645 4.0645 4.8429 4.8429 5.3663 5.3663 6.4874 6.4874 6.5650 6.5650 6.6947 6.6947 9.6811 9.6811 10.7249 10.7249 11.1658 11.1658 11.2703 11.2703 k = 0.5000 0.1443 0.4082 ( 8942 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9940 -26.9940 -26.9934 -26.9934 -9.8681 -9.8681 -9.8611 -9.8611 -8.8132 -8.8132 -8.8033 -8.8033 -8.6298 -8.6298 -8.6273 -8.6273 2.2018 2.2018 2.7016 2.7016 2.9411 2.9411 4.0244 4.0244 4.8852 4.8852 5.3683 5.3683 6.4837 6.4837 6.5683 6.5683 6.6937 6.6937 9.7285 9.7285 10.7169 10.7169 11.2095 11.2095 11.3050 11.3050 k = 0.5000 0.1540 0.3946 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9941 -26.9941 -26.9934 -26.9934 -9.8668 -9.8668 -9.8597 -9.8597 -8.8089 -8.8089 -8.7992 -8.7992 -8.6349 -8.6349 -8.6325 -8.6325 2.1811 2.1811 2.7157 2.7157 2.9335 2.9335 3.9849 3.9849 4.9276 4.9276 5.3693 5.3693 6.4792 6.4792 6.5716 6.5716 6.6930 6.6930 9.7795 9.7795 10.7091 10.7091 11.2546 11.2546 11.3412 11.3412 k = 0.5000 0.1636 0.3810 ( 8926 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9941 -26.9941 -26.9934 -26.9934 -9.8656 -9.8656 -9.8584 -9.8584 -8.8045 -8.8045 -8.7948 -8.7948 -8.6402 -8.6402 -8.6379 -8.6379 2.1610 2.1610 2.7302 2.7302 2.9260 2.9260 3.9461 3.9461 4.9696 4.9696 5.3694 5.3694 6.4741 6.4741 6.5746 6.5746 6.6925 6.6925 9.8339 9.8339 10.7018 10.7018 11.3006 11.3006 11.3787 11.3787 k = 0.5000 0.1732 0.3674 ( 8916 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9942 -26.9942 -26.9934 -26.9934 -9.8644 -9.8644 -9.8570 -9.8570 -8.7998 -8.7998 -8.7903 -8.7903 -8.6456 -8.6456 -8.6435 -8.6435 2.1417 2.1417 2.7450 2.7450 2.9188 2.9188 3.9086 3.9086 5.0108 5.0108 5.3688 5.3688 6.4683 6.4683 6.5775 6.5775 6.6922 6.6922 9.8915 9.8915 10.6948 10.6948 11.3472 11.3472 11.4172 11.4172 k = 0.5000 0.1828 0.3538 ( 8918 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9942 -26.9942 -26.9933 -26.9933 -9.8632 -9.8632 -9.8557 -9.8557 -8.7949 -8.7949 -8.7854 -8.7854 -8.6513 -8.6513 -8.6492 -8.6492 2.1234 2.1234 2.7600 2.7600 2.9118 2.9118 3.8724 3.8724 5.0507 5.0507 5.3679 5.3679 6.4620 6.4620 6.5802 6.5802 6.6920 6.6920 9.9524 9.9524 10.6881 10.6881 11.3940 11.3940 11.4565 11.4565 k = 0.5000 0.1925 0.3402 ( 8920 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9943 -26.9943 -26.9933 -26.9933 -9.8621 -9.8621 -9.8544 -9.8544 -8.7898 -8.7898 -8.7804 -8.7804 -8.6571 -8.6571 -8.6552 -8.6552 2.1061 2.1061 2.7749 2.7749 2.9052 2.9052 3.8378 3.8378 5.0888 5.0888 5.3669 5.3669 6.4553 6.4553 6.5826 6.5826 6.6921 6.6921 10.0161 10.0161 10.6818 10.6818 11.4401 11.4401 11.4962 11.4962 k = 0.5000 0.2021 0.3266 ( 8920 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9943 -26.9943 -26.9933 -26.9933 -9.8611 -9.8611 -9.8532 -9.8532 -8.7846 -8.7846 -8.7752 -8.7752 -8.6630 -8.6630 -8.6612 -8.6612 2.0902 2.0902 2.7895 2.7895 2.8990 2.8990 3.8051 3.8051 5.1243 5.1243 5.3662 5.3662 6.4482 6.4482 6.5847 6.5847 6.6922 6.6922 10.0825 10.0825 10.6760 10.6760 11.4841 11.4841 11.5355 11.5355 k = 0.5000 0.2117 0.3130 ( 8926 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8602 -9.8602 -9.8521 -9.8521 -8.7793 -8.7793 -8.7698 -8.7698 -8.6690 -8.6690 -8.6674 -8.6674 2.0756 2.0756 2.8038 2.8038 2.8933 2.8933 3.7747 3.7747 5.1567 5.1567 5.3661 5.3661 6.4409 6.4409 6.5866 6.5866 6.6924 6.6924 10.1514 10.1514 10.6705 10.6705 11.5059 11.5059 11.5504 11.5504 k = 0.5000 0.2213 0.2994 ( 8920 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8593 -9.8593 -9.8511 -9.8511 -8.7738 -8.7738 -8.7642 -8.7642 -8.6751 -8.6751 -8.6737 -8.6737 2.0625 2.0625 2.8173 2.8173 2.8882 2.8882 3.7467 3.7467 5.1854 5.1854 5.3670 5.3670 6.4337 6.4337 6.5882 6.5882 6.6927 6.6927 10.2222 10.2222 10.6656 10.6656 11.4407 11.4407 11.5791 11.5791 k = 0.5000 0.2309 0.2858 ( 8918 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8586 -9.8586 -9.8502 -9.8502 -8.7684 -8.7684 -8.7585 -8.7585 -8.6811 -8.6811 -8.6800 -8.6800 2.0509 2.0509 2.8298 2.8298 2.8837 2.8837 3.7215 3.7215 5.2096 5.2096 5.3693 5.3693 6.4268 6.4268 6.5896 6.5896 6.6931 6.6931 10.2947 10.2947 10.6611 10.6611 11.3611 11.3611 11.6170 11.6170 k = 0.5000 0.2406 0.2722 ( 8910 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8580 -9.8580 -9.8494 -9.8494 -8.7629 -8.7629 -8.7527 -8.7527 -8.6870 -8.6870 -8.6864 -8.6864 2.0410 2.0410 2.8411 2.8411 2.8799 2.8799 3.6995 3.6995 5.2290 5.2290 5.3731 5.3731 6.4203 6.4203 6.5907 6.5907 6.6934 6.6934 10.3680 10.3680 10.6572 10.6572 11.2806 11.2806 11.6522 11.6522 k = 0.5000 0.2502 0.2586 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8574 -9.8574 -9.8487 -9.8487 -8.7576 -8.7576 -8.7467 -8.7467 -8.6928 -8.6928 -8.6927 -8.6927 2.0328 2.0328 2.8508 2.8508 2.8768 2.8768 3.6808 3.6808 5.2434 5.2434 5.3781 5.3781 6.4145 6.4145 6.5916 6.5916 6.6937 6.6937 10.4410 10.4410 10.6539 10.6539 11.2013 11.2013 11.6833 11.6833 k = 0.5000 0.2598 0.2449 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8570 -9.8570 -9.8482 -9.8482 -8.7527 -8.7527 -8.7408 -8.7408 -8.6991 -8.6991 -8.6980 -8.6980 2.0264 2.0264 2.8584 2.8584 2.8746 2.8746 3.6660 3.6660 5.2534 5.2534 5.3836 5.3836 6.4098 6.4098 6.5923 6.5923 6.6939 6.6939 10.5120 10.5120 10.6513 10.6513 11.1253 11.1253 11.7090 11.7090 k = 0.5000 0.2694 0.2313 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8567 -9.8567 -9.8478 -9.8478 -8.7484 -8.7484 -8.7351 -8.7351 -8.7051 -8.7051 -8.7025 -8.7025 2.0218 2.0218 2.8635 2.8635 2.8736 2.8736 3.6551 3.6551 5.2598 5.2598 5.3885 5.3885 6.4062 6.4062 6.5928 6.5928 6.6941 6.6941 10.5769 10.5769 10.6495 10.6495 11.0568 11.0568 11.7284 11.7284 k = 0.5000 0.2791 0.2177 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8476 -9.8476 -8.7453 -8.7453 -8.7301 -8.7301 -8.7103 -8.7103 -8.7057 -8.7057 2.0190 2.0190 2.8658 2.8658 2.8738 2.8738 3.6485 3.6485 5.2633 5.2633 5.3919 5.3919 6.4040 6.4040 6.5931 6.5931 6.6943 6.6943 10.6271 10.6271 10.6486 10.6486 11.0042 11.0042 11.7404 11.7404 k = 0.5000 0.2887 0.2041 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8475 -9.8475 -8.7442 -8.7442 -8.7276 -8.7276 -8.7127 -8.7127 -8.7069 -8.7069 2.0181 2.0181 2.8664 2.8664 2.8742 2.8742 3.6463 3.6463 5.2643 5.2643 5.3931 5.3931 6.4032 6.4032 6.5932 6.5932 6.6943 6.6943 10.6449 10.6449 10.6508 10.6508 10.9830 10.9830 11.7445 11.7445 k = 0.5000 0.2887 0.2041 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8475 -9.8475 -8.7442 -8.7442 -8.7276 -8.7276 -8.7127 -8.7127 -8.7069 -8.7069 2.0181 2.0181 2.8664 2.8664 2.8742 2.8742 3.6463 3.6463 5.2643 5.2643 5.3931 5.3931 6.4032 6.4032 6.5932 6.5932 6.6943 6.6943 10.6449 10.6449 10.6508 10.6508 10.9830 10.9830 11.7445 11.7445 k = 0.4952 0.2859 0.2198 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9946 -26.9946 -26.9933 -26.9933 -9.8565 -9.8565 -9.8476 -9.8476 -8.7453 -8.7453 -8.7300 -8.7300 -8.7103 -8.7103 -8.7057 -8.7057 2.0190 2.0190 2.8658 2.8658 2.8738 2.8738 3.6485 3.6485 5.2633 5.2633 5.3919 5.3919 6.4040 6.4040 6.5931 6.5931 6.6943 6.6943 10.6271 10.6271 10.6486 10.6486 11.0041 11.0041 11.7404 11.7404 k = 0.4904 0.2831 0.2355 ( 8926 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8567 -9.8567 -9.8478 -9.8478 -8.7484 -8.7484 -8.7351 -8.7351 -8.7051 -8.7051 -8.7025 -8.7025 2.0218 2.0218 2.8635 2.8635 2.8736 2.8736 3.6551 3.6551 5.2598 5.2598 5.3885 5.3885 6.4062 6.4062 6.5928 6.5928 6.6941 6.6941 10.5770 10.5770 10.6495 10.6495 11.0567 11.0567 11.7284 11.7284 k = 0.4856 0.2803 0.2512 ( 8921 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8570 -9.8570 -9.8482 -9.8482 -8.7526 -8.7526 -8.7408 -8.7408 -8.6991 -8.6991 -8.6980 -8.6980 2.0264 2.0264 2.8584 2.8584 2.8746 2.8746 3.6659 3.6659 5.2535 5.2535 5.3836 5.3836 6.4098 6.4098 6.5923 6.5923 6.6939 6.6939 10.5121 10.5121 10.6514 10.6514 11.1252 11.1252 11.7091 11.7091 k = 0.4808 0.2776 0.2669 ( 8921 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8574 -9.8574 -9.8487 -9.8487 -8.7576 -8.7576 -8.7467 -8.7467 -8.6930 -8.6930 -8.6925 -8.6925 2.0328 2.0328 2.8508 2.8508 2.8768 2.8768 3.6808 3.6808 5.2434 5.2434 5.3782 5.3782 6.4145 6.4145 6.5916 6.5916 6.6937 6.6937 10.4411 10.4411 10.6541 10.6541 11.2010 11.2010 11.6834 11.6834 k = 0.4760 0.2748 0.2826 ( 8919 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8580 -9.8580 -9.8494 -9.8494 -8.7629 -8.7629 -8.7526 -8.7526 -8.6872 -8.6872 -8.6863 -8.6863 2.0410 2.0410 2.8411 2.8411 2.8799 2.8799 3.6994 3.6994 5.2288 5.2288 5.3733 5.3733 6.4202 6.4202 6.5907 6.5907 6.6934 6.6934 10.3679 10.3679 10.6577 10.6577 11.2801 11.2801 11.6524 11.6524 k = 0.4712 0.2720 0.2983 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9945 -26.9945 -26.9933 -26.9933 -9.8586 -9.8586 -9.8502 -9.8502 -8.7684 -8.7684 -8.7584 -8.7584 -8.6813 -8.6813 -8.6799 -8.6799 2.0509 2.0509 2.8298 2.8298 2.8838 2.8838 3.7214 3.7214 5.2093 5.2093 5.3698 5.3698 6.4267 6.4267 6.5896 6.5896 6.6931 6.6931 10.2943 10.2943 10.6621 10.6621 11.3603 11.3603 11.6172 11.6172 k = 0.4663 0.2692 0.3140 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8593 -9.8593 -9.8511 -9.8511 -8.7740 -8.7740 -8.7640 -8.7640 -8.6753 -8.6753 -8.6735 -8.6735 2.0624 2.0624 2.8172 2.8172 2.8884 2.8884 3.7465 3.7465 5.1846 5.1846 5.3680 5.3680 6.4336 6.4336 6.5883 6.5883 6.6927 6.6927 10.2215 10.2215 10.6673 10.6673 11.4397 11.4397 11.5791 11.5791 k = 0.4615 0.2665 0.3297 ( 8925 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8602 -9.8602 -9.8521 -9.8521 -8.7796 -8.7796 -8.7694 -8.7694 -8.6693 -8.6693 -8.6672 -8.6672 2.0755 2.0755 2.8035 2.8035 2.8937 2.8937 3.7744 3.7744 5.1553 5.1553 5.3680 5.3680 6.4406 6.4406 6.5867 6.5867 6.6924 6.6924 10.1499 10.1499 10.6734 10.6734 11.5069 11.5069 11.5465 11.5465 k = 0.4567 0.2637 0.3454 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2084 -32.2084 -26.9944 -26.9944 -26.9933 -26.9933 -9.8611 -9.8611 -9.8532 -9.8532 -8.7852 -8.7852 -8.7745 -8.7745 -8.6634 -8.6634 -8.6610 -8.6610 2.0900 2.0900 2.7892 2.7892 2.8996 2.8996 3.8048 3.8048 5.1218 5.1218 5.3694 5.3694 6.4476 6.4476 6.5850 6.5850 6.6922 6.6922 10.0801 10.0801 10.6803 10.6803 11.4863 11.4863 11.5329 11.5329 k = 0.4519 0.2609 0.3611 ( 8928 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9944 -26.9944 -26.9933 -26.9933 -9.8621 -9.8621 -9.8544 -9.8544 -8.7907 -8.7907 -8.7794 -8.7794 -8.6574 -8.6574 -8.6550 -8.6550 2.1059 2.1059 2.7743 2.7743 2.9060 2.9060 3.8373 3.8373 5.0849 5.0849 5.3720 5.3720 6.4542 6.4542 6.5831 6.5831 6.6920 6.6920 10.0123 10.0123 10.6881 10.6881 11.4418 11.4418 11.4945 11.4945 k = 0.4471 0.2581 0.3768 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9944 -26.9944 -26.9932 -26.9932 -9.8632 -9.8632 -9.8557 -9.8557 -8.7962 -8.7962 -8.7840 -8.7840 -8.6516 -8.6516 -8.6491 -8.6491 2.1230 2.1230 2.7591 2.7591 2.9130 2.9130 3.8717 3.8717 5.0451 5.0451 5.3755 5.3755 6.4602 6.4602 6.5810 6.5810 6.6919 6.6919 9.9468 9.9468 10.6968 10.6968 11.3951 11.3951 11.4550 11.4550 k = 0.4423 0.2554 0.3925 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9944 -26.9944 -26.9931 -26.9931 -9.8644 -9.8644 -9.8570 -9.8570 -8.8016 -8.8016 -8.7883 -8.7883 -8.6459 -8.6459 -8.6433 -8.6433 2.1412 2.1412 2.7439 2.7439 2.9205 2.9205 3.9076 3.9076 5.0031 5.0031 5.3796 5.3796 6.4654 6.4654 6.5790 6.5790 6.6919 6.6919 9.8838 9.8838 10.7064 10.7064 11.3476 11.3476 11.4161 11.4161 k = 0.4375 0.2526 0.4082 ( 8924 PWs) bands (ev): -62.7469 -62.7469 -35.3718 -35.3718 -32.2088 -32.2088 -32.2085 -32.2085 -26.9945 -26.9945 -26.9930 -26.9930 -9.8656 -9.8656 -9.8583 -9.8583 -8.8069 -8.8069 -8.7922 -8.7922 -8.6404 -8.6404 -8.6378 -8.6378 2.1603 2.1603 2.7286 2.7286 2.9285 2.9285 3.9448 3.9448 4.9594 4.9594 5.3842 5.3842 6.4695 6.4695 6.5770 6.5770 6.6921 6.6921 9.8234 9.8234 10.7169 10.7169 11.2999 11.2999 11.3782 11.3782 k = 0.4327 0.2498 0.4240 ( 8930 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9945 -26.9945 -26.9929 -26.9929 -9.8669 -9.8669 -9.8596 -9.8596 -8.8121 -8.8121 -8.7959 -8.7959 -8.6350 -8.6350 -8.6326 -8.6326 2.1802 2.1802 2.7137 2.7137 2.9368 2.9368 3.9828 3.9828 4.9147 4.9147 5.3890 5.3890 6.4724 6.4724 6.5753 6.5753 6.6925 6.6925 9.7658 9.7658 10.7281 10.7281 11.2525 11.2525 11.3415 11.3415 k = 0.4279 0.2470 0.4397 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9947 -26.9947 -26.9927 -26.9927 -9.8682 -9.8682 -9.8609 -9.8609 -8.8171 -8.8171 -8.7991 -8.7991 -8.6299 -8.6299 -8.6274 -8.6274 2.2005 2.2005 2.6990 2.6990 2.9454 2.9454 4.0213 4.0213 4.8694 4.8694 5.3939 5.3939 6.4737 6.4737 6.5738 6.5738 6.6930 6.6930 9.7109 9.7109 10.7400 10.7400 11.2058 11.2058 11.3063 11.3063 k = 0.4231 0.2443 0.4554 ( 8937 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9948 -26.9948 -26.9925 -26.9925 -9.8696 -9.8696 -9.8621 -9.8621 -8.8220 -8.8220 -8.8021 -8.8021 -8.6251 -8.6251 -8.6224 -8.6224 2.2211 2.2211 2.6848 2.6848 2.9543 2.9543 4.0598 4.0598 4.8244 4.8244 5.3987 5.3987 6.4735 6.4735 6.5728 6.5728 6.6937 6.6937 9.6590 9.6590 10.7524 10.7524 11.1606 11.1606 11.2726 11.2726 k = 0.4183 0.2415 0.4711 ( 8933 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9950 -26.9950 -26.9923 -26.9923 -9.8711 -9.8711 -9.8633 -9.8633 -8.8268 -8.8268 -8.8047 -8.8047 -8.6208 -8.6208 -8.6175 -8.6175 2.2418 2.2418 2.6711 2.6711 2.9635 2.9635 4.0977 4.0977 4.7805 4.7805 5.4033 5.4033 6.4717 6.4717 6.5723 6.5723 6.6945 6.6945 9.6100 9.6100 10.7649 10.7649 11.1173 11.1173 11.2408 11.2408 k = 0.4135 0.2387 0.4868 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9952 -26.9952 -26.9921 -26.9921 -9.8726 -9.8726 -9.8643 -9.8643 -8.8314 -8.8314 -8.8070 -8.8070 -8.6169 -8.6169 -8.6127 -8.6127 2.2622 2.2622 2.6581 2.6581 2.9728 2.9728 4.1340 4.1340 4.7388 4.7388 5.4075 5.4075 6.4683 6.4683 6.5722 6.5722 6.6955 6.6955 9.5641 9.5641 10.7766 10.7766 11.0771 11.0771 11.2108 11.2108 k = 0.4087 0.2359 0.5025 ( 8932 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9954 -26.9954 -26.9918 -26.9918 -9.8741 -9.8741 -9.8653 -9.8653 -8.8358 -8.8358 -8.8089 -8.8089 -8.6134 -8.6134 -8.6080 -8.6080 2.2820 2.2820 2.6458 2.6458 2.9821 2.9821 4.1676 4.1676 4.7007 4.7007 5.4112 5.4112 6.4634 6.4634 6.5726 6.5726 6.6966 6.6966 9.5212 9.5212 10.7864 10.7864 11.0413 11.0413 11.1830 11.1830 k = 0.4038 0.2332 0.5182 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9957 -26.9957 -26.9915 -26.9915 -9.8757 -9.8757 -9.8660 -9.8660 -8.8400 -8.8400 -8.8105 -8.8105 -8.6104 -8.6104 -8.6033 -8.6033 2.3009 2.3009 2.6342 2.6342 2.9915 2.9915 4.1969 4.1969 4.6681 4.6681 5.4143 5.4143 6.4573 6.4573 6.5733 6.5733 6.6977 6.6977 9.4814 9.4814 10.7919 10.7919 11.0126 11.0126 11.1573 11.1573 k = 0.3990 0.2304 0.5339 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9960 -26.9960 -26.9912 -26.9912 -9.8774 -9.8774 -9.8666 -9.8666 -8.8440 -8.8440 -8.8117 -8.8117 -8.6079 -8.6079 -8.5989 -8.5989 2.3185 2.3185 2.6235 2.6235 3.0009 3.0009 4.2195 4.2195 4.6435 4.6435 5.4166 5.4166 6.4500 6.4500 6.5743 6.5743 6.6989 6.6989 9.4447 9.4447 10.7902 10.7902 10.9939 10.9939 11.1340 11.1340 k = 0.3942 0.2276 0.5496 ( 8949 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9963 -26.9963 -26.9908 -26.9908 -9.8790 -9.8790 -9.8670 -9.8670 -8.8479 -8.8479 -8.8126 -8.8126 -8.6058 -8.6058 -8.5945 -8.5945 2.3345 2.3345 2.6136 2.6136 3.0101 3.0101 4.2331 4.2331 4.6295 4.6295 5.4180 5.4180 6.4417 6.4417 6.5754 6.5754 6.7002 6.7002 9.4111 9.4111 10.7790 10.7790 10.9878 10.9878 11.1135 11.1135 k = 0.3894 0.2248 0.5653 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2086 -32.2086 -26.9966 -26.9966 -26.9904 -26.9904 -9.8807 -9.8807 -9.8672 -9.8672 -8.8515 -8.8515 -8.8132 -8.8132 -8.6042 -8.6042 -8.5904 -8.5904 2.3486 2.3486 2.6046 2.6046 3.0192 3.0192 4.2363 4.2363 4.6278 4.6278 5.4185 5.4185 6.4327 6.4327 6.5766 6.5766 6.7015 6.7015 9.3807 9.3807 10.7591 10.7591 10.9932 10.9932 11.0960 11.0960 k = 0.3846 0.2221 0.5810 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9970 -26.9970 -26.9900 -26.9900 -9.8825 -9.8825 -9.8672 -9.8672 -8.8549 -8.8549 -8.8134 -8.8134 -8.6030 -8.6030 -8.5864 -8.5864 2.3603 2.3603 2.5963 2.5963 3.0280 3.0280 4.2295 4.2295 4.6384 4.6384 5.4178 5.4178 6.4230 6.4230 6.5780 6.5780 6.7027 6.7027 9.3535 9.3535 10.7332 10.7332 11.0067 11.0067 11.0826 11.0826 k = 0.3798 0.2193 0.5967 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9974 -26.9974 -26.9896 -26.9896 -9.8842 -9.8842 -9.8669 -9.8669 -8.8582 -8.8582 -8.8133 -8.8133 -8.6024 -8.6024 -8.5825 -8.5825 2.3695 2.3695 2.5886 2.5886 3.0365 3.0365 4.2150 4.2150 4.6590 4.6590 5.4160 5.4160 6.4129 6.4129 6.5794 6.5794 6.7040 6.7040 9.3296 9.3296 10.7044 10.7044 11.0227 11.0227 11.0764 11.0764 k = 0.3750 0.2165 0.6124 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9979 -26.9979 -26.9891 -26.9891 -9.8859 -9.8859 -9.8664 -9.8664 -8.8612 -8.8612 -8.8128 -8.8128 -8.6022 -8.6022 -8.5789 -8.5789 2.3758 2.3758 2.5814 2.5814 3.0446 3.0446 4.1958 4.1958 4.6869 4.6869 5.4129 5.4129 6.4023 6.4023 6.5808 6.5808 6.7052 6.7052 9.3089 9.3089 10.6745 10.6745 11.0323 11.0323 11.0845 11.0845 k = 0.6250-0.0722 0.4082 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2088 -32.2088 -32.2085 -32.2085 -26.9979 -26.9979 -26.9891 -26.9891 -9.8859 -9.8859 -9.8664 -9.8664 -8.8612 -8.8612 -8.8128 -8.8128 -8.6022 -8.6022 -8.5789 -8.5789 2.3758 2.3758 2.5814 2.5814 3.0446 3.0446 4.1958 4.1958 4.6869 4.6869 5.4129 5.4129 6.4023 6.4023 6.5808 6.5808 6.7052 6.7052 9.3089 9.3089 10.6745 10.6745 11.0323 11.0323 11.0845 11.0845 k = 0.6167-0.0866 0.4082 ( 8954 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2086 -32.2086 -26.9986 -26.9986 -26.9884 -26.9884 -9.8889 -9.8889 -9.8653 -9.8653 -8.8660 -8.8660 -8.8118 -8.8118 -8.6023 -8.6023 -8.5728 -8.5728 2.3830 2.3830 2.5697 2.5697 3.0582 3.0582 4.1610 4.1610 4.7407 4.7407 5.4059 5.4059 6.3833 6.3833 6.5833 6.5833 6.7072 6.7072 9.2765 9.2765 10.6241 10.6241 11.0283 11.0283 11.1271 11.1271 k = 0.6083-0.1010 0.4082 ( 8942 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -26.9993 -26.9993 -26.9876 -26.9876 -9.8917 -9.8917 -9.8643 -9.8643 -8.8706 -8.8706 -8.8107 -8.8107 -8.6024 -8.6024 -8.5670 -8.5670 2.3879 2.3879 2.5589 2.5589 3.0715 3.0715 4.1276 4.1276 4.7959 4.7959 5.3981 5.3981 6.3635 6.3635 6.5856 6.5856 6.7091 6.7091 9.2453 9.2453 10.5768 10.5768 11.0176 11.0176 11.1795 11.1795 k = 0.6000-0.1155 0.4082 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0000 -27.0000 -26.9869 -26.9869 -9.8943 -9.8943 -9.8634 -9.8634 -8.8748 -8.8748 -8.8097 -8.8097 -8.6024 -8.6024 -8.5616 -8.5616 2.3909 2.3909 2.5491 2.5491 3.0845 3.0845 4.0960 4.0960 4.8517 4.8517 5.3898 5.3898 6.3428 6.3428 6.5876 6.5876 6.7108 6.7108 9.2154 9.2154 10.5326 10.5326 11.0070 11.0070 11.2346 11.2346 k = 0.5917-0.1299 0.4082 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0007 -27.0007 -26.9863 -26.9863 -9.8967 -9.8967 -9.8626 -9.8626 -8.8787 -8.8787 -8.8087 -8.8087 -8.6024 -8.6024 -8.5565 -8.5565 2.3921 2.3921 2.5404 2.5404 3.0970 3.0970 4.0662 4.0662 4.9076 4.9076 5.3812 5.3812 6.3215 6.3215 6.5894 6.5894 6.7123 6.7123 9.1867 9.1867 10.4917 10.4917 10.9979 10.9979 11.2910 11.2910 k = 0.5833-0.1443 0.4082 ( 8934 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0012 -27.0012 -26.9857 -26.9857 -9.8990 -9.8990 -9.8618 -9.8618 -8.8823 -8.8823 -8.8078 -8.8078 -8.6024 -8.6024 -8.5518 -8.5518 2.3919 2.3919 2.5327 2.5327 3.1089 3.1089 4.0385 4.0385 4.9631 4.9631 5.3725 5.3725 6.2997 6.2997 6.5910 6.5910 6.7136 6.7136 9.1594 9.1594 10.4540 10.4540 10.9906 10.9906 11.3478 11.3478 k = 0.5750-0.1588 0.4082 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0018 -27.0018 -26.9851 -26.9851 -9.9010 -9.9010 -9.8611 -9.8611 -8.8855 -8.8855 -8.8069 -8.8069 -8.6024 -8.6024 -8.5475 -8.5475 2.3906 2.3906 2.5261 2.5261 3.1201 3.1201 4.0131 4.0131 5.0174 5.0174 5.3639 5.3639 6.2775 6.2775 6.5924 6.5924 6.7147 6.7147 9.1337 9.1337 10.4197 10.4197 10.9852 10.9852 11.4042 11.4042 k = 0.5667-0.1732 0.4082 ( 8944 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0023 -27.0023 -26.9847 -26.9847 -9.9028 -9.9028 -9.8605 -9.8605 -8.8885 -8.8885 -8.8061 -8.8061 -8.6024 -8.6024 -8.5436 -8.5436 2.3884 2.3884 2.5205 2.5205 3.1304 3.1304 3.9899 3.9899 5.0697 5.0697 5.3557 5.3557 6.2552 6.2552 6.5936 6.5936 6.7157 6.7157 9.1097 9.1097 10.3889 10.3889 10.9816 10.9816 11.4594 11.4594 k = 0.5583-0.1876 0.4082 ( 8936 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0027 -27.0027 -26.9842 -26.9842 -9.9044 -9.9044 -9.8600 -9.8600 -8.8910 -8.8910 -8.8054 -8.8054 -8.6024 -8.6024 -8.5402 -8.5402 2.3857 2.3857 2.5158 2.5158 3.1399 3.1399 3.9693 3.9693 5.1194 5.1194 5.3480 5.3480 6.2332 6.2332 6.5946 6.5946 6.7165 6.7165 9.0877 9.0877 10.3615 10.3615 10.9799 10.9799 11.5125 11.5125 k = 0.5500-0.2021 0.4082 ( 8940 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0030 -27.0030 -26.9838 -26.9838 -9.9058 -9.9058 -9.8596 -9.8596 -8.8932 -8.8932 -8.8048 -8.8048 -8.6024 -8.6024 -8.5371 -8.5371 2.3827 2.3827 2.5119 2.5119 3.1483 3.1483 3.9512 3.9512 5.1655 5.1655 5.3412 5.3412 6.2119 6.2119 6.5954 6.5954 6.7171 6.7171 9.0680 9.0680 10.3376 10.3376 10.9795 10.9795 11.5625 11.5625 k = 0.5417-0.2165 0.4082 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2089 -32.2089 -32.2085 -32.2085 -27.0034 -27.0034 -26.9835 -26.9835 -9.9070 -9.9070 -9.8592 -9.8592 -8.8951 -8.8951 -8.8042 -8.8042 -8.6023 -8.6023 -8.5346 -8.5346 2.3798 2.3798 2.5087 2.5087 3.1556 3.1556 3.9357 3.9357 5.2069 5.2069 5.3354 5.3354 6.1919 6.1919 6.5961 6.5961 6.7177 6.7177 9.0507 9.0507 10.3174 10.3174 10.9803 10.9803 11.6079 11.6079 k = 0.5333-0.2309 0.4082 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0036 -27.0036 -26.9833 -26.9833 -9.9080 -9.9080 -9.8589 -9.8589 -8.8967 -8.8967 -8.8038 -8.8038 -8.6023 -8.6023 -8.5324 -8.5324 2.3771 2.3771 2.5062 2.5062 3.1617 3.1617 3.9230 3.9230 5.2423 5.2423 5.3310 5.3310 6.1738 6.1738 6.5967 6.5967 6.7181 6.7181 9.0361 9.0361 10.3007 10.3007 10.9819 10.9819 11.6472 11.6472 k = 0.5250-0.2454 0.4082 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0038 -27.0038 -26.9831 -26.9831 -9.9087 -9.9087 -9.8586 -9.8586 -8.8979 -8.8979 -8.8034 -8.8034 -8.6023 -8.6023 -8.5308 -8.5308 2.3748 2.3748 2.5043 2.5043 3.1665 3.1665 3.9130 3.9130 5.2702 5.2702 5.3287 5.3287 6.1585 6.1585 6.5971 6.5971 6.7184 6.7184 9.0246 9.0246 10.2878 10.2878 10.9836 10.9836 11.6783 11.6783 k = 0.5167-0.2598 0.4082 ( 8948 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0040 -27.0040 -26.9829 -26.9829 -9.9093 -9.9093 -9.8585 -9.8585 -8.8987 -8.8987 -8.8032 -8.8032 -8.6023 -8.6023 -8.5296 -8.5296 2.3731 2.3731 2.5030 2.5030 3.1700 3.1700 3.9058 3.9058 5.2888 5.2888 5.3293 5.3293 6.1468 6.1468 6.5974 6.5974 6.7187 6.7187 9.0162 9.0162 10.2785 10.2785 10.9853 10.9853 11.6982 11.6982 k = 0.5083-0.2742 0.4082 ( 8964 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0041 -27.0041 -26.9828 -26.9828 -9.9096 -9.9096 -9.8584 -9.8584 -8.8993 -8.8993 -8.8030 -8.8030 -8.6023 -8.6023 -8.5288 -8.5288 2.3720 2.3720 2.5022 2.5022 3.1721 3.1721 3.9015 3.9015 5.2977 5.2977 5.3323 5.3323 6.1394 6.1394 6.5975 6.5975 6.7188 6.7188 9.0111 9.0111 10.2729 10.2729 10.9864 10.9864 11.7058 11.7058 k = 0.5000-0.2887 0.4082 ( 8952 PWs) bands (ev): -62.7469 -62.7469 -35.3719 -35.3719 -32.2090 -32.2090 -32.2085 -32.2085 -27.0041 -27.0041 -26.9828 -26.9828 -9.9097 -9.9097 -9.8583 -9.8583 -8.8994 -8.8994 -8.8029 -8.8029 -8.6023 -8.6023 -8.5286 -8.5286 2.3717 2.3717 2.5020 2.5020 3.1728 3.1728 3.9001 3.9001 5.3000 5.3000 5.3340 5.3340 6.1369 6.1369 6.5976 6.5976 6.7188 6.7188 9.0093 9.0093 10.2710 10.2710 10.9868 10.9868 11.7069 11.7069 Writing output data file Sr2H6Ru.save init_run : 0.20s CPU 0.30s WALL ( 1 calls) electrons : 212.00s CPU 214.58s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 211.99s CPU 214.57s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.05s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.10s WALL ( 280 calls) cegterg : 192.97s CPU 194.90s WALL ( 433 calls) Called by sum_band: Called by *egterg: h_psi : 127.74s CPU 129.35s WALL ( 7745 calls) s_psi : 4.01s CPU 3.93s WALL ( 7745 calls) g_psi : 0.42s CPU 0.40s WALL ( 7032 calls) cdiaghg : 49.06s CPU 49.97s WALL ( 7312 calls) cegterg:over : 8.89s CPU 9.07s WALL ( 7032 calls) cegterg:upda : 9.86s CPU 9.61s WALL ( 7032 calls) cegterg:last : 4.34s CPU 4.23s WALL ( 993 calls) cdiaghg:chol : 2.96s CPU 2.86s WALL ( 7312 calls) cdiaghg:inve : 1.66s CPU 1.86s WALL ( 7312 calls) cdiaghg:para : 3.05s CPU 2.86s WALL ( 14624 calls) Called by h_psi: h_psi:vloc : 116.58s CPU 118.01s WALL ( 7745 calls) h_psi:vnl : 10.80s CPU 10.92s WALL ( 7745 calls) add_vuspsi : 4.96s CPU 5.23s WALL ( 7745 calls) General routines calbec : 5.82s CPU 5.67s WALL ( 7745 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 110.47s CPU 111.87s WALL ( 640420 calls) davcio : 0.27s CPU 0.32s WALL ( 560 calls) Parallel routines fft_scatter : 34.73s CPU 35.16s WALL ( 640435 calls) PWSCF : 3m53.15s CPU 4m 5.68s WALL This run was terminated on: 19:20:51 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=