Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:43:24 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: ./CrC.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 18 18 5 305 296 49 Max 19 19 6 309 302 52 Sum 649 649 199 11017 10777 1807 bravais-lattice index = 14 lattice parameter (alat) = 5.3850 a.u. unit-cell volume = 110.4210 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 18.00 number of Kohn-Sham states= 26 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.385039 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 Cr read from file: /users/gautes/Pseudo/Cr.rel-pbe-oncvpsp.UPF MD5 check sum: 05b5af6f30ea3763d55f309fcccb1da3 Pseudo is Norm-conserving, Zval = 14.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1638 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. # 2 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Cr 14.00 51.99610 Cr( 1.00) C 4.00 12.01070 C( 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= 514 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019455 k( 2) = ( 0.0064103 -0.0037010 0.0052340), wk = 0.0019455 k( 3) = ( 0.0128205 -0.0074019 0.0104679), wk = 0.0019455 k( 4) = ( 0.0192308 -0.0111029 0.0157019), wk = 0.0019455 k( 5) = ( 0.0256410 -0.0148039 0.0209358), wk = 0.0019455 k( 6) = ( 0.0320513 -0.0185048 0.0261698), wk = 0.0019455 k( 7) = ( 0.0384615 -0.0222058 0.0314037), wk = 0.0019455 k( 8) = ( 0.0448718 -0.0259067 0.0366377), wk = 0.0019455 k( 9) = ( 0.0512821 -0.0296077 0.0418716), wk = 0.0019455 k( 10) = ( 0.0576923 -0.0333087 0.0471056), wk = 0.0019455 k( 11) = ( 0.0641026 -0.0370096 0.0523395), wk = 0.0019455 k( 12) = ( 0.0705128 -0.0407106 0.0575735), wk = 0.0019455 k( 13) = ( 0.0769231 -0.0444116 0.0628074), wk = 0.0019455 k( 14) = ( 0.0833333 -0.0481125 0.0680414), wk = 0.0019455 k( 15) = ( 0.0897436 -0.0518135 0.0732753), wk = 0.0019455 k( 16) = ( 0.0961538 -0.0555145 0.0785093), wk = 0.0019455 k( 17) = ( 0.1025641 -0.0592154 0.0837432), wk = 0.0019455 k( 18) = ( 0.1089744 -0.0629164 0.0889772), wk = 0.0019455 k( 19) = ( 0.1153846 -0.0666173 0.0942111), wk = 0.0019455 k( 20) = ( 0.1217949 -0.0703183 0.0994451), wk = 0.0019455 k( 21) = ( 0.1282051 -0.0740193 0.1046791), wk = 0.0019455 k( 22) = ( 0.1346154 -0.0777202 0.1099130), wk = 0.0019455 k( 23) = ( 0.1410256 -0.0814212 0.1151470), wk = 0.0019455 k( 24) = ( 0.1474359 -0.0851222 0.1203809), wk = 0.0019455 k( 25) = ( 0.1538461 -0.0888231 0.1256149), wk = 0.0019455 k( 26) = ( 0.1602564 -0.0925241 0.1308488), wk = 0.0019455 k( 27) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0019455 k( 28) = ( 0.1730769 -0.0999260 0.1413167), wk = 0.0019455 k( 29) = ( 0.1794872 -0.1036270 0.1465507), wk = 0.0019455 k( 30) = ( 0.1858974 -0.1073279 0.1517846), wk = 0.0019455 k( 31) = ( 0.1923077 -0.1110289 0.1570186), wk = 0.0019455 k( 32) = ( 0.1987180 -0.1147299 0.1622525), wk = 0.0019455 k( 33) = ( 0.2051282 -0.1184308 0.1674865), wk = 0.0019455 k( 34) = ( 0.2115385 -0.1221318 0.1727204), wk = 0.0019455 k( 35) = ( 0.2179487 -0.1258328 0.1779544), wk = 0.0019455 k( 36) = ( 0.2243590 -0.1295337 0.1831883), wk = 0.0019455 k( 37) = ( 0.2307692 -0.1332347 0.1884223), wk = 0.0019455 k( 38) = ( 0.2371795 -0.1369356 0.1936562), wk = 0.0019455 k( 39) = ( 0.2435897 -0.1406366 0.1988902), wk = 0.0019455 k( 40) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0019455 k( 41) = ( 0.2564103 -0.1480385 0.2093581), wk = 0.0019455 k( 42) = ( 0.2628205 -0.1517395 0.2145920), wk = 0.0019455 k( 43) = ( 0.2692308 -0.1554405 0.2198260), wk = 0.0019455 k( 44) = ( 0.2756410 -0.1591414 0.2250600), wk = 0.0019455 k( 45) = ( 0.2820513 -0.1628424 0.2302939), wk = 0.0019455 k( 46) = ( 0.2884615 -0.1665433 0.2355279), wk = 0.0019455 k( 47) = ( 0.2948718 -0.1702443 0.2407618), wk = 0.0019455 k( 48) = ( 0.3012821 -0.1739453 0.2459958), wk = 0.0019455 k( 49) = ( 0.3076923 -0.1776462 0.2512297), wk = 0.0019455 k( 50) = ( 0.3141026 -0.1813472 0.2564637), wk = 0.0019455 k( 51) = ( 0.3205128 -0.1850482 0.2616976), wk = 0.0019455 k( 52) = ( 0.3269231 -0.1887491 0.2669316), wk = 0.0019455 k( 53) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0019455 k( 54) = ( 0.3397436 -0.1961511 0.2773995), wk = 0.0019455 k( 55) = ( 0.3461538 -0.1998520 0.2826334), wk = 0.0019455 k( 56) = ( 0.3525641 -0.2035530 0.2878674), wk = 0.0019455 k( 57) = ( 0.3589744 -0.2072539 0.2931013), wk = 0.0019455 k( 58) = ( 0.3653846 -0.2109549 0.2983353), wk = 0.0019455 k( 59) = ( 0.3717949 -0.2146559 0.3035692), wk = 0.0019455 k( 60) = ( 0.3782051 -0.2183568 0.3088032), wk = 0.0019455 k( 61) = ( 0.3846154 -0.2220578 0.3140371), wk = 0.0019455 k( 62) = ( 0.3910256 -0.2257588 0.3192711), wk = 0.0019455 k( 63) = ( 0.3974359 -0.2294597 0.3245051), wk = 0.0019455 k( 64) = ( 0.4038462 -0.2331607 0.3297390), wk = 0.0019455 k( 65) = ( 0.4102564 -0.2368616 0.3349730), wk = 0.0019455 k( 66) = ( 0.4166667 -0.2405626 0.3402069), wk = 0.0019455 k( 67) = ( 0.4230769 -0.2442636 0.3454409), wk = 0.0019455 k( 68) = ( 0.4294872 -0.2479645 0.3506748), wk = 0.0019455 k( 69) = ( 0.4358974 -0.2516655 0.3559088), wk = 0.0019455 k( 70) = ( 0.4423077 -0.2553665 0.3611427), wk = 0.0019455 k( 71) = ( 0.4487179 -0.2590674 0.3663767), wk = 0.0019455 k( 72) = ( 0.4551282 -0.2627684 0.3716106), wk = 0.0019455 k( 73) = ( 0.4615385 -0.2664694 0.3768446), wk = 0.0019455 k( 74) = ( 0.4679487 -0.2701703 0.3820785), wk = 0.0019455 k( 75) = ( 0.4743590 -0.2738713 0.3873125), wk = 0.0019455 k( 76) = ( 0.4807692 -0.2775722 0.3925464), wk = 0.0019455 k( 77) = ( 0.4871795 -0.2812732 0.3977804), wk = 0.0019455 k( 78) = ( 0.4935897 -0.2849742 0.4030143), wk = 0.0019455 k( 79) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0019455 k( 80) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0019455 k( 81) = ( 0.5000000 -0.2812732 0.4134822), wk = 0.0019455 k( 82) = ( 0.5000000 -0.2738713 0.4187162), wk = 0.0019455 k( 83) = ( 0.5000000 -0.2664694 0.4239501), wk = 0.0019455 k( 84) = ( 0.5000000 -0.2590674 0.4291841), wk = 0.0019455 k( 85) = ( 0.5000000 -0.2516655 0.4344181), wk = 0.0019455 k( 86) = ( 0.5000000 -0.2442636 0.4396520), wk = 0.0019455 k( 87) = ( 0.5000000 -0.2368617 0.4448860), wk = 0.0019455 k( 88) = ( 0.5000000 -0.2294597 0.4501199), wk = 0.0019455 k( 89) = ( 0.5000000 -0.2220578 0.4553539), wk = 0.0019455 k( 90) = ( 0.5000000 -0.2146559 0.4605878), wk = 0.0019455 k( 91) = ( 0.5000000 -0.2072539 0.4658218), wk = 0.0019455 k( 92) = ( 0.5000000 -0.1998520 0.4710557), wk = 0.0019455 k( 93) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0019455 k( 94) = ( 0.5000000 -0.1850482 0.4815236), wk = 0.0019455 k( 95) = ( 0.5000000 -0.1776462 0.4867576), wk = 0.0019455 k( 96) = ( 0.5000000 -0.1702443 0.4919915), wk = 0.0019455 k( 97) = ( 0.5000000 -0.1628424 0.4972255), wk = 0.0019455 k( 98) = ( 0.5000000 -0.1554405 0.5024594), wk = 0.0019455 k( 99) = ( 0.5000000 -0.1480385 0.5076934), wk = 0.0019455 k( 100) = ( 0.5000000 -0.1406366 0.5129273), wk = 0.0019455 k( 101) = ( 0.5000000 -0.1332347 0.5181613), wk = 0.0019455 k( 102) = ( 0.5000000 -0.1258328 0.5233952), wk = 0.0019455 k( 103) = ( 0.5000000 -0.1184308 0.5286292), wk = 0.0019455 k( 104) = ( 0.5000000 -0.1110289 0.5338631), wk = 0.0019455 k( 105) = ( 0.5000000 -0.1036270 0.5390971), wk = 0.0019455 k( 106) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0019455 k( 107) = ( 0.5000000 -0.0888231 0.5495650), wk = 0.0019455 k( 108) = ( 0.5000000 -0.0814212 0.5547990), wk = 0.0019455 k( 109) = ( 0.5000000 -0.0740193 0.5600329), wk = 0.0019455 k( 110) = ( 0.5000000 -0.0666173 0.5652669), wk = 0.0019455 k( 111) = ( 0.5000000 -0.0592154 0.5705008), wk = 0.0019455 k( 112) = ( 0.5000000 -0.0518135 0.5757348), wk = 0.0019455 k( 113) = ( 0.5000000 -0.0444116 0.5809687), wk = 0.0019455 k( 114) = ( 0.5000000 -0.0370096 0.5862027), wk = 0.0019455 k( 115) = ( 0.5000000 -0.0296077 0.5914366), wk = 0.0019455 k( 116) = ( 0.5000000 -0.0222058 0.5966706), wk = 0.0019455 k( 117) = ( 0.5000000 -0.0148038 0.6019045), wk = 0.0019455 k( 118) = ( 0.5000000 -0.0074019 0.6071385), wk = 0.0019455 k( 119) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0019455 k( 120) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0019455 k( 121) = ( 0.4955357 0.0077324 0.6123724), wk = 0.0019455 k( 122) = ( 0.4910714 0.0154647 0.6123724), wk = 0.0019455 k( 123) = ( 0.4866071 0.0231971 0.6123724), wk = 0.0019455 k( 124) = ( 0.4821429 0.0309295 0.6123724), wk = 0.0019455 k( 125) = ( 0.4776786 0.0386619 0.6123724), wk = 0.0019455 k( 126) = ( 0.4732143 0.0463942 0.6123724), wk = 0.0019455 k( 127) = ( 0.4687500 0.0541266 0.6123724), wk = 0.0019455 k( 128) = ( 0.4642857 0.0618590 0.6123724), wk = 0.0019455 k( 129) = ( 0.4598214 0.0695913 0.6123724), wk = 0.0019455 k( 130) = ( 0.4553571 0.0773237 0.6123724), wk = 0.0019455 k( 131) = ( 0.4508929 0.0850561 0.6123724), wk = 0.0019455 k( 132) = ( 0.4464286 0.0927884 0.6123724), wk = 0.0019455 k( 133) = ( 0.4419643 0.1005208 0.6123724), wk = 0.0019455 k( 134) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0019455 k( 135) = ( 0.4330357 0.1159856 0.6123724), wk = 0.0019455 k( 136) = ( 0.4285714 0.1237179 0.6123724), wk = 0.0019455 k( 137) = ( 0.4241071 0.1314503 0.6123724), wk = 0.0019455 k( 138) = ( 0.4196429 0.1391826 0.6123724), wk = 0.0019455 k( 139) = ( 0.4151786 0.1469150 0.6123724), wk = 0.0019455 k( 140) = ( 0.4107143 0.1546474 0.6123724), wk = 0.0019455 k( 141) = ( 0.4062500 0.1623798 0.6123724), wk = 0.0019455 k( 142) = ( 0.4017857 0.1701121 0.6123724), wk = 0.0019455 k( 143) = ( 0.3973214 0.1778445 0.6123724), wk = 0.0019455 k( 144) = ( 0.3928571 0.1855769 0.6123724), wk = 0.0019455 k( 145) = ( 0.3883929 0.1933092 0.6123724), wk = 0.0019455 k( 146) = ( 0.3839286 0.2010416 0.6123724), wk = 0.0019455 k( 147) = ( 0.3794643 0.2087740 0.6123724), wk = 0.0019455 k( 148) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0019455 k( 149) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0019455 k( 150) = ( 0.3704819 0.2138978 0.6049945), wk = 0.0019455 k( 151) = ( 0.3659639 0.2112893 0.5976165), wk = 0.0019455 k( 152) = ( 0.3614458 0.2086808 0.5902385), wk = 0.0019455 k( 153) = ( 0.3569277 0.2060723 0.5828605), wk = 0.0019455 k( 154) = ( 0.3524096 0.2034638 0.5754825), wk = 0.0019455 k( 155) = ( 0.3478916 0.2008553 0.5681045), wk = 0.0019455 k( 156) = ( 0.3433735 0.1982468 0.5607266), wk = 0.0019455 k( 157) = ( 0.3388554 0.1956383 0.5533486), wk = 0.0019455 k( 158) = ( 0.3343373 0.1930298 0.5459706), wk = 0.0019455 k( 159) = ( 0.3298193 0.1904213 0.5385926), wk = 0.0019455 k( 160) = ( 0.3253012 0.1878127 0.5312146), wk = 0.0019455 k( 161) = ( 0.3207831 0.1852042 0.5238367), wk = 0.0019455 k( 162) = ( 0.3162651 0.1825957 0.5164587), wk = 0.0019455 k( 163) = ( 0.3117470 0.1799872 0.5090807), wk = 0.0019455 k( 164) = ( 0.3072289 0.1773787 0.5017027), wk = 0.0019455 k( 165) = ( 0.3027108 0.1747702 0.4943247), wk = 0.0019455 k( 166) = ( 0.2981928 0.1721617 0.4869468), wk = 0.0019455 k( 167) = ( 0.2936747 0.1695532 0.4795688), wk = 0.0019455 k( 168) = ( 0.2891566 0.1669447 0.4721908), wk = 0.0019455 k( 169) = ( 0.2846385 0.1643361 0.4648128), wk = 0.0019455 k( 170) = ( 0.2801205 0.1617276 0.4574348), wk = 0.0019455 k( 171) = ( 0.2756024 0.1591191 0.4500569), wk = 0.0019455 k( 172) = ( 0.2710843 0.1565106 0.4426789), wk = 0.0019455 k( 173) = ( 0.2665663 0.1539021 0.4353009), wk = 0.0019455 k( 174) = ( 0.2620482 0.1512936 0.4279229), wk = 0.0019455 k( 175) = ( 0.2575301 0.1486851 0.4205449), wk = 0.0019455 k( 176) = ( 0.2530120 0.1460766 0.4131669), wk = 0.0019455 k( 177) = ( 0.2484940 0.1434681 0.4057890), wk = 0.0019455 k( 178) = ( 0.2439759 0.1408596 0.3984110), wk = 0.0019455 k( 179) = ( 0.2394578 0.1382510 0.3910330), wk = 0.0019455 k( 180) = ( 0.2349398 0.1356425 0.3836550), wk = 0.0019455 k( 181) = ( 0.2304217 0.1330340 0.3762770), wk = 0.0019455 k( 182) = ( 0.2259036 0.1304255 0.3688991), wk = 0.0019455 k( 183) = ( 0.2213855 0.1278170 0.3615211), wk = 0.0019455 k( 184) = ( 0.2168675 0.1252085 0.3541431), wk = 0.0019455 k( 185) = ( 0.2123494 0.1226000 0.3467651), wk = 0.0019455 k( 186) = ( 0.2078313 0.1199915 0.3393871), wk = 0.0019455 k( 187) = ( 0.2033133 0.1173830 0.3320092), wk = 0.0019455 k( 188) = ( 0.1987952 0.1147745 0.3246312), wk = 0.0019455 k( 189) = ( 0.1942771 0.1121659 0.3172532), wk = 0.0019455 k( 190) = ( 0.1897590 0.1095574 0.3098752), wk = 0.0019455 k( 191) = ( 0.1852410 0.1069489 0.3024972), wk = 0.0019455 k( 192) = ( 0.1807229 0.1043404 0.2951192), wk = 0.0019455 k( 193) = ( 0.1762048 0.1017319 0.2877413), wk = 0.0019455 k( 194) = ( 0.1716867 0.0991234 0.2803633), wk = 0.0019455 k( 195) = ( 0.1671687 0.0965149 0.2729853), wk = 0.0019455 k( 196) = ( 0.1626506 0.0939064 0.2656073), wk = 0.0019455 k( 197) = ( 0.1581325 0.0912979 0.2582293), wk = 0.0019455 k( 198) = ( 0.1536145 0.0886893 0.2508514), wk = 0.0019455 k( 199) = ( 0.1490964 0.0860808 0.2434734), wk = 0.0019455 k( 200) = ( 0.1445783 0.0834723 0.2360954), wk = 0.0019455 k( 201) = ( 0.1400602 0.0808638 0.2287174), wk = 0.0019455 k( 202) = ( 0.1355422 0.0782553 0.2213394), wk = 0.0019455 k( 203) = ( 0.1310241 0.0756468 0.2139614), wk = 0.0019455 k( 204) = ( 0.1265060 0.0730383 0.2065835), wk = 0.0019455 k( 205) = ( 0.1219879 0.0704298 0.1992055), wk = 0.0019455 k( 206) = ( 0.1174699 0.0678213 0.1918275), wk = 0.0019455 k( 207) = ( 0.1129518 0.0652128 0.1844495), wk = 0.0019455 k( 208) = ( 0.1084337 0.0626042 0.1770716), wk = 0.0019455 k( 209) = ( 0.1039157 0.0599957 0.1696936), wk = 0.0019455 k( 210) = ( 0.0993976 0.0573872 0.1623156), wk = 0.0019455 k( 211) = ( 0.0948795 0.0547787 0.1549376), wk = 0.0019455 k( 212) = ( 0.0903614 0.0521702 0.1475596), wk = 0.0019455 k( 213) = ( 0.0858434 0.0495617 0.1401816), wk = 0.0019455 k( 214) = ( 0.0813253 0.0469532 0.1328037), wk = 0.0019455 k( 215) = ( 0.0768072 0.0443447 0.1254257), wk = 0.0019455 k( 216) = ( 0.0722892 0.0417362 0.1180477), wk = 0.0019455 k( 217) = ( 0.0677711 0.0391277 0.1106697), wk = 0.0019455 k( 218) = ( 0.0632530 0.0365191 0.1032917), wk = 0.0019455 k( 219) = ( 0.0587349 0.0339106 0.0959138), wk = 0.0019455 k( 220) = ( 0.0542169 0.0313021 0.0885358), wk = 0.0019455 k( 221) = ( 0.0496988 0.0286936 0.0811578), wk = 0.0019455 k( 222) = ( 0.0451807 0.0260851 0.0737798), wk = 0.0019455 k( 223) = ( 0.0406627 0.0234766 0.0664018), wk = 0.0019455 k( 224) = ( 0.0361446 0.0208681 0.0590239), wk = 0.0019455 k( 225) = ( 0.0316265 0.0182596 0.0516459), wk = 0.0019455 k( 226) = ( 0.0271084 0.0156511 0.0442679), wk = 0.0019455 k( 227) = ( 0.0225904 0.0130426 0.0368899), wk = 0.0019455 k( 228) = ( 0.0180723 0.0104340 0.0295119), wk = 0.0019455 k( 229) = ( 0.0135542 0.0078255 0.0221339), wk = 0.0019455 k( 230) = ( 0.0090361 0.0052170 0.0147560), wk = 0.0019455 k( 231) = ( 0.0045181 0.0026085 0.0073780), wk = 0.0019455 k( 232) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019455 k( 233) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019455 k( 234) = ( 0.0073529 0.0042452 0.0030018), wk = 0.0019455 k( 235) = ( 0.0147059 0.0084904 0.0060037), wk = 0.0019455 k( 236) = ( 0.0220588 0.0127357 0.0090055), wk = 0.0019455 k( 237) = ( 0.0294118 0.0169809 0.0120073), wk = 0.0019455 k( 238) = ( 0.0367647 0.0212261 0.0150091), wk = 0.0019455 k( 239) = ( 0.0441177 0.0254713 0.0180110), wk = 0.0019455 k( 240) = ( 0.0514706 0.0297166 0.0210128), wk = 0.0019455 k( 241) = ( 0.0588235 0.0339618 0.0240146), wk = 0.0019455 k( 242) = ( 0.0661765 0.0382070 0.0270164), wk = 0.0019455 k( 243) = ( 0.0735294 0.0424522 0.0300183), wk = 0.0019455 k( 244) = ( 0.0808824 0.0466974 0.0330201), wk = 0.0019455 k( 245) = ( 0.0882353 0.0509427 0.0360219), wk = 0.0019455 k( 246) = ( 0.0955882 0.0551879 0.0390237), wk = 0.0019455 k( 247) = ( 0.1029412 0.0594331 0.0420256), wk = 0.0019455 k( 248) = ( 0.1102941 0.0636783 0.0450274), wk = 0.0019455 k( 249) = ( 0.1176471 0.0679236 0.0480292), wk = 0.0019455 k( 250) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0019455 k( 251) = ( 0.1323529 0.0764140 0.0540329), wk = 0.0019455 k( 252) = ( 0.1397059 0.0806592 0.0570347), wk = 0.0019455 k( 253) = ( 0.1470588 0.0849044 0.0600365), wk = 0.0019455 k( 254) = ( 0.1544118 0.0891497 0.0630383), wk = 0.0019455 k( 255) = ( 0.1617647 0.0933949 0.0660402), wk = 0.0019455 k( 256) = ( 0.1691177 0.0976401 0.0690420), wk = 0.0019455 k( 257) = ( 0.1764706 0.1018853 0.0720438), wk = 0.0019455 k( 258) = ( 0.1838235 0.1061306 0.0750456), wk = 0.0019455 k( 259) = ( 0.1911765 0.1103758 0.0780475), wk = 0.0019455 k( 260) = ( 0.1985294 0.1146210 0.0810493), wk = 0.0019455 k( 261) = ( 0.2058823 0.1188662 0.0840511), wk = 0.0019455 k( 262) = ( 0.2132353 0.1231115 0.0870529), wk = 0.0019455 k( 263) = ( 0.2205882 0.1273567 0.0900548), wk = 0.0019455 k( 264) = ( 0.2279412 0.1316019 0.0930566), wk = 0.0019455 k( 265) = ( 0.2352941 0.1358471 0.0960584), wk = 0.0019455 k( 266) = ( 0.2426471 0.1400923 0.0990602), wk = 0.0019455 k( 267) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0019455 k( 268) = ( 0.2573529 0.1485828 0.1050639), wk = 0.0019455 k( 269) = ( 0.2647059 0.1528280 0.1080657), wk = 0.0019455 k( 270) = ( 0.2720588 0.1570732 0.1110675), wk = 0.0019455 k( 271) = ( 0.2794118 0.1613185 0.1140694), wk = 0.0019455 k( 272) = ( 0.2867647 0.1655637 0.1170712), wk = 0.0019455 k( 273) = ( 0.2941177 0.1698089 0.1200730), wk = 0.0019455 k( 274) = ( 0.3014706 0.1740541 0.1230749), wk = 0.0019455 k( 275) = ( 0.3088235 0.1782993 0.1260767), wk = 0.0019455 k( 276) = ( 0.3161765 0.1825446 0.1290785), wk = 0.0019455 k( 277) = ( 0.3235294 0.1867898 0.1320803), wk = 0.0019455 k( 278) = ( 0.3308823 0.1910350 0.1350822), wk = 0.0019455 k( 279) = ( 0.3382353 0.1952802 0.1380840), wk = 0.0019455 k( 280) = ( 0.3455882 0.1995255 0.1410858), wk = 0.0019455 k( 281) = ( 0.3529412 0.2037707 0.1440876), wk = 0.0019455 k( 282) = ( 0.3602941 0.2080159 0.1470895), wk = 0.0019455 k( 283) = ( 0.3676471 0.2122611 0.1500913), wk = 0.0019455 k( 284) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0019455 k( 285) = ( 0.3823529 0.2207516 0.1560949), wk = 0.0019455 k( 286) = ( 0.3897059 0.2249968 0.1590968), wk = 0.0019455 k( 287) = ( 0.3970588 0.2292420 0.1620986), wk = 0.0019455 k( 288) = ( 0.4044118 0.2334872 0.1651004), wk = 0.0019455 k( 289) = ( 0.4117647 0.2377325 0.1681022), wk = 0.0019455 k( 290) = ( 0.4191177 0.2419777 0.1711041), wk = 0.0019455 k( 291) = ( 0.4264706 0.2462229 0.1741059), wk = 0.0019455 k( 292) = ( 0.4338235 0.2504681 0.1771077), wk = 0.0019455 k( 293) = ( 0.4411765 0.2547134 0.1801095), wk = 0.0019455 k( 294) = ( 0.4485294 0.2589586 0.1831114), wk = 0.0019455 k( 295) = ( 0.4558823 0.2632038 0.1861132), wk = 0.0019455 k( 296) = ( 0.4632353 0.2674490 0.1891150), wk = 0.0019455 k( 297) = ( 0.4705882 0.2716942 0.1921168), wk = 0.0019455 k( 298) = ( 0.4779412 0.2759395 0.1951187), wk = 0.0019455 k( 299) = ( 0.4852941 0.2801847 0.1981205), wk = 0.0019455 k( 300) = ( 0.4926471 0.2844299 0.2011223), wk = 0.0019455 k( 301) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0019455 k( 302) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0019455 k( 303) = ( 0.5026042 0.2811576 0.2083767), wk = 0.0019455 k( 304) = ( 0.5052083 0.2736400 0.2126293), wk = 0.0019455 k( 305) = ( 0.5078125 0.2661224 0.2168819), wk = 0.0019455 k( 306) = ( 0.5104167 0.2586048 0.2211345), wk = 0.0019455 k( 307) = ( 0.5130208 0.2510872 0.2253871), wk = 0.0019455 k( 308) = ( 0.5156250 0.2435696 0.2296397), wk = 0.0019455 k( 309) = ( 0.5182292 0.2360521 0.2338923), wk = 0.0019455 k( 310) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0019455 k( 311) = ( 0.5234375 0.2210169 0.2423974), wk = 0.0019455 k( 312) = ( 0.5260417 0.2134993 0.2466500), wk = 0.0019455 k( 313) = ( 0.5286458 0.2059817 0.2509026), wk = 0.0019455 k( 314) = ( 0.5312500 0.1984642 0.2551552), wk = 0.0019455 k( 315) = ( 0.5338542 0.1909466 0.2594078), wk = 0.0019455 k( 316) = ( 0.5364583 0.1834290 0.2636604), wk = 0.0019455 k( 317) = ( 0.5390625 0.1759114 0.2679129), wk = 0.0019455 k( 318) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0019455 k( 319) = ( 0.5442708 0.1608762 0.2764181), wk = 0.0019455 k( 320) = ( 0.5468750 0.1533587 0.2806707), wk = 0.0019455 k( 321) = ( 0.5494792 0.1458411 0.2849233), wk = 0.0019455 k( 322) = ( 0.5520833 0.1383235 0.2891759), wk = 0.0019455 k( 323) = ( 0.5546875 0.1308059 0.2934285), wk = 0.0019455 k( 324) = ( 0.5572917 0.1232883 0.2976810), wk = 0.0019455 k( 325) = ( 0.5598958 0.1157708 0.3019336), wk = 0.0019455 k( 326) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0019455 k( 327) = ( 0.5651042 0.1007356 0.3104388), wk = 0.0019455 k( 328) = ( 0.5677083 0.0932180 0.3146914), wk = 0.0019455 k( 329) = ( 0.5703125 0.0857004 0.3189440), wk = 0.0019455 k( 330) = ( 0.5729167 0.0781829 0.3231966), wk = 0.0019455 k( 331) = ( 0.5755208 0.0706653 0.3274491), wk = 0.0019455 k( 332) = ( 0.5781250 0.0631477 0.3317017), wk = 0.0019455 k( 333) = ( 0.5807292 0.0556301 0.3359543), wk = 0.0019455 k( 334) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0019455 k( 335) = ( 0.5859375 0.0405949 0.3444595), wk = 0.0019455 k( 336) = ( 0.5885417 0.0330774 0.3487121), wk = 0.0019455 k( 337) = ( 0.5911458 0.0255598 0.3529647), wk = 0.0019455 k( 338) = ( 0.5937500 0.0180422 0.3572173), wk = 0.0019455 k( 339) = ( 0.5963542 0.0105246 0.3614698), wk = 0.0019455 k( 340) = ( 0.5989583 0.0030070 0.3657224), wk = 0.0019455 k( 341) = ( 0.6015625 -0.0045105 0.3699750), wk = 0.0019455 k( 342) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0019455 k( 343) = ( 0.6067708 -0.0195457 0.3784802), wk = 0.0019455 k( 344) = ( 0.6093750 -0.0270633 0.3827328), wk = 0.0019455 k( 345) = ( 0.6119792 -0.0345809 0.3869854), wk = 0.0019455 k( 346) = ( 0.6145833 -0.0420985 0.3912379), wk = 0.0019455 k( 347) = ( 0.6171875 -0.0496160 0.3954905), wk = 0.0019455 k( 348) = ( 0.6197917 -0.0571336 0.3997431), wk = 0.0019455 k( 349) = ( 0.6223958 -0.0646512 0.4039957), wk = 0.0019455 k( 350) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0019455 k( 351) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0019455 k( 352) = ( 0.6205357 -0.0695913 0.4155384), wk = 0.0019455 k( 353) = ( 0.6160714 -0.0670139 0.4228286), wk = 0.0019455 k( 354) = ( 0.6116071 -0.0644364 0.4301187), wk = 0.0019455 k( 355) = ( 0.6071429 -0.0618590 0.4374089), wk = 0.0019455 k( 356) = ( 0.6026786 -0.0592815 0.4446990), wk = 0.0019455 k( 357) = ( 0.5982143 -0.0567040 0.4519892), wk = 0.0019455 k( 358) = ( 0.5937500 -0.0541266 0.4592793), wk = 0.0019455 k( 359) = ( 0.5892857 -0.0515491 0.4665695), wk = 0.0019455 k( 360) = ( 0.5848214 -0.0489717 0.4738596), wk = 0.0019455 k( 361) = ( 0.5803571 -0.0463942 0.4811498), wk = 0.0019455 k( 362) = ( 0.5758929 -0.0438168 0.4884399), wk = 0.0019455 k( 363) = ( 0.5714286 -0.0412393 0.4957301), wk = 0.0019455 k( 364) = ( 0.5669643 -0.0386619 0.5030202), wk = 0.0019455 k( 365) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0019455 k( 366) = ( 0.5580357 -0.0335069 0.5176005), wk = 0.0019455 k( 367) = ( 0.5535714 -0.0309295 0.5248907), wk = 0.0019455 k( 368) = ( 0.5491071 -0.0283520 0.5321808), wk = 0.0019455 k( 369) = ( 0.5446429 -0.0257746 0.5394710), wk = 0.0019455 k( 370) = ( 0.5401786 -0.0231971 0.5467611), wk = 0.0019455 k( 371) = ( 0.5357143 -0.0206197 0.5540512), wk = 0.0019455 k( 372) = ( 0.5312500 -0.0180422 0.5613414), wk = 0.0019455 k( 373) = ( 0.5267857 -0.0154647 0.5686316), wk = 0.0019455 k( 374) = ( 0.5223214 -0.0128873 0.5759217), wk = 0.0019455 k( 375) = ( 0.5178571 -0.0103098 0.5832118), wk = 0.0019455 k( 376) = ( 0.5133929 -0.0077324 0.5905020), wk = 0.0019455 k( 377) = ( 0.5089286 -0.0051549 0.5977921), wk = 0.0019455 k( 378) = ( 0.5044643 -0.0025775 0.6050823), wk = 0.0019455 k( 379) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0019455 k( 380) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0019455 k( 381) = ( 0.5000000 0.0051549 0.6050823), wk = 0.0019455 k( 382) = ( 0.5000000 0.0103098 0.5977921), wk = 0.0019455 k( 383) = ( 0.5000000 0.0154647 0.5905020), wk = 0.0019455 k( 384) = ( 0.5000000 0.0206196 0.5832118), wk = 0.0019455 k( 385) = ( 0.5000000 0.0257746 0.5759217), wk = 0.0019455 k( 386) = ( 0.5000000 0.0309295 0.5686316), wk = 0.0019455 k( 387) = ( 0.5000000 0.0360844 0.5613414), wk = 0.0019455 k( 388) = ( 0.5000000 0.0412393 0.5540512), wk = 0.0019455 k( 389) = ( 0.5000000 0.0463942 0.5467611), wk = 0.0019455 k( 390) = ( 0.5000000 0.0515491 0.5394710), wk = 0.0019455 k( 391) = ( 0.5000000 0.0567040 0.5321808), wk = 0.0019455 k( 392) = ( 0.5000000 0.0618590 0.5248907), wk = 0.0019455 k( 393) = ( 0.5000000 0.0670139 0.5176005), wk = 0.0019455 k( 394) = ( 0.5000000 0.0721688 0.5103104), wk = 0.0019455 k( 395) = ( 0.5000000 0.0773237 0.5030202), wk = 0.0019455 k( 396) = ( 0.5000000 0.0824786 0.4957301), wk = 0.0019455 k( 397) = ( 0.5000000 0.0876335 0.4884399), wk = 0.0019455 k( 398) = ( 0.5000000 0.0927884 0.4811498), wk = 0.0019455 k( 399) = ( 0.5000000 0.0979434 0.4738596), wk = 0.0019455 k( 400) = ( 0.5000000 0.1030983 0.4665695), wk = 0.0019455 k( 401) = ( 0.5000000 0.1082532 0.4592793), wk = 0.0019455 k( 402) = ( 0.5000000 0.1134081 0.4519892), wk = 0.0019455 k( 403) = ( 0.5000000 0.1185630 0.4446990), wk = 0.0019455 k( 404) = ( 0.5000000 0.1237179 0.4374089), wk = 0.0019455 k( 405) = ( 0.5000000 0.1288728 0.4301187), wk = 0.0019455 k( 406) = ( 0.5000000 0.1340277 0.4228286), wk = 0.0019455 k( 407) = ( 0.5000000 0.1391826 0.4155384), wk = 0.0019455 k( 408) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0019455 k( 409) = ( 0.5000000 0.1494925 0.4009581), wk = 0.0019455 k( 410) = ( 0.5000000 0.1546474 0.3936680), wk = 0.0019455 k( 411) = ( 0.5000000 0.1598023 0.3863778), wk = 0.0019455 k( 412) = ( 0.5000000 0.1649572 0.3790877), wk = 0.0019455 k( 413) = ( 0.5000000 0.1701121 0.3717975), wk = 0.0019455 k( 414) = ( 0.5000000 0.1752670 0.3645074), wk = 0.0019455 k( 415) = ( 0.5000000 0.1804220 0.3572173), wk = 0.0019455 k( 416) = ( 0.5000000 0.1855769 0.3499271), wk = 0.0019455 k( 417) = ( 0.5000000 0.1907318 0.3426370), wk = 0.0019455 k( 418) = ( 0.5000000 0.1958867 0.3353468), wk = 0.0019455 k( 419) = ( 0.5000000 0.2010416 0.3280567), wk = 0.0019455 k( 420) = ( 0.5000000 0.2061965 0.3207665), wk = 0.0019455 k( 421) = ( 0.5000000 0.2113514 0.3134764), wk = 0.0019455 k( 422) = ( 0.5000000 0.2165064 0.3061862), wk = 0.0019455 k( 423) = ( 0.5000000 0.2216613 0.2988961), wk = 0.0019455 k( 424) = ( 0.5000000 0.2268162 0.2916059), wk = 0.0019455 k( 425) = ( 0.5000000 0.2319711 0.2843158), wk = 0.0019455 k( 426) = ( 0.5000000 0.2371260 0.2770256), wk = 0.0019455 k( 427) = ( 0.5000000 0.2422809 0.2697355), wk = 0.0019455 k( 428) = ( 0.5000000 0.2474358 0.2624453), wk = 0.0019455 k( 429) = ( 0.5000000 0.2525907 0.2551552), wk = 0.0019455 k( 430) = ( 0.5000000 0.2577457 0.2478650), wk = 0.0019455 k( 431) = ( 0.5000000 0.2629006 0.2405749), wk = 0.0019455 k( 432) = ( 0.5000000 0.2680555 0.2332847), wk = 0.0019455 k( 433) = ( 0.5000000 0.2732104 0.2259946), wk = 0.0019455 k( 434) = ( 0.5000000 0.2783653 0.2187044), wk = 0.0019455 k( 435) = ( 0.5000000 0.2835202 0.2114143), wk = 0.0019455 k( 436) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0019455 k( 437) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0019455 k( 438) = ( 0.4973958 0.2871716 0.2126293), wk = 0.0019455 k( 439) = ( 0.4947917 0.2856681 0.2211345), wk = 0.0019455 k( 440) = ( 0.4921875 0.2841646 0.2296397), wk = 0.0019455 k( 441) = ( 0.4895833 0.2826611 0.2381448), wk = 0.0019455 k( 442) = ( 0.4869792 0.2811576 0.2466500), wk = 0.0019455 k( 443) = ( 0.4843750 0.2796540 0.2551552), wk = 0.0019455 k( 444) = ( 0.4817708 0.2781505 0.2636604), wk = 0.0019455 k( 445) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0019455 k( 446) = ( 0.4765625 0.2751435 0.2806707), wk = 0.0019455 k( 447) = ( 0.4739583 0.2736400 0.2891759), wk = 0.0019455 k( 448) = ( 0.4713542 0.2721365 0.2976810), wk = 0.0019455 k( 449) = ( 0.4687500 0.2706329 0.3061862), wk = 0.0019455 k( 450) = ( 0.4661458 0.2691294 0.3146914), wk = 0.0019455 k( 451) = ( 0.4635417 0.2676259 0.3231966), wk = 0.0019455 k( 452) = ( 0.4609375 0.2661224 0.3317017), wk = 0.0019455 k( 453) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0019455 k( 454) = ( 0.4557292 0.2631154 0.3487121), wk = 0.0019455 k( 455) = ( 0.4531250 0.2616118 0.3572173), wk = 0.0019455 k( 456) = ( 0.4505208 0.2601083 0.3657224), wk = 0.0019455 k( 457) = ( 0.4479167 0.2586048 0.3742276), wk = 0.0019455 k( 458) = ( 0.4453125 0.2571013 0.3827328), wk = 0.0019455 k( 459) = ( 0.4427083 0.2555978 0.3912379), wk = 0.0019455 k( 460) = ( 0.4401042 0.2540943 0.3997431), wk = 0.0019455 k( 461) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0019455 k( 462) = ( 0.4348958 0.2510872 0.4167535), wk = 0.0019455 k( 463) = ( 0.4322917 0.2495837 0.4252586), wk = 0.0019455 k( 464) = ( 0.4296875 0.2480802 0.4337638), wk = 0.0019455 k( 465) = ( 0.4270833 0.2465767 0.4422690), wk = 0.0019455 k( 466) = ( 0.4244792 0.2450732 0.4507742), wk = 0.0019455 k( 467) = ( 0.4218750 0.2435696 0.4592793), wk = 0.0019455 k( 468) = ( 0.4192708 0.2420661 0.4677845), wk = 0.0019455 k( 469) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0019455 k( 470) = ( 0.4140625 0.2390591 0.4847948), wk = 0.0019455 k( 471) = ( 0.4114583 0.2375556 0.4933000), wk = 0.0019455 k( 472) = ( 0.4088542 0.2360521 0.5018052), wk = 0.0019455 k( 473) = ( 0.4062500 0.2345485 0.5103104), wk = 0.0019455 k( 474) = ( 0.4036458 0.2330450 0.5188155), wk = 0.0019455 k( 475) = ( 0.4010417 0.2315415 0.5273207), wk = 0.0019455 k( 476) = ( 0.3984375 0.2300380 0.5358259), wk = 0.0019455 k( 477) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0019455 k( 478) = ( 0.3932292 0.2270310 0.5528362), wk = 0.0019455 k( 479) = ( 0.3906250 0.2255274 0.5613414), wk = 0.0019455 k( 480) = ( 0.3880208 0.2240239 0.5698466), wk = 0.0019455 k( 481) = ( 0.3854167 0.2225204 0.5783517), wk = 0.0019455 k( 482) = ( 0.3828125 0.2210169 0.5868569), wk = 0.0019455 k( 483) = ( 0.3802083 0.2195134 0.5953621), wk = 0.0019455 k( 484) = ( 0.3776042 0.2180099 0.6038673), wk = 0.0019455 k( 485) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0019455 k( 486) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0019455 k( 487) = ( 0.6205357 -0.0799011 0.4082483), wk = 0.0019455 k( 488) = ( 0.6160714 -0.0876335 0.4082483), wk = 0.0019455 k( 489) = ( 0.6116071 -0.0953659 0.4082483), wk = 0.0019455 k( 490) = ( 0.6071429 -0.1030983 0.4082483), wk = 0.0019455 k( 491) = ( 0.6026786 -0.1108306 0.4082483), wk = 0.0019455 k( 492) = ( 0.5982143 -0.1185630 0.4082483), wk = 0.0019455 k( 493) = ( 0.5937500 -0.1262954 0.4082483), wk = 0.0019455 k( 494) = ( 0.5892857 -0.1340277 0.4082483), wk = 0.0019455 k( 495) = ( 0.5848214 -0.1417601 0.4082483), wk = 0.0019455 k( 496) = ( 0.5803571 -0.1494925 0.4082483), wk = 0.0019455 k( 497) = ( 0.5758929 -0.1572249 0.4082483), wk = 0.0019455 k( 498) = ( 0.5714286 -0.1649572 0.4082483), wk = 0.0019455 k( 499) = ( 0.5669643 -0.1726896 0.4082483), wk = 0.0019455 k( 500) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0019455 k( 501) = ( 0.5580357 -0.1881543 0.4082483), wk = 0.0019455 k( 502) = ( 0.5535714 -0.1958867 0.4082483), wk = 0.0019455 k( 503) = ( 0.5491071 -0.2036191 0.4082483), wk = 0.0019455 k( 504) = ( 0.5446429 -0.2113514 0.4082483), wk = 0.0019455 k( 505) = ( 0.5401786 -0.2190838 0.4082483), wk = 0.0019455 k( 506) = ( 0.5357143 -0.2268162 0.4082483), wk = 0.0019455 k( 507) = ( 0.5312500 -0.2345485 0.4082483), wk = 0.0019455 k( 508) = ( 0.5267857 -0.2422809 0.4082483), wk = 0.0019455 k( 509) = ( 0.5223214 -0.2500133 0.4082483), wk = 0.0019455 k( 510) = ( 0.5178571 -0.2577456 0.4082483), wk = 0.0019455 k( 511) = ( 0.5133929 -0.2654780 0.4082483), wk = 0.0019455 k( 512) = ( 0.5089286 -0.2732104 0.4082483), wk = 0.0019455 k( 513) = ( 0.5044643 -0.2809428 0.4082483), wk = 0.0019455 k( 514) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0019455 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019455 k( 2) = ( 0.0064103 -0.0000000 0.0064103), wk = 0.0019455 k( 3) = ( 0.0128205 -0.0000000 0.0128205), wk = 0.0019455 k( 4) = ( 0.0192308 -0.0000000 0.0192308), wk = 0.0019455 k( 5) = ( 0.0256410 -0.0000000 0.0256410), wk = 0.0019455 k( 6) = ( 0.0320513 -0.0000000 0.0320513), wk = 0.0019455 k( 7) = ( 0.0384615 -0.0000000 0.0384615), wk = 0.0019455 k( 8) = ( 0.0448718 -0.0000000 0.0448718), wk = 0.0019455 k( 9) = ( 0.0512821 -0.0000000 0.0512820), wk = 0.0019455 k( 10) = ( 0.0576923 -0.0000000 0.0576923), wk = 0.0019455 k( 11) = ( 0.0641026 -0.0000000 0.0641026), wk = 0.0019455 k( 12) = ( 0.0705128 -0.0000000 0.0705128), wk = 0.0019455 k( 13) = ( 0.0769231 -0.0000000 0.0769231), wk = 0.0019455 k( 14) = ( 0.0833333 -0.0000000 0.0833333), wk = 0.0019455 k( 15) = ( 0.0897436 -0.0000000 0.0897436), wk = 0.0019455 k( 16) = ( 0.0961538 -0.0000000 0.0961538), wk = 0.0019455 k( 17) = ( 0.1025641 -0.0000000 0.1025641), wk = 0.0019455 k( 18) = ( 0.1089744 -0.0000000 0.1089744), wk = 0.0019455 k( 19) = ( 0.1153846 -0.0000000 0.1153846), wk = 0.0019455 k( 20) = ( 0.1217949 -0.0000000 0.1217949), wk = 0.0019455 k( 21) = ( 0.1282051 -0.0000000 0.1282051), wk = 0.0019455 k( 22) = ( 0.1346154 -0.0000000 0.1346154), wk = 0.0019455 k( 23) = ( 0.1410256 -0.0000000 0.1410256), wk = 0.0019455 k( 24) = ( 0.1474359 -0.0000000 0.1474359), wk = 0.0019455 k( 25) = ( 0.1538461 -0.0000000 0.1538461), wk = 0.0019455 k( 26) = ( 0.1602564 -0.0000000 0.1602564), wk = 0.0019455 k( 27) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0019455 k( 28) = ( 0.1730769 -0.0000000 0.1730769), wk = 0.0019455 k( 29) = ( 0.1794872 -0.0000000 0.1794872), wk = 0.0019455 k( 30) = ( 0.1858974 -0.0000000 0.1858974), wk = 0.0019455 k( 31) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0019455 k( 32) = ( 0.1987180 -0.0000000 0.1987179), wk = 0.0019455 k( 33) = ( 0.2051282 -0.0000000 0.2051282), wk = 0.0019455 k( 34) = ( 0.2115385 -0.0000000 0.2115385), wk = 0.0019455 k( 35) = ( 0.2179487 -0.0000000 0.2179487), wk = 0.0019455 k( 36) = ( 0.2243590 -0.0000000 0.2243590), wk = 0.0019455 k( 37) = ( 0.2307692 -0.0000000 0.2307692), wk = 0.0019455 k( 38) = ( 0.2371795 -0.0000000 0.2371795), wk = 0.0019455 k( 39) = ( 0.2435897 -0.0000000 0.2435897), wk = 0.0019455 k( 40) = ( 0.2500000 -0.0000000 0.2500000), wk = 0.0019455 k( 41) = ( 0.2564103 -0.0000000 0.2564103), wk = 0.0019455 k( 42) = ( 0.2628205 -0.0000000 0.2628205), wk = 0.0019455 k( 43) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0019455 k( 44) = ( 0.2756410 -0.0000000 0.2756410), wk = 0.0019455 k( 45) = ( 0.2820513 -0.0000000 0.2820513), wk = 0.0019455 k( 46) = ( 0.2884615 -0.0000000 0.2884615), wk = 0.0019455 k( 47) = ( 0.2948718 -0.0000000 0.2948718), wk = 0.0019455 k( 48) = ( 0.3012821 -0.0000000 0.3012821), wk = 0.0019455 k( 49) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0019455 k( 50) = ( 0.3141026 -0.0000000 0.3141026), wk = 0.0019455 k( 51) = ( 0.3205128 -0.0000000 0.3205128), wk = 0.0019455 k( 52) = ( 0.3269231 -0.0000000 0.3269231), wk = 0.0019455 k( 53) = ( 0.3333333 -0.0000000 0.3333333), wk = 0.0019455 k( 54) = ( 0.3397436 -0.0000000 0.3397436), wk = 0.0019455 k( 55) = ( 0.3461538 -0.0000000 0.3461538), wk = 0.0019455 k( 56) = ( 0.3525641 -0.0000000 0.3525641), wk = 0.0019455 k( 57) = ( 0.3589744 -0.0000000 0.3589744), wk = 0.0019455 k( 58) = ( 0.3653846 -0.0000000 0.3653846), wk = 0.0019455 k( 59) = ( 0.3717949 -0.0000000 0.3717949), wk = 0.0019455 k( 60) = ( 0.3782051 -0.0000000 0.3782051), wk = 0.0019455 k( 61) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0019455 k( 62) = ( 0.3910256 -0.0000000 0.3910256), wk = 0.0019455 k( 63) = ( 0.3974359 -0.0000000 0.3974359), wk = 0.0019455 k( 64) = ( 0.4038462 -0.0000000 0.4038462), wk = 0.0019455 k( 65) = ( 0.4102564 -0.0000000 0.4102564), wk = 0.0019455 k( 66) = ( 0.4166667 -0.0000000 0.4166667), wk = 0.0019455 k( 67) = ( 0.4230769 -0.0000000 0.4230769), wk = 0.0019455 k( 68) = ( 0.4294872 -0.0000000 0.4294872), wk = 0.0019455 k( 69) = ( 0.4358974 -0.0000000 0.4358974), wk = 0.0019455 k( 70) = ( 0.4423077 -0.0000000 0.4423077), wk = 0.0019455 k( 71) = ( 0.4487179 -0.0000000 0.4487179), wk = 0.0019455 k( 72) = ( 0.4551282 -0.0000000 0.4551282), wk = 0.0019455 k( 73) = ( 0.4615385 -0.0000000 0.4615385), wk = 0.0019455 k( 74) = ( 0.4679487 -0.0000000 0.4679487), wk = 0.0019455 k( 75) = ( 0.4743590 -0.0000000 0.4743590), wk = 0.0019455 k( 76) = ( 0.4807692 -0.0000000 0.4807692), wk = 0.0019455 k( 77) = ( 0.4871795 -0.0000000 0.4871795), wk = 0.0019455 k( 78) = ( 0.4935897 -0.0000000 0.4935897), wk = 0.0019455 k( 79) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0019455 k( 80) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0019455 k( 81) = ( 0.5000000 0.0064103 0.5064103), wk = 0.0019455 k( 82) = ( 0.5000000 0.0128205 0.5128205), wk = 0.0019455 k( 83) = ( 0.5000000 0.0192308 0.5192308), wk = 0.0019455 k( 84) = ( 0.5000000 0.0256410 0.5256410), wk = 0.0019455 k( 85) = ( 0.5000000 0.0320513 0.5320513), wk = 0.0019455 k( 86) = ( 0.5000000 0.0384615 0.5384615), wk = 0.0019455 k( 87) = ( 0.5000000 0.0448718 0.5448718), wk = 0.0019455 k( 88) = ( 0.5000000 0.0512820 0.5512820), wk = 0.0019455 k( 89) = ( 0.5000000 0.0576923 0.5576923), wk = 0.0019455 k( 90) = ( 0.5000000 0.0641026 0.5641026), wk = 0.0019455 k( 91) = ( 0.5000000 0.0705128 0.5705128), wk = 0.0019455 k( 92) = ( 0.5000000 0.0769231 0.5769231), wk = 0.0019455 k( 93) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0019455 k( 94) = ( 0.5000000 0.0897436 0.5897436), wk = 0.0019455 k( 95) = ( 0.5000000 0.0961538 0.5961538), wk = 0.0019455 k( 96) = ( 0.5000000 0.1025641 0.6025641), wk = 0.0019455 k( 97) = ( 0.5000000 0.1089744 0.6089744), wk = 0.0019455 k( 98) = ( 0.5000000 0.1153846 0.6153846), wk = 0.0019455 k( 99) = ( 0.5000000 0.1217949 0.6217949), wk = 0.0019455 k( 100) = ( 0.5000000 0.1282051 0.6282051), wk = 0.0019455 k( 101) = ( 0.5000000 0.1346154 0.6346154), wk = 0.0019455 k( 102) = ( 0.5000000 0.1410256 0.6410256), wk = 0.0019455 k( 103) = ( 0.5000000 0.1474359 0.6474359), wk = 0.0019455 k( 104) = ( 0.5000000 0.1538461 0.6538462), wk = 0.0019455 k( 105) = ( 0.5000000 0.1602564 0.6602564), wk = 0.0019455 k( 106) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0019455 k( 107) = ( 0.5000000 0.1730769 0.6730769), wk = 0.0019455 k( 108) = ( 0.5000000 0.1794872 0.6794872), wk = 0.0019455 k( 109) = ( 0.5000000 0.1858974 0.6858974), wk = 0.0019455 k( 110) = ( 0.5000000 0.1923077 0.6923077), wk = 0.0019455 k( 111) = ( 0.5000000 0.1987179 0.6987179), wk = 0.0019455 k( 112) = ( 0.5000000 0.2051282 0.7051282), wk = 0.0019455 k( 113) = ( 0.5000000 0.2115385 0.7115385), wk = 0.0019455 k( 114) = ( 0.5000000 0.2179487 0.7179487), wk = 0.0019455 k( 115) = ( 0.5000000 0.2243590 0.7243590), wk = 0.0019455 k( 116) = ( 0.5000000 0.2307692 0.7307692), wk = 0.0019455 k( 117) = ( 0.5000000 0.2371795 0.7371795), wk = 0.0019455 k( 118) = ( 0.5000000 0.2435897 0.7435897), wk = 0.0019455 k( 119) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0019455 k( 120) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0019455 k( 121) = ( 0.4955357 0.2544643 0.7500000), wk = 0.0019455 k( 122) = ( 0.4910714 0.2589286 0.7500000), wk = 0.0019455 k( 123) = ( 0.4866071 0.2633929 0.7500000), wk = 0.0019455 k( 124) = ( 0.4821429 0.2678571 0.7500000), wk = 0.0019455 k( 125) = ( 0.4776786 0.2723214 0.7500000), wk = 0.0019455 k( 126) = ( 0.4732143 0.2767857 0.7500000), wk = 0.0019455 k( 127) = ( 0.4687500 0.2812500 0.7500000), wk = 0.0019455 k( 128) = ( 0.4642857 0.2857143 0.7500000), wk = 0.0019455 k( 129) = ( 0.4598214 0.2901786 0.7500000), wk = 0.0019455 k( 130) = ( 0.4553571 0.2946429 0.7500000), wk = 0.0019455 k( 131) = ( 0.4508929 0.2991071 0.7500000), wk = 0.0019455 k( 132) = ( 0.4464286 0.3035714 0.7500000), wk = 0.0019455 k( 133) = ( 0.4419643 0.3080357 0.7500000), wk = 0.0019455 k( 134) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0019455 k( 135) = ( 0.4330357 0.3169643 0.7500000), wk = 0.0019455 k( 136) = ( 0.4285714 0.3214286 0.7500000), wk = 0.0019455 k( 137) = ( 0.4241071 0.3258929 0.7500000), wk = 0.0019455 k( 138) = ( 0.4196429 0.3303571 0.7500000), wk = 0.0019455 k( 139) = ( 0.4151786 0.3348214 0.7500000), wk = 0.0019455 k( 140) = ( 0.4107143 0.3392857 0.7500000), wk = 0.0019455 k( 141) = ( 0.4062500 0.3437500 0.7500000), wk = 0.0019455 k( 142) = ( 0.4017857 0.3482143 0.7500000), wk = 0.0019455 k( 143) = ( 0.3973214 0.3526786 0.7500000), wk = 0.0019455 k( 144) = ( 0.3928571 0.3571429 0.7500000), wk = 0.0019455 k( 145) = ( 0.3883929 0.3616071 0.7500000), wk = 0.0019455 k( 146) = ( 0.3839286 0.3660714 0.7500000), wk = 0.0019455 k( 147) = ( 0.3794643 0.3705357 0.7500000), wk = 0.0019455 k( 148) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0019455 k( 149) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0019455 k( 150) = ( 0.3704819 0.3704819 0.7409639), wk = 0.0019455 k( 151) = ( 0.3659639 0.3659639 0.7319277), wk = 0.0019455 k( 152) = ( 0.3614458 0.3614458 0.7228916), wk = 0.0019455 k( 153) = ( 0.3569277 0.3569277 0.7138554), wk = 0.0019455 k( 154) = ( 0.3524096 0.3524096 0.7048193), wk = 0.0019455 k( 155) = ( 0.3478916 0.3478916 0.6957831), wk = 0.0019455 k( 156) = ( 0.3433735 0.3433735 0.6867470), wk = 0.0019455 k( 157) = ( 0.3388554 0.3388554 0.6777108), wk = 0.0019455 k( 158) = ( 0.3343373 0.3343373 0.6686747), wk = 0.0019455 k( 159) = ( 0.3298193 0.3298193 0.6596385), wk = 0.0019455 k( 160) = ( 0.3253012 0.3253012 0.6506024), wk = 0.0019455 k( 161) = ( 0.3207831 0.3207831 0.6415663), wk = 0.0019455 k( 162) = ( 0.3162651 0.3162651 0.6325301), wk = 0.0019455 k( 163) = ( 0.3117470 0.3117470 0.6234940), wk = 0.0019455 k( 164) = ( 0.3072289 0.3072289 0.6144578), wk = 0.0019455 k( 165) = ( 0.3027108 0.3027108 0.6054217), wk = 0.0019455 k( 166) = ( 0.2981928 0.2981928 0.5963855), wk = 0.0019455 k( 167) = ( 0.2936747 0.2936747 0.5873494), wk = 0.0019455 k( 168) = ( 0.2891566 0.2891566 0.5783132), wk = 0.0019455 k( 169) = ( 0.2846385 0.2846385 0.5692771), wk = 0.0019455 k( 170) = ( 0.2801205 0.2801205 0.5602410), wk = 0.0019455 k( 171) = ( 0.2756024 0.2756024 0.5512048), wk = 0.0019455 k( 172) = ( 0.2710843 0.2710843 0.5421687), wk = 0.0019455 k( 173) = ( 0.2665663 0.2665663 0.5331325), wk = 0.0019455 k( 174) = ( 0.2620482 0.2620482 0.5240964), wk = 0.0019455 k( 175) = ( 0.2575301 0.2575301 0.5150602), wk = 0.0019455 k( 176) = ( 0.2530120 0.2530120 0.5060241), wk = 0.0019455 k( 177) = ( 0.2484940 0.2484940 0.4969879), wk = 0.0019455 k( 178) = ( 0.2439759 0.2439759 0.4879518), wk = 0.0019455 k( 179) = ( 0.2394578 0.2394578 0.4789157), wk = 0.0019455 k( 180) = ( 0.2349398 0.2349398 0.4698795), wk = 0.0019455 k( 181) = ( 0.2304217 0.2304217 0.4608434), wk = 0.0019455 k( 182) = ( 0.2259036 0.2259036 0.4518072), wk = 0.0019455 k( 183) = ( 0.2213855 0.2213855 0.4427711), wk = 0.0019455 k( 184) = ( 0.2168675 0.2168675 0.4337349), wk = 0.0019455 k( 185) = ( 0.2123494 0.2123494 0.4246988), wk = 0.0019455 k( 186) = ( 0.2078313 0.2078313 0.4156626), wk = 0.0019455 k( 187) = ( 0.2033133 0.2033133 0.4066265), wk = 0.0019455 k( 188) = ( 0.1987952 0.1987952 0.3975904), wk = 0.0019455 k( 189) = ( 0.1942771 0.1942771 0.3885542), wk = 0.0019455 k( 190) = ( 0.1897590 0.1897590 0.3795181), wk = 0.0019455 k( 191) = ( 0.1852410 0.1852410 0.3704819), wk = 0.0019455 k( 192) = ( 0.1807229 0.1807229 0.3614458), wk = 0.0019455 k( 193) = ( 0.1762048 0.1762048 0.3524096), wk = 0.0019455 k( 194) = ( 0.1716867 0.1716867 0.3433735), wk = 0.0019455 k( 195) = ( 0.1671687 0.1671687 0.3343373), wk = 0.0019455 k( 196) = ( 0.1626506 0.1626506 0.3253012), wk = 0.0019455 k( 197) = ( 0.1581325 0.1581325 0.3162651), wk = 0.0019455 k( 198) = ( 0.1536145 0.1536145 0.3072289), wk = 0.0019455 k( 199) = ( 0.1490964 0.1490964 0.2981928), wk = 0.0019455 k( 200) = ( 0.1445783 0.1445783 0.2891566), wk = 0.0019455 k( 201) = ( 0.1400602 0.1400602 0.2801205), wk = 0.0019455 k( 202) = ( 0.1355422 0.1355422 0.2710843), wk = 0.0019455 k( 203) = ( 0.1310241 0.1310241 0.2620482), wk = 0.0019455 k( 204) = ( 0.1265060 0.1265060 0.2530120), wk = 0.0019455 k( 205) = ( 0.1219879 0.1219879 0.2439759), wk = 0.0019455 k( 206) = ( 0.1174699 0.1174699 0.2349398), wk = 0.0019455 k( 207) = ( 0.1129518 0.1129518 0.2259036), wk = 0.0019455 k( 208) = ( 0.1084337 0.1084337 0.2168675), wk = 0.0019455 k( 209) = ( 0.1039157 0.1039157 0.2078313), wk = 0.0019455 k( 210) = ( 0.0993976 0.0993976 0.1987952), wk = 0.0019455 k( 211) = ( 0.0948795 0.0948795 0.1897590), wk = 0.0019455 k( 212) = ( 0.0903614 0.0903614 0.1807229), wk = 0.0019455 k( 213) = ( 0.0858434 0.0858434 0.1716867), wk = 0.0019455 k( 214) = ( 0.0813253 0.0813253 0.1626506), wk = 0.0019455 k( 215) = ( 0.0768072 0.0768072 0.1536145), wk = 0.0019455 k( 216) = ( 0.0722892 0.0722892 0.1445783), wk = 0.0019455 k( 217) = ( 0.0677711 0.0677711 0.1355422), wk = 0.0019455 k( 218) = ( 0.0632530 0.0632530 0.1265060), wk = 0.0019455 k( 219) = ( 0.0587349 0.0587349 0.1174699), wk = 0.0019455 k( 220) = ( 0.0542169 0.0542169 0.1084337), wk = 0.0019455 k( 221) = ( 0.0496988 0.0496988 0.0993976), wk = 0.0019455 k( 222) = ( 0.0451807 0.0451807 0.0903614), wk = 0.0019455 k( 223) = ( 0.0406627 0.0406627 0.0813253), wk = 0.0019455 k( 224) = ( 0.0361446 0.0361446 0.0722892), wk = 0.0019455 k( 225) = ( 0.0316265 0.0316265 0.0632530), wk = 0.0019455 k( 226) = ( 0.0271084 0.0271084 0.0542169), wk = 0.0019455 k( 227) = ( 0.0225904 0.0225904 0.0451807), wk = 0.0019455 k( 228) = ( 0.0180723 0.0180723 0.0361446), wk = 0.0019455 k( 229) = ( 0.0135542 0.0135542 0.0271084), wk = 0.0019455 k( 230) = ( 0.0090361 0.0090361 0.0180723), wk = 0.0019455 k( 231) = ( 0.0045181 0.0045181 0.0090361), wk = 0.0019455 k( 232) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019455 k( 233) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019455 k( 234) = ( 0.0073529 0.0073529 0.0073529), wk = 0.0019455 k( 235) = ( 0.0147059 0.0147059 0.0147059), wk = 0.0019455 k( 236) = ( 0.0220588 0.0220588 0.0220588), wk = 0.0019455 k( 237) = ( 0.0294118 0.0294118 0.0294118), wk = 0.0019455 k( 238) = ( 0.0367647 0.0367647 0.0367647), wk = 0.0019455 k( 239) = ( 0.0441177 0.0441176 0.0441177), wk = 0.0019455 k( 240) = ( 0.0514706 0.0514706 0.0514706), wk = 0.0019455 k( 241) = ( 0.0588235 0.0588235 0.0588235), wk = 0.0019455 k( 242) = ( 0.0661765 0.0661765 0.0661765), wk = 0.0019455 k( 243) = ( 0.0735294 0.0735294 0.0735294), wk = 0.0019455 k( 244) = ( 0.0808824 0.0808824 0.0808823), wk = 0.0019455 k( 245) = ( 0.0882353 0.0882353 0.0882353), wk = 0.0019455 k( 246) = ( 0.0955882 0.0955882 0.0955882), wk = 0.0019455 k( 247) = ( 0.1029412 0.1029412 0.1029412), wk = 0.0019455 k( 248) = ( 0.1102941 0.1102941 0.1102941), wk = 0.0019455 k( 249) = ( 0.1176471 0.1176471 0.1176471), wk = 0.0019455 k( 250) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0019455 k( 251) = ( 0.1323529 0.1323529 0.1323529), wk = 0.0019455 k( 252) = ( 0.1397059 0.1397059 0.1397059), wk = 0.0019455 k( 253) = ( 0.1470588 0.1470588 0.1470588), wk = 0.0019455 k( 254) = ( 0.1544118 0.1544118 0.1544118), wk = 0.0019455 k( 255) = ( 0.1617647 0.1617647 0.1617647), wk = 0.0019455 k( 256) = ( 0.1691177 0.1691176 0.1691176), wk = 0.0019455 k( 257) = ( 0.1764706 0.1764706 0.1764706), wk = 0.0019455 k( 258) = ( 0.1838235 0.1838235 0.1838235), wk = 0.0019455 k( 259) = ( 0.1911765 0.1911765 0.1911765), wk = 0.0019455 k( 260) = ( 0.1985294 0.1985294 0.1985294), wk = 0.0019455 k( 261) = ( 0.2058823 0.2058823 0.2058823), wk = 0.0019455 k( 262) = ( 0.2132353 0.2132353 0.2132353), wk = 0.0019455 k( 263) = ( 0.2205882 0.2205882 0.2205882), wk = 0.0019455 k( 264) = ( 0.2279412 0.2279412 0.2279412), wk = 0.0019455 k( 265) = ( 0.2352941 0.2352941 0.2352941), wk = 0.0019455 k( 266) = ( 0.2426471 0.2426471 0.2426471), wk = 0.0019455 k( 267) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0019455 k( 268) = ( 0.2573529 0.2573529 0.2573529), wk = 0.0019455 k( 269) = ( 0.2647059 0.2647059 0.2647059), wk = 0.0019455 k( 270) = ( 0.2720588 0.2720588 0.2720588), wk = 0.0019455 k( 271) = ( 0.2794118 0.2794118 0.2794118), wk = 0.0019455 k( 272) = ( 0.2867647 0.2867647 0.2867647), wk = 0.0019455 k( 273) = ( 0.2941177 0.2941177 0.2941177), wk = 0.0019455 k( 274) = ( 0.3014706 0.3014706 0.3014706), wk = 0.0019455 k( 275) = ( 0.3088235 0.3088235 0.3088235), wk = 0.0019455 k( 276) = ( 0.3161765 0.3161765 0.3161765), wk = 0.0019455 k( 277) = ( 0.3235294 0.3235294 0.3235294), wk = 0.0019455 k( 278) = ( 0.3308823 0.3308823 0.3308823), wk = 0.0019455 k( 279) = ( 0.3382353 0.3382353 0.3382353), wk = 0.0019455 k( 280) = ( 0.3455882 0.3455882 0.3455882), wk = 0.0019455 k( 281) = ( 0.3529412 0.3529412 0.3529412), wk = 0.0019455 k( 282) = ( 0.3602941 0.3602941 0.3602941), wk = 0.0019455 k( 283) = ( 0.3676471 0.3676471 0.3676471), wk = 0.0019455 k( 284) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0019455 k( 285) = ( 0.3823529 0.3823529 0.3823529), wk = 0.0019455 k( 286) = ( 0.3897059 0.3897059 0.3897059), wk = 0.0019455 k( 287) = ( 0.3970588 0.3970588 0.3970588), wk = 0.0019455 k( 288) = ( 0.4044118 0.4044118 0.4044118), wk = 0.0019455 k( 289) = ( 0.4117647 0.4117647 0.4117647), wk = 0.0019455 k( 290) = ( 0.4191177 0.4191177 0.4191177), wk = 0.0019455 k( 291) = ( 0.4264706 0.4264706 0.4264706), wk = 0.0019455 k( 292) = ( 0.4338235 0.4338235 0.4338235), wk = 0.0019455 k( 293) = ( 0.4411765 0.4411765 0.4411765), wk = 0.0019455 k( 294) = ( 0.4485294 0.4485294 0.4485294), wk = 0.0019455 k( 295) = ( 0.4558823 0.4558823 0.4558823), wk = 0.0019455 k( 296) = ( 0.4632353 0.4632353 0.4632353), wk = 0.0019455 k( 297) = ( 0.4705882 0.4705882 0.4705882), wk = 0.0019455 k( 298) = ( 0.4779412 0.4779412 0.4779412), wk = 0.0019455 k( 299) = ( 0.4852941 0.4852941 0.4852941), wk = 0.0019455 k( 300) = ( 0.4926471 0.4926471 0.4926471), wk = 0.0019455 k( 301) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019455 k( 302) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019455 k( 303) = ( 0.5026042 0.4947917 0.5026042), wk = 0.0019455 k( 304) = ( 0.5052083 0.4895833 0.5052083), wk = 0.0019455 k( 305) = ( 0.5078125 0.4843750 0.5078125), wk = 0.0019455 k( 306) = ( 0.5104167 0.4791667 0.5104167), wk = 0.0019455 k( 307) = ( 0.5130208 0.4739583 0.5130208), wk = 0.0019455 k( 308) = ( 0.5156250 0.4687500 0.5156250), wk = 0.0019455 k( 309) = ( 0.5182292 0.4635417 0.5182292), wk = 0.0019455 k( 310) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0019455 k( 311) = ( 0.5234375 0.4531250 0.5234375), wk = 0.0019455 k( 312) = ( 0.5260417 0.4479167 0.5260417), wk = 0.0019455 k( 313) = ( 0.5286458 0.4427083 0.5286458), wk = 0.0019455 k( 314) = ( 0.5312500 0.4375000 0.5312500), wk = 0.0019455 k( 315) = ( 0.5338542 0.4322917 0.5338542), wk = 0.0019455 k( 316) = ( 0.5364583 0.4270833 0.5364583), wk = 0.0019455 k( 317) = ( 0.5390625 0.4218750 0.5390625), wk = 0.0019455 k( 318) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0019455 k( 319) = ( 0.5442708 0.4114583 0.5442708), wk = 0.0019455 k( 320) = ( 0.5468750 0.4062500 0.5468750), wk = 0.0019455 k( 321) = ( 0.5494792 0.4010417 0.5494792), wk = 0.0019455 k( 322) = ( 0.5520833 0.3958333 0.5520833), wk = 0.0019455 k( 323) = ( 0.5546875 0.3906250 0.5546875), wk = 0.0019455 k( 324) = ( 0.5572917 0.3854167 0.5572917), wk = 0.0019455 k( 325) = ( 0.5598958 0.3802083 0.5598958), wk = 0.0019455 k( 326) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0019455 k( 327) = ( 0.5651042 0.3697917 0.5651042), wk = 0.0019455 k( 328) = ( 0.5677083 0.3645833 0.5677083), wk = 0.0019455 k( 329) = ( 0.5703125 0.3593750 0.5703125), wk = 0.0019455 k( 330) = ( 0.5729167 0.3541667 0.5729167), wk = 0.0019455 k( 331) = ( 0.5755208 0.3489583 0.5755208), wk = 0.0019455 k( 332) = ( 0.5781250 0.3437500 0.5781250), wk = 0.0019455 k( 333) = ( 0.5807292 0.3385417 0.5807292), wk = 0.0019455 k( 334) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0019455 k( 335) = ( 0.5859375 0.3281250 0.5859375), wk = 0.0019455 k( 336) = ( 0.5885417 0.3229167 0.5885417), wk = 0.0019455 k( 337) = ( 0.5911458 0.3177083 0.5911458), wk = 0.0019455 k( 338) = ( 0.5937500 0.3125000 0.5937500), wk = 0.0019455 k( 339) = ( 0.5963542 0.3072917 0.5963542), wk = 0.0019455 k( 340) = ( 0.5989583 0.3020833 0.5989583), wk = 0.0019455 k( 341) = ( 0.6015625 0.2968750 0.6015625), wk = 0.0019455 k( 342) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0019455 k( 343) = ( 0.6067708 0.2864583 0.6067708), wk = 0.0019455 k( 344) = ( 0.6093750 0.2812500 0.6093750), wk = 0.0019455 k( 345) = ( 0.6119792 0.2760417 0.6119792), wk = 0.0019455 k( 346) = ( 0.6145833 0.2708333 0.6145833), wk = 0.0019455 k( 347) = ( 0.6171875 0.2656250 0.6171875), wk = 0.0019455 k( 348) = ( 0.6197917 0.2604167 0.6197917), wk = 0.0019455 k( 349) = ( 0.6223958 0.2552083 0.6223958), wk = 0.0019455 k( 350) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0019455 k( 351) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0019455 k( 352) = ( 0.6205357 0.2500000 0.6294643), wk = 0.0019455 k( 353) = ( 0.6160714 0.2500000 0.6339286), wk = 0.0019455 k( 354) = ( 0.6116071 0.2500000 0.6383929), wk = 0.0019455 k( 355) = ( 0.6071429 0.2500000 0.6428571), wk = 0.0019455 k( 356) = ( 0.6026786 0.2500000 0.6473214), wk = 0.0019455 k( 357) = ( 0.5982143 0.2500000 0.6517857), wk = 0.0019455 k( 358) = ( 0.5937500 0.2500000 0.6562500), wk = 0.0019455 k( 359) = ( 0.5892857 0.2500000 0.6607143), wk = 0.0019455 k( 360) = ( 0.5848214 0.2500000 0.6651786), wk = 0.0019455 k( 361) = ( 0.5803571 0.2500000 0.6696429), wk = 0.0019455 k( 362) = ( 0.5758929 0.2500000 0.6741071), wk = 0.0019455 k( 363) = ( 0.5714286 0.2500000 0.6785714), wk = 0.0019455 k( 364) = ( 0.5669643 0.2500000 0.6830357), wk = 0.0019455 k( 365) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0019455 k( 366) = ( 0.5580357 0.2500000 0.6919643), wk = 0.0019455 k( 367) = ( 0.5535714 0.2500000 0.6964286), wk = 0.0019455 k( 368) = ( 0.5491071 0.2500000 0.7008929), wk = 0.0019455 k( 369) = ( 0.5446429 0.2500000 0.7053571), wk = 0.0019455 k( 370) = ( 0.5401786 0.2500000 0.7098214), wk = 0.0019455 k( 371) = ( 0.5357143 0.2500000 0.7142857), wk = 0.0019455 k( 372) = ( 0.5312500 0.2500000 0.7187500), wk = 0.0019455 k( 373) = ( 0.5267857 0.2500000 0.7232143), wk = 0.0019455 k( 374) = ( 0.5223214 0.2500000 0.7276786), wk = 0.0019455 k( 375) = ( 0.5178571 0.2500000 0.7321429), wk = 0.0019455 k( 376) = ( 0.5133929 0.2500000 0.7366071), wk = 0.0019455 k( 377) = ( 0.5089286 0.2500000 0.7410714), wk = 0.0019455 k( 378) = ( 0.5044643 0.2500000 0.7455357), wk = 0.0019455 k( 379) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0019455 k( 380) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0019455 k( 381) = ( 0.5000000 0.2544643 0.7455357), wk = 0.0019455 k( 382) = ( 0.5000000 0.2589286 0.7410714), wk = 0.0019455 k( 383) = ( 0.5000000 0.2633929 0.7366071), wk = 0.0019455 k( 384) = ( 0.5000000 0.2678571 0.7321429), wk = 0.0019455 k( 385) = ( 0.5000000 0.2723214 0.7276786), wk = 0.0019455 k( 386) = ( 0.5000000 0.2767857 0.7232143), wk = 0.0019455 k( 387) = ( 0.5000000 0.2812500 0.7187500), wk = 0.0019455 k( 388) = ( 0.5000000 0.2857143 0.7142857), wk = 0.0019455 k( 389) = ( 0.5000000 0.2901786 0.7098214), wk = 0.0019455 k( 390) = ( 0.5000000 0.2946429 0.7053571), wk = 0.0019455 k( 391) = ( 0.5000000 0.2991071 0.7008929), wk = 0.0019455 k( 392) = ( 0.5000000 0.3035714 0.6964286), wk = 0.0019455 k( 393) = ( 0.5000000 0.3080357 0.6919643), wk = 0.0019455 k( 394) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0019455 k( 395) = ( 0.5000000 0.3169643 0.6830357), wk = 0.0019455 k( 396) = ( 0.5000000 0.3214286 0.6785714), wk = 0.0019455 k( 397) = ( 0.5000000 0.3258929 0.6741071), wk = 0.0019455 k( 398) = ( 0.5000000 0.3303571 0.6696429), wk = 0.0019455 k( 399) = ( 0.5000000 0.3348214 0.6651786), wk = 0.0019455 k( 400) = ( 0.5000000 0.3392857 0.6607143), wk = 0.0019455 k( 401) = ( 0.5000000 0.3437500 0.6562500), wk = 0.0019455 k( 402) = ( 0.5000000 0.3482143 0.6517857), wk = 0.0019455 k( 403) = ( 0.5000000 0.3526786 0.6473214), wk = 0.0019455 k( 404) = ( 0.5000000 0.3571429 0.6428571), wk = 0.0019455 k( 405) = ( 0.5000000 0.3616071 0.6383929), wk = 0.0019455 k( 406) = ( 0.5000000 0.3660714 0.6339286), wk = 0.0019455 k( 407) = ( 0.5000000 0.3705357 0.6294643), wk = 0.0019455 k( 408) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0019455 k( 409) = ( 0.5000000 0.3794643 0.6205357), wk = 0.0019455 k( 410) = ( 0.5000000 0.3839286 0.6160714), wk = 0.0019455 k( 411) = ( 0.5000000 0.3883929 0.6116071), wk = 0.0019455 k( 412) = ( 0.5000000 0.3928571 0.6071429), wk = 0.0019455 k( 413) = ( 0.5000000 0.3973214 0.6026786), wk = 0.0019455 k( 414) = ( 0.5000000 0.4017857 0.5982143), wk = 0.0019455 k( 415) = ( 0.5000000 0.4062500 0.5937500), wk = 0.0019455 k( 416) = ( 0.5000000 0.4107143 0.5892857), wk = 0.0019455 k( 417) = ( 0.5000000 0.4151786 0.5848214), wk = 0.0019455 k( 418) = ( 0.5000000 0.4196429 0.5803571), wk = 0.0019455 k( 419) = ( 0.5000000 0.4241071 0.5758929), wk = 0.0019455 k( 420) = ( 0.5000000 0.4285714 0.5714286), wk = 0.0019455 k( 421) = ( 0.5000000 0.4330357 0.5669643), wk = 0.0019455 k( 422) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0019455 k( 423) = ( 0.5000000 0.4419643 0.5580357), wk = 0.0019455 k( 424) = ( 0.5000000 0.4464286 0.5535714), wk = 0.0019455 k( 425) = ( 0.5000000 0.4508929 0.5491071), wk = 0.0019455 k( 426) = ( 0.5000000 0.4553571 0.5446429), wk = 0.0019455 k( 427) = ( 0.5000000 0.4598214 0.5401786), wk = 0.0019455 k( 428) = ( 0.5000000 0.4642857 0.5357143), wk = 0.0019455 k( 429) = ( 0.5000000 0.4687500 0.5312500), wk = 0.0019455 k( 430) = ( 0.5000000 0.4732143 0.5267857), wk = 0.0019455 k( 431) = ( 0.5000000 0.4776786 0.5223214), wk = 0.0019455 k( 432) = ( 0.5000000 0.4821429 0.5178571), wk = 0.0019455 k( 433) = ( 0.5000000 0.4866071 0.5133929), wk = 0.0019455 k( 434) = ( 0.5000000 0.4910714 0.5089286), wk = 0.0019455 k( 435) = ( 0.5000000 0.4955357 0.5044643), wk = 0.0019455 k( 436) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019455 k( 437) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019455 k( 438) = ( 0.4973958 0.4973958 0.5052083), wk = 0.0019455 k( 439) = ( 0.4947917 0.4947917 0.5104167), wk = 0.0019455 k( 440) = ( 0.4921875 0.4921875 0.5156250), wk = 0.0019455 k( 441) = ( 0.4895833 0.4895833 0.5208333), wk = 0.0019455 k( 442) = ( 0.4869792 0.4869792 0.5260417), wk = 0.0019455 k( 443) = ( 0.4843750 0.4843750 0.5312500), wk = 0.0019455 k( 444) = ( 0.4817708 0.4817708 0.5364583), wk = 0.0019455 k( 445) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0019455 k( 446) = ( 0.4765625 0.4765625 0.5468750), wk = 0.0019455 k( 447) = ( 0.4739583 0.4739583 0.5520833), wk = 0.0019455 k( 448) = ( 0.4713542 0.4713542 0.5572917), wk = 0.0019455 k( 449) = ( 0.4687500 0.4687500 0.5625000), wk = 0.0019455 k( 450) = ( 0.4661458 0.4661458 0.5677083), wk = 0.0019455 k( 451) = ( 0.4635417 0.4635417 0.5729167), wk = 0.0019455 k( 452) = ( 0.4609375 0.4609375 0.5781250), wk = 0.0019455 k( 453) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0019455 k( 454) = ( 0.4557292 0.4557292 0.5885417), wk = 0.0019455 k( 455) = ( 0.4531250 0.4531250 0.5937500), wk = 0.0019455 k( 456) = ( 0.4505208 0.4505208 0.5989583), wk = 0.0019455 k( 457) = ( 0.4479167 0.4479167 0.6041667), wk = 0.0019455 k( 458) = ( 0.4453125 0.4453125 0.6093750), wk = 0.0019455 k( 459) = ( 0.4427083 0.4427083 0.6145833), wk = 0.0019455 k( 460) = ( 0.4401042 0.4401042 0.6197917), wk = 0.0019455 k( 461) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0019455 k( 462) = ( 0.4348958 0.4348958 0.6302083), wk = 0.0019455 k( 463) = ( 0.4322917 0.4322917 0.6354167), wk = 0.0019455 k( 464) = ( 0.4296875 0.4296875 0.6406250), wk = 0.0019455 k( 465) = ( 0.4270833 0.4270833 0.6458333), wk = 0.0019455 k( 466) = ( 0.4244792 0.4244792 0.6510417), wk = 0.0019455 k( 467) = ( 0.4218750 0.4218750 0.6562500), wk = 0.0019455 k( 468) = ( 0.4192708 0.4192708 0.6614583), wk = 0.0019455 k( 469) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0019455 k( 470) = ( 0.4140625 0.4140625 0.6718750), wk = 0.0019455 k( 471) = ( 0.4114583 0.4114583 0.6770833), wk = 0.0019455 k( 472) = ( 0.4088542 0.4088542 0.6822917), wk = 0.0019455 k( 473) = ( 0.4062500 0.4062500 0.6875000), wk = 0.0019455 k( 474) = ( 0.4036458 0.4036458 0.6927083), wk = 0.0019455 k( 475) = ( 0.4010417 0.4010417 0.6979167), wk = 0.0019455 k( 476) = ( 0.3984375 0.3984375 0.7031250), wk = 0.0019455 k( 477) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0019455 k( 478) = ( 0.3932292 0.3932292 0.7135417), wk = 0.0019455 k( 479) = ( 0.3906250 0.3906250 0.7187500), wk = 0.0019455 k( 480) = ( 0.3880208 0.3880208 0.7239583), wk = 0.0019455 k( 481) = ( 0.3854167 0.3854167 0.7291667), wk = 0.0019455 k( 482) = ( 0.3828125 0.3828125 0.7343750), wk = 0.0019455 k( 483) = ( 0.3802083 0.3802083 0.7395833), wk = 0.0019455 k( 484) = ( 0.3776042 0.3776042 0.7447917), wk = 0.0019455 k( 485) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0019455 k( 486) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0019455 k( 487) = ( 0.6205357 0.2410714 0.6205357), wk = 0.0019455 k( 488) = ( 0.6160714 0.2321429 0.6160714), wk = 0.0019455 k( 489) = ( 0.6116071 0.2232143 0.6116071), wk = 0.0019455 k( 490) = ( 0.6071429 0.2142857 0.6071429), wk = 0.0019455 k( 491) = ( 0.6026786 0.2053571 0.6026786), wk = 0.0019455 k( 492) = ( 0.5982143 0.1964286 0.5982143), wk = 0.0019455 k( 493) = ( 0.5937500 0.1875000 0.5937500), wk = 0.0019455 k( 494) = ( 0.5892857 0.1785714 0.5892857), wk = 0.0019455 k( 495) = ( 0.5848214 0.1696429 0.5848214), wk = 0.0019455 k( 496) = ( 0.5803571 0.1607143 0.5803571), wk = 0.0019455 k( 497) = ( 0.5758929 0.1517857 0.5758929), wk = 0.0019455 k( 498) = ( 0.5714286 0.1428571 0.5714286), wk = 0.0019455 k( 499) = ( 0.5669643 0.1339286 0.5669643), wk = 0.0019455 k( 500) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0019455 k( 501) = ( 0.5580357 0.1160714 0.5580357), wk = 0.0019455 k( 502) = ( 0.5535714 0.1071429 0.5535714), wk = 0.0019455 k( 503) = ( 0.5491071 0.0982143 0.5491071), wk = 0.0019455 k( 504) = ( 0.5446429 0.0892857 0.5446429), wk = 0.0019455 k( 505) = ( 0.5401786 0.0803571 0.5401786), wk = 0.0019455 k( 506) = ( 0.5357143 0.0714286 0.5357143), wk = 0.0019455 k( 507) = ( 0.5312500 0.0625000 0.5312500), wk = 0.0019455 k( 508) = ( 0.5267857 0.0535714 0.5267857), wk = 0.0019455 k( 509) = ( 0.5223214 0.0446429 0.5223214), wk = 0.0019455 k( 510) = ( 0.5178571 0.0357143 0.5178571), wk = 0.0019455 k( 511) = ( 0.5133929 0.0267857 0.5133929), wk = 0.0019455 k( 512) = ( 0.5089286 0.0178571 0.5089286), wk = 0.0019455 k( 513) = ( 0.5044643 0.0089286 0.5044643), wk = 0.0019455 k( 514) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0019455 Dense grid: 11017 G-vectors FFT dimensions: ( 32, 32, 32) Smooth grid: 10777 G-vectors FFT dimensions: ( 32, 32, 32) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.03 Mb ( 88, 26) NL pseudopotentials 0.03 Mb ( 44, 48) Each V/rho on FFT grid 0.02 Mb ( 1024) Each G-vector array 0.00 Mb ( 307) G-vector shells 0.00 Mb ( 114) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.14 Mb ( 88, 104) Each subspace H/S matrix 0.01 Mb ( 26, 26) Each matrix 0.04 Mb ( 48, 2, 26) Check: negative/imaginary core charge= -0.000011 0.000000 The potential is recalculated from file : ./CrC.save/charge-density.dat Starting wfc are 28 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.0 secs Computing kpt #: 2 total cpu time spent up to now is 2.1 secs Computing kpt #: 3 total cpu time spent up to now is 2.1 secs Computing kpt #: 4 total cpu time spent up to now is 2.2 secs Computing kpt #: 5 total cpu time spent up to now is 2.2 secs Computing kpt #: 6 total cpu time spent up to now is 2.3 secs Computing kpt #: 7 total cpu time spent up to now is 2.4 secs Computing kpt #: 8 total cpu time spent up to now is 2.4 secs Computing kpt #: 9 total cpu time spent up to now is 2.5 secs Computing kpt #: 10 total cpu time spent up to now is 2.5 secs Computing kpt #: 11 total cpu time spent up to now is 2.6 secs Computing kpt #: 12 total cpu time spent up to now is 2.6 secs Computing kpt #: 13 total cpu time spent up to now is 2.7 secs Computing kpt #: 14 total cpu time spent up to now is 2.8 secs Computing kpt #: 15 total cpu time spent up to now is 2.8 secs Computing kpt #: 16 total cpu time spent up to now is 2.9 secs Computing kpt #: 17 total cpu time spent up to now is 2.9 secs Computing kpt #: 18 total cpu time spent up to now is 3.0 secs Computing kpt #: 19 total cpu time spent up to now is 3.1 secs Computing kpt #: 20 total cpu time spent up to now is 3.1 secs Computing kpt #: 21 total cpu time spent up to now is 3.2 secs Computing kpt #: 22 total cpu time spent up to now is 3.3 secs Computing kpt #: 23 total cpu time spent up to now is 3.3 secs Computing kpt #: 24 total cpu time spent up to now is 3.4 secs Computing kpt #: 25 total cpu time spent up to now is 3.4 secs Computing kpt #: 26 total cpu time spent up to now is 3.5 secs Computing kpt #: 27 total cpu time spent up to now is 3.6 secs Computing kpt #: 28 total cpu time spent up to now is 3.6 secs Computing kpt #: 29 total cpu time spent up to now is 3.7 secs Computing kpt #: 30 total cpu time spent up to now is 3.8 secs Computing kpt #: 31 total cpu time spent up to now is 3.8 secs Computing kpt #: 32 total cpu time spent up to now is 3.9 secs Computing kpt #: 33 total cpu time spent up to now is 3.9 secs Computing kpt #: 34 total cpu time spent up to now is 4.0 secs Computing kpt #: 35 total cpu time spent up to now is 4.1 secs Computing kpt #: 36 total cpu time spent up to now is 4.1 secs Computing kpt #: 37 total cpu time spent up to now is 4.2 secs Computing kpt #: 38 total cpu time spent up to now is 4.2 secs Computing kpt #: 39 total cpu time spent up to now is 4.3 secs Computing kpt #: 40 total cpu time spent up to now is 4.4 secs Computing kpt #: 41 total cpu time spent up to now is 4.4 secs Computing kpt #: 42 total cpu time spent up to now is 4.5 secs Computing kpt #: 43 total cpu time spent up to now is 4.6 secs Computing kpt #: 44 total cpu time spent up to now is 4.6 secs Computing kpt #: 45 total cpu time spent up to now is 4.7 secs Computing kpt #: 46 total cpu time spent up to now is 4.7 secs Computing kpt #: 47 total cpu time spent up to now is 4.8 secs Computing kpt #: 48 total cpu time spent up to now is 4.9 secs Computing kpt #: 49 total cpu time spent up to now is 4.9 secs Computing kpt #: 50 total cpu time spent up to now is 5.0 secs Computing kpt #: 51 total cpu time spent up to now is 5.1 secs Computing kpt #: 52 total cpu time spent up to now is 5.1 secs Computing kpt #: 53 total cpu time spent up to now is 5.2 secs Computing kpt #: 54 total cpu time spent up to now is 5.2 secs Computing kpt #: 55 total cpu time spent up to now is 5.3 secs Computing kpt #: 56 total cpu time spent up to now is 5.4 secs Computing kpt #: 57 total cpu time spent up to now is 5.4 secs Computing kpt #: 58 total cpu time spent up to now is 5.5 secs Computing kpt #: 59 total cpu time spent up to now is 5.6 secs Computing kpt #: 60 total cpu time spent up to now is 5.6 secs Computing kpt #: 61 total cpu time spent up to now is 5.7 secs Computing kpt #: 62 total cpu time spent up to now is 5.7 secs Computing kpt #: 63 total cpu time spent up to now is 5.8 secs Computing kpt #: 64 total cpu time spent up to now is 5.9 secs Computing kpt #: 65 total cpu time spent up to now is 5.9 secs Computing kpt #: 66 total cpu time spent up to now is 6.0 secs Computing kpt #: 67 total cpu time spent up to now is 6.1 secs Computing kpt #: 68 total cpu time spent up to now is 6.1 secs Computing kpt #: 69 total cpu time spent up to now is 6.2 secs Computing kpt #: 70 total cpu time spent up to now is 6.3 secs Computing kpt #: 71 total cpu time spent up to now is 6.3 secs Computing kpt #: 72 total cpu time spent up to now is 6.4 secs Computing kpt #: 73 total cpu time spent up to now is 6.5 secs Computing kpt #: 74 total cpu time spent up to now is 6.5 secs Computing kpt #: 75 total cpu time spent up to now is 6.6 secs Computing kpt #: 76 total cpu time spent up to now is 6.7 secs Computing kpt #: 77 total cpu time spent up to now is 6.7 secs Computing kpt #: 78 total cpu time spent up to now is 6.8 secs Computing kpt #: 79 total cpu time spent up to now is 6.9 secs Computing kpt #: 80 total cpu time spent up to now is 6.9 secs Computing kpt #: 81 total cpu time spent up to now is 7.0 secs Computing kpt #: 82 total cpu time spent up to now is 7.1 secs Computing kpt #: 83 total cpu time spent up to now is 7.1 secs Computing kpt #: 84 total cpu time spent up to now is 7.2 secs Computing kpt #: 85 total cpu time spent up to now is 7.3 secs Computing kpt #: 86 total cpu time spent up to now is 7.3 secs Computing kpt #: 87 total cpu time spent up to now is 7.4 secs Computing kpt #: 88 total cpu time spent up to now is 7.5 secs Computing kpt #: 89 total cpu time spent up to now is 7.5 secs Computing kpt #: 90 total cpu time spent up to now is 7.6 secs Computing kpt #: 91 total cpu time spent up to now is 7.6 secs Computing kpt #: 92 total cpu time spent up to now is 7.7 secs Computing kpt #: 93 total cpu time spent up to now is 7.8 secs Computing kpt #: 94 total cpu time spent up to now is 7.8 secs Computing kpt #: 95 total cpu time spent up to now is 7.9 secs Computing kpt #: 96 total cpu time spent up to now is 8.0 secs Computing kpt #: 97 total cpu time spent up to now is 8.0 secs Computing kpt #: 98 total cpu time spent up to now is 8.1 secs Computing kpt #: 99 total cpu time spent up to now is 8.2 secs Computing kpt #: 100 total cpu time spent up to now is 8.2 secs Computing kpt #: 101 total cpu time spent up to now is 8.3 secs Computing kpt #: 102 total cpu time spent up to now is 8.4 secs Computing kpt #: 103 total cpu time spent up to now is 8.4 secs Computing kpt #: 104 total cpu time spent up to now is 8.5 secs Computing kpt #: 105 total cpu time spent up to now is 8.6 secs Computing kpt #: 106 total cpu time spent up to now is 8.6 secs Computing kpt #: 107 total cpu time spent up to now is 8.7 secs Computing kpt #: 108 total cpu time spent up to now is 8.8 secs Computing kpt #: 109 total cpu time spent up to now is 8.8 secs Computing kpt #: 110 total cpu time spent up to now is 8.9 secs Computing kpt #: 111 total cpu time spent up to now is 9.0 secs Computing kpt #: 112 total cpu time spent up to now is 9.0 secs Computing kpt #: 113 total cpu time spent up to now is 9.1 secs Computing kpt #: 114 total cpu time spent up to now is 9.1 secs Computing kpt #: 115 total cpu time spent up to now is 9.2 secs Computing kpt #: 116 total cpu time spent up to now is 9.3 secs Computing kpt #: 117 total cpu time spent up to now is 9.3 secs Computing kpt #: 118 total cpu time spent up to now is 9.4 secs Computing kpt #: 119 total cpu time spent up to now is 9.5 secs Computing kpt #: 120 total cpu time spent up to now is 9.5 secs Computing kpt #: 121 total cpu time spent up to now is 9.6 secs Computing kpt #: 122 total cpu time spent up to now is 9.7 secs Computing kpt #: 123 total cpu time spent up to now is 9.8 secs Computing kpt #: 124 total cpu time spent up to now is 9.8 secs Computing kpt #: 125 total cpu time spent up to now is 9.9 secs Computing kpt #: 126 total cpu time spent up to now is 9.9 secs Computing kpt #: 127 total cpu time spent up to now is 10.0 secs Computing kpt #: 128 total cpu time spent up to now is 10.1 secs Computing kpt #: 129 total cpu time spent up to now is 10.2 secs Computing kpt #: 130 total cpu time spent up to now is 10.2 secs Computing kpt #: 131 total cpu time spent up to now is 10.3 secs Computing kpt #: 132 total cpu time spent up to now is 10.3 secs Computing kpt #: 133 total cpu time spent up to now is 10.4 secs Computing kpt #: 134 total cpu time spent up to now is 10.5 secs Computing kpt #: 135 total cpu time spent up to now is 10.5 secs Computing kpt #: 136 total cpu time spent up to now is 10.6 secs Computing kpt #: 137 total cpu time spent up to now is 10.7 secs Computing kpt #: 138 total cpu time spent up to now is 10.7 secs Computing kpt #: 139 total cpu time spent up to now is 10.8 secs Computing kpt #: 140 total cpu time spent up to now is 10.8 secs Computing kpt #: 141 total cpu time spent up to now is 10.9 secs Computing kpt #: 142 total cpu time spent up to now is 11.0 secs Computing kpt #: 143 total cpu time spent up to now is 11.1 secs Computing kpt #: 144 total cpu time spent up to now is 11.1 secs Computing kpt #: 145 total cpu time spent up to now is 11.2 secs Computing kpt #: 146 total cpu time spent up to now is 11.2 secs Computing kpt #: 147 total cpu time spent up to now is 11.3 secs Computing kpt #: 148 total cpu time spent up to now is 11.4 secs Computing kpt #: 149 total cpu time spent up to now is 11.4 secs Computing kpt #: 150 total cpu time spent up to now is 11.5 secs Computing kpt #: 151 total cpu time spent up to now is 11.6 secs Computing kpt #: 152 total cpu time spent up to now is 11.6 secs Computing kpt #: 153 total cpu time spent up to now is 11.7 secs Computing kpt #: 154 total cpu time spent up to now is 11.7 secs Computing kpt #: 155 total cpu time spent up to now is 11.8 secs Computing kpt #: 156 total cpu time spent up to now is 11.9 secs Computing kpt #: 157 total cpu time spent up to now is 11.9 secs Computing kpt #: 158 total cpu time spent up to now is 12.0 secs Computing kpt #: 159 total cpu time spent up to now is 12.1 secs Computing kpt #: 160 total cpu time spent up to now is 12.1 secs Computing kpt #: 161 total cpu time spent up to now is 12.2 secs Computing kpt #: 162 total cpu time spent up to now is 12.2 secs Computing kpt #: 163 total cpu time spent up to now is 12.3 secs Computing kpt #: 164 total cpu time spent up to now is 12.4 secs Computing kpt #: 165 total cpu time spent up to now is 12.4 secs Computing kpt #: 166 total cpu time spent up to now is 12.5 secs Computing kpt #: 167 total cpu time spent up to now is 12.6 secs Computing kpt #: 168 total cpu time spent up to now is 12.6 secs Computing kpt #: 169 total cpu time spent up to now is 12.7 secs Computing kpt #: 170 total cpu time spent up to now is 12.7 secs Computing kpt #: 171 total cpu time spent up to now is 12.8 secs Computing kpt #: 172 total cpu time spent up to now is 12.9 secs Computing kpt #: 173 total cpu time spent up to now is 12.9 secs Computing kpt #: 174 total cpu time spent up to now is 13.0 secs Computing kpt #: 175 total cpu time spent up to now is 13.1 secs Computing kpt #: 176 total cpu time spent up to now is 13.1 secs Computing kpt #: 177 total cpu time spent up to now is 13.2 secs Computing kpt #: 178 total cpu time spent up to now is 13.3 secs Computing kpt #: 179 total cpu time spent up to now is 13.3 secs Computing kpt #: 180 total cpu time spent up to now is 13.4 secs Computing kpt #: 181 total cpu time spent up to now is 13.4 secs Computing kpt #: 182 total cpu time spent up to now is 13.5 secs Computing kpt #: 183 total cpu time spent up to now is 13.6 secs Computing kpt #: 184 total cpu time spent up to now is 13.6 secs Computing kpt #: 185 total cpu time spent up to now is 13.7 secs Computing kpt #: 186 total cpu time spent up to now is 13.7 secs Computing kpt #: 187 total cpu time spent up to now is 13.8 secs Computing kpt #: 188 total cpu time spent up to now is 13.9 secs Computing kpt #: 189 total cpu time spent up to now is 13.9 secs Computing kpt #: 190 total cpu time spent up to now is 14.0 secs Computing kpt #: 191 total cpu time spent up to now is 14.0 secs Computing kpt #: 192 total cpu time spent up to now is 14.1 secs Computing kpt #: 193 total cpu time spent up to now is 14.2 secs Computing kpt #: 194 total cpu time spent up to now is 14.2 secs Computing kpt #: 195 total cpu time spent up to now is 14.3 secs Computing kpt #: 196 total cpu time spent up to now is 14.3 secs Computing kpt #: 197 total cpu time spent up to now is 14.4 secs Computing kpt #: 198 total cpu time spent up to now is 14.5 secs Computing kpt #: 199 total cpu time spent up to now is 14.5 secs Computing kpt #: 200 total cpu time spent up to now is 14.6 secs Computing kpt #: 201 total cpu time spent up to now is 14.6 secs Computing kpt #: 202 total cpu time spent up to now is 14.7 secs Computing kpt #: 203 total cpu time spent up to now is 14.7 secs Computing kpt #: 204 total cpu time spent up to now is 14.8 secs Computing kpt #: 205 total cpu time spent up to now is 14.9 secs Computing kpt #: 206 total cpu time spent up to now is 14.9 secs Computing kpt #: 207 total cpu time spent up to now is 15.0 secs Computing kpt #: 208 total cpu time spent up to now is 15.0 secs Computing kpt #: 209 total cpu time spent up to now is 15.1 secs Computing kpt #: 210 total cpu time spent up to now is 15.1 secs Computing kpt #: 211 total cpu time spent up to now is 15.2 secs Computing kpt #: 212 total cpu time spent up to now is 15.3 secs Computing kpt #: 213 total cpu time spent up to now is 15.3 secs Computing kpt #: 214 total cpu time spent up to now is 15.4 secs Computing kpt #: 215 total cpu time spent up to now is 15.4 secs Computing kpt #: 216 total cpu time spent up to now is 15.5 secs Computing kpt #: 217 total cpu time spent up to now is 15.6 secs Computing kpt #: 218 total cpu time spent up to now is 15.6 secs Computing kpt #: 219 total cpu time spent up to now is 15.7 secs Computing kpt #: 220 total cpu time spent up to now is 15.7 secs Computing kpt #: 221 total cpu time spent up to now is 15.8 secs Computing kpt #: 222 total cpu time spent up to now is 15.9 secs Computing kpt #: 223 total cpu time spent up to now is 15.9 secs Computing kpt #: 224 total cpu time spent up to now is 16.0 secs Computing kpt #: 225 total cpu time spent up to now is 16.0 secs Computing kpt #: 226 total cpu time spent up to now is 16.1 secs Computing kpt #: 227 total cpu time spent up to now is 16.1 secs Computing kpt #: 228 total cpu time spent up to now is 16.2 secs Computing kpt #: 229 total cpu time spent up to now is 16.3 secs Computing kpt #: 230 total cpu time spent up to now is 16.3 secs Computing kpt #: 231 total cpu time spent up to now is 16.4 secs Computing kpt #: 232 total cpu time spent up to now is 16.4 secs Computing kpt #: 233 total cpu time spent up to now is 16.5 secs Computing kpt #: 234 total cpu time spent up to now is 16.6 secs Computing kpt #: 235 total cpu time spent up to now is 16.6 secs Computing kpt #: 236 total cpu time spent up to now is 16.7 secs Computing kpt #: 237 total cpu time spent up to now is 16.7 secs Computing kpt #: 238 total cpu time spent up to now is 16.8 secs Computing kpt #: 239 total cpu time spent up to now is 16.8 secs Computing kpt #: 240 total cpu time spent up to now is 16.9 secs Computing kpt #: 241 total cpu time spent up to now is 17.0 secs Computing kpt #: 242 total cpu time spent up to now is 17.1 secs Computing kpt #: 243 total cpu time spent up to now is 17.1 secs Computing kpt #: 244 total cpu time spent up to now is 17.2 secs Computing kpt #: 245 total cpu time spent up to now is 17.2 secs Computing kpt #: 246 total cpu time spent up to now is 17.3 secs Computing kpt #: 247 total cpu time spent up to now is 17.4 secs Computing kpt #: 248 total cpu time spent up to now is 17.4 secs Computing kpt #: 249 total cpu time spent up to now is 17.5 secs Computing kpt #: 250 total cpu time spent up to now is 17.5 secs Computing kpt #: 251 total cpu time spent up to now is 17.6 secs Computing kpt #: 252 total cpu time spent up to now is 17.6 secs Computing kpt #: 253 total cpu time spent up to now is 17.7 secs Computing kpt #: 254 total cpu time spent up to now is 17.8 secs Computing kpt #: 255 total cpu time spent up to now is 17.9 secs Computing kpt #: 256 total cpu time spent up to now is 17.9 secs Computing kpt #: 257 total cpu time spent up to now is 18.0 secs Computing kpt #: 258 total cpu time spent up to now is 18.0 secs Computing kpt #: 259 total cpu time spent up to now is 18.1 secs Computing kpt #: 260 total cpu time spent up to now is 18.1 secs Computing kpt #: 261 total cpu time spent up to now is 18.2 secs Computing kpt #: 262 total cpu time spent up to now is 18.3 secs Computing kpt #: 263 total cpu time spent up to now is 18.3 secs Computing kpt #: 264 total cpu time spent up to now is 18.4 secs Computing kpt #: 265 total cpu time spent up to now is 18.4 secs Computing kpt #: 266 total cpu time spent up to now is 18.5 secs Computing kpt #: 267 total cpu time spent up to now is 18.6 secs Computing kpt #: 268 total cpu time spent up to now is 18.6 secs Computing kpt #: 269 total cpu time spent up to now is 18.7 secs Computing kpt #: 270 total cpu time spent up to now is 18.7 secs Computing kpt #: 271 total cpu time spent up to now is 18.8 secs Computing kpt #: 272 total cpu time spent up to now is 18.8 secs Computing kpt #: 273 total cpu time spent up to now is 18.9 secs Computing kpt #: 274 total cpu time spent up to now is 19.0 secs Computing kpt #: 275 total cpu time spent up to now is 19.0 secs Computing kpt #: 276 total cpu time spent up to now is 19.1 secs Computing kpt #: 277 total cpu time spent up to now is 19.1 secs Computing kpt #: 278 total cpu time spent up to now is 19.2 secs Computing kpt #: 279 total cpu time spent up to now is 19.3 secs Computing kpt #: 280 total cpu time spent up to now is 19.3 secs Computing kpt #: 281 total cpu time spent up to now is 19.4 secs Computing kpt #: 282 total cpu time spent up to now is 19.5 secs Computing kpt #: 283 total cpu time spent up to now is 19.5 secs Computing kpt #: 284 total cpu time spent up to now is 19.6 secs Computing kpt #: 285 total cpu time spent up to now is 19.7 secs Computing kpt #: 286 total cpu time spent up to now is 19.7 secs Computing kpt #: 287 total cpu time spent up to now is 19.8 secs Computing kpt #: 288 total cpu time spent up to now is 19.9 secs Computing kpt #: 289 total cpu time spent up to now is 19.9 secs Computing kpt #: 290 total cpu time spent up to now is 20.0 secs Computing kpt #: 291 total cpu time spent up to now is 20.1 secs Computing kpt #: 292 total cpu time spent up to now is 20.1 secs Computing kpt #: 293 total cpu time spent up to now is 20.2 secs Computing kpt #: 294 total cpu time spent up to now is 20.3 secs Computing kpt #: 295 total cpu time spent up to now is 20.3 secs Computing kpt #: 296 total cpu time spent up to now is 20.4 secs Computing kpt #: 297 total cpu time spent up to now is 20.5 secs Computing kpt #: 298 total cpu time spent up to now is 20.5 secs Computing kpt #: 299 total cpu time spent up to now is 20.6 secs Computing kpt #: 300 total cpu time spent up to now is 20.7 secs Computing kpt #: 301 total cpu time spent up to now is 20.7 secs Computing kpt #: 302 total cpu time spent up to now is 20.8 secs Computing kpt #: 303 total cpu time spent up to now is 20.9 secs Computing kpt #: 304 total cpu time spent up to now is 20.9 secs Computing kpt #: 305 total cpu time spent up to now is 21.0 secs Computing kpt #: 306 total cpu time spent up to now is 21.1 secs Computing kpt #: 307 total cpu time spent up to now is 21.2 secs Computing kpt #: 308 total cpu time spent up to now is 21.2 secs Computing kpt #: 309 total cpu time spent up to now is 21.3 secs Computing kpt #: 310 total cpu time spent up to now is 21.4 secs Computing kpt #: 311 total cpu time spent up to now is 21.4 secs Computing kpt #: 312 total cpu time spent up to now is 21.5 secs Computing kpt #: 313 total cpu time spent up to now is 21.6 secs Computing kpt #: 314 total cpu time spent up to now is 21.6 secs Computing kpt #: 315 total cpu time spent up to now is 21.7 secs Computing kpt #: 316 total cpu time spent up to now is 21.8 secs Computing kpt #: 317 total cpu time spent up to now is 21.8 secs Computing kpt #: 318 total cpu time spent up to now is 21.9 secs Computing kpt #: 319 total cpu time spent up to now is 22.0 secs Computing kpt #: 320 total cpu time spent up to now is 22.0 secs Computing kpt #: 321 total cpu time spent up to now is 22.1 secs Computing kpt #: 322 total cpu time spent up to now is 22.2 secs Computing kpt #: 323 total cpu time spent up to now is 22.2 secs Computing kpt #: 324 total cpu time spent up to now is 22.3 secs Computing kpt #: 325 total cpu time spent up to now is 22.4 secs Computing kpt #: 326 total cpu time spent up to now is 22.4 secs Computing kpt #: 327 total cpu time spent up to now is 22.5 secs Computing kpt #: 328 total cpu time spent up to now is 22.6 secs Computing kpt #: 329 total cpu time spent up to now is 22.6 secs Computing kpt #: 330 total cpu time spent up to now is 22.7 secs Computing kpt #: 331 total cpu time spent up to now is 22.7 secs Computing kpt #: 332 total cpu time spent up to now is 22.8 secs Computing kpt #: 333 total cpu time spent up to now is 22.9 secs Computing kpt #: 334 total cpu time spent up to now is 22.9 secs Computing kpt #: 335 total cpu time spent up to now is 23.0 secs Computing kpt #: 336 total cpu time spent up to now is 23.1 secs Computing kpt #: 337 total cpu time spent up to now is 23.1 secs Computing kpt #: 338 total cpu time spent up to now is 23.2 secs Computing kpt #: 339 total cpu time spent up to now is 23.3 secs Computing kpt #: 340 total cpu time spent up to now is 23.3 secs Computing kpt #: 341 total cpu time spent up to now is 23.4 secs Computing kpt #: 342 total cpu time spent up to now is 23.4 secs Computing kpt #: 343 total cpu time spent up to now is 23.5 secs Computing kpt #: 344 total cpu time spent up to now is 23.6 secs Computing kpt #: 345 total cpu time spent up to now is 23.6 secs Computing kpt #: 346 total cpu time spent up to now is 23.7 secs Computing kpt #: 347 total cpu time spent up to now is 23.8 secs Computing kpt #: 348 total cpu time spent up to now is 23.8 secs Computing kpt #: 349 total cpu time spent up to now is 23.9 secs Computing kpt #: 350 total cpu time spent up to now is 23.9 secs Computing kpt #: 351 total cpu time spent up to now is 24.0 secs Computing kpt #: 352 total cpu time spent up to now is 24.1 secs Computing kpt #: 353 total cpu time spent up to now is 24.1 secs Computing kpt #: 354 total cpu time spent up to now is 24.2 secs Computing kpt #: 355 total cpu time spent up to now is 24.2 secs Computing kpt #: 356 total cpu time spent up to now is 24.3 secs Computing kpt #: 357 total cpu time spent up to now is 24.4 secs Computing kpt #: 358 total cpu time spent up to now is 24.4 secs Computing kpt #: 359 total cpu time spent up to now is 24.5 secs Computing kpt #: 360 total cpu time spent up to now is 24.6 secs Computing kpt #: 361 total cpu time spent up to now is 24.6 secs Computing kpt #: 362 total cpu time spent up to now is 24.7 secs Computing kpt #: 363 total cpu time spent up to now is 24.8 secs Computing kpt #: 364 total cpu time spent up to now is 24.8 secs Computing kpt #: 365 total cpu time spent up to now is 24.9 secs Computing kpt #: 366 total cpu time spent up to now is 24.9 secs Computing kpt #: 367 total cpu time spent up to now is 25.0 secs Computing kpt #: 368 total cpu time spent up to now is 25.1 secs Computing kpt #: 369 total cpu time spent up to now is 25.1 secs Computing kpt #: 370 total cpu time spent up to now is 25.2 secs Computing kpt #: 371 total cpu time spent up to now is 25.2 secs Computing kpt #: 372 total cpu time spent up to now is 25.3 secs Computing kpt #: 373 total cpu time spent up to now is 25.4 secs Computing kpt #: 374 total cpu time spent up to now is 25.4 secs Computing kpt #: 375 total cpu time spent up to now is 25.5 secs Computing kpt #: 376 total cpu time spent up to now is 25.6 secs Computing kpt #: 377 total cpu time spent up to now is 25.6 secs Computing kpt #: 378 total cpu time spent up to now is 25.7 secs Computing kpt #: 379 total cpu time spent up to now is 25.8 secs Computing kpt #: 380 total cpu time spent up to now is 25.8 secs Computing kpt #: 381 total cpu time spent up to now is 25.9 secs Computing kpt #: 382 total cpu time spent up to now is 26.0 secs Computing kpt #: 383 total cpu time spent up to now is 26.0 secs Computing kpt #: 384 total cpu time spent up to now is 26.1 secs Computing kpt #: 385 total cpu time spent up to now is 26.2 secs Computing kpt #: 386 total cpu time spent up to now is 26.2 secs Computing kpt #: 387 total cpu time spent up to now is 26.3 secs Computing kpt #: 388 total cpu time spent up to now is 26.3 secs Computing kpt #: 389 total cpu time spent up to now is 26.4 secs Computing kpt #: 390 total cpu time spent up to now is 26.5 secs Computing kpt #: 391 total cpu time spent up to now is 26.5 secs Computing kpt #: 392 total cpu time spent up to now is 26.6 secs Computing kpt #: 393 total cpu time spent up to now is 26.6 secs Computing kpt #: 394 total cpu time spent up to now is 26.7 secs Computing kpt #: 395 total cpu time spent up to now is 26.8 secs Computing kpt #: 396 total cpu time spent up to now is 26.8 secs Computing kpt #: 397 total cpu time spent up to now is 26.9 secs Computing kpt #: 398 total cpu time spent up to now is 26.9 secs Computing kpt #: 399 total cpu time spent up to now is 27.0 secs Computing kpt #: 400 total cpu time spent up to now is 27.1 secs Computing kpt #: 401 total cpu time spent up to now is 27.1 secs Computing kpt #: 402 total cpu time spent up to now is 27.2 secs Computing kpt #: 403 total cpu time spent up to now is 27.3 secs Computing kpt #: 404 total cpu time spent up to now is 27.3 secs Computing kpt #: 405 total cpu time spent up to now is 27.4 secs Computing kpt #: 406 total cpu time spent up to now is 27.4 secs Computing kpt #: 407 total cpu time spent up to now is 27.5 secs Computing kpt #: 408 total cpu time spent up to now is 27.6 secs Computing kpt #: 409 total cpu time spent up to now is 27.6 secs Computing kpt #: 410 total cpu time spent up to now is 27.7 secs Computing kpt #: 411 total cpu time spent up to now is 27.8 secs Computing kpt #: 412 total cpu time spent up to now is 27.8 secs Computing kpt #: 413 total cpu time spent up to now is 27.9 secs Computing kpt #: 414 total cpu time spent up to now is 28.0 secs Computing kpt #: 415 total cpu time spent up to now is 28.0 secs Computing kpt #: 416 total cpu time spent up to now is 28.1 secs Computing kpt #: 417 total cpu time spent up to now is 28.2 secs Computing kpt #: 418 total cpu time spent up to now is 28.2 secs Computing kpt #: 419 total cpu time spent up to now is 28.3 secs Computing kpt #: 420 total cpu time spent up to now is 28.3 secs Computing kpt #: 421 total cpu time spent up to now is 28.4 secs Computing kpt #: 422 total cpu time spent up to now is 28.5 secs Computing kpt #: 423 total cpu time spent up to now is 28.6 secs Computing kpt #: 424 total cpu time spent up to now is 28.6 secs Computing kpt #: 425 total cpu time spent up to now is 28.7 secs Computing kpt #: 426 total cpu time spent up to now is 28.8 secs Computing kpt #: 427 total cpu time spent up to now is 28.9 secs Computing kpt #: 428 total cpu time spent up to now is 28.9 secs Computing kpt #: 429 total cpu time spent up to now is 29.0 secs Computing kpt #: 430 total cpu time spent up to now is 29.1 secs Computing kpt #: 431 total cpu time spent up to now is 29.1 secs Computing kpt #: 432 total cpu time spent up to now is 29.2 secs Computing kpt #: 433 total cpu time spent up to now is 29.3 secs Computing kpt #: 434 total cpu time spent up to now is 29.4 secs Computing kpt #: 435 total cpu time spent up to now is 29.4 secs Computing kpt #: 436 total cpu time spent up to now is 29.5 secs Computing kpt #: 437 total cpu time spent up to now is 29.6 secs Computing kpt #: 438 total cpu time spent up to now is 29.6 secs Computing kpt #: 439 total cpu time spent up to now is 29.7 secs Computing kpt #: 440 total cpu time spent up to now is 29.8 secs Computing kpt #: 441 total cpu time spent up to now is 29.8 secs Computing kpt #: 442 total cpu time spent up to now is 29.9 secs Computing kpt #: 443 total cpu time spent up to now is 30.0 secs Computing kpt #: 444 total cpu time spent up to now is 30.1 secs Computing kpt #: 445 total cpu time spent up to now is 30.1 secs Computing kpt #: 446 total cpu time spent up to now is 30.2 secs Computing kpt #: 447 total cpu time spent up to now is 30.3 secs Computing kpt #: 448 total cpu time spent up to now is 30.3 secs Computing kpt #: 449 total cpu time spent up to now is 30.4 secs Computing kpt #: 450 total cpu time spent up to now is 30.5 secs Computing kpt #: 451 total cpu time spent up to now is 30.5 secs Computing kpt #: 452 total cpu time spent up to now is 30.6 secs Computing kpt #: 453 total cpu time spent up to now is 30.7 secs Computing kpt #: 454 total cpu time spent up to now is 30.7 secs Computing kpt #: 455 total cpu time spent up to now is 30.8 secs Computing kpt #: 456 total cpu time spent up to now is 30.9 secs Computing kpt #: 457 total cpu time spent up to now is 30.9 secs Computing kpt #: 458 total cpu time spent up to now is 31.0 secs Computing kpt #: 459 total cpu time spent up to now is 31.0 secs Computing kpt #: 460 total cpu time spent up to now is 31.1 secs Computing kpt #: 461 total cpu time spent up to now is 31.2 secs Computing kpt #: 462 total cpu time spent up to now is 31.2 secs Computing kpt #: 463 total cpu time spent up to now is 31.3 secs Computing kpt #: 464 total cpu time spent up to now is 31.4 secs Computing kpt #: 465 total cpu time spent up to now is 31.4 secs Computing kpt #: 466 total cpu time spent up to now is 31.5 secs Computing kpt #: 467 total cpu time spent up to now is 31.6 secs Computing kpt #: 468 total cpu time spent up to now is 31.6 secs Computing kpt #: 469 total cpu time spent up to now is 31.7 secs Computing kpt #: 470 total cpu time spent up to now is 31.8 secs Computing kpt #: 471 total cpu time spent up to now is 31.8 secs Computing kpt #: 472 total cpu time spent up to now is 31.9 secs Computing kpt #: 473 total cpu time spent up to now is 31.9 secs Computing kpt #: 474 total cpu time spent up to now is 32.0 secs Computing kpt #: 475 total cpu time spent up to now is 32.1 secs Computing kpt #: 476 total cpu time spent up to now is 32.1 secs Computing kpt #: 477 total cpu time spent up to now is 32.2 secs Computing kpt #: 478 total cpu time spent up to now is 32.2 secs Computing kpt #: 479 total cpu time spent up to now is 32.3 secs Computing kpt #: 480 total cpu time spent up to now is 32.4 secs Computing kpt #: 481 total cpu time spent up to now is 32.4 secs Computing kpt #: 482 total cpu time spent up to now is 32.5 secs Computing kpt #: 483 total cpu time spent up to now is 32.6 secs Computing kpt #: 484 total cpu time spent up to now is 32.6 secs Computing kpt #: 485 total cpu time spent up to now is 32.7 secs Computing kpt #: 486 total cpu time spent up to now is 32.7 secs Computing kpt #: 487 total cpu time spent up to now is 32.8 secs Computing kpt #: 488 total cpu time spent up to now is 32.9 secs Computing kpt #: 489 total cpu time spent up to now is 32.9 secs Computing kpt #: 490 total cpu time spent up to now is 33.0 secs Computing kpt #: 491 total cpu time spent up to now is 33.0 secs Computing kpt #: 492 total cpu time spent up to now is 33.1 secs Computing kpt #: 493 total cpu time spent up to now is 33.2 secs Computing kpt #: 494 total cpu time spent up to now is 33.2 secs Computing kpt #: 495 total cpu time spent up to now is 33.3 secs Computing kpt #: 496 total cpu time spent up to now is 33.4 secs Computing kpt #: 497 total cpu time spent up to now is 33.4 secs Computing kpt #: 498 total cpu time spent up to now is 33.5 secs Computing kpt #: 499 total cpu time spent up to now is 33.6 secs Computing kpt #: 500 total cpu time spent up to now is 33.6 secs Computing kpt #: 501 total cpu time spent up to now is 33.7 secs Computing kpt #: 502 total cpu time spent up to now is 33.7 secs Computing kpt #: 503 total cpu time spent up to now is 33.8 secs Computing kpt #: 504 total cpu time spent up to now is 33.9 secs Computing kpt #: 505 total cpu time spent up to now is 33.9 secs Computing kpt #: 506 total cpu time spent up to now is 34.0 secs Computing kpt #: 507 total cpu time spent up to now is 34.1 secs Computing kpt #: 508 total cpu time spent up to now is 34.1 secs Computing kpt #: 509 total cpu time spent up to now is 34.2 secs Computing kpt #: 510 total cpu time spent up to now is 34.3 secs Computing kpt #: 511 total cpu time spent up to now is 34.3 secs Computing kpt #: 512 total cpu time spent up to now is 34.4 secs Computing kpt #: 513 total cpu time spent up to now is 34.4 secs Computing kpt #: 514 total cpu time spent up to now is 34.5 secs ethr = 5.56E-08, avg # of iterations = 7.3 total cpu time spent up to now is 34.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1363 PWs) bands (ev): -52.7994 -52.7994 -24.7006 -24.7006 -23.7161 -23.7161 -23.7161 -23.7161 4.1067 4.1067 17.3882 17.3882 17.3882 17.3882 17.4341 17.4341 18.3538 18.3538 18.3538 18.3538 20.1318 20.1318 20.1663 20.1663 20.1663 20.1663 k = 0.0064-0.0037 0.0052 ( 1363 PWs) bands (ev): -52.7994 -52.7994 -24.7006 -24.7006 -23.7163 -23.7163 -23.7162 -23.7162 4.1081 4.1081 17.3870 17.3870 17.3871 17.3871 17.4329 17.4329 18.3381 18.3381 18.3542 18.3542 20.1375 20.1375 20.1684 20.1684 20.1780 20.1780 k = 0.0128-0.0074 0.0105 ( 1363 PWs) bands (ev): -52.7993 -52.7993 -24.7009 -24.7009 -23.7166 -23.7166 -23.7164 -23.7164 4.1124 4.1124 17.3833 17.3833 17.3838 17.3838 17.4293 17.4293 18.2926 18.2926 18.3553 18.3553 20.1480 20.1480 20.1747 20.1747 20.2178 20.2178 k = 0.0192-0.0111 0.0157 ( 1363 PWs) bands (ev): -52.7991 -52.7991 -24.7013 -24.7013 -23.7172 -23.7172 -23.7167 -23.7167 4.1196 4.1196 17.3772 17.3772 17.3782 17.3782 17.4234 17.4234 18.2213 18.2213 18.3571 18.3571 20.1602 20.1602 20.1850 20.1850 20.2851 20.2851 k = 0.0256-0.0148 0.0209 ( 1363 PWs) bands (ev): -52.7989 -52.7989 -24.7019 -24.7019 -23.7181 -23.7181 -23.7170 -23.7170 4.1296 4.1296 17.3688 17.3688 17.3705 17.3705 17.4153 17.4153 18.1291 18.1291 18.3596 18.3596 20.1753 20.1753 20.1994 20.1994 20.3734 20.3734 k = 0.0321-0.0185 0.0262 ( 1363 PWs) bands (ev): -52.7986 -52.7986 -24.7026 -24.7026 -23.7191 -23.7191 -23.7176 -23.7176 4.1424 4.1424 17.3582 17.3582 17.3606 17.3606 17.4049 17.4049 18.0209 18.0209 18.3629 18.3629 20.1937 20.1937 20.2176 20.2176 20.4773 20.4773 k = 0.0385-0.0222 0.0314 ( 1359 PWs) bands (ev): -52.7970 -52.7970 -24.7033 -24.7033 -23.7201 -23.7201 -23.7181 -23.7181 4.1582 4.1582 17.3473 17.3473 17.3494 17.3494 17.3937 17.3937 17.9070 17.9070 18.3671 18.3671 20.2157 20.2157 20.2396 20.2396 20.5940 20.5940 k = 0.0449-0.0259 0.0366 ( 1359 PWs) bands (ev): -52.7966 -52.7966 -24.7044 -24.7044 -23.7216 -23.7216 -23.7189 -23.7189 4.1766 4.1766 17.3325 17.3325 17.3355 17.3355 17.3793 17.3793 17.7777 17.7777 18.3718 18.3718 20.2409 20.2409 20.2649 20.2649 20.7175 20.7175 k = 0.0513-0.0296 0.0419 ( 1351 PWs) bands (ev): -52.7938 -52.7938 -24.7052 -24.7052 -23.7229 -23.7229 -23.7194 -23.7194 4.1981 4.1981 17.3230 17.3230 17.3238 17.3238 17.3688 17.3688 17.6442 17.6442 18.3778 18.3778 20.2701 20.2701 20.2942 20.2942 20.8472 20.8472 k = 0.0577-0.0333 0.0471 ( 1351 PWs) bands (ev): -52.7933 -52.7933 -24.7066 -24.7066 -23.7249 -23.7249 -23.7204 -23.7204 4.2221 4.2221 17.3038 17.3038 17.3061 17.3061 17.3508 17.3508 17.5047 17.5047 18.3839 18.3839 20.3014 20.3014 20.3257 20.3257 20.9802 20.9802 k = 0.0641-0.0370 0.0523 ( 1351 PWs) bands (ev): -52.7927 -52.7927 -24.7081 -24.7081 -23.7274 -23.7274 -23.7211 -23.7211 4.2489 4.2489 17.2794 17.2794 17.2903 17.2903 17.3339 17.3339 17.3594 17.3594 18.3936 18.3936 20.3360 20.3360 20.3606 20.3606 21.1088 21.1088 k = 0.0705-0.0407 0.0576 ( 1343 PWs) bands (ev): -52.7899 -52.7899 -24.7094 -24.7094 -23.7293 -23.7293 -23.7221 -23.7221 4.2787 4.2787 17.1972 17.1972 17.2714 17.2714 17.2854 17.2854 17.3173 17.3173 18.4014 18.4014 20.3733 20.3733 20.3982 20.3982 21.2481 21.2481 k = 0.0769-0.0444 0.0628 ( 1343 PWs) bands (ev): -52.7893 -52.7893 -24.7113 -24.7113 -23.7319 -23.7319 -23.7233 -23.7233 4.3107 4.3107 17.0549 17.0549 17.2485 17.2485 17.2584 17.2584 17.2953 17.2953 18.4095 18.4095 20.4116 20.4116 20.4369 20.4369 21.3847 21.3847 k = 0.0833-0.0481 0.0680 ( 1343 PWs) bands (ev): -52.7886 -52.7886 -24.7132 -24.7132 -23.7348 -23.7348 -23.7247 -23.7247 4.3454 4.3454 16.9075 16.9075 17.2240 17.2240 17.2351 17.2351 17.2725 17.2725 18.4183 18.4183 20.4518 20.4518 20.4773 20.4773 21.5211 21.5211 k = 0.0897-0.0518 0.0733 ( 1343 PWs) bands (ev): -52.7879 -52.7879 -24.7153 -24.7153 -23.7379 -23.7379 -23.7262 -23.7262 4.3826 4.3826 16.7589 16.7589 17.1979 17.1979 17.2122 17.2122 17.2492 17.2492 18.4277 18.4277 20.4933 20.4933 20.5192 20.5192 21.6568 21.6568 k = 0.0962-0.0555 0.0785 ( 1331 PWs) bands (ev): -52.7837 -52.7837 -24.7171 -24.7171 -23.7407 -23.7407 -23.7270 -23.7270 4.4227 4.4227 16.6119 16.6119 17.1794 17.1794 17.1939 17.1939 17.2309 17.2309 18.4456 18.4456 20.5378 20.5378 20.5641 20.5641 21.7927 21.7927 k = 0.1026-0.0592 0.0837 ( 1331 PWs) bands (ev): -52.7829 -52.7829 -24.7195 -24.7195 -23.7442 -23.7442 -23.7286 -23.7286 4.4649 4.4649 16.4635 16.4635 17.1502 17.1502 17.1712 17.1712 17.2072 17.2072 18.4562 18.4562 20.5814 20.5814 20.6082 20.6082 21.9257 21.9257 k = 0.1090-0.0629 0.0890 ( 1331 PWs) bands (ev): -52.7820 -52.7820 -24.7220 -24.7220 -23.7478 -23.7478 -23.7303 -23.7303 4.5095 4.5095 16.3159 16.3159 17.1193 17.1193 17.1486 17.1486 17.1837 17.1837 18.4675 18.4675 20.6255 20.6255 20.6527 20.6527 22.0569 22.0569 k = 0.1154-0.0666 0.0942 ( 1331 PWs) bands (ev): -52.7810 -52.7810 -24.7246 -24.7246 -23.7516 -23.7516 -23.7322 -23.7322 4.5564 4.5564 16.1694 16.1694 17.0868 17.0868 17.1265 17.1265 17.1608 17.1608 18.4793 18.4793 20.6699 20.6699 20.6976 20.6976 22.1860 22.1860 k = 0.1218-0.0703 0.0994 ( 1331 PWs) bands (ev): -52.7800 -52.7800 -24.7274 -24.7274 -23.7556 -23.7556 -23.7341 -23.7341 4.6056 4.6056 16.0242 16.0242 17.0528 17.0528 17.1049 17.1049 17.1385 17.1385 18.4918 18.4918 20.7143 20.7143 20.7425 20.7425 22.3127 22.3127 k = 0.1282-0.0740 0.1047 ( 1327 PWs) bands (ev): -52.7779 -52.7779 -24.7301 -24.7301 -23.7598 -23.7598 -23.7356 -23.7356 4.6572 4.6572 15.8758 15.8758 17.0205 17.0205 17.0877 17.0877 17.1208 17.1208 18.5117 18.5117 20.7605 20.7605 20.7891 20.7891 22.4291 22.4291 k = 0.1346-0.0777 0.1099 ( 1327 PWs) bands (ev): -52.7768 -52.7768 -24.7332 -24.7332 -23.7641 -23.7641 -23.7377 -23.7377 4.7107 4.7107 15.7340 15.7340 16.9837 16.9837 17.0674 17.0674 17.1001 17.1001 18.5252 18.5252 20.8042 20.8042 20.8333 20.8333 22.5500 22.5500 k = 0.1410-0.0814 0.1151 ( 1327 PWs) bands (ev): -52.7757 -52.7757 -24.7363 -24.7363 -23.7685 -23.7685 -23.7398 -23.7398 4.7662 4.7662 15.5941 15.5941 16.9457 16.9457 17.0480 17.0480 17.0805 17.0805 18.5392 18.5392 20.8471 20.8471 20.8767 20.8767 22.6680 22.6680 k = 0.1474-0.0851 0.1204 ( 1327 PWs) bands (ev): -52.7746 -52.7746 -24.7395 -24.7395 -23.7731 -23.7731 -23.7420 -23.7420 4.8237 4.8237 15.4565 15.4565 16.9066 16.9066 17.0296 17.0296 17.0619 17.0619 18.5537 18.5537 20.8890 20.8890 20.9191 20.9191 22.7828 22.7828 k = 0.1538-0.0888 0.1256 ( 1327 PWs) bands (ev): -52.7734 -52.7734 -24.7428 -24.7428 -23.7778 -23.7778 -23.7443 -23.7443 4.8830 4.8830 15.3211 15.3211 16.8665 16.8665 17.0122 17.0122 17.0445 17.0445 18.5687 18.5687 20.9296 20.9296 20.9603 20.9603 22.8944 22.8944 k = 0.1603-0.0925 0.1308 ( 1327 PWs) bands (ev): -52.7722 -52.7722 -24.7463 -24.7463 -23.7826 -23.7826 -23.7467 -23.7467 4.9440 4.9440 15.1883 15.1883 16.8255 16.8255 16.9961 16.9961 17.0284 17.0284 18.5842 18.5842 20.9688 20.9688 21.0000 21.0000 23.0026 23.0026 k = 0.1667-0.0962 0.1361 ( 1335 PWs) bands (ev): -52.7732 -52.7732 -24.7501 -24.7501 -23.7878 -23.7878 -23.7496 -23.7496 5.0067 5.0067 15.0567 15.0567 16.7821 16.7821 16.9787 16.9787 17.0110 17.0110 18.5873 18.5873 21.0050 21.0050 21.0368 21.0368 23.1059 23.1059 k = 0.1731-0.0999 0.1413 ( 1335 PWs) bands (ev): -52.7719 -52.7719 -24.7537 -24.7537 -23.7929 -23.7929 -23.7521 -23.7521 5.0709 5.0709 14.9294 14.9294 16.7396 16.7396 16.9651 16.9651 16.9976 16.9976 18.6035 18.6035 21.0406 21.0406 21.0729 21.0729 23.2070 23.2070 k = 0.1795-0.1036 0.1466 ( 1335 PWs) bands (ev): -52.7706 -52.7706 -24.7574 -24.7574 -23.7980 -23.7980 -23.7546 -23.7546 5.1365 5.1365 14.8051 14.8051 16.6964 16.6964 16.9530 16.9530 16.9856 16.9856 18.6201 18.6201 21.0741 21.0741 21.1069 21.1069 23.3043 23.3043 k = 0.1859-0.1073 0.1518 ( 1335 PWs) bands (ev): -52.7692 -52.7692 -24.7612 -24.7612 -23.8032 -23.8032 -23.7572 -23.7572 5.2035 5.2035 14.6839 14.6839 16.6528 16.6528 16.9423 16.9423 16.9751 16.9751 18.6371 18.6371 21.1053 21.1053 21.1387 21.1387 23.3977 23.3977 k = 0.1923-0.1110 0.1570 ( 1335 PWs) bands (ev): -52.7678 -52.7678 -24.7650 -24.7650 -23.8085 -23.8085 -23.7598 -23.7598 5.2716 5.2716 14.5660 14.5660 16.6087 16.6087 16.9331 16.9331 16.9661 16.9661 18.6544 18.6544 21.1341 21.1341 21.1681 21.1681 23.4872 23.4872 k = 0.1987-0.1147 0.1623 ( 1327 PWs) bands (ev): -52.7640 -52.7640 -24.7686 -24.7686 -23.8135 -23.8135 -23.7619 -23.7619 5.3409 5.3409 14.4530 14.4530 16.5720 16.5720 16.9269 16.9269 16.9601 16.9601 18.6764 18.6764 21.1623 21.1623 21.1968 21.1968 23.5748 23.5748 k = 0.2051-0.1184 0.1675 ( 1335 PWs) bands (ev): -52.7649 -52.7649 -24.7729 -24.7729 -23.8194 -23.8194 -23.7650 -23.7650 5.4107 5.4107 14.3421 14.3421 16.5224 16.5224 16.9162 16.9162 16.9496 16.9496 18.6935 18.6935 21.1815 21.1815 21.2166 21.2166 23.6560 23.6560 k = 0.2115-0.1221 0.1727 ( 1335 PWs) bands (ev): -52.7634 -52.7634 -24.7769 -24.7769 -23.8248 -23.8248 -23.7677 -23.7677 5.4813 5.4813 14.2349 14.2349 16.4773 16.4773 16.9117 16.9117 16.9454 16.9454 18.7116 18.7116 21.2021 21.2021 21.2378 21.2378 23.7331 23.7331 k = 0.2179-0.1258 0.1780 ( 1335 PWs) bands (ev): -52.7620 -52.7620 -24.7809 -24.7809 -23.8303 -23.8303 -23.7705 -23.7705 5.5526 5.5526 14.1317 14.1317 16.4321 16.4321 16.9089 16.9089 16.9429 16.9429 18.7301 18.7301 21.2198 21.2198 21.2560 21.2560 23.8059 23.8059 k = 0.2244-0.1295 0.1832 ( 1335 PWs) bands (ev): -52.7605 -52.7605 -24.7850 -24.7850 -23.8358 -23.8358 -23.7732 -23.7732 5.6242 5.6242 14.0324 14.0324 16.3868 16.3868 16.9078 16.9078 16.9421 16.9421 18.7487 18.7487 21.2345 21.2345 21.2712 21.2712 23.8743 23.8743 k = 0.2308-0.1332 0.1884 ( 1335 PWs) bands (ev): -52.7589 -52.7589 -24.7891 -24.7891 -23.8413 -23.8413 -23.7760 -23.7760 5.6960 5.6960 13.9373 13.9373 16.3416 16.3416 16.9084 16.9084 16.9430 16.9430 18.7675 18.7675 21.2461 21.2461 21.2834 21.2834 23.9381 23.9381 k = 0.2372-0.1369 0.1937 ( 1331 PWs) bands (ev): -52.7562 -52.7562 -24.7930 -24.7930 -23.8465 -23.8465 -23.7788 -23.7788 5.7682 5.7682 13.8489 13.8489 16.2965 16.2965 16.9111 16.9111 16.9460 16.9460 18.7865 18.7865 21.2553 21.2553 21.2932 21.2932 24.0076 24.0076 k = 0.2436-0.1406 0.1989 ( 1331 PWs) bands (ev): -52.7547 -52.7547 -24.7972 -24.7972 -23.8520 -23.8520 -23.7816 -23.7816 5.8399 5.8399 13.7623 13.7623 16.2516 16.2516 16.9151 16.9151 16.9503 16.9503 18.8056 18.8056 21.2606 21.2606 21.2989 21.2989 24.0621 24.0621 k = 0.2500-0.1443 0.2041 ( 1331 PWs) bands (ev): -52.7532 -52.7532 -24.8014 -24.8014 -23.8575 -23.8575 -23.7844 -23.7844 5.9113 5.9113 13.6804 13.6804 16.2070 16.2070 16.9207 16.9207 16.9564 16.9564 18.8247 18.8247 21.2626 21.2626 21.3015 21.3015 24.1117 24.1117 k = 0.2564-0.1480 0.2094 ( 1331 PWs) bands (ev): -52.7516 -52.7516 -24.8055 -24.8055 -23.8630 -23.8630 -23.7873 -23.7873 5.9821 5.9821 13.6032 13.6032 16.1626 16.1626 16.9281 16.9281 16.9641 16.9641 18.8440 18.8440 21.2614 21.2614 21.3008 21.3008 24.1563 24.1563 k = 0.2628-0.1517 0.2146 ( 1331 PWs) bands (ev): -52.7501 -52.7501 -24.8097 -24.8097 -23.8685 -23.8685 -23.7901 -23.7901 6.0522 6.0522 13.5309 13.5309 16.1187 16.1187 16.9372 16.9372 16.9736 16.9736 18.8633 18.8633 21.2570 21.2570 21.2968 21.2968 24.1958 24.1958 k = 0.2692-0.1554 0.2198 ( 1331 PWs) bands (ev): -52.7485 -52.7485 -24.8138 -24.8138 -23.8739 -23.8739 -23.7929 -23.7929 6.1214 6.1214 13.4635 13.4635 16.0752 16.0752 16.9480 16.9480 16.9848 16.9848 18.8826 18.8826 21.2494 21.2494 21.2897 21.2897 24.2302 24.2302 k = 0.2756-0.1591 0.2251 ( 1331 PWs) bands (ev): -52.7469 -52.7469 -24.8180 -24.8180 -23.8793 -23.8793 -23.7957 -23.7957 6.1894 6.1894 13.4011 13.4011 16.0322 16.0322 16.9605 16.9605 16.9977 16.9977 18.9018 18.9018 21.2386 21.2386 21.2793 21.2793 24.2593 24.2593 k = 0.2821-0.1628 0.2303 ( 1331 PWs) bands (ev): -52.7453 -52.7453 -24.8221 -24.8221 -23.8847 -23.8847 -23.7984 -23.7984 6.2562 6.2562 13.3440 13.3440 15.9899 15.9899 16.9746 16.9746 17.0122 17.0122 18.9210 18.9210 21.2247 21.2247 21.2658 21.2658 24.2830 24.2830 k = 0.2885-0.1665 0.2355 ( 1323 PWs) bands (ev): -52.7415 -52.7415 -24.8258 -24.8258 -23.8893 -23.8893 -23.8010 -23.8010 6.3224 6.3224 13.2934 13.2934 15.9482 15.9482 16.9926 16.9926 17.0306 17.0306 18.9409 18.9409 21.2129 21.2129 21.2544 21.2544 24.3143 24.3143 k = 0.2949-0.1702 0.2408 ( 1327 PWs) bands (ev): -52.7412 -52.7412 -24.8300 -24.8300 -23.8947 -23.8947 -23.8040 -23.8040 6.3859 6.3859 13.2465 13.2465 15.9028 15.9028 17.0088 17.0088 17.0472 17.0472 18.9599 18.9599 21.1911 21.1911 21.2330 21.2330 24.3261 24.3261 k = 0.3013-0.1739 0.2460 ( 1327 PWs) bands (ev): -52.7397 -52.7397 -24.8340 -24.8340 -23.8999 -23.8999 -23.8067 -23.8067 6.4476 6.4476 13.2051 13.2051 15.8625 15.8625 17.0276 17.0276 17.0665 17.0665 18.9787 18.9787 21.1683 21.1683 21.2106 21.2106 24.3330 24.3330 k = 0.3077-0.1776 0.2512 ( 1327 PWs) bands (ev): -52.7382 -52.7382 -24.8380 -24.8380 -23.9049 -23.9049 -23.8094 -23.8094 6.5072 6.5072 13.1692 13.1692 15.8229 15.8229 17.0480 17.0480 17.0874 17.0874 18.9973 18.9973 21.1428 21.1428 21.1853 21.1853 24.3343 24.3343 k = 0.3141-0.1813 0.2565 ( 1327 PWs) bands (ev): -52.7367 -52.7367 -24.8419 -24.8419 -23.9099 -23.9099 -23.8120 -23.8120 6.5646 6.5646 13.1386 13.1386 15.7842 15.7842 17.0699 17.0699 17.1097 17.1097 19.0157 19.0157 21.1146 21.1146 21.1575 21.1575 24.3299 24.3299 k = 0.3205-0.1850 0.2617 ( 1335 PWs) bands (ev): -52.7375 -52.7375 -24.8461 -24.8461 -23.9154 -23.9154 -23.8146 -23.8146 6.6188 6.6188 13.1097 13.1097 15.7464 15.7464 17.0923 17.0923 17.1325 17.1325 19.0338 19.0338 21.0815 21.0815 21.1247 21.1247 24.2982 24.2982 k = 0.3269-0.1887 0.2669 ( 1335 PWs) bands (ev): -52.7361 -52.7361 -24.8499 -24.8499 -23.9202 -23.9202 -23.8171 -23.8171 6.6714 6.6714 13.0899 13.0899 15.7095 15.7095 17.1170 17.1170 17.1577 17.1577 19.0516 19.0516 21.0485 21.0485 21.0919 21.0919 24.2820 24.2820 k = 0.3333-0.1925 0.2722 ( 1331 PWs) bands (ev): -52.7336 -52.7336 -24.8534 -24.8534 -23.9245 -23.9245 -23.8196 -23.8196 6.7221 6.7221 13.0765 13.0765 15.6736 15.6736 17.1432 17.1432 17.1844 17.1844 19.0692 19.0692 21.0138 21.0138 21.0574 21.0574 24.2739 24.2739 k = 0.3397-0.1962 0.2774 ( 1331 PWs) bands (ev): -52.7323 -52.7323 -24.8570 -24.8570 -23.9290 -23.9290 -23.8220 -23.8220 6.7695 6.7695 13.0670 13.0670 15.6387 15.6387 17.1704 17.1704 17.2122 17.2122 19.0863 19.0863 20.9766 20.9766 21.0203 21.0203 24.2467 24.2467 k = 0.3462-0.1999 0.2826 ( 1335 PWs) bands (ev): -52.7321 -52.7321 -24.8607 -24.8607 -23.9336 -23.9336 -23.8245 -23.8245 6.8140 6.8140 13.0623 13.0623 15.6049 15.6049 17.1974 17.1974 17.2396 17.2396 19.1002 19.1002 20.9337 20.9337 20.9776 20.9776 24.2139 24.2139 k = 0.3526-0.2036 0.2879 ( 1335 PWs) bands (ev): -52.7308 -52.7308 -24.8641 -24.8641 -23.9379 -23.9379 -23.8268 -23.8268 6.8559 6.8559 13.0625 13.0625 15.5722 15.5722 17.2269 17.2269 17.2696 17.2696 19.1166 19.1166 20.8929 20.8929 20.9370 20.9370 24.1768 24.1768 k = 0.3590-0.2073 0.2931 ( 1327 PWs) bands (ev): -52.7272 -52.7272 -24.8671 -24.8671 -23.9415 -23.9415 -23.8287 -23.8287 6.8956 6.8956 13.0673 13.0673 15.5420 15.5420 17.2596 17.2596 17.3028 17.3028 19.1348 19.1348 20.8599 20.8599 20.9040 20.9040 24.1373 24.1373 k = 0.3654-0.2110 0.2983 ( 1327 PWs) bands (ev): -52.7260 -52.7260 -24.8703 -24.8703 -23.9455 -23.9455 -23.8308 -23.8308 6.9319 6.9319 13.0763 13.0763 15.5116 15.5116 17.2908 17.2908 17.3345 17.3345 19.1502 19.1502 20.8165 20.8165 20.8607 20.8607 24.0913 24.0913 k = 0.3718-0.2147 0.3036 ( 1327 PWs) bands (ev): -52.7249 -52.7249 -24.8734 -24.8734 -23.9493 -23.9493 -23.8329 -23.8329 6.9656 6.9656 13.0892 13.0892 15.4824 15.4824 17.3228 17.3228 17.3670 17.3670 19.1651 19.1651 20.7722 20.7722 20.8164 20.8164 24.0417 24.0417 k = 0.3782-0.2184 0.3088 ( 1327 PWs) bands (ev): -52.7238 -52.7238 -24.8764 -24.8764 -23.9531 -23.9531 -23.8348 -23.8348 6.9963 6.9963 13.1054 13.1054 15.4560 15.4560 17.3552 17.3552 17.3999 17.3999 19.1795 19.1795 20.7282 20.7282 20.7725 20.7725 23.9837 23.9837 k = 0.3846-0.2221 0.3140 ( 1335 PWs) bands (ev): -52.7251 -52.7251 -24.8796 -24.8796 -23.9569 -23.9569 -23.8373 -23.8373 7.0246 7.0246 13.1243 13.1243 15.4240 15.4240 17.3879 17.3879 17.4331 17.4331 19.1826 19.1826 20.6822 20.6822 20.7264 20.7264 23.9203 23.9203 k = 0.3910-0.2258 0.3193 ( 1335 PWs) bands (ev): -52.7241 -52.7241 -24.8823 -24.8823 -23.9602 -23.9602 -23.8391 -23.8391 7.0504 7.0504 13.1471 13.1471 15.3986 15.3986 17.4213 17.4213 17.4670 17.4670 19.1958 19.1958 20.6363 20.6363 20.6805 20.6805 23.8622 23.8622 k = 0.3974-0.2295 0.3245 ( 1347 PWs) bands (ev): -52.7265 -52.7265 -24.8855 -24.8855 -23.9642 -23.9642 -23.8413 -23.8413 7.0733 7.0733 13.1716 13.1716 15.3732 15.3732 17.4519 17.4519 17.4982 17.4982 19.2050 19.2050 20.5766 20.5766 20.6208 20.6208 23.7976 23.7976 k = 0.4038-0.2332 0.3297 ( 1339 PWs) bands (ev): -52.7233 -52.7233 -24.8876 -24.8876 -23.9667 -23.9667 -23.8427 -23.8427 7.0952 7.0952 13.1987 13.1987 15.3509 15.3509 17.4866 17.4866 17.5334 17.5334 19.2185 19.2185 20.5398 20.5398 20.5839 20.5839 23.7444 23.7444 k = 0.4103-0.2369 0.3350 ( 1339 PWs) bands (ev): -52.7226 -52.7226 -24.8899 -24.8899 -23.9695 -23.9695 -23.8443 -23.8443 7.1141 7.1141 13.2272 13.2272 15.3294 15.3294 17.5199 17.5199 17.5672 17.5672 19.2298 19.2298 20.4944 20.4944 20.5383 20.5383 23.6833 23.6833 k = 0.4167-0.2406 0.3402 ( 1339 PWs) bands (ev): -52.7218 -52.7218 -24.8921 -24.8921 -23.9722 -23.9722 -23.8457 -23.8457 7.1310 7.1310 13.2567 13.2567 15.3093 15.3093 17.5527 17.5527 17.6005 17.6005 19.2403 19.2403 20.4499 20.4499 20.4937 20.4937 23.6225 23.6225 k = 0.4231-0.2443 0.3454 ( 1338 PWs) bands (ev): -52.7208 -52.7208 -24.8941 -24.8941 -23.9745 -23.9745 -23.8471 -23.8471 7.1463 7.1463 13.2867 13.2867 15.2906 15.2906 17.5847 17.5847 17.6331 17.6331 19.2502 19.2502 20.4066 20.4066 20.4503 20.4503 23.5666 23.5666 k = 0.4295-0.2480 0.3507 ( 1338 PWs) bands (ev): -52.7201 -52.7201 -24.8960 -24.8960 -23.9768 -23.9768 -23.8483 -23.8483 7.1596 7.1596 13.3165 13.3165 15.2734 15.2734 17.6158 17.6158 17.6647 17.6647 19.2594 19.2594 20.3650 20.3650 20.4085 20.4085 23.5086 23.5086 k = 0.4359-0.2517 0.3559 ( 1338 PWs) bands (ev): -52.7195 -52.7195 -24.8978 -24.8978 -23.9789 -23.9789 -23.8495 -23.8495 7.1711 7.1711 13.3458 13.3458 15.2576 15.2576 17.6457 17.6457 17.6950 17.6950 19.2679 19.2679 20.3253 20.3253 20.3686 20.3686 23.4530 23.4530 k = 0.4423-0.2554 0.3611 ( 1338 PWs) bands (ev): -52.7189 -52.7189 -24.8994 -24.8994 -23.9809 -23.9809 -23.8506 -23.8506 7.1812 7.1812 13.3741 13.3741 15.2433 15.2433 17.6740 17.6740 17.7238 17.7238 19.2756 19.2756 20.2880 20.2880 20.3311 20.3311 23.4005 23.4005 k = 0.4487-0.2591 0.3664 ( 1338 PWs) bands (ev): -52.7184 -52.7184 -24.9008 -24.9008 -23.9826 -23.9826 -23.8515 -23.8515 7.1898 7.1898 13.4009 13.4009 15.2304 15.2304 17.7004 17.7004 17.7507 17.7507 19.2826 19.2826 20.2533 20.2533 20.2962 20.2962 23.3517 23.3517 k = 0.4551-0.2628 0.3716 ( 1338 PWs) bands (ev): -52.7179 -52.7179 -24.9020 -24.9020 -23.9841 -23.9841 -23.8523 -23.8523 7.1972 7.1972 13.4257 13.4257 15.2191 15.2191 17.7247 17.7247 17.7754 17.7754 19.2889 19.2889 20.2217 20.2217 20.2644 20.2644 23.3071 23.3071 k = 0.4615-0.2665 0.3768 ( 1338 PWs) bands (ev): -52.7175 -52.7175 -24.9031 -24.9031 -23.9854 -23.9854 -23.8531 -23.8531 7.2034 7.2034 13.4481 13.4481 15.2092 15.2092 17.7466 17.7466 17.7976 17.7976 19.2943 19.2943 20.1935 20.1935 20.2360 20.2360 23.2674 23.2674 k = 0.4679-0.2702 0.3821 ( 1338 PWs) bands (ev): -52.7171 -52.7171 -24.9041 -24.9041 -23.9865 -23.9865 -23.8537 -23.8537 7.2085 7.2085 13.4677 13.4677 15.2008 15.2008 17.7656 17.7656 17.8170 17.8170 19.2990 19.2990 20.1690 20.1690 20.2114 20.2114 23.2329 23.2329 k = 0.4744-0.2739 0.3873 ( 1338 PWs) bands (ev): -52.7168 -52.7168 -24.9048 -24.9048 -23.9874 -23.9874 -23.8542 -23.8542 7.2125 7.2125 13.4843 13.4843 15.1940 15.1940 17.7816 17.7816 17.8333 17.8333 19.3029 19.3029 20.1486 20.1486 20.1909 20.1909 23.2042 23.2042 k = 0.4808-0.2776 0.3925 ( 1330 PWs) bands (ev): -52.7142 -52.7142 -24.9051 -24.9051 -23.9878 -23.9878 -23.8542 -23.8542 7.2157 7.2157 13.4976 13.4976 15.1889 15.1889 17.7944 17.7944 17.8463 17.8463 19.3156 19.3156 20.1422 20.1422 20.1843 20.1843 23.1818 23.1818 k = 0.4872-0.2813 0.3978 ( 1342 PWs) bands (ev): -52.7174 -52.7174 -24.9061 -24.9061 -23.9890 -23.9890 -23.8549 -23.8549 7.2174 7.2174 13.5070 13.5070 15.1843 15.1843 17.8034 17.8034 17.8554 17.8554 19.3112 19.3112 20.1147 20.1147 20.1569 20.1569 23.1613 23.1613 k = 0.4936-0.2850 0.4030 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9061 -24.9061 -23.9890 -23.9890 -23.8550 -23.8550 7.2195 7.2195 13.5129 13.5129 15.1821 15.1821 17.8090 17.8090 17.8611 17.8611 19.3125 19.3125 20.1104 20.1104 20.1525 20.1525 23.1597 23.1597 k = 0.5000-0.2887 0.4082 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9891 -23.9891 -23.8550 -23.8550 7.2200 7.2200 13.5148 13.5148 15.1814 15.1814 17.8109 17.8109 17.8631 17.8631 19.3129 19.3129 20.1080 20.1080 20.1500 20.1500 23.1564 23.1564 k = 0.5000-0.2887 0.4082 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9891 -23.9891 -23.8550 -23.8550 7.2200 7.2200 13.5148 13.5148 15.1814 15.1814 17.8109 17.8109 17.8631 17.8631 19.3129 19.3129 20.1080 20.1080 20.1500 20.1500 23.1564 23.1564 k = 0.5000-0.2813 0.4135 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9891 -23.9891 -23.8551 -23.8551 7.2209 7.2209 13.5149 13.5149 15.1787 15.1787 17.8038 17.8038 17.8590 17.8590 19.3265 19.3265 20.1082 20.1082 20.1503 20.1503 23.1560 23.1560 k = 0.5000-0.2739 0.4187 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9890 -23.9890 -23.8552 -23.8552 7.2238 7.2238 13.5150 13.5150 15.1709 15.1709 17.7713 17.7713 17.8597 17.8597 19.3660 19.3660 20.1088 20.1088 20.1509 20.1509 23.1549 23.1549 k = 0.5000-0.2665 0.4240 ( 1334 PWs) bands (ev): -52.7150 -52.7150 -24.9060 -24.9060 -23.9887 -23.9887 -23.8552 -23.8552 7.2288 7.2288 13.5152 13.5152 15.1605 15.1605 17.7100 17.7100 17.8733 17.8733 19.4296 19.4296 20.1104 20.1104 20.1527 20.1527 23.1573 23.1573 k = 0.5000-0.2591 0.4292 ( 1332 PWs) bands (ev): -52.7145 -52.7145 -24.9058 -24.9058 -23.9883 -23.9883 -23.8555 -23.8555 7.2357 7.2357 13.5155 13.5155 15.1427 15.1427 17.6267 17.6267 17.8960 17.8960 19.5076 19.5076 20.1134 20.1134 20.1569 20.1569 23.1564 23.1564 k = 0.5000-0.2517 0.4344 ( 1332 PWs) bands (ev): -52.7145 -52.7145 -24.9057 -24.9057 -23.9881 -23.9881 -23.8559 -23.8559 7.2443 7.2443 13.5159 13.5159 15.1203 15.1203 17.5283 17.5283 17.9259 17.9259 19.5972 19.5972 20.1146 20.1146 20.1590 20.1590 23.1528 23.1528 k = 0.5000-0.2443 0.4397 ( 1328 PWs) bands (ev): -52.7134 -52.7134 -24.9054 -24.9054 -23.9876 -23.9876 -23.8561 -23.8561 7.2549 7.2549 13.5163 13.5163 15.0959 15.0959 17.4197 17.4197 17.9627 17.9627 19.7002 19.7002 20.1162 20.1162 20.1619 20.1619 23.1527 23.1527 k = 0.5000-0.2369 0.4449 ( 1332 PWs) bands (ev): -52.7146 -52.7146 -24.9055 -24.9055 -23.9875 -23.9875 -23.8568 -23.8568 7.2663 7.2663 13.5169 13.5169 15.0655 15.0655 17.3028 17.3028 18.0047 18.0047 19.8036 19.8036 20.1146 20.1146 20.1623 20.1623 23.1390 23.1390 k = 0.5000-0.2295 0.4501 ( 1332 PWs) bands (ev): -52.7146 -52.7146 -24.9053 -24.9053 -23.9871 -23.9871 -23.8574 -23.8574 7.2803 7.2803 13.5177 13.5177 15.0318 15.0318 17.1806 17.1806 18.0518 18.0518 19.9102 19.9102 20.1162 20.1162 20.1666 20.1666 23.1329 23.1329 k = 0.5000-0.2221 0.4554 ( 1332 PWs) bands (ev): -52.7146 -52.7146 -24.9051 -24.9051 -23.9866 -23.9866 -23.8582 -23.8582 7.2960 7.2960 13.5186 13.5186 14.9953 14.9953 17.0546 17.0546 18.1035 18.1035 20.0176 20.0176 20.1180 20.1180 20.1724 20.1724 23.1259 23.1259 k = 0.5000-0.2147 0.4606 ( 1328 PWs) bands (ev): -52.7134 -52.7134 -24.9047 -24.9047 -23.9859 -23.9859 -23.8589 -23.8589 7.3134 7.3134 13.5198 13.5198 14.9567 14.9567 16.9269 16.9269 18.1595 18.1595 20.1168 20.1168 20.1331 20.1331 20.1873 20.1873 23.1183 23.1183 k = 0.5000-0.2073 0.4658 ( 1328 PWs) bands (ev): -52.7134 -52.7134 -24.9045 -24.9045 -23.9853 -23.9853 -23.8598 -23.8598 7.3323 7.3323 13.5211 13.5211 14.9157 14.9157 16.7971 16.7971 18.2188 18.2188 20.1273 20.1273 20.1730 20.1730 20.2532 20.2532 23.1097 23.1097 k = 0.5000-0.1999 0.4711 ( 1328 PWs) bands (ev): -52.7134 -52.7134 -24.9043 -24.9043 -23.9846 -23.9846 -23.8608 -23.8608 7.3526 7.3526 13.5227 13.5227 14.8730 14.8730 16.6667 16.6667 18.2812 18.2812 20.1289 20.1289 20.1829 20.1829 20.3577 20.3577 23.1001 23.1001 k = 0.5000-0.1925 0.4763 ( 1328 PWs) bands (ev): -52.7133 -52.7133 -24.9040 -24.9040 -23.9839 -23.9839 -23.8618 -23.8618 7.3744 7.3744 13.5247 13.5247 14.8290 14.8290 16.5363 16.5363 18.3462 18.3462 20.1301 20.1301 20.1898 20.1898 20.4645 20.4645 23.0897 23.0897 k = 0.5000-0.1850 0.4815 ( 1328 PWs) bands (ev): -52.7133 -52.7133 -24.9037 -24.9037 -23.9832 -23.9832 -23.8629 -23.8629 7.3975 7.3975 13.5269 13.5269 14.7841 14.7841 16.4066 16.4066 18.4135 18.4135 20.1312 20.1312 20.1962 20.1962 20.5704 20.5704 23.0784 23.0784 k = 0.5000-0.1776 0.4868 ( 1328 PWs) bands (ev): -52.7132 -52.7132 -24.9035 -24.9035 -23.9824 -23.9824 -23.8641 -23.8641 7.4217 7.4217 13.5296 13.5296 14.7384 14.7384 16.2780 16.2780 18.4826 18.4826 20.1321 20.1321 20.2025 20.2025 20.6746 20.6746 23.0661 23.0661 k = 0.5000-0.1702 0.4920 ( 1328 PWs) bands (ev): -52.7132 -52.7132 -24.9032 -24.9032 -23.9816 -23.9816 -23.8654 -23.8654 7.4470 7.4470 13.5326 13.5326 14.6923 14.6923 16.1509 16.1509 18.5531 18.5531 20.1329 20.1329 20.2085 20.2085 20.7768 20.7768 23.0528 23.0528 k = 0.5000-0.1628 0.4972 ( 1330 PWs) bands (ev): -52.7137 -52.7137 -24.9030 -24.9030 -23.9807 -23.9807 -23.8668 -23.8668 7.4732 7.4732 13.5361 13.5361 14.6459 14.6459 16.0247 16.0247 18.6246 18.6246 20.1336 20.1336 20.2142 20.2142 20.8728 20.8728 23.0359 23.0359 k = 0.5000-0.1554 0.5025 ( 1326 PWs) bands (ev): -52.7125 -52.7125 -24.9025 -24.9025 -23.9797 -23.9797 -23.8678 -23.8678 7.5003 7.5003 13.5403 13.5403 14.5999 14.5999 15.9042 15.9042 18.6974 18.6974 20.1345 20.1345 20.2222 20.2222 20.9754 20.9754 23.0239 23.0239 k = 0.5000-0.1480 0.5077 ( 1326 PWs) bands (ev): -52.7124 -52.7124 -24.9022 -24.9022 -23.9788 -23.9788 -23.8692 -23.8692 7.5280 7.5280 13.5448 13.5448 14.5538 14.5538 15.7841 15.7841 18.7702 18.7702 20.1351 20.1351 20.2269 20.2269 21.0701 21.0701 23.0074 23.0074 k = 0.5000-0.1406 0.5129 ( 1322 PWs) bands (ev): -52.7112 -52.7112 -24.9017 -24.9017 -23.9775 -23.9775 -23.8704 -23.8704 7.5565 7.5565 13.5509 13.5509 14.5082 14.5082 15.6670 15.6670 18.8443 18.8443 20.1374 20.1374 20.2386 20.2386 21.1626 21.1626 22.9906 22.9906 k = 0.5000-0.1332 0.5182 ( 1322 PWs) bands (ev): -52.7112 -52.7112 -24.9014 -24.9014 -23.9765 -23.9765 -23.8719 -23.8719 7.5850 7.5850 13.5567 13.5567 14.4628 14.4628 15.5534 15.5534 18.9171 18.9171 20.1378 20.1378 20.2414 20.2414 21.2520 21.2520 22.9718 22.9718 k = 0.5000-0.1258 0.5234 ( 1324 PWs) bands (ev): -52.7117 -52.7117 -24.9012 -24.9012 -23.9757 -23.9757 -23.8734 -23.8734 7.6137 7.6137 13.5635 13.5635 14.4179 14.4179 15.4424 15.4424 18.9895 18.9895 20.1290 20.1290 20.2473 20.2473 21.3368 21.3368 22.9520 22.9520 k = 0.5000-0.1184 0.5286 ( 1324 PWs) bands (ev): -52.7117 -52.7117 -24.9009 -24.9009 -23.9746 -23.9746 -23.8748 -23.8748 7.6423 7.6423 13.5707 13.5707 14.3739 14.3739 15.3366 15.3366 19.0612 19.0612 20.1294 20.1294 20.2479 20.2479 21.4207 21.4207 22.9310 22.9310 k = 0.5000-0.1110 0.5339 ( 1332 PWs) bands (ev): -52.7140 -52.7140 -24.9010 -24.9010 -23.9741 -23.9741 -23.8765 -23.8765 7.6704 7.6704 13.5783 13.5783 14.3295 14.3295 15.2350 15.2350 19.1308 19.1308 20.1225 20.1225 20.2347 20.2347 21.4999 21.4999 22.9055 22.9055 k = 0.5000-0.1036 0.5391 ( 1332 PWs) bands (ev): -52.7140 -52.7140 -24.9007 -24.9007 -23.9731 -23.9731 -23.8779 -23.8779 7.6983 7.6983 13.5871 13.5871 14.2873 14.2873 15.1383 15.1383 19.2003 19.2003 20.1227 20.1227 20.2326 20.2326 21.5783 21.5783 22.8821 22.8821 k = 0.5000-0.0962 0.5443 ( 1336 PWs) bands (ev): -52.7151 -52.7151 -24.9007 -24.9007 -23.9723 -23.9723 -23.8795 -23.8795 7.7254 7.7254 13.5964 13.5964 14.2458 14.2458 15.0466 15.0466 19.2681 19.2681 20.1206 20.1206 20.2206 20.2206 21.6521 21.6521 22.8566 22.8566 k = 0.5000-0.0888 0.5496 ( 1332 PWs) bands (ev): -52.7139 -52.7139 -24.9002 -24.9002 -23.9710 -23.9710 -23.8807 -23.8807 7.7521 7.7521 13.6076 13.6076 14.2061 14.2061 14.9603 14.9603 19.3359 19.3359 20.1259 20.1259 20.2200 20.2200 21.7253 21.7253 22.8316 22.8316 k = 0.5000-0.0814 0.5548 ( 1332 PWs) bands (ev): -52.7139 -52.7139 -24.9000 -24.9000 -23.9701 -23.9701 -23.8820 -23.8820 7.7775 7.7775 13.6190 13.6190 14.1671 14.1671 14.8795 14.8795 19.4009 19.4009 20.1257 20.1257 20.2128 20.2128 21.7958 21.7958 22.8045 22.8045 k = 0.5000-0.0740 0.5600 ( 1332 PWs) bands (ev): -52.7138 -52.7138 -24.8998 -24.8998 -23.9691 -23.9691 -23.8833 -23.8833 7.8015 7.8015 13.6313 13.6313 14.1292 14.1292 14.8046 14.8046 19.4641 19.4641 20.1254 20.1254 20.2039 20.2039 21.8637 21.8637 22.7760 22.7760 k = 0.5000-0.0666 0.5653 ( 1338 PWs) bands (ev): -52.7155 -52.7155 -24.8998 -24.8998 -23.9683 -23.9683 -23.8850 -23.8850 7.8240 7.8240 13.6443 13.6443 14.0915 14.0915 14.7346 14.7346 19.5230 19.5230 20.1239 20.1239 20.1881 20.1881 21.9227 21.9227 22.7417 22.7417 k = 0.5000-0.0592 0.5705 ( 1342 PWs) bands (ev): -52.7167 -52.7167 -24.8997 -24.8997 -23.9675 -23.9675 -23.8865 -23.8865 7.8448 7.8448 13.6585 13.6585 14.0561 14.0561 14.6700 14.6700 19.5815 19.5815 20.1225 20.1225 20.1747 20.1747 21.9788 21.9788 22.7051 22.7051 k = 0.5000-0.0518 0.5757 ( 1338 PWs) bands (ev): -52.7155 -52.7155 -24.8994 -24.8994 -23.9666 -23.9666 -23.8872 -23.8872 7.8638 7.8638 13.6741 13.6741 14.0232 14.0232 14.6152 14.6152 19.6421 19.6421 20.1201 20.1201 20.1622 20.1622 22.0411 22.0411 22.6770 22.6770 k = 0.5000-0.0444 0.5810 ( 1336 PWs) bands (ev): -52.7149 -52.7149 -24.8992 -24.8992 -23.9659 -23.9659 -23.8879 -23.8879 7.8806 7.8806 13.6907 13.6907 13.9904 13.9904 14.5675 14.5675 19.6961 19.6961 20.1145 20.1145 20.1505 20.1505 22.1024 22.1024 22.6447 22.6447 k = 0.5000-0.0370 0.5862 ( 1336 PWs) bands (ev): -52.7149 -52.7149 -24.8991 -24.8991 -23.9653 -23.9653 -23.8888 -23.8888 7.8952 7.8952 13.7082 13.7082 13.9590 13.9590 14.5258 14.5258 19.7475 19.7475 20.1023 20.1023 20.1418 20.1418 22.1584 22.1584 22.6087 22.6087 k = 0.5000-0.0296 0.5914 ( 1336 PWs) bands (ev): -52.7149 -52.7149 -24.8990 -24.8990 -23.9647 -23.9647 -23.8894 -23.8894 7.9073 7.9073 13.7268 13.7268 13.9290 13.9290 14.4914 14.4914 19.7963 19.7963 20.0832 20.0832 20.1374 20.1374 22.2123 22.2123 22.5712 22.5712 k = 0.5000-0.0222 0.5967 ( 1336 PWs) bands (ev): -52.7149 -52.7149 -24.8989 -24.8989 -23.9643 -23.9643 -23.8900 -23.8900 7.9169 7.9169 13.7463 13.7463 13.9006 13.9006 14.4645 14.4645 19.8423 19.8423 20.0590 20.0590 20.1354 20.1354 22.2642 22.2642 22.5321 22.5321 k = 0.5000-0.0148 0.6019 ( 1340 PWs) bands (ev): -52.7160 -52.7160 -24.8990 -24.8990 -23.9642 -23.9642 -23.8905 -23.8905 7.9237 7.9237 13.7664 13.7664 13.8731 13.8731 14.4447 14.4447 19.8825 19.8825 20.0301 20.0301 20.1303 20.1303 22.3111 22.3111 22.4906 22.4906 k = 0.5000-0.0074 0.6071 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8993 -24.8993 -23.9643 -23.9643 -23.8913 -23.8913 7.9278 7.9278 13.7844 13.7844 13.8484 13.8484 14.4327 14.4327 19.9174 19.9174 19.9894 19.9894 20.1256 20.1256 22.3551 22.3551 22.4471 22.4471 k = 0.5000 0.0000 0.6124 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8993 -24.8993 -23.9643 -23.9643 -23.8914 -23.8914 7.9292 7.9292 13.7952 13.7952 13.8364 13.8364 14.4288 14.4288 19.9503 19.9503 19.9594 19.9594 20.1255 20.1255 22.3932 22.3932 22.4108 22.4108 k = 0.5000 0.0000 0.6124 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8993 -24.8993 -23.9643 -23.9643 -23.8914 -23.8914 7.9292 7.9292 13.7952 13.7952 13.8364 13.8364 14.4288 14.4288 19.9503 19.9503 19.9594 19.9594 20.1255 20.1255 22.3932 22.3932 22.4108 22.4108 k = 0.4955 0.0077 0.6124 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8992 -24.8992 -23.9643 -23.9643 -23.8913 -23.8913 7.9287 7.9287 13.7888 13.7888 13.8398 13.8398 14.4332 14.4332 19.9275 19.9275 19.9737 19.9737 20.1318 20.1318 22.3724 22.3724 22.4342 22.4342 k = 0.4911 0.0155 0.6124 ( 1340 PWs) bands (ev): -52.7161 -52.7161 -24.8989 -24.8989 -23.9641 -23.9641 -23.8906 -23.8906 7.9276 7.9276 13.7770 13.7770 13.8439 13.8439 14.4476 14.4476 19.9011 19.9011 19.9870 19.9870 20.1563 20.1563 22.3558 22.3558 22.4648 22.4648 k = 0.4866 0.0232 0.6124 ( 1336 PWs) bands (ev): -52.7150 -52.7150 -24.8987 -24.8987 -23.9641 -23.9641 -23.8899 -23.8899 7.9255 7.9255 13.7637 13.7637 13.8422 13.8422 14.4705 14.4705 19.8666 19.8666 19.9857 19.9857 20.1891 20.1891 22.3419 22.3419 22.4955 22.4955 k = 0.4821 0.0309 0.6124 ( 1336 PWs) bands (ev): -52.7150 -52.7150 -24.8986 -24.8986 -23.9645 -23.9645 -23.8892 -23.8892 7.9227 7.9227 13.7500 13.7500 13.8350 13.8350 14.5002 14.5002 19.8274 19.8274 19.9762 19.9762 20.2208 20.2208 22.3328 22.3328 22.5233 22.5233 k = 0.4777 0.0387 0.6124 ( 1336 PWs) bands (ev): -52.7151 -52.7151 -24.8986 -24.8986 -23.9649 -23.9649 -23.8883 -23.8883 7.9193 7.9193 13.7367 13.7367 13.8231 13.8231 14.5365 14.5365 19.7842 19.7842 19.9640 19.9640 20.2545 20.2545 22.3299 22.3299 22.5500 22.5500 k = 0.4732 0.0464 0.6124 ( 1336 PWs) bands (ev): -52.7151 -52.7151 -24.8985 -24.8985 -23.9654 -23.9654 -23.8873 -23.8873 7.9154 7.9154 13.7239 13.7239 13.8077 13.8077 14.5782 14.5782 19.7372 19.7372 19.9506 19.9506 20.2886 20.2886 22.3331 22.3331 22.5756 22.5756 k = 0.4688 0.0541 0.6124 ( 1338 PWs) bands (ev): -52.7158 -52.7158 -24.8986 -24.8986 -23.9661 -23.9661 -23.8864 -23.8864 7.9109 7.9109 13.7114 13.7114 13.7892 13.7892 14.6239 14.6239 19.6842 19.6842 19.9363 19.9363 20.3222 20.3222 22.3416 22.3416 22.5973 22.5973 k = 0.4643 0.0619 0.6124 ( 1338 PWs) bands (ev): -52.7159 -52.7159 -24.8985 -24.8985 -23.9667 -23.9667 -23.8852 -23.8852 7.9061 7.9061 13.6996 13.6996 13.7696 13.7696 14.6731 14.6731 19.6305 19.6305 19.9226 19.9226 20.3551 20.3551 22.3558 22.3558 22.6207 22.6207 k = 0.4598 0.0696 0.6124 ( 1338 PWs) bands (ev): -52.7159 -52.7159 -24.8984 -24.8984 -23.9674 -23.9674 -23.8838 -23.8838 7.9010 7.9010 13.6881 13.6881 13.7491 13.7491 14.7247 14.7247 19.5739 19.5739 19.9092 19.9092 20.3868 20.3868 22.3748 22.3748 22.6430 22.6430 k = 0.4554 0.0773 0.6124 ( 1342 PWs) bands (ev): -52.7172 -52.7172 -24.8986 -24.8986 -23.9684 -23.9684 -23.8826 -23.8826 7.8956 7.8956 13.6767 13.6767 13.7295 13.7295 14.7760 14.7760 19.5167 19.5167 19.8847 19.8847 20.4168 20.4168 22.3938 22.3938 22.6637 22.6637 k = 0.4509 0.0851 0.6124 ( 1338 PWs) bands (ev): -52.7161 -52.7161 -24.8984 -24.8984 -23.9690 -23.9690 -23.8808 -23.8808 7.8901 7.8901 13.6655 13.6655 13.7098 13.7098 14.8316 14.8316 19.4574 19.4574 19.8775 19.8775 20.4461 20.4461 22.4232 22.4232 22.6867 22.6867 k = 0.4464 0.0928 0.6124 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.8983 -24.8983 -23.9698 -23.9698 -23.8794 -23.8794 7.8845 7.8845 13.6535 13.6535 13.6911 13.6911 14.8867 14.8867 19.3956 19.3956 19.8653 19.8653 20.4736 20.4736 22.4528 22.4528 22.7055 22.7055 k = 0.4420 0.1005 0.6124 ( 1338 PWs) bands (ev): -52.7163 -52.7163 -24.8982 -24.8982 -23.9706 -23.9706 -23.8779 -23.8779 7.8788 7.8788 13.6401 13.6401 13.6750 13.6750 14.9419 14.9419 19.3330 19.3330 19.8538 19.8538 20.4996 20.4996 22.4848 22.4848 22.7231 22.7231 k = 0.4375 0.1083 0.6124 ( 1330 PWs) bands (ev): -52.7141 -52.7141 -24.8979 -24.8979 -23.9710 -23.9710 -23.8759 -23.8759 7.8733 7.8733 13.6252 13.6252 13.6621 13.6621 14.9994 14.9994 19.2714 19.2714 19.8532 19.8532 20.5281 20.5281 22.5251 22.5251 22.7441 22.7441 k = 0.4330 0.1160 0.6124 ( 1334 PWs) bands (ev): -52.7154 -52.7154 -24.8980 -24.8980 -23.9718 -23.9718 -23.8748 -23.8748 7.8677 7.8677 13.6082 13.6082 13.6515 13.6515 15.0529 15.0529 19.2062 19.2062 19.8405 19.8405 20.5509 20.5509 22.5554 22.5554 22.7573 22.7573 k = 0.4286 0.1237 0.6124 ( 1334 PWs) bands (ev): -52.7155 -52.7155 -24.8979 -24.8979 -23.9726 -23.9726 -23.8735 -23.8735 7.8623 7.8623 13.5914 13.5914 13.6430 13.6430 15.1058 15.1058 19.1453 19.1453 19.8310 19.8310 20.5720 20.5720 22.5902 22.5902 22.7716 22.7716 k = 0.4241 0.1315 0.6124 ( 1330 PWs) bands (ev): -52.7145 -52.7145 -24.8977 -24.8977 -23.9730 -23.9730 -23.8720 -23.8720 7.8574 7.8574 13.5751 13.5751 13.6360 13.6360 15.1578 15.1578 19.0878 19.0878 19.8264 19.8264 20.5933 20.5933 22.6291 22.6291 22.7863 22.7863 k = 0.4196 0.1392 0.6124 ( 1326 PWs) bands (ev): -52.7134 -52.7134 -24.8975 -24.8975 -23.9736 -23.9736 -23.8704 -23.8704 7.8527 7.8527 13.5603 13.5603 13.6299 13.6299 15.2084 15.2084 19.0329 19.0329 19.8209 19.8209 20.6114 20.6114 22.6670 22.6670 22.8008 22.8008 k = 0.4152 0.1469 0.6124 ( 1326 PWs) bands (ev): -52.7135 -52.7135 -24.8975 -24.8975 -23.9742 -23.9742 -23.8692 -23.8692 7.8481 7.8481 13.5458 13.5458 13.6244 13.6244 15.2550 15.2550 18.9788 18.9788 19.8137 19.8137 20.6275 20.6275 22.6995 22.6995 22.8118 22.8118 k = 0.4107 0.1546 0.6124 ( 1326 PWs) bands (ev): -52.7136 -52.7136 -24.8975 -24.8975 -23.9747 -23.9747 -23.8681 -23.8681 7.8439 7.8439 13.5326 13.5326 13.6197 13.6197 15.2986 15.2986 18.9281 18.9281 19.8072 19.8072 20.6421 20.6421 22.7300 22.7300 22.8217 22.8217 k = 0.4062 0.1624 0.6124 ( 1327 PWs) bands (ev): -52.7140 -52.7140 -24.8975 -24.8975 -23.9753 -23.9753 -23.8672 -23.8672 7.8400 7.8400 13.5206 13.5206 13.6156 13.6156 15.3380 15.3380 18.8815 18.8815 19.8015 19.8015 20.6549 20.6549 22.7552 22.7552 22.8306 22.8306 k = 0.4018 0.1701 0.6124 ( 1327 PWs) bands (ev): -52.7140 -52.7140 -24.8975 -24.8975 -23.9757 -23.9757 -23.8663 -23.8663 7.8366 7.8366 13.5102 13.5102 13.6121 13.6121 15.3739 15.3739 18.8398 18.8398 19.7966 19.7966 20.6660 20.6660 22.7801 22.7801 22.8388 22.8388 k = 0.3973 0.1778 0.6124 ( 1327 PWs) bands (ev): -52.7141 -52.7141 -24.8975 -24.8975 -23.9761 -23.9761 -23.8655 -23.8655 7.8341 7.8341 13.5008 13.5008 13.6093 13.6093 15.4057 15.4057 18.8026 18.8026 19.7952 19.7952 20.6711 20.6711 22.8029 22.8029 22.8470 22.8470 k = 0.3929 0.1856 0.6124 ( 1327 PWs) bands (ev): -52.7142 -52.7142 -24.8974 -24.8974 -23.9764 -23.9764 -23.8649 -23.8649 7.8317 7.8317 13.4934 13.4934 13.6069 13.6069 15.4321 15.4321 18.7719 18.7719 19.7918 19.7918 20.6788 20.6788 22.8199 22.8199 22.8540 22.8540 k = 0.3884 0.1933 0.6124 ( 1327 PWs) bands (ev): -52.7142 -52.7142 -24.8974 -24.8974 -23.9767 -23.9767 -23.8644 -23.8644 7.8298 7.8298 13.4876 13.4876 13.6051 13.6051 15.4531 15.4531 18.7475 18.7475 19.7892 19.7892 20.6848 20.6848 22.8322 22.8322 22.8607 22.8607 k = 0.3839 0.2010 0.6124 ( 1331 PWs) bands (ev): -52.7154 -52.7154 -24.8976 -24.8976 -23.9770 -23.9770 -23.8643 -23.8643 7.8283 7.8283 13.4834 13.4834 13.6031 13.6031 15.4675 15.4675 18.7296 18.7296 19.7821 19.7821 20.6848 20.6848 22.8388 22.8388 22.8655 22.8655 k = 0.3795 0.2088 0.6124 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9772 -23.9772 -23.8643 -23.8643 7.8274 7.8274 13.4808 13.4808 13.6023 13.6023 15.4746 15.4746 18.7186 18.7186 19.7799 19.7799 20.6868 20.6868 22.8406 22.8406 22.8645 22.8645 k = 0.3750 0.2165 0.6124 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9773 -23.9773 -23.8642 -23.8642 7.8271 7.8271 13.4799 13.4799 13.6020 13.6020 15.4777 15.4777 18.7150 18.7150 19.7795 19.7795 20.6877 20.6877 22.8420 22.8420 22.8659 22.8659 k = 0.3750 0.2165 0.6124 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9773 -23.9773 -23.8642 -23.8642 7.8271 7.8271 13.4799 13.4799 13.6020 13.6020 15.4777 15.4777 18.7150 18.7150 19.7795 19.7795 20.6877 20.6877 22.8420 22.8420 22.8659 22.8659 k = 0.3705 0.2139 0.6050 ( 1334 PWs) bands (ev): -52.7165 -52.7165 -24.8971 -24.8971 -23.9769 -23.9769 -23.8634 -23.8634 7.8598 7.8598 13.3869 13.3869 13.6111 13.6111 15.4054 15.4054 18.7782 18.7782 19.7542 19.7542 20.7227 20.7227 22.8198 22.8198 23.0177 23.0177 k = 0.3660 0.2113 0.5976 ( 1330 PWs) bands (ev): -52.7155 -52.7155 -24.8962 -24.8962 -23.9763 -23.9763 -23.8623 -23.8623 7.8916 7.8916 13.2952 13.2952 13.6218 13.6218 15.3364 15.3364 18.8473 18.8473 19.7282 19.7282 20.7593 20.7593 22.7995 22.7995 23.1711 23.1711 k = 0.3614 0.2087 0.5902 ( 1328 PWs) bands (ev): -52.7152 -52.7152 -24.8954 -24.8954 -23.9760 -23.9760 -23.8609 -23.8609 7.9222 7.9222 13.2024 13.2024 13.6342 13.6342 15.2718 15.2718 18.9070 18.9070 19.7073 19.7073 20.7954 20.7954 22.7781 22.7781 23.3248 23.3248 k = 0.3569 0.2061 0.5829 ( 1324 PWs) bands (ev): -52.7145 -52.7145 -24.8945 -24.8945 -23.9754 -23.9754 -23.8595 -23.8595 7.9515 7.9515 13.1134 13.1134 13.6476 13.6476 15.2079 15.2079 18.9723 18.9723 19.6855 19.6855 20.8344 20.8344 22.7545 22.7545 23.4751 23.4751 k = 0.3524 0.2035 0.5755 ( 1324 PWs) bands (ev): -52.7148 -52.7148 -24.8937 -24.8937 -23.9750 -23.9750 -23.8581 -23.8581 7.9788 7.9788 13.0270 13.0270 13.6613 13.6613 15.1459 15.1459 19.0374 19.0374 19.6569 19.6569 20.8700 20.8700 22.7298 22.7298 23.6224 23.6224 k = 0.3479 0.2009 0.5681 ( 1320 PWs) bands (ev): -52.7140 -52.7140 -24.8927 -24.8927 -23.9743 -23.9743 -23.8564 -23.8564 8.0039 8.0039 12.9442 12.9442 13.6764 13.6764 15.0868 15.0868 19.1087 19.1087 19.6277 19.6277 20.9081 20.9081 22.7065 22.7065 23.7685 23.7685 k = 0.3434 0.1982 0.5607 ( 1316 PWs) bands (ev): -52.7134 -52.7134 -24.8917 -24.8917 -23.9735 -23.9735 -23.8546 -23.8546 8.0265 8.0265 12.8650 12.8650 13.6934 13.6934 15.0305 15.0305 19.1758 19.1758 19.5979 19.5979 20.9509 20.9509 22.6813 22.6813 23.9124 23.9124 k = 0.3389 0.1956 0.5533 ( 1316 PWs) bands (ev): -52.7138 -52.7138 -24.8907 -24.8907 -23.9730 -23.9730 -23.8528 -23.8528 8.0462 8.0462 12.7891 12.7891 13.7103 13.7103 14.9767 14.9767 19.2396 19.2396 19.5672 19.5672 20.9859 20.9859 22.6560 22.6560 24.0536 24.0536 k = 0.3343 0.1930 0.5460 ( 1316 PWs) bands (ev): -52.7143 -52.7143 -24.8897 -24.8897 -23.9724 -23.9724 -23.8508 -23.8508 8.0626 8.0626 12.7178 12.7178 13.7284 13.7284 14.9258 14.9258 19.3024 19.3024 19.5359 19.5359 21.0206 21.0206 22.6306 22.6306 24.1924 24.1924 k = 0.3298 0.1904 0.5386 ( 1316 PWs) bands (ev): -52.7148 -52.7148 -24.8887 -24.8887 -23.9718 -23.9718 -23.8488 -23.8488 8.0753 8.0753 12.6516 12.6516 13.7476 13.7476 14.8776 14.8776 19.3638 19.3638 19.5040 19.5040 21.0550 21.0550 22.6053 22.6053 24.3283 24.3283 k = 0.3253 0.1878 0.5312 ( 1316 PWs) bands (ev): -52.7153 -52.7153 -24.8876 -24.8876 -23.9710 -23.9710 -23.8466 -23.8466 8.0839 8.0839 12.5909 12.5909 13.7679 13.7679 14.8323 14.8323 19.4231 19.4231 19.4718 19.4718 21.0890 21.0890 22.5802 22.5802 24.4612 24.4612 k = 0.3208 0.1852 0.5238 ( 1316 PWs) bands (ev): -52.7158 -52.7158 -24.8864 -24.8864 -23.9701 -23.9701 -23.8443 -23.8443 8.0881 8.0881 12.5363 12.5363 13.7895 13.7895 14.7899 14.7899 19.4373 19.4373 19.4821 19.4821 21.1223 21.1223 22.5554 22.5554 24.5907 24.5907 k = 0.3163 0.1826 0.5165 ( 1326 PWs) bands (ev): -52.7193 -52.7193 -24.8855 -24.8855 -23.9697 -23.9697 -23.8424 -23.8424 8.0871 8.0871 12.4872 12.4872 13.8115 13.8115 14.7462 14.7462 19.4014 19.4014 19.5310 19.5310 21.1477 21.1477 22.5272 22.5272 24.7049 24.7049 k = 0.3117 0.1800 0.5091 ( 1326 PWs) bands (ev): -52.7199 -52.7199 -24.8842 -24.8842 -23.9687 -23.9687 -23.8399 -23.8399 8.0814 8.0814 12.4458 12.4458 13.8355 13.8355 14.7095 14.7095 19.3671 19.3671 19.5832 19.5832 21.1796 21.1796 22.5033 22.5033 24.8264 24.8264 k = 0.3072 0.1774 0.5017 ( 1326 PWs) bands (ev): -52.7206 -52.7206 -24.8828 -24.8828 -23.9675 -23.9675 -23.8374 -23.8374 8.0704 8.0704 12.4117 12.4117 13.8607 13.8607 14.6757 14.6757 19.3323 19.3323 19.6323 19.6323 21.2107 21.2107 22.4799 22.4799 24.9436 24.9436 k = 0.3027 0.1748 0.4943 ( 1330 PWs) bands (ev): -52.7224 -52.7224 -24.8814 -24.8814 -23.9663 -23.9663 -23.8351 -23.8351 8.0537 8.0537 12.3849 12.3849 13.8869 13.8869 14.6429 14.6429 19.2933 19.2933 19.6781 19.6781 21.2379 21.2379 22.4564 22.4564 25.0499 25.0499 k = 0.2982 0.1722 0.4869 ( 1330 PWs) bands (ev): -52.7231 -52.7231 -24.8798 -24.8798 -23.9648 -23.9648 -23.8324 -23.8324 8.0313 8.0313 12.3657 12.3657 13.9148 13.9148 14.6152 14.6152 19.2574 19.2574 19.7195 19.7195 21.2670 21.2670 22.4347 22.4347 25.1581 25.1581 k = 0.2937 0.1696 0.4796 ( 1326 PWs) bands (ev): -52.7227 -52.7227 -24.8780 -24.8780 -23.9631 -23.9631 -23.8295 -23.8295 8.0033 8.0033 12.3544 12.3544 13.9443 13.9443 14.5933 14.5933 19.2224 19.2224 19.7579 19.7579 21.2961 21.2961 22.4156 22.4156 25.2675 25.2675 k = 0.2892 0.1669 0.4722 ( 1326 PWs) bands (ev): -52.7235 -52.7235 -24.8762 -24.8762 -23.9613 -23.9613 -23.8268 -23.8268 7.9696 7.9696 12.3509 12.3509 13.9749 13.9749 14.5712 14.5712 19.1856 19.1856 19.7916 19.7916 21.3227 21.3227 22.3951 22.3951 25.3636 25.3636 k = 0.2846 0.1643 0.4648 ( 1326 PWs) bands (ev): -52.7244 -52.7244 -24.8743 -24.8743 -23.9594 -23.9594 -23.8240 -23.8240 7.9302 7.9302 12.3551 12.3551 14.0069 14.0069 14.5520 14.5520 19.1485 19.1485 19.8208 19.8208 21.3481 21.3481 22.3754 22.3754 25.4536 25.4536 k = 0.2801 0.1617 0.4574 ( 1326 PWs) bands (ev): -52.7252 -52.7252 -24.8723 -24.8723 -23.9573 -23.9573 -23.8212 -23.8212 7.8854 7.8854 12.3670 12.3670 14.0403 14.0403 14.5359 14.5359 19.1110 19.1110 19.8453 19.8453 21.3720 21.3720 22.3566 22.3566 25.5372 25.5372 k = 0.2756 0.1591 0.4501 ( 1330 PWs) bands (ev): -52.7273 -52.7273 -24.8704 -24.8704 -23.9553 -23.9553 -23.8187 -23.8187 7.8351 7.8351 12.3863 12.3863 14.0750 14.0750 14.5198 14.5198 19.0724 19.0724 19.8650 19.8650 21.3939 21.3939 22.3348 22.3348 25.6052 25.6052 k = 0.2711 0.1565 0.4427 ( 1330 PWs) bands (ev): -52.7282 -52.7282 -24.8682 -24.8682 -23.9529 -23.9529 -23.8159 -23.8159 7.7799 7.7799 12.4130 12.4130 14.1112 14.1112 14.5096 14.5096 19.0344 19.0344 19.8798 19.8798 21.4148 21.4148 22.3175 22.3175 25.6747 25.6747 k = 0.2666 0.1539 0.4353 ( 1328 PWs) bands (ev): -52.7286 -52.7286 -24.8658 -24.8658 -23.9502 -23.9502 -23.8130 -23.8130 7.7199 7.7199 12.4468 12.4468 14.1498 14.1498 14.5026 14.5026 18.9968 18.9968 19.8916 19.8916 21.4367 21.4367 22.3004 22.3004 25.7368 25.7368 k = 0.2620 0.1513 0.4279 ( 1328 PWs) bands (ev): -52.7296 -52.7296 -24.8634 -24.8634 -23.9475 -23.9475 -23.8101 -23.8101 7.6557 7.6557 12.4872 12.4872 14.1889 14.1889 14.4984 14.4984 18.9583 18.9583 19.8963 19.8963 21.4540 21.4540 22.2843 22.2843 25.7908 25.7908 k = 0.2575 0.1487 0.4205 ( 1328 PWs) bands (ev): -52.7306 -52.7306 -24.8609 -24.8609 -23.9447 -23.9447 -23.8072 -23.8072 7.5875 7.5875 12.5340 12.5340 14.2294 14.2294 14.4972 14.4972 18.9195 18.9195 19.8961 19.8961 21.4696 21.4696 22.2686 22.2686 25.8367 25.8367 k = 0.2530 0.1461 0.4132 ( 1328 PWs) bands (ev): -52.7317 -52.7317 -24.8583 -24.8583 -23.9417 -23.9417 -23.8044 -23.8044 7.5157 7.5157 12.5868 12.5868 14.2713 14.2713 14.4991 14.4991 18.8806 18.8806 19.8911 19.8911 21.4833 21.4833 22.2532 22.2532 25.8743 25.8743 k = 0.2485 0.1435 0.4058 ( 1332 PWs) bands (ev): -52.7339 -52.7339 -24.8557 -24.8557 -23.9387 -23.9387 -23.8018 -23.8018 7.4404 7.4404 12.6445 12.6445 14.3136 14.3136 14.5052 14.5052 18.8316 18.8316 19.8857 19.8857 21.4885 21.4885 22.2369 22.2369 25.9048 25.9048 k = 0.2440 0.1409 0.3984 ( 1332 PWs) bands (ev): -52.7351 -52.7351 -24.8529 -24.8529 -23.9353 -23.9353 -23.7990 -23.7990 7.3623 7.3623 12.7084 12.7084 14.3582 14.3582 14.5130 14.5130 18.7924 18.7924 19.8713 19.8713 21.4982 21.4982 22.2214 22.2214 25.9249 25.9249 k = 0.2395 0.1383 0.3910 ( 1332 PWs) bands (ev): -52.7363 -52.7363 -24.8500 -24.8500 -23.9319 -23.9319 -23.7962 -23.7962 7.2818 7.2818 12.7773 12.7773 14.4043 14.4043 14.5240 14.5240 18.7532 18.7532 19.8526 19.8526 21.5060 21.5060 22.2057 22.2057 25.9361 25.9361 k = 0.2349 0.1356 0.3837 ( 1332 PWs) bands (ev): -52.7375 -52.7375 -24.8469 -24.8469 -23.9282 -23.9282 -23.7934 -23.7934 7.1990 7.1990 12.8508 12.8508 14.4517 14.4517 14.5380 14.5380 18.7140 18.7140 19.8297 19.8297 21.5117 21.5117 22.1894 22.1894 25.9385 25.9385 k = 0.2304 0.1330 0.3763 ( 1334 PWs) bands (ev): -52.7393 -52.7393 -24.8439 -24.8439 -23.9246 -23.9246 -23.7906 -23.7906 7.1141 7.1141 12.9287 12.9287 14.5003 14.5003 14.5551 14.5551 18.6748 18.6748 19.7976 19.7976 21.5148 21.5148 22.1725 22.1725 25.9314 25.9314 k = 0.2259 0.1304 0.3689 ( 1334 PWs) bands (ev): -52.7406 -52.7406 -24.8407 -24.8407 -23.9207 -23.9207 -23.7878 -23.7878 7.0279 7.0279 13.0108 13.0108 14.5494 14.5494 14.5763 14.5763 18.6356 18.6356 19.7669 19.7669 21.5164 21.5164 22.1548 22.1548 25.9159 25.9159 k = 0.2214 0.1278 0.3615 ( 1334 PWs) bands (ev): -52.7419 -52.7419 -24.8374 -24.8374 -23.9166 -23.9166 -23.7851 -23.7851 6.9404 6.9404 13.0966 13.0966 14.5919 14.5919 14.6086 14.6086 18.5966 18.5966 19.7329 19.7329 21.5159 21.5159 22.1362 22.1362 25.8916 25.8916 k = 0.2169 0.1252 0.3541 ( 1334 PWs) bands (ev): -52.7432 -52.7432 -24.8340 -24.8340 -23.9125 -23.9125 -23.7824 -23.7824 6.8520 6.8520 13.1859 13.1859 14.6212 14.6212 14.6585 14.6585 18.5577 18.5577 19.6958 19.6958 21.5133 21.5133 22.1165 22.1165 25.8586 25.8586 k = 0.2123 0.1226 0.3468 ( 1330 PWs) bands (ev): -52.7434 -52.7434 -24.8303 -24.8303 -23.9078 -23.9078 -23.7797 -23.7797 6.7629 6.7629 13.2787 13.2787 14.6511 14.6511 14.7125 14.7125 18.5189 18.5189 19.6682 19.6682 21.5088 21.5088 22.0956 22.0956 25.8176 25.8176 k = 0.2078 0.1200 0.3394 ( 1330 PWs) bands (ev): -52.7447 -52.7447 -24.8267 -24.8267 -23.9033 -23.9033 -23.7771 -23.7771 6.6732 6.6732 13.3743 13.3743 14.6834 14.6834 14.7682 14.7682 18.4804 18.4804 19.6254 19.6254 21.5021 21.5021 22.0734 22.0734 25.7676 25.7676 k = 0.2033 0.1174 0.3320 ( 1330 PWs) bands (ev): -52.7461 -52.7461 -24.8230 -24.8230 -23.8988 -23.8988 -23.7745 -23.7745 6.5833 6.5833 13.4728 13.4728 14.7185 14.7185 14.8253 14.8253 18.4421 18.4421 19.5804 19.5804 21.4932 21.4932 22.0499 22.0499 25.7095 25.7095 k = 0.1988 0.1148 0.3246 ( 1330 PWs) bands (ev): -52.7474 -52.7474 -24.8193 -24.8193 -23.8941 -23.8941 -23.7720 -23.7720 6.4932 6.4932 13.5739 13.5739 14.7565 14.7565 14.8838 14.8838 18.4040 18.4040 19.5335 19.5335 21.4824 21.4824 22.0249 22.0249 25.6436 25.6436 k = 0.1943 0.1122 0.3173 ( 1330 PWs) bands (ev): -52.7488 -52.7488 -24.8156 -24.8156 -23.8892 -23.8892 -23.7694 -23.7694 6.4033 6.4033 13.6774 13.6774 14.7975 14.7975 14.9435 14.9435 18.3663 18.3663 19.4847 19.4847 21.4695 21.4695 21.9986 21.9986 25.5701 25.5701 k = 0.1898 0.1096 0.3099 ( 1336 PWs) bands (ev): -52.7519 -52.7519 -24.8120 -24.8120 -23.8847 -23.8847 -23.7671 -23.7671 6.3133 6.3133 13.7829 13.7829 14.8384 14.8384 15.0030 15.0030 18.3285 18.3285 19.4287 19.4287 21.4516 21.4516 21.9700 21.9700 25.4829 25.4829 k = 0.1852 0.1069 0.3025 ( 1336 PWs) bands (ev): -52.7533 -52.7533 -24.8082 -24.8082 -23.8797 -23.8797 -23.7647 -23.7647 6.2242 6.2242 13.8906 13.8906 14.8852 14.8852 15.0651 15.0651 18.2915 18.2915 19.3771 19.3771 21.4348 21.4348 21.9407 21.9407 25.3952 25.3952 k = 0.1807 0.1043 0.2951 ( 1342 PWs) bands (ev): -52.7565 -52.7565 -24.8046 -24.8046 -23.8751 -23.8751 -23.7624 -23.7624 6.1350 6.1350 14.0000 14.0000 14.9339 14.9339 15.1278 15.1278 18.2549 18.2549 19.3093 19.3093 21.4151 21.4151 21.9098 21.9098 25.2989 25.2989 k = 0.1762 0.1017 0.2877 ( 1342 PWs) bands (ev): -52.7579 -52.7579 -24.8007 -24.8007 -23.8699 -23.8699 -23.7601 -23.7601 6.0472 6.0472 14.1113 14.1113 14.9865 14.9865 15.1921 15.1921 18.2187 18.2187 19.2555 19.2555 21.3946 21.3946 21.8776 21.8776 25.1985 25.1985 k = 0.1717 0.0991 0.2804 ( 1342 PWs) bands (ev): -52.7593 -52.7593 -24.7967 -24.7967 -23.8646 -23.8646 -23.7578 -23.7578 5.9603 5.9603 14.2242 14.2242 15.0420 15.0420 15.2576 15.2576 18.1830 18.1830 19.2011 19.2011 21.3722 21.3722 21.8440 21.8440 25.0923 25.0923 k = 0.1672 0.0965 0.2730 ( 1342 PWs) bands (ev): -52.7607 -52.7607 -24.7927 -24.7927 -23.8593 -23.8593 -23.7556 -23.7556 5.8744 5.8744 14.3384 14.3384 15.1003 15.1003 15.3240 15.3240 18.1478 18.1478 19.1462 19.1462 21.3481 21.3481 21.8091 21.8091 24.9807 24.9807 k = 0.1627 0.0939 0.2656 ( 1349 PWs) bands (ev): -52.7642 -52.7642 -24.7890 -24.7890 -23.8541 -23.8541 -23.7541 -23.7541 5.7895 5.7895 14.4526 14.4526 15.1607 15.1607 15.3911 15.3911 18.1012 18.1012 19.0895 19.0895 21.3217 21.3217 21.7675 21.7675 24.8631 24.8631 k = 0.1581 0.0913 0.2582 ( 1349 PWs) bands (ev): -52.7656 -52.7656 -24.7850 -24.7850 -23.8486 -23.8486 -23.7519 -23.7519 5.7060 5.7060 14.5690 14.5690 15.2247 15.2247 15.4594 15.4594 18.0671 18.0671 19.0343 19.0343 21.2943 21.2943 21.7299 21.7299 24.7417 24.7417 k = 0.1536 0.0887 0.2509 ( 1349 PWs) bands (ev): -52.7670 -52.7670 -24.7811 -24.7811 -23.8432 -23.8432 -23.7499 -23.7499 5.6238 5.6238 14.6864 14.6864 15.2915 15.2915 15.5284 15.5284 18.0336 18.0336 18.9791 18.9791 21.2654 21.2654 21.6910 21.6910 24.6159 24.6159 k = 0.1491 0.0861 0.2435 ( 1349 PWs) bands (ev): -52.7684 -52.7684 -24.7771 -24.7771 -23.8376 -23.8376 -23.7479 -23.7479 5.5431 5.5431 14.8046 14.8046 15.3610 15.3610 15.5983 15.5983 18.0008 18.0008 18.9242 18.9242 21.2349 21.2349 21.6509 21.6509 24.4860 24.4860 k = 0.1446 0.0835 0.2361 ( 1353 PWs) bands (ev): -52.7709 -52.7709 -24.7734 -24.7734 -23.8322 -23.8322 -23.7463 -23.7463 5.4638 5.4638 14.9215 14.9215 15.4321 15.4321 15.6687 15.6687 17.9664 17.9664 18.8690 18.8690 21.2029 21.2029 21.6042 21.6042 24.3505 24.3505 k = 0.1401 0.0809 0.2287 ( 1349 PWs) bands (ev): -52.7711 -52.7711 -24.7693 -24.7693 -23.8265 -23.8265 -23.7442 -23.7442 5.3863 5.3863 15.0414 15.0414 15.5111 15.5111 15.7398 15.7398 17.9351 17.9351 18.8155 18.8155 21.1697 21.1697 21.5645 21.5645 24.2200 24.2200 k = 0.1355 0.0783 0.2213 ( 1349 PWs) bands (ev): -52.7724 -52.7724 -24.7655 -24.7655 -23.8210 -23.8210 -23.7423 -23.7423 5.3105 5.3105 15.1608 15.1608 15.5887 15.5887 15.8115 15.8115 17.9043 17.9043 18.7625 18.7625 21.1353 21.1353 21.5208 21.5208 24.0799 24.0799 k = 0.1310 0.0756 0.2140 ( 1349 PWs) bands (ev): -52.7737 -52.7737 -24.7617 -24.7617 -23.8154 -23.8154 -23.7406 -23.7406 5.2364 5.2364 15.2803 15.2803 15.6689 15.6689 15.8835 15.8835 17.8742 17.8742 18.7104 18.7104 21.0996 21.0996 21.4760 21.4760 23.9371 23.9371 k = 0.1265 0.0730 0.2066 ( 1349 PWs) bands (ev): -52.7750 -52.7750 -24.7579 -24.7579 -23.8100 -23.8100 -23.7389 -23.7389 5.1642 5.1642 15.3998 15.3998 15.7518 15.7518 15.9559 15.9559 17.8449 17.8449 18.6594 18.6594 21.0629 21.0629 21.4301 21.4301 23.7918 23.7918 k = 0.1220 0.0704 0.1992 ( 1349 PWs) bands (ev): -52.7762 -52.7762 -24.7543 -24.7543 -23.8045 -23.8045 -23.7372 -23.7372 5.0939 5.0939 15.5190 15.5190 15.8371 15.8371 16.0285 16.0285 17.8165 17.8165 18.6096 18.6096 21.0251 21.0251 21.3831 21.3831 23.6444 23.6444 k = 0.1175 0.0678 0.1918 ( 1349 PWs) bands (ev): -52.7775 -52.7775 -24.7507 -24.7507 -23.7991 -23.7991 -23.7357 -23.7357 5.0257 5.0257 15.6378 15.6378 15.9249 15.9249 16.1013 16.1013 17.7888 17.7888 18.5613 18.5613 20.9865 20.9865 21.3352 21.3352 23.4950 23.4950 k = 0.1130 0.0652 0.1844 ( 1341 PWs) bands (ev): -52.7764 -52.7764 -24.7468 -24.7468 -23.7932 -23.7932 -23.7339 -23.7339 4.9596 4.9596 15.7573 15.7573 16.0198 16.0198 16.1790 16.1790 17.7624 17.7624 18.5175 18.5175 20.9497 20.9497 21.2880 21.2880 23.3497 23.3497 k = 0.1084 0.0626 0.1771 ( 1341 PWs) bands (ev): -52.7776 -52.7776 -24.7434 -24.7434 -23.7879 -23.7879 -23.7324 -23.7324 4.8956 4.8956 15.8745 15.8745 16.1124 16.1124 16.2517 16.2517 17.7365 17.7365 18.4725 18.4725 20.9093 20.9093 21.2380 21.2380 23.1971 23.1971 k = 0.1039 0.0600 0.1697 ( 1333 PWs) bands (ev): -52.7764 -52.7764 -24.7397 -24.7397 -23.7825 -23.7825 -23.7305 -23.7305 4.8338 4.8338 15.9956 15.9956 16.2093 16.2093 16.3269 16.3269 17.7128 17.7128 18.4323 18.4323 20.8692 20.8692 21.1943 21.1943 23.0464 23.0464 k = 0.0994 0.0574 0.1623 ( 1337 PWs) bands (ev): -52.7787 -52.7787 -24.7366 -24.7366 -23.7775 -23.7775 -23.7294 -23.7294 4.7740 4.7740 16.1096 16.1096 16.3043 16.3043 16.3983 16.3983 17.6844 17.6844 18.3910 18.3910 20.8272 20.8272 21.1410 21.1410 22.8898 22.8898 k = 0.0949 0.0548 0.1549 ( 1335 PWs) bands (ev): -52.7792 -52.7792 -24.7334 -24.7334 -23.7724 -23.7724 -23.7281 -23.7281 4.7166 4.7166 16.2231 16.2231 16.4034 16.4034 16.4718 16.4718 17.6611 17.6611 18.3545 18.3545 20.7861 20.7861 21.0883 21.0883 22.7347 22.7347 k = 0.0904 0.0522 0.1476 ( 1343 PWs) bands (ev): -52.7826 -52.7826 -24.7307 -24.7307 -23.7678 -23.7678 -23.7274 -23.7274 4.6614 4.6614 16.3317 16.3317 16.5027 16.5027 16.5416 16.5416 17.6307 17.6307 18.3136 18.3136 20.7426 20.7426 21.0316 21.0316 22.5785 22.5785 k = 0.0858 0.0496 0.1402 ( 1343 PWs) bands (ev): -52.7836 -52.7836 -24.7279 -24.7279 -23.7631 -23.7631 -23.7262 -23.7262 4.6088 4.6088 16.4401 16.4401 16.6005 16.6005 16.6169 16.6169 17.6094 17.6094 18.2802 18.2802 20.7004 20.7004 20.9774 20.9774 22.4230 22.4230 k = 0.0813 0.0470 0.1328 ( 1343 PWs) bands (ev): -52.7846 -52.7846 -24.7251 -24.7251 -23.7586 -23.7586 -23.7251 -23.7251 4.5585 4.5585 16.5456 16.5456 16.6764 16.6764 16.7148 16.7148 17.5891 17.5891 18.2500 18.2500 20.6582 20.6582 20.9226 20.9226 22.2677 22.2677 k = 0.0768 0.0443 0.1254 ( 1343 PWs) bands (ev): -52.7855 -52.7855 -24.7224 -24.7224 -23.7543 -23.7543 -23.7240 -23.7240 4.5107 4.5107 16.6470 16.6470 16.7411 16.7411 16.8236 16.8236 17.5722 17.5722 18.2225 18.2225 20.6147 20.6147 20.8670 20.8670 22.1159 22.1159 k = 0.0723 0.0417 0.1180 ( 1343 PWs) bands (ev): -52.7864 -52.7864 -24.7199 -24.7199 -23.7500 -23.7500 -23.7231 -23.7231 4.4655 4.4655 16.7450 16.7450 16.8071 16.8071 16.9316 16.9316 17.5539 17.5539 18.1996 18.1996 20.5732 20.5732 20.8113 20.8113 21.9616 21.9616 k = 0.0678 0.0391 0.1107 ( 1343 PWs) bands (ev): -52.7872 -52.7872 -24.7175 -24.7175 -23.7460 -23.7460 -23.7221 -23.7221 4.4228 4.4228 16.8383 16.8383 16.8714 16.8714 17.0411 17.0411 17.5367 17.5367 18.1811 18.1811 20.5322 20.5322 20.7553 20.7553 21.8083 21.8083 k = 0.0633 0.0365 0.1033 ( 1343 PWs) bands (ev): -52.7880 -52.7880 -24.7153 -24.7153 -23.7422 -23.7422 -23.7213 -23.7213 4.3827 4.3827 16.9253 16.9253 16.9346 16.9346 17.1516 17.1516 17.5206 17.5206 18.1673 18.1673 20.4919 20.4919 20.6994 20.6994 21.6563 21.6563 k = 0.0587 0.0339 0.0959 ( 1345 PWs) bands (ev): -52.7893 -52.7893 -24.7133 -24.7133 -23.7386 -23.7386 -23.7206 -23.7206 4.3452 4.3452 16.9921 16.9921 17.0073 17.0073 17.2610 17.2610 17.5058 17.5058 18.1587 18.1587 20.4527 20.4527 20.6424 20.6424 21.5053 21.5053 k = 0.0542 0.0313 0.0885 ( 1345 PWs) bands (ev): -52.7900 -52.7900 -24.7113 -24.7113 -23.7352 -23.7352 -23.7199 -23.7199 4.3104 4.3104 17.0497 17.0497 17.0816 17.0816 17.3722 17.3722 17.4925 17.4925 18.1559 18.1559 20.4147 20.4147 20.5872 20.5872 21.3574 21.3574 k = 0.0497 0.0287 0.0812 ( 1345 PWs) bands (ev): -52.7905 -52.7905 -24.7095 -24.7095 -23.7321 -23.7321 -23.7192 -23.7192 4.2781 4.2781 17.1028 17.1028 17.1479 17.1479 17.4700 17.4700 17.4954 17.4954 18.1594 18.1594 20.3777 20.3777 20.5330 20.5330 21.2131 21.2131 k = 0.0452 0.0261 0.0738 ( 1345 PWs) bands (ev): -52.7911 -52.7911 -24.7078 -24.7078 -23.7292 -23.7292 -23.7186 -23.7186 4.2487 4.2487 17.1539 17.1539 17.2064 17.2064 17.4659 17.4659 17.5991 17.5991 18.1688 18.1688 20.3429 20.3429 20.4799 20.4799 21.0710 21.0710 k = 0.0407 0.0235 0.0664 ( 1345 PWs) bands (ev): -52.7916 -52.7916 -24.7063 -24.7063 -23.7265 -23.7265 -23.7180 -23.7180 4.2219 4.2219 17.2002 17.2002 17.2553 17.2553 17.4561 17.4561 17.7101 17.7101 18.1841 18.1841 20.3099 20.3099 20.4285 20.4285 20.9338 20.9338 k = 0.0361 0.0209 0.0590 ( 1353 PWs) bands (ev): -52.7944 -52.7944 -24.7053 -24.7053 -23.7246 -23.7246 -23.7178 -23.7178 4.1977 4.1977 17.2353 17.2353 17.2947 17.2947 17.4451 17.4451 17.8120 17.8120 18.2028 18.2028 20.2784 20.2784 20.3787 20.3787 20.7991 20.7991 k = 0.0316 0.0183 0.0516 ( 1357 PWs) bands (ev): -52.7960 -52.7960 -24.7043 -24.7043 -23.7227 -23.7227 -23.7175 -23.7175 4.1764 4.1764 17.2687 17.2687 17.3256 17.3256 17.4369 17.4369 17.9146 17.9146 18.2265 18.2265 20.2500 20.2500 20.3325 20.3325 20.6723 20.6723 k = 0.0271 0.0157 0.0443 ( 1363 PWs) bands (ev): -52.7982 -52.7982 -24.7035 -24.7035 -23.7214 -23.7214 -23.7172 -23.7172 4.1578 4.1578 17.2990 17.2990 17.3455 17.3455 17.4307 17.4307 18.0111 18.0111 18.2486 18.2486 20.2247 20.2247 20.2901 20.2901 20.5532 20.5532 k = 0.0226 0.0130 0.0369 ( 1363 PWs) bands (ev): -52.7986 -52.7986 -24.7026 -24.7026 -23.7198 -23.7198 -23.7169 -23.7169 4.1422 4.1422 17.3276 17.3276 17.3639 17.3639 17.4268 17.4268 18.1029 18.1029 18.2755 18.2755 20.2025 20.2025 20.2525 20.2525 20.4449 20.4449 k = 0.0181 0.0104 0.0295 ( 1363 PWs) bands (ev): -52.7989 -52.7989 -24.7019 -24.7019 -23.7185 -23.7185 -23.7166 -23.7166 4.1294 4.1294 17.3506 17.3506 17.3763 17.3763 17.4255 17.4255 18.1852 18.1852 18.3008 18.3008 20.1831 20.1831 20.2207 20.2207 20.3493 20.3493 k = 0.0136 0.0078 0.0221 ( 1363 PWs) bands (ev): -52.7991 -52.7991 -24.7013 -24.7013 -23.7175 -23.7175 -23.7164 -23.7164 4.1195 4.1195 17.3679 17.3679 17.3834 17.3834 17.4270 17.4270 18.2549 18.2549 18.3227 18.3227 20.1660 20.1660 20.1959 20.1959 20.2699 20.2699 k = 0.0090 0.0052 0.0148 ( 1363 PWs) bands (ev): -52.7993 -52.7993 -24.7009 -24.7009 -23.7167 -23.7167 -23.7163 -23.7163 4.1124 4.1124 17.3796 17.3796 17.3867 17.3867 17.4300 17.4300 18.3083 18.3083 18.3396 18.3396 20.1508 20.1508 20.1789 20.1789 20.2109 20.2109 k = 0.0045 0.0026 0.0074 ( 1363 PWs) bands (ev): -52.7994 -52.7994 -24.7006 -24.7006 -23.7163 -23.7163 -23.7162 -23.7162 4.1081 4.1081 17.3861 17.3861 17.3880 17.3880 17.4329 17.4329 18.3422 18.3422 18.3502 18.3502 20.1378 20.1378 20.1693 20.1693 20.1766 20.1766 k = 0.0000 0.0000 0.0000 ( 1363 PWs) bands (ev): -52.7994 -52.7994 -24.7006 -24.7006 -23.7161 -23.7161 -23.7161 -23.7161 4.1067 4.1067 17.3882 17.3882 17.3882 17.3882 17.4341 17.4341 18.3538 18.3538 18.3538 18.3538 20.1318 20.1318 20.1663 20.1663 20.1663 20.1663 k = 0.0000 0.0000 0.0000 ( 1363 PWs) bands (ev): -52.7994 -52.7994 -24.7006 -24.7006 -23.7161 -23.7161 -23.7161 -23.7161 4.1067 4.1067 17.3882 17.3882 17.3882 17.3882 17.4341 17.4341 18.3538 18.3538 18.3538 18.3538 20.1318 20.1318 20.1663 20.1663 20.1663 20.1663 k = 0.0074 0.0042 0.0030 ( 1363 PWs) bands (ev): -52.7994 -52.7994 -24.7006 -24.7006 -23.7163 -23.7163 -23.7162 -23.7162 4.1081 4.1081 17.3860 17.3860 17.3881 17.3881 17.4329 17.4329 18.3460 18.3460 18.3464 18.3464 20.1379 20.1379 20.1702 20.1702 20.1756 20.1756 k = 0.0147 0.0085 0.0060 ( 1363 PWs) bands (ev): -52.7993 -52.7993 -24.7009 -24.7009 -23.7168 -23.7168 -23.7162 -23.7162 4.1124 4.1124 17.3785 17.3785 17.3877 17.3877 17.4302 17.4302 18.3233 18.3233 18.3249 18.3249 20.1487 20.1487 20.1886 20.1886 20.2030 20.2030 k = 0.0221 0.0127 0.0090 ( 1363 PWs) bands (ev): -52.7991 -52.7991 -24.7013 -24.7013 -23.7175 -23.7175 -23.7163 -23.7163 4.1194 4.1194 17.3645 17.3645 17.3867 17.3867 17.4270 17.4270 18.2871 18.2871 18.2908 18.2908 20.1551 20.1551 20.2293 20.2293 20.2471 20.2471 k = 0.0294 0.0170 0.0120 ( 1363 PWs) bands (ev): -52.7989 -52.7989 -24.7018 -24.7018 -23.7186 -23.7186 -23.7165 -23.7165 4.1293 4.1293 17.3430 17.3430 17.3848 17.3848 17.4240 17.4240 18.2401 18.2401 18.2463 18.2463 20.1593 20.1593 20.2879 20.2879 20.3061 20.3061 k = 0.0368 0.0212 0.0150 ( 1363 PWs) bands (ev): -52.7986 -52.7986 -24.7026 -24.7026 -23.7199 -23.7199 -23.7167 -23.7167 4.1420 4.1420 17.3142 17.3142 17.3813 17.3813 17.4208 17.4208 18.1848 18.1848 18.1943 18.1943 20.1634 20.1634 20.3602 20.3602 20.3778 20.3778 k = 0.0441 0.0255 0.0180 ( 1357 PWs) bands (ev): -52.7965 -52.7965 -24.7032 -24.7032 -23.7210 -23.7210 -23.7169 -23.7169 4.1577 4.1577 17.2897 17.2897 17.3758 17.3758 17.4167 17.4167 18.1257 18.1257 18.1389 18.1389 20.1689 20.1689 20.4436 20.4436 20.4601 20.4601 k = 0.0515 0.0297 0.0210 ( 1357 PWs) bands (ev): -52.7961 -52.7961 -24.7042 -24.7042 -23.7230 -23.7230 -23.7172 -23.7172 4.1759 4.1759 17.2466 17.2466 17.3663 17.3663 17.4091 17.4091 18.0633 18.0633 18.0806 18.0806 20.1740 20.1740 20.5358 20.5358 20.5513 20.5513 k = 0.0588 0.0340 0.0240 ( 1351 PWs) bands (ev): -52.7939 -52.7939 -24.7052 -24.7052 -23.7248 -23.7248 -23.7173 -23.7173 4.1972 4.1972 17.1987 17.1987 17.3525 17.3525 17.3978 17.3978 18.0080 18.0080 18.0296 18.0296 20.1799 20.1799 20.6361 20.6361 20.6504 20.6504 k = 0.0662 0.0382 0.0270 ( 1351 PWs) bands (ev): -52.7934 -52.7934 -24.7065 -24.7065 -23.7273 -23.7273 -23.7177 -23.7177 4.2210 4.2210 17.1430 17.1430 17.3304 17.3304 17.3781 17.3781 17.9519 17.9519 17.9774 17.9774 20.1860 20.1860 20.7416 20.7416 20.7547 20.7547 k = 0.0735 0.0425 0.0300 ( 1351 PWs) bands (ev): -52.7928 -52.7928 -24.7080 -24.7080 -23.7301 -23.7301 -23.7181 -23.7181 4.2476 4.2476 17.0816 17.0816 17.2994 17.2994 17.3487 17.3487 17.9043 17.9043 17.9327 17.9327 20.1925 20.1925 20.8519 20.8519 20.8639 20.8639 k = 0.0809 0.0467 0.0330 ( 1345 PWs) bands (ev): -52.7905 -52.7905 -24.7094 -24.7094 -23.7328 -23.7328 -23.7183 -23.7183 4.2772 4.2772 17.0174 17.0174 17.2612 17.2612 17.3109 17.3109 17.8705 17.8705 17.9005 17.9005 20.2006 20.2006 20.9654 20.9654 20.9764 20.9764 k = 0.0882 0.0509 0.0360 ( 1345 PWs) bands (ev): -52.7899 -52.7899 -24.7112 -24.7112 -23.7361 -23.7361 -23.7188 -23.7188 4.3093 4.3093 16.9449 16.9449 17.2085 17.2085 17.2571 17.2571 17.8468 17.8468 17.8767 17.8767 20.2080 20.2080 21.0827 21.0827 21.0927 21.0927 k = 0.0956 0.0552 0.0390 ( 1345 PWs) bands (ev): -52.7893 -52.7893 -24.7132 -24.7132 -23.7396 -23.7396 -23.7193 -23.7193 4.3440 4.3440 16.8674 16.8674 17.1462 17.1462 17.1925 17.1925 17.8345 17.8345 17.8631 17.8631 20.2158 20.2158 21.2027 21.2027 21.2117 21.2117 k = 0.1029 0.0594 0.0420 ( 1345 PWs) bands (ev): -52.7885 -52.7885 -24.7153 -24.7153 -23.7434 -23.7434 -23.7199 -23.7199 4.3813 4.3813 16.7852 16.7852 17.0757 17.0757 17.1192 17.1192 17.8321 17.8321 17.8587 17.8587 20.2239 20.2239 21.3247 21.3247 21.3329 21.3329 k = 0.1103 0.0637 0.0450 ( 1351 PWs) bands (ev): -52.7895 -52.7895 -24.7178 -24.7178 -23.7477 -23.7477 -23.7208 -23.7208 4.4212 4.4212 16.6984 16.6984 16.9971 16.9971 17.0377 17.0377 17.8318 17.8318 17.8563 17.8563 20.2322 20.2322 21.4468 21.4468 21.4541 21.4541 k = 0.1176 0.0679 0.0480 ( 1345 PWs) bands (ev): -52.7870 -52.7870 -24.7199 -24.7199 -23.7516 -23.7516 -23.7211 -23.7211 4.4641 4.4641 16.6077 16.6077 16.9171 16.9171 16.9548 16.9548 17.8498 17.8498 17.8721 17.8721 20.2409 20.2409 21.5726 21.5726 21.5792 21.5792 k = 0.1250 0.0722 0.0510 ( 1333 PWs) bands (ev): -52.7826 -52.7826 -24.7219 -24.7219 -23.7556 -23.7556 -23.7210 -23.7210 4.5097 4.5097 16.5152 16.5152 16.8389 16.8389 16.8739 16.8739 17.8718 17.8718 17.8920 17.8920 20.2514 20.2514 21.7025 21.7025 21.7083 21.7083 k = 0.1324 0.0764 0.0540 ( 1333 PWs) bands (ev): -52.7818 -52.7818 -24.7246 -24.7246 -23.7602 -23.7602 -23.7217 -23.7217 4.5574 4.5574 16.4167 16.4167 16.7517 16.7517 16.7844 16.7844 17.8922 17.8922 17.9107 17.9107 20.2607 20.2607 21.8298 21.8298 21.8349 21.8349 k = 0.1397 0.0807 0.0570 ( 1333 PWs) bands (ev): -52.7808 -52.7808 -24.7274 -24.7274 -23.7650 -23.7650 -23.7225 -23.7225 4.6077 4.6077 16.3147 16.3147 16.6632 16.6632 16.6939 16.6939 17.9158 17.9158 17.9328 17.9328 20.2705 20.2705 21.9578 21.9578 21.9621 21.9621 k = 0.1471 0.0849 0.0600 ( 1336 PWs) bands (ev): -52.7807 -52.7807 -24.7304 -24.7304 -23.7703 -23.7703 -23.7232 -23.7232 4.6604 4.6604 16.2048 16.2048 16.5739 16.5739 16.6029 16.6029 17.9419 17.9419 17.9577 17.9577 20.2779 20.2779 22.0862 22.0862 22.0899 22.0899 k = 0.1544 0.0891 0.0630 ( 1336 PWs) bands (ev): -52.7797 -52.7797 -24.7334 -24.7334 -23.7753 -23.7753 -23.7240 -23.7240 4.7156 4.7156 16.0967 16.0967 16.4844 16.4844 16.5119 16.5119 17.9707 17.9707 17.9853 17.9853 20.2880 20.2880 22.2149 22.2149 22.2179 22.2179 k = 0.1618 0.0934 0.0660 ( 1342 PWs) bands (ev): -52.7804 -52.7804 -24.7368 -24.7368 -23.7808 -23.7808 -23.7252 -23.7252 4.7732 4.7732 15.9855 15.9855 16.3922 16.3922 16.4184 16.4184 17.9987 17.9987 18.0123 18.0123 20.2977 20.2977 22.3405 22.3405 22.3429 22.3429 k = 0.1691 0.0976 0.0690 ( 1342 PWs) bands (ev): -52.7793 -52.7793 -24.7401 -24.7401 -23.7862 -23.7862 -23.7261 -23.7261 4.8332 4.8332 15.8721 15.8721 16.3033 16.3033 16.3284 16.3284 18.0314 18.0314 18.0442 18.0442 20.3087 20.3087 22.4691 22.4691 22.4709 22.4709 k = 0.1765 0.1019 0.0720 ( 1336 PWs) bands (ev): -52.7765 -52.7765 -24.7432 -24.7432 -23.7914 -23.7914 -23.7265 -23.7265 4.8958 4.8958 15.7568 15.7568 16.2172 16.2172 16.2412 16.2412 18.0702 18.0702 18.0823 18.0823 20.3208 20.3208 22.5994 22.5994 22.6006 22.6006 k = 0.1838 0.1061 0.0750 ( 1336 PWs) bands (ev): -52.7754 -52.7754 -24.7467 -24.7467 -23.7969 -23.7969 -23.7274 -23.7274 4.9604 4.9604 15.6388 15.6388 16.1299 16.1299 16.1529 16.1529 18.1062 18.1062 18.1177 18.1177 20.3327 20.3327 22.7276 22.7276 22.7282 22.7282 k = 0.1912 0.1104 0.0780 ( 1336 PWs) bands (ev): -52.7742 -52.7742 -24.7502 -24.7502 -23.8026 -23.8026 -23.7283 -23.7283 5.0273 5.0273 15.5188 15.5188 16.0435 16.0435 16.0658 16.0658 18.1436 18.1436 18.1545 18.1545 20.3451 20.3451 22.8553 22.8553 22.8553 22.8553 k = 0.1985 0.1146 0.0810 ( 1336 PWs) bands (ev): -52.7730 -52.7730 -24.7539 -24.7539 -23.8083 -23.8083 -23.7292 -23.7292 5.0964 5.0964 15.3970 15.3970 15.9584 15.9584 15.9800 15.9800 18.1823 18.1823 18.1927 18.1927 20.3581 20.3581 22.9818 22.9818 22.9824 22.9824 k = 0.2059 0.1189 0.0841 ( 1336 PWs) bands (ev): -52.7717 -52.7717 -24.7576 -24.7576 -23.8140 -23.8140 -23.7302 -23.7302 5.1677 5.1677 15.2735 15.2735 15.8746 15.8746 15.8955 15.8955 18.2221 18.2221 18.2321 18.2321 20.3716 20.3716 23.1077 23.1077 23.1088 23.1088 k = 0.2132 0.1231 0.0871 ( 1336 PWs) bands (ev): -52.7705 -52.7705 -24.7614 -24.7614 -23.8198 -23.8198 -23.7311 -23.7311 5.2410 5.2410 15.1485 15.1485 15.7921 15.7921 15.8125 15.8125 18.2631 18.2631 18.2726 18.2726 20.3858 20.3858 23.2327 23.2327 23.2343 23.2343 k = 0.2206 0.1274 0.0901 ( 1339 PWs) bands (ev): -52.7700 -52.7700 -24.7654 -24.7654 -23.8258 -23.8258 -23.7322 -23.7322 5.3164 5.3164 15.0220 15.0220 15.7097 15.7097 15.7295 15.7295 18.3039 18.3039 18.3131 18.3131 20.4006 20.4006 23.3544 23.3544 23.3566 23.3566 k = 0.2279 0.1316 0.0931 ( 1339 PWs) bands (ev): -52.7687 -52.7687 -24.7694 -24.7694 -23.8317 -23.8317 -23.7331 -23.7331 5.3938 5.3938 14.8945 14.8945 15.6303 15.6303 15.6497 15.6497 18.3467 18.3467 18.3555 18.3555 20.4161 20.4161 23.4773 23.4773 23.4801 23.4801 k = 0.2353 0.1358 0.0961 ( 1339 PWs) bands (ev): -52.7674 -52.7674 -24.7733 -24.7733 -23.8375 -23.8375 -23.7341 -23.7341 5.4732 5.4732 14.7659 14.7659 15.5525 15.5525 15.5715 15.5715 18.3902 18.3902 18.3988 18.3988 20.4323 20.4323 23.5991 23.5991 23.6024 23.6024 k = 0.2426 0.1401 0.0991 ( 1339 PWs) bands (ev): -52.7661 -52.7661 -24.7774 -24.7774 -23.8433 -23.8433 -23.7351 -23.7351 5.5544 5.5544 14.6363 14.6363 15.4764 15.4764 15.4950 15.4950 18.4344 18.4344 18.4427 18.4427 20.4492 20.4492 23.7196 23.7196 23.7234 23.7234 k = 0.2500 0.1443 0.1021 ( 1339 PWs) bands (ev): -52.7647 -52.7647 -24.7814 -24.7814 -23.8491 -23.8491 -23.7360 -23.7360 5.6375 5.6375 14.5060 14.5060 15.4020 15.4020 15.4203 15.4203 18.4792 18.4792 18.4872 18.4872 20.4668 20.4668 23.8387 23.8387 23.8431 23.8431 k = 0.2574 0.1486 0.1051 ( 1339 PWs) bands (ev): -52.7634 -52.7634 -24.7855 -24.7855 -23.8549 -23.8549 -23.7370 -23.7370 5.7224 5.7224 14.3750 14.3750 15.3295 15.3295 15.3474 15.3474 18.5245 18.5245 18.5322 18.5322 20.4852 20.4852 23.9564 23.9564 23.9612 23.9612 k = 0.2647 0.1528 0.1081 ( 1344 PWs) bands (ev): -52.7635 -52.7635 -24.7899 -24.7899 -23.8608 -23.8608 -23.7383 -23.7383 5.8089 5.8089 14.2442 14.2442 15.2554 15.2554 15.2731 15.2731 18.5684 18.5684 18.5760 18.5760 20.5061 20.5061 24.0664 24.0664 24.0718 24.0718 k = 0.2721 0.1571 0.1111 ( 1344 PWs) bands (ev): -52.7621 -52.7621 -24.7940 -24.7940 -23.8664 -23.8664 -23.7392 -23.7392 5.8971 5.8971 14.1121 14.1121 15.1865 15.1865 15.2039 15.2039 18.6143 18.6143 18.6217 18.6217 20.5260 20.5260 24.1805 24.1805 24.1865 24.1865 k = 0.2794 0.1613 0.1141 ( 1344 PWs) bands (ev): -52.7608 -52.7608 -24.7981 -24.7981 -23.8720 -23.8720 -23.7402 -23.7402 5.9869 5.9869 13.9798 13.9798 15.1195 15.1195 15.1367 15.1367 18.6604 18.6604 18.6675 18.6675 20.5466 20.5466 24.2928 24.2928 24.2993 24.2993 k = 0.2868 0.1656 0.1171 ( 1344 PWs) bands (ev): -52.7594 -52.7594 -24.8022 -24.8022 -23.8775 -23.8775 -23.7411 -23.7411 6.0782 6.0782 13.8472 13.8472 15.0545 15.0545 15.0714 15.0714 18.7065 18.7065 18.7134 18.7134 20.5679 20.5679 24.4032 24.4032 24.4101 24.4101 k = 0.2941 0.1698 0.1201 ( 1344 PWs) bands (ev): -52.7581 -52.7581 -24.8063 -24.8063 -23.8828 -23.8828 -23.7421 -23.7421 6.1709 6.1709 13.7145 13.7145 14.9914 14.9914 15.0082 15.0082 18.7526 18.7526 18.7593 18.7593 20.5900 20.5900 24.5115 24.5115 24.5189 24.5189 k = 0.3015 0.1741 0.1231 ( 1344 PWs) bands (ev): -52.7568 -52.7568 -24.8104 -24.8104 -23.8881 -23.8881 -23.7430 -23.7430 6.2649 6.2649 13.5819 13.5819 14.9304 14.9304 14.9470 14.9470 18.7985 18.7985 18.8051 18.8051 20.6127 20.6127 24.6176 24.6176 24.6256 24.6256 k = 0.3088 0.1783 0.1261 ( 1341 PWs) bands (ev): -52.7546 -52.7546 -24.8143 -24.8143 -23.8930 -23.8930 -23.7439 -23.7439 6.3605 6.3605 13.4508 13.4508 14.8714 14.8714 14.8878 14.8878 18.8452 18.8452 18.8516 18.8516 20.6406 20.6406 24.7217 24.7217 24.7302 24.7302 k = 0.3162 0.1825 0.1291 ( 1335 PWs) bands (ev): -52.7516 -52.7516 -24.8181 -24.8181 -23.8979 -23.8979 -23.7443 -23.7443 6.4570 6.4570 13.3189 13.3189 14.8158 14.8158 14.8320 14.8320 18.8946 18.8946 18.9008 18.9008 20.6684 20.6684 24.8256 24.8256 24.8346 24.8346 k = 0.3235 0.1868 0.1321 ( 1341 PWs) bands (ev): -52.7520 -52.7520 -24.8223 -24.8223 -23.9030 -23.9030 -23.7456 -23.7456 6.5545 6.5545 13.1868 13.1868 14.7589 14.7589 14.7750 14.7750 18.9349 18.9349 18.9409 18.9409 20.6917 20.6917 24.9208 24.9208 24.9303 24.9303 k = 0.3309 0.1910 0.1351 ( 1338 PWs) bands (ev): -52.7499 -52.7499 -24.8260 -24.8260 -23.9076 -23.9076 -23.7464 -23.7464 6.6531 6.6531 13.0557 13.0557 14.7071 14.7071 14.7231 14.7231 18.9805 18.9805 18.9863 18.9863 20.7179 20.7179 25.0193 25.0193 25.0293 25.0293 k = 0.3382 0.1953 0.1381 ( 1341 PWs) bands (ev): -52.7496 -52.7496 -24.8299 -24.8299 -23.9124 -23.9124 -23.7473 -23.7473 6.7523 6.7523 12.9241 12.9241 14.6563 14.6563 14.6722 14.6722 19.0203 19.0203 19.0260 19.0260 20.7422 20.7422 25.1125 25.1125 25.1230 25.1230 k = 0.3456 0.1995 0.1411 ( 1335 PWs) bands (ev): -52.7467 -52.7467 -24.8333 -24.8333 -23.9164 -23.9164 -23.7480 -23.7480 6.8528 6.8528 12.7952 12.7952 14.6084 14.6084 14.6242 14.6242 19.0671 19.0671 19.0725 19.0725 20.7721 20.7721 25.2052 25.2052 25.2162 25.2162 k = 0.3529 0.2038 0.1441 ( 1335 PWs) bands (ev): -52.7456 -52.7456 -24.8369 -24.8369 -23.9207 -23.9207 -23.7487 -23.7487 6.9534 6.9534 12.6658 12.6658 14.5620 14.5620 14.5777 14.5777 19.1085 19.1085 19.1138 19.1138 20.7979 20.7979 25.2929 25.2929 25.3043 25.3043 k = 0.3603 0.2080 0.1471 ( 1341 PWs) bands (ev): -52.7463 -52.7463 -24.8406 -24.8406 -23.9250 -23.9250 -23.7499 -23.7499 7.0543 7.0543 12.5373 12.5373 14.5150 14.5150 14.5307 14.5307 19.1482 19.1482 19.1534 19.1534 20.8194 20.8194 25.3713 25.3713 25.3832 25.3832 k = 0.3676 0.2123 0.1501 ( 1344 PWs) bands (ev): -52.7461 -52.7461 -24.8442 -24.8442 -23.9292 -23.9292 -23.7507 -23.7507 7.1554 7.1554 12.4088 12.4088 14.4728 14.4728 14.4883 14.4883 19.1867 19.1867 19.1917 19.1917 20.8399 20.8399 25.4520 25.4520 25.4644 25.4644 k = 0.3750 0.2165 0.1531 ( 1344 PWs) bands (ev): -52.7450 -52.7450 -24.8475 -24.8475 -23.9329 -23.9329 -23.7514 -23.7514 7.2567 7.2567 12.2832 12.2832 14.4329 14.4329 14.4484 14.4484 19.2246 19.2246 19.2295 19.2295 20.8655 20.8655 25.5299 25.5299 25.5427 25.5427 k = 0.3824 0.2208 0.1561 ( 1344 PWs) bands (ev): -52.7441 -52.7441 -24.8506 -24.8506 -23.9365 -23.9365 -23.7520 -23.7520 7.3577 7.3577 12.1593 12.1593 14.3952 14.3952 14.4107 14.4107 19.2611 19.2611 19.2658 19.2658 20.8907 20.8907 25.6044 25.6044 25.6176 25.6176 k = 0.3897 0.2250 0.1591 ( 1338 PWs) bands (ev): -52.7414 -52.7414 -24.8533 -24.8533 -23.9395 -23.9395 -23.7525 -23.7525 7.4586 7.4586 12.0378 12.0378 14.3605 14.3605 14.3759 14.3759 19.3026 19.3026 19.3072 19.3072 20.9171 20.9171 25.6775 25.6775 25.6912 25.6912 k = 0.3971 0.2292 0.1621 ( 1338 PWs) bands (ev): -52.7406 -52.7406 -24.8561 -24.8561 -23.9427 -23.9427 -23.7531 -23.7531 7.5583 7.5583 11.9179 11.9179 14.3273 14.3273 14.3427 14.3427 19.3359 19.3359 19.3403 19.3403 20.9414 20.9414 25.7446 25.7446 25.7587 25.7587 k = 0.4044 0.2335 0.1651 ( 1338 PWs) bands (ev): -52.7397 -52.7397 -24.8588 -24.8588 -23.9457 -23.9457 -23.7536 -23.7536 7.6569 7.6569 11.8007 11.8007 14.2964 14.2964 14.3117 14.3117 19.3674 19.3674 19.3717 19.3717 20.9651 20.9651 25.8078 25.8078 25.8223 25.8223 k = 0.4118 0.2377 0.1681 ( 1338 PWs) bands (ev): -52.7389 -52.7389 -24.8613 -24.8613 -23.9484 -23.9484 -23.7542 -23.7542 7.7543 7.7543 11.6867 11.6867 14.2677 14.2677 14.2830 14.2830 19.3945 19.3945 19.3986 19.3986 20.9923 20.9923 25.8669 25.8669 25.8817 25.8817 k = 0.4191 0.2420 0.1711 ( 1344 PWs) bands (ev): -52.7399 -52.7399 -24.8640 -24.8640 -23.9514 -23.9514 -23.7548 -23.7548 7.8493 7.8493 11.5736 11.5736 14.2408 14.2408 14.2560 14.2560 19.4184 19.4184 19.4224 19.4224 21.0071 21.0071 25.9199 25.9199 25.9351 25.9351 k = 0.4265 0.2462 0.1741 ( 1344 PWs) bands (ev): -52.7393 -52.7393 -24.8661 -24.8661 -23.9537 -23.9537 -23.7553 -23.7553 7.9416 7.9416 11.4669 11.4669 14.2166 14.2166 14.2318 14.2318 19.4438 19.4438 19.4477 19.4477 21.0274 21.0274 25.9707 25.9707 25.9862 25.9862 k = 0.4338 0.2505 0.1771 ( 1344 PWs) bands (ev): -52.7387 -52.7387 -24.8681 -24.8681 -23.9558 -23.9558 -23.7557 -23.7557 8.0306 8.0306 11.3649 11.3649 14.1948 14.1948 14.2099 14.2099 19.4671 19.4671 19.4709 19.4709 21.0463 21.0463 26.0170 26.0170 26.0329 26.0329 k = 0.4412 0.2547 0.1801 ( 1344 PWs) bands (ev): -52.7382 -52.7382 -24.8699 -24.8699 -23.9577 -23.9577 -23.7560 -23.7560 8.1154 8.1154 11.2685 11.2685 14.1752 14.1752 14.1903 14.1903 19.4882 19.4882 19.4920 19.4920 21.0638 21.0638 26.0589 26.0589 26.0750 26.0750 k = 0.4485 0.2590 0.1831 ( 1338 PWs) bands (ev): -52.7360 -52.7360 -24.8712 -24.8712 -23.9591 -23.9591 -23.7561 -23.7561 8.1951 8.1951 11.1788 11.1788 14.1602 14.1602 14.1753 14.1753 19.5107 19.5107 19.5143 19.5143 21.0796 21.0796 26.1026 26.1026 26.1189 26.1189 k = 0.4559 0.2632 0.1861 ( 1335 PWs) bands (ev): -52.7347 -52.7347 -24.8725 -24.8725 -23.9604 -23.9604 -23.7562 -23.7562 8.2684 8.2684 11.0968 11.0968 14.1452 14.1452 14.1603 14.1603 19.5322 19.5322 19.5357 19.5357 21.0938 21.0938 26.1352 26.1352 26.1518 26.1518 k = 0.4632 0.2674 0.1891 ( 1335 PWs) bands (ev): -52.7344 -52.7344 -24.8737 -24.8737 -23.9617 -23.9617 -23.7565 -23.7565 8.3340 8.3340 11.0238 11.0238 14.1325 14.1325 14.1476 14.1476 19.5462 19.5462 19.5497 19.5497 21.1060 21.1060 26.1629 26.1629 26.1797 26.1797 k = 0.4706 0.2717 0.1921 ( 1335 PWs) bands (ev): -52.7341 -52.7341 -24.8746 -24.8746 -23.9627 -23.9627 -23.7567 -23.7567 8.3905 8.3905 10.9611 10.9611 14.1221 14.1221 14.1372 14.1372 19.5578 19.5578 19.5613 19.5613 21.1162 21.1162 26.1857 26.1857 26.2026 26.2026 k = 0.4779 0.2759 0.1951 ( 1347 PWs) bands (ev): -52.7373 -52.7373 -24.8760 -24.8760 -23.9642 -23.9642 -23.7572 -23.7572 8.4366 8.4366 10.9092 10.9092 14.1117 14.1117 14.1267 14.1267 19.5547 19.5547 19.5582 19.5582 21.1222 21.1222 26.1958 26.1958 26.2130 26.2130 k = 0.4853 0.2802 0.1981 ( 1350 PWs) bands (ev): -52.7380 -52.7380 -24.8767 -24.8767 -23.9650 -23.9650 -23.7574 -23.7574 8.4707 8.4707 10.8701 10.8701 14.1058 14.1058 14.1208 14.1208 19.5608 19.5608 19.5643 19.5643 21.1203 21.1203 26.2083 26.2083 26.2256 26.2256 k = 0.4926 0.2844 0.2011 ( 1350 PWs) bands (ev): -52.7380 -52.7380 -24.8770 -24.8770 -23.9653 -23.9653 -23.7574 -23.7574 8.4917 8.4917 10.8470 10.8470 14.1024 14.1024 14.1173 14.1173 19.5647 19.5647 19.5681 19.5681 21.1237 21.1237 26.2159 26.2159 26.2332 26.2332 k = 0.5000 0.2887 0.2041 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8771 -24.8771 -23.9654 -23.9654 -23.7575 -23.7575 8.4988 8.4988 10.8393 10.8393 14.1012 14.1012 14.1162 14.1162 19.5659 19.5659 19.5694 19.5694 21.1248 21.1248 26.2185 26.2185 26.2358 26.2358 k = 0.5000 0.2887 0.2041 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8771 -24.8771 -23.9654 -23.9654 -23.7575 -23.7575 8.4988 8.4988 10.8393 10.8393 14.1012 14.1012 14.1162 14.1162 19.5659 19.5659 19.5694 19.5694 21.1248 21.1248 26.2185 26.2185 26.2358 26.2358 k = 0.5026 0.2812 0.2084 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8772 -24.8772 -23.9654 -23.9654 -23.7576 -23.7576 8.4983 8.4983 10.8408 10.8408 14.1015 14.1015 14.1165 14.1165 19.5657 19.5657 19.5691 19.5691 21.1242 21.1242 26.2136 26.2136 26.2314 26.2314 k = 0.5052 0.2736 0.2126 ( 1350 PWs) bands (ev): -52.7378 -52.7378 -24.8772 -24.8772 -23.9655 -23.9655 -23.7579 -23.7579 8.4968 8.4968 10.8455 10.8455 14.1023 14.1023 14.1178 14.1178 19.5647 19.5647 19.5686 19.5686 21.1223 21.1223 26.1970 26.1970 26.2204 26.2204 k = 0.5078 0.2661 0.2169 ( 1348 PWs) bands (ev): -52.7372 -52.7372 -24.8772 -24.8772 -23.9654 -23.9654 -23.7583 -23.7583 8.4944 8.4944 10.8533 10.8533 14.1044 14.1044 14.1207 14.1207 19.5633 19.5633 19.5681 19.5681 21.1212 21.1212 26.1710 26.1710 26.2058 26.2058 k = 0.5104 0.2586 0.2211 ( 1348 PWs) bands (ev): -52.7370 -52.7370 -24.8772 -24.8772 -23.9655 -23.9655 -23.7590 -23.7590 8.4910 8.4910 10.8643 10.8643 14.1050 14.1050 14.1247 14.1247 19.5605 19.5605 19.5675 19.5675 21.1168 21.1168 26.1295 26.1295 26.1864 26.1864 k = 0.5130 0.2511 0.2254 ( 1344 PWs) bands (ev): -52.7357 -52.7357 -24.8771 -24.8771 -23.9654 -23.9654 -23.7598 -23.7598 8.4867 8.4867 10.8786 10.8786 14.1059 14.1059 14.1321 14.1321 19.5606 19.5606 19.5681 19.5681 21.1121 21.1121 26.0818 26.0818 26.1662 26.1662 k = 0.5156 0.2436 0.2296 ( 1347 PWs) bands (ev): -52.7365 -52.7365 -24.8773 -24.8773 -23.9657 -23.9657 -23.7611 -23.7611 8.4815 8.4815 10.8956 10.8956 14.1038 14.1038 14.1398 14.1398 19.5512 19.5512 19.5661 19.5661 21.1053 21.1053 26.0181 26.0181 26.1374 26.1374 k = 0.5182 0.2361 0.2339 ( 1343 PWs) bands (ev): -52.7351 -52.7351 -24.8772 -24.8772 -23.9656 -23.9656 -23.7623 -23.7623 8.4754 8.4754 10.9161 10.9161 14.1030 14.1030 14.1505 14.1505 19.5488 19.5488 19.5703 19.5703 21.0980 21.0980 25.9530 25.9530 26.1073 26.1073 k = 0.5208 0.2285 0.2381 ( 1345 PWs) bands (ev): -52.7355 -52.7355 -24.8774 -24.8774 -23.9659 -23.9659 -23.7639 -23.7639 8.4684 8.4684 10.9392 10.9392 14.1018 14.1018 14.1605 14.1605 19.5400 19.5400 19.5665 19.5665 21.0893 21.0893 25.8814 25.8814 26.0668 26.0668 k = 0.5234 0.2210 0.2424 ( 1345 PWs) bands (ev): -52.7353 -52.7353 -24.8776 -24.8776 -23.9661 -23.9661 -23.7657 -23.7657 8.4605 8.4605 10.9653 10.9653 14.0996 14.0996 14.1732 14.1732 19.5331 19.5331 19.5657 19.5657 21.0793 21.0793 25.8039 25.8039 26.0243 26.0243 k = 0.5260 0.2135 0.2467 ( 1345 PWs) bands (ev): -52.7350 -52.7350 -24.8777 -24.8777 -23.9663 -23.9663 -23.7676 -23.7676 8.4517 8.4517 10.9944 10.9944 14.0971 14.0971 14.1875 14.1875 19.5256 19.5256 19.5650 19.5650 21.0683 21.0683 25.7222 25.7222 25.9777 25.9777 k = 0.5286 0.2060 0.2509 ( 1343 PWs) bands (ev): -52.7341 -52.7341 -24.8779 -24.8779 -23.9664 -23.9664 -23.7695 -23.7695 8.4422 8.4422 11.0265 11.0265 14.0953 14.0953 14.2033 14.2033 19.5192 19.5192 19.5643 19.5643 21.0585 21.0585 25.6395 25.6395 25.9273 25.9273 k = 0.5312 0.1985 0.2552 ( 1345 PWs) bands (ev): -52.7344 -52.7344 -24.8782 -24.8782 -23.9667 -23.9667 -23.7719 -23.7719 8.4319 8.4319 11.0612 11.0612 14.0924 14.0924 14.2202 14.2202 19.5107 19.5107 19.5562 19.5562 21.0448 21.0448 25.5528 25.5528 25.8724 25.8724 k = 0.5339 0.1909 0.2594 ( 1341 PWs) bands (ev): -52.7329 -52.7329 -24.8782 -24.8782 -23.9668 -23.9668 -23.7742 -23.7742 8.4210 8.4210 11.0993 11.0993 14.0889 14.0889 14.2400 14.2400 19.5031 19.5031 19.5619 19.5619 21.0319 21.0319 25.4628 25.4628 25.8184 25.8184 k = 0.5365 0.1834 0.2637 ( 1341 PWs) bands (ev): -52.7326 -52.7326 -24.8785 -24.8785 -23.9670 -23.9670 -23.7768 -23.7768 8.4092 8.4092 11.1398 11.1398 14.0844 14.0844 14.2600 14.2600 19.4940 19.4940 19.5612 19.5612 21.0178 21.0178 25.3690 25.3690 25.7573 25.7573 k = 0.5391 0.1759 0.2679 ( 1341 PWs) bands (ev): -52.7322 -52.7322 -24.8787 -24.8787 -23.9673 -23.9673 -23.7795 -23.7795 8.3968 8.3968 11.1830 11.1830 14.0794 14.0794 14.2814 14.2814 19.4847 19.4847 19.5606 19.5606 21.0031 21.0031 25.2730 25.2730 25.6932 25.6932 k = 0.5417 0.1684 0.2722 ( 1341 PWs) bands (ev): -52.7317 -52.7317 -24.8790 -24.8790 -23.9676 -23.9676 -23.7823 -23.7823 8.3838 8.3838 11.2289 11.2289 14.0738 14.0738 14.3041 14.3041 19.4751 19.4751 19.5602 19.5602 20.9881 20.9881 25.1751 25.1751 25.6262 25.6262 k = 0.5443 0.1609 0.2764 ( 1339 PWs) bands (ev): -52.7307 -52.7307 -24.8793 -24.8793 -23.9678 -23.9678 -23.7851 -23.7851 8.3702 8.3702 11.2773 11.2773 14.0677 14.0677 14.3291 14.3291 19.4655 19.4655 19.5619 19.5619 20.9746 20.9746 25.0757 25.0757 25.5589 25.5589 k = 0.5469 0.1534 0.2807 ( 1338 PWs) bands (ev): -52.7300 -52.7300 -24.8796 -24.8796 -23.9680 -23.9680 -23.7881 -23.7881 8.3561 8.3561 11.3288 11.3288 14.0609 14.0609 14.3543 14.3543 19.4556 19.4556 19.5619 19.5619 20.9617 20.9617 24.9748 24.9748 25.4868 25.4868 k = 0.5495 0.1458 0.2849 ( 1336 PWs) bands (ev): -52.7289 -52.7289 -24.8799 -24.8799 -23.9682 -23.9682 -23.7912 -23.7912 8.3415 8.3415 11.3827 11.3827 14.0536 14.0536 14.3809 14.3809 19.4498 19.4498 19.5621 19.5621 20.9467 20.9467 24.8733 24.8733 25.4128 25.4128 k = 0.5521 0.1383 0.2892 ( 1338 PWs) bands (ev): -52.7290 -52.7290 -24.8804 -24.8804 -23.9686 -23.9686 -23.7945 -23.7945 8.3264 8.3264 11.4382 11.4382 14.0455 14.0455 14.4081 14.4081 19.4348 19.4348 19.5625 19.5625 20.9310 20.9310 24.7697 24.7697 25.3353 25.3353 k = 0.5547 0.1308 0.2934 ( 1334 PWs) bands (ev): -52.7273 -52.7273 -24.8807 -24.8807 -23.9687 -23.9687 -23.7976 -23.7976 8.3111 8.3111 11.4964 11.4964 14.0386 14.0386 14.4372 14.4372 19.4248 19.4248 19.5656 19.5656 20.9165 20.9165 24.6750 24.6750 25.2576 25.2576 k = 0.5573 0.1233 0.2977 ( 1332 PWs) bands (ev): -52.7262 -52.7262 -24.8810 -24.8810 -23.9689 -23.9689 -23.8009 -23.8009 8.2953 8.2953 11.5573 11.5573 14.0280 14.0280 14.4681 14.4681 19.4129 19.4129 19.5703 19.5703 20.9032 20.9032 24.5690 24.5690 25.1810 25.1810 k = 0.5599 0.1158 0.3019 ( 1332 PWs) bands (ev): -52.7257 -52.7257 -24.8816 -24.8816 -23.9693 -23.9693 -23.8042 -23.8042 8.2790 8.2790 11.6195 11.6195 14.0177 14.0177 14.5002 14.5002 19.4005 19.4005 19.5692 19.5692 20.8892 20.8892 24.4636 24.4636 25.1027 25.1027 k = 0.5625 0.1083 0.3062 ( 1334 PWs) bands (ev): -52.7258 -52.7258 -24.8822 -24.8822 -23.9697 -23.9697 -23.8077 -23.8077 8.2624 8.2624 11.6839 11.6839 14.0068 14.0068 14.5312 14.5312 19.3844 19.3844 19.5709 19.5709 20.8745 20.8745 24.3591 24.3591 25.0175 25.0175 k = 0.5651 0.1007 0.3104 ( 1334 PWs) bands (ev): -52.7253 -52.7253 -24.8827 -24.8827 -23.9700 -23.9700 -23.8112 -23.8112 8.2455 8.2455 11.7502 11.7502 13.9953 13.9953 14.5640 14.5640 19.3706 19.3706 19.5730 19.5730 20.8618 20.8618 24.2551 24.2551 24.9331 24.9331 k = 0.5677 0.0932 0.3147 ( 1332 PWs) bands (ev): -52.7242 -52.7242 -24.8832 -24.8832 -23.9702 -23.9702 -23.8145 -23.8145 8.2284 8.2284 11.8187 11.8187 13.9833 13.9833 14.5981 14.5981 19.3567 19.3567 19.5758 19.5758 20.8536 20.8536 24.1519 24.1519 24.8488 24.8488 k = 0.5703 0.0857 0.3189 ( 1328 PWs) bands (ev): -52.7225 -52.7225 -24.8837 -24.8837 -23.9704 -23.9704 -23.8177 -23.8177 8.2111 8.2111 11.8885 11.8885 13.9720 13.9720 14.6332 14.6332 19.3426 19.3426 19.5800 19.5800 20.8469 20.8469 24.0548 24.0548 24.7635 24.7635 k = 0.5729 0.0782 0.3232 ( 1329 PWs) bands (ev): -52.7223 -52.7223 -24.8844 -24.8844 -23.9707 -23.9707 -23.8211 -23.8211 8.1934 8.1934 11.9601 11.9601 13.9571 13.9571 14.6686 14.6686 19.3277 19.3277 19.5833 19.5833 20.8369 20.8369 23.9490 23.9490 24.6760 24.6760 k = 0.5755 0.0707 0.3274 ( 1333 PWs) bands (ev): -52.7230 -52.7230 -24.8852 -24.8852 -23.9712 -23.9712 -23.8247 -23.8247 8.1756 8.1756 12.0329 12.0329 13.9430 13.9430 14.7029 14.7029 19.3072 19.3072 19.5825 19.5825 20.8277 20.8277 23.8486 23.8486 24.5838 24.5838 k = 0.5781 0.0631 0.3317 ( 1333 PWs) bands (ev): -52.7225 -52.7225 -24.8859 -24.8859 -23.9715 -23.9715 -23.8280 -23.8280 8.1577 8.1577 12.1071 12.1071 13.9284 13.9284 14.7398 14.7398 19.2871 19.2871 19.5870 19.5870 20.8211 20.8211 23.7511 23.7511 24.4948 24.4948 k = 0.5807 0.0556 0.3360 ( 1331 PWs) bands (ev): -52.7215 -52.7215 -24.8864 -24.8864 -23.9716 -23.9716 -23.8312 -23.8312 8.1397 8.1397 12.1834 12.1834 13.9133 13.9133 14.7775 14.7775 19.2663 19.2663 19.5923 19.5923 20.8195 20.8195 23.6565 23.6565 24.4054 24.4054 k = 0.5833 0.0481 0.3402 ( 1328 PWs) bands (ev): -52.7201 -52.7201 -24.8870 -24.8870 -23.9718 -23.9718 -23.8342 -23.8342 8.1219 8.1219 12.2599 12.2599 13.8978 13.8978 14.8174 14.8174 19.2442 19.2442 19.5981 19.5981 20.8161 20.8161 23.5680 23.5680 24.3195 24.3195 k = 0.5859 0.0406 0.3445 ( 1331 PWs) bands (ev): -52.7205 -52.7205 -24.8879 -24.8879 -23.9724 -23.9724 -23.8373 -23.8373 8.1036 8.1036 12.3363 12.3363 13.8814 13.8814 14.8562 14.8562 19.2162 19.2162 19.6045 19.6045 20.8100 20.8100 23.4768 23.4768 24.2287 24.2287 k = 0.5885 0.0331 0.3487 ( 1333 PWs) bands (ev): -52.7206 -52.7206 -24.8887 -24.8887 -23.9728 -23.9728 -23.8403 -23.8403 8.0853 8.0853 12.4143 12.4143 13.8643 13.8643 14.8944 14.8944 19.1898 19.1898 19.6098 19.6098 20.8077 20.8077 23.3898 23.3898 24.1351 24.1351 k = 0.5911 0.0256 0.3530 ( 1333 PWs) bands (ev): -52.7202 -52.7202 -24.8895 -24.8895 -23.9731 -23.9731 -23.8431 -23.8431 8.0670 8.0670 12.4930 12.4930 13.8471 13.8471 14.9343 14.9343 19.1621 19.1621 19.6176 19.6176 20.8061 20.8061 23.3088 23.3088 24.0438 24.0438 k = 0.5938 0.0180 0.3572 ( 1329 PWs) bands (ev): -52.7186 -52.7186 -24.8901 -24.8901 -23.9732 -23.9732 -23.8455 -23.8455 8.0488 8.0488 12.5720 12.5720 13.8295 13.8295 14.9762 14.9762 19.1337 19.1337 19.6312 19.6312 20.8074 20.8074 23.2332 23.2332 23.9566 23.9566 k = 0.5964 0.0105 0.3615 ( 1329 PWs) bands (ev): -52.7181 -52.7181 -24.8908 -24.8908 -23.9736 -23.9736 -23.8480 -23.8480 8.0305 8.0305 12.6514 12.6514 13.8114 13.8114 15.0169 15.0169 19.1032 19.1032 19.6403 19.6403 20.8060 20.8060 23.1622 23.1622 23.8648 23.8648 k = 0.5990 0.0030 0.3657 ( 1327 PWs) bands (ev): -52.7171 -52.7171 -24.8915 -24.8915 -23.9738 -23.9738 -23.8503 -23.8503 8.0121 8.0121 12.7309 12.7309 13.7932 13.7932 15.0586 15.0586 19.0723 19.0723 19.6507 19.6507 20.8072 20.8072 23.0970 23.0970 23.7747 23.7747 k = 0.6016-0.0045 0.3700 ( 1327 PWs) bands (ev): -52.7167 -52.7167 -24.8922 -24.8922 -23.9741 -23.9741 -23.8525 -23.8525 7.9938 7.9938 12.8103 12.8103 13.7743 13.7743 15.1000 15.1000 19.0395 19.0395 19.6612 19.6612 20.8046 20.8046 23.0381 23.0381 23.6828 23.6828 k = 0.6042-0.0120 0.3742 ( 1327 PWs) bands (ev): -52.7163 -52.7163 -24.8929 -24.8929 -23.9745 -23.9745 -23.8545 -23.8545 7.9754 7.9754 12.8895 12.8895 13.7550 13.7550 15.1416 15.1416 19.0058 19.0058 19.6723 19.6723 20.8007 20.8007 22.9859 22.9859 23.5910 23.5910 k = 0.6068-0.0195 0.3785 ( 1321 PWs) bands (ev): -52.7142 -52.7142 -24.8933 -24.8933 -23.9744 -23.9744 -23.8561 -23.8561 7.9574 7.9574 12.9693 12.9693 13.7356 13.7356 15.1845 15.1845 18.9729 18.9729 19.6902 19.6902 20.8002 20.8002 22.9440 22.9440 23.5023 23.5023 k = 0.6094-0.0271 0.3827 ( 1323 PWs) bands (ev): -52.7145 -52.7145 -24.8941 -24.8941 -23.9749 -23.9749 -23.8578 -23.8578 7.9390 7.9390 13.0474 13.0474 13.7152 13.7152 15.2264 15.2264 18.9345 18.9345 19.7024 19.7024 20.7915 20.7915 22.9059 22.9059 23.4106 23.4106 k = 0.6120-0.0346 0.3870 ( 1327 PWs) bands (ev): -52.7153 -52.7153 -24.8949 -24.8949 -23.9755 -23.9755 -23.8594 -23.8594 7.9205 7.9205 13.1242 13.1242 13.6941 13.6941 15.2684 15.2684 18.8975 18.8975 19.7142 19.7142 20.7736 20.7736 22.8758 22.8758 23.3189 23.3189 k = 0.6146-0.0421 0.3912 ( 1327 PWs) bands (ev): -52.7150 -52.7150 -24.8955 -24.8955 -23.9758 -23.9758 -23.8607 -23.8607 7.9020 7.9020 13.2006 13.2006 13.6736 13.6736 15.3107 15.3107 18.8617 18.8617 19.7275 19.7275 20.7619 20.7619 22.8540 22.8540 23.2281 23.2281 k = 0.6172-0.0496 0.3955 ( 1331 PWs) bands (ev): -52.7159 -52.7159 -24.8962 -24.8962 -23.9764 -23.9764 -23.8619 -23.8619 7.8833 7.8833 13.2747 13.2747 13.6531 13.6531 15.3526 15.3526 18.8231 18.8231 19.7400 19.7400 20.7437 20.7437 22.8371 22.8371 23.1365 23.1365 k = 0.6198-0.0571 0.3997 ( 1329 PWs) bands (ev): -52.7151 -52.7151 -24.8966 -24.8966 -23.9765 -23.9765 -23.8628 -23.8628 7.8650 7.8650 13.3483 13.3483 13.6334 13.6334 15.3939 15.3939 18.7876 18.7876 19.7563 19.7563 20.7312 20.7312 22.8329 22.8329 23.0451 23.0451 k = 0.6224-0.0647 0.4040 ( 1334 PWs) bands (ev): -52.7164 -52.7164 -24.8973 -24.8973 -23.9770 -23.9770 -23.8637 -23.8637 7.8460 7.8460 13.4182 13.4182 13.6140 13.6140 15.4353 15.4353 18.7512 18.7512 19.7652 19.7652 20.7072 20.7072 22.8332 22.8332 22.9539 22.9539 k = 0.6250-0.0722 0.4082 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9773 -23.9773 -23.8642 -23.8642 7.8271 7.8271 13.4799 13.4799 13.6020 13.6020 15.4777 15.4777 18.7150 18.7150 19.7795 19.7795 20.6877 20.6877 22.8420 22.8420 22.8659 22.8659 k = 0.6250-0.0722 0.4082 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9773 -23.9773 -23.8642 -23.8642 7.8271 7.8271 13.4799 13.4799 13.6020 13.6020 15.4777 15.4777 18.7150 18.7150 19.7795 19.7795 20.6877 20.6877 22.8420 22.8420 22.8659 22.8659 k = 0.6205-0.0696 0.4155 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9772 -23.9772 -23.8643 -23.8643 7.8274 7.8274 13.4808 13.4808 13.6023 13.6023 15.4746 15.4746 18.7186 18.7186 19.7799 19.7799 20.6868 20.6868 22.8406 22.8406 22.8645 22.8645 k = 0.6161-0.0670 0.4228 ( 1331 PWs) bands (ev): -52.7154 -52.7154 -24.8976 -24.8976 -23.9770 -23.9770 -23.8643 -23.8643 7.8283 7.8283 13.4834 13.4834 13.6031 13.6031 15.4675 15.4675 18.7296 18.7296 19.7821 19.7821 20.6848 20.6848 22.8388 22.8388 22.8655 22.8655 k = 0.6116-0.0644 0.4301 ( 1327 PWs) bands (ev): -52.7142 -52.7142 -24.8974 -24.8974 -23.9767 -23.9767 -23.8644 -23.8644 7.8298 7.8298 13.4876 13.4876 13.6051 13.6051 15.4531 15.4531 18.7475 18.7475 19.7892 19.7892 20.6848 20.6848 22.8322 22.8322 22.8607 22.8607 k = 0.6071-0.0619 0.4374 ( 1327 PWs) bands (ev): -52.7142 -52.7142 -24.8974 -24.8974 -23.9764 -23.9764 -23.8649 -23.8649 7.8317 7.8317 13.4934 13.4934 13.6069 13.6069 15.4321 15.4321 18.7719 18.7719 19.7918 19.7918 20.6788 20.6788 22.8199 22.8199 22.8540 22.8540 k = 0.6027-0.0593 0.4447 ( 1327 PWs) bands (ev): -52.7141 -52.7141 -24.8975 -24.8975 -23.9761 -23.9761 -23.8655 -23.8655 7.8341 7.8341 13.5008 13.5008 13.6093 13.6093 15.4057 15.4057 18.8026 18.8026 19.7952 19.7952 20.6711 20.6711 22.8029 22.8029 22.8470 22.8470 k = 0.5982-0.0567 0.4520 ( 1327 PWs) bands (ev): -52.7140 -52.7140 -24.8975 -24.8975 -23.9757 -23.9757 -23.8663 -23.8663 7.8366 7.8366 13.5102 13.5102 13.6121 13.6121 15.3739 15.3739 18.8398 18.8398 19.7966 19.7966 20.6660 20.6660 22.7801 22.7801 22.8388 22.8388 k = 0.5938-0.0541 0.4593 ( 1327 PWs) bands (ev): -52.7140 -52.7140 -24.8975 -24.8975 -23.9753 -23.9753 -23.8672 -23.8672 7.8400 7.8400 13.5206 13.5206 13.6156 13.6156 15.3380 15.3380 18.8815 18.8815 19.8015 19.8015 20.6549 20.6549 22.7552 22.7552 22.8306 22.8306 k = 0.5893-0.0515 0.4666 ( 1326 PWs) bands (ev): -52.7136 -52.7136 -24.8975 -24.8975 -23.9747 -23.9747 -23.8681 -23.8681 7.8439 7.8439 13.5326 13.5326 13.6197 13.6197 15.2986 15.2986 18.9281 18.9281 19.8072 19.8072 20.6421 20.6421 22.7300 22.7300 22.8217 22.8217 k = 0.5848-0.0490 0.4739 ( 1326 PWs) bands (ev): -52.7135 -52.7135 -24.8975 -24.8975 -23.9742 -23.9742 -23.8692 -23.8692 7.8481 7.8481 13.5458 13.5458 13.6244 13.6244 15.2550 15.2550 18.9788 18.9788 19.8137 19.8137 20.6275 20.6275 22.6995 22.6995 22.8118 22.8118 k = 0.5804-0.0464 0.4811 ( 1326 PWs) bands (ev): -52.7134 -52.7134 -24.8975 -24.8975 -23.9736 -23.9736 -23.8704 -23.8704 7.8527 7.8527 13.5603 13.5603 13.6299 13.6299 15.2084 15.2084 19.0329 19.0329 19.8209 19.8209 20.6114 20.6114 22.6670 22.6670 22.8008 22.8008 k = 0.5759-0.0438 0.4884 ( 1330 PWs) bands (ev): -52.7145 -52.7145 -24.8977 -24.8977 -23.9730 -23.9730 -23.8720 -23.8720 7.8574 7.8574 13.5751 13.5751 13.6360 13.6360 15.1578 15.1578 19.0878 19.0878 19.8264 19.8264 20.5933 20.5933 22.6291 22.6291 22.7863 22.7863 k = 0.5714-0.0412 0.4957 ( 1334 PWs) bands (ev): -52.7155 -52.7155 -24.8979 -24.8979 -23.9726 -23.9726 -23.8735 -23.8735 7.8623 7.8623 13.5914 13.5914 13.6430 13.6430 15.1058 15.1058 19.1453 19.1453 19.8310 19.8310 20.5720 20.5720 22.5902 22.5902 22.7716 22.7716 k = 0.5670-0.0387 0.5030 ( 1334 PWs) bands (ev): -52.7154 -52.7154 -24.8980 -24.8980 -23.9718 -23.9718 -23.8748 -23.8748 7.8677 7.8677 13.6082 13.6082 13.6515 13.6515 15.0529 15.0529 19.2062 19.2062 19.8405 19.8405 20.5509 20.5509 22.5554 22.5554 22.7573 22.7573 k = 0.5625-0.0361 0.5103 ( 1330 PWs) bands (ev): -52.7141 -52.7141 -24.8979 -24.8979 -23.9710 -23.9710 -23.8759 -23.8759 7.8733 7.8733 13.6252 13.6252 13.6621 13.6621 14.9994 14.9994 19.2714 19.2714 19.8532 19.8532 20.5281 20.5281 22.5251 22.5251 22.7441 22.7441 k = 0.5580-0.0335 0.5176 ( 1338 PWs) bands (ev): -52.7163 -52.7163 -24.8982 -24.8982 -23.9706 -23.9706 -23.8779 -23.8779 7.8788 7.8788 13.6401 13.6401 13.6750 13.6750 14.9419 14.9419 19.3331 19.3331 19.8538 19.8538 20.4996 20.4996 22.4848 22.4848 22.7231 22.7231 k = 0.5536-0.0309 0.5249 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.8983 -24.8983 -23.9698 -23.9698 -23.8794 -23.8794 7.8845 7.8845 13.6535 13.6535 13.6911 13.6911 14.8867 14.8867 19.3956 19.3956 19.8653 19.8653 20.4736 20.4736 22.4528 22.4528 22.7055 22.7055 k = 0.5491-0.0284 0.5322 ( 1338 PWs) bands (ev): -52.7161 -52.7161 -24.8984 -24.8984 -23.9690 -23.9690 -23.8808 -23.8808 7.8901 7.8901 13.6655 13.6655 13.7098 13.7098 14.8316 14.8316 19.4574 19.4574 19.8775 19.8775 20.4461 20.4461 22.4232 22.4232 22.6867 22.6867 k = 0.5446-0.0258 0.5395 ( 1342 PWs) bands (ev): -52.7172 -52.7172 -24.8986 -24.8986 -23.9684 -23.9684 -23.8826 -23.8826 7.8956 7.8956 13.6767 13.6767 13.7295 13.7295 14.7760 14.7760 19.5167 19.5167 19.8847 19.8847 20.4168 20.4168 22.3938 22.3938 22.6637 22.6637 k = 0.5402-0.0232 0.5468 ( 1338 PWs) bands (ev): -52.7159 -52.7159 -24.8984 -24.8984 -23.9674 -23.9674 -23.8838 -23.8838 7.9010 7.9010 13.6881 13.6881 13.7491 13.7491 14.7247 14.7247 19.5739 19.5739 19.9092 19.9092 20.3868 20.3868 22.3748 22.3748 22.6430 22.6430 k = 0.5357-0.0206 0.5541 ( 1338 PWs) bands (ev): -52.7159 -52.7159 -24.8985 -24.8985 -23.9667 -23.9667 -23.8852 -23.8852 7.9061 7.9061 13.6996 13.6996 13.7696 13.7696 14.6731 14.6731 19.6305 19.6305 19.9226 19.9226 20.3551 20.3551 22.3558 22.3558 22.6207 22.6207 k = 0.5312-0.0180 0.5613 ( 1338 PWs) bands (ev): -52.7158 -52.7158 -24.8986 -24.8986 -23.9661 -23.9661 -23.8864 -23.8864 7.9109 7.9109 13.7114 13.7114 13.7892 13.7892 14.6239 14.6239 19.6842 19.6842 19.9363 19.9363 20.3222 20.3222 22.3416 22.3416 22.5973 22.5973 k = 0.5268-0.0155 0.5686 ( 1336 PWs) bands (ev): -52.7151 -52.7151 -24.8985 -24.8985 -23.9654 -23.9654 -23.8873 -23.8873 7.9154 7.9154 13.7239 13.7239 13.8077 13.8077 14.5782 14.5782 19.7372 19.7372 19.9506 19.9506 20.2886 20.2886 22.3331 22.3331 22.5756 22.5756 k = 0.5223-0.0129 0.5759 ( 1336 PWs) bands (ev): -52.7151 -52.7151 -24.8986 -24.8986 -23.9649 -23.9649 -23.8883 -23.8883 7.9193 7.9193 13.7367 13.7367 13.8231 13.8231 14.5365 14.5365 19.7842 19.7842 19.9640 19.9640 20.2545 20.2545 22.3299 22.3299 22.5500 22.5500 k = 0.5179-0.0103 0.5832 ( 1336 PWs) bands (ev): -52.7150 -52.7150 -24.8986 -24.8986 -23.9645 -23.9645 -23.8892 -23.8892 7.9227 7.9227 13.7500 13.7500 13.8350 13.8350 14.5002 14.5002 19.8274 19.8274 19.9762 19.9762 20.2208 20.2208 22.3328 22.3328 22.5233 22.5233 k = 0.5134-0.0077 0.5905 ( 1336 PWs) bands (ev): -52.7150 -52.7150 -24.8987 -24.8987 -23.9641 -23.9641 -23.8899 -23.8899 7.9255 7.9255 13.7637 13.7637 13.8422 13.8422 14.4705 14.4705 19.8666 19.8666 19.9857 19.9857 20.1891 20.1891 22.3419 22.3419 22.4955 22.4955 k = 0.5089-0.0052 0.5978 ( 1340 PWs) bands (ev): -52.7161 -52.7161 -24.8989 -24.8989 -23.9641 -23.9641 -23.8906 -23.8906 7.9276 7.9276 13.7770 13.7770 13.8439 13.8439 14.4476 14.4476 19.9011 19.9011 19.9870 19.9870 20.1563 20.1563 22.3558 22.3558 22.4648 22.4648 k = 0.5045-0.0026 0.6051 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8992 -24.8992 -23.9643 -23.9643 -23.8913 -23.8913 7.9287 7.9287 13.7888 13.7888 13.8398 13.8398 14.4332 14.4332 19.9275 19.9275 19.9737 19.9737 20.1318 20.1318 22.3724 22.3724 22.4342 22.4342 k = 0.5000 0.0000 0.6124 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8993 -24.8993 -23.9643 -23.9643 -23.8914 -23.8914 7.9292 7.9292 13.7952 13.7952 13.8364 13.8364 14.4288 14.4288 19.9503 19.9503 19.9594 19.9594 20.1255 20.1255 22.3932 22.3932 22.4108 22.4108 k = 0.5000 0.0000 0.6124 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8993 -24.8993 -23.9643 -23.9643 -23.8914 -23.8914 7.9292 7.9292 13.7952 13.7952 13.8364 13.8364 14.4288 14.4288 19.9503 19.9503 19.9594 19.9594 20.1255 20.1255 22.3932 22.3932 22.4108 22.4108 k = 0.5000 0.0052 0.6051 ( 1348 PWs) bands (ev): -52.7183 -52.7183 -24.8992 -24.8992 -23.9643 -23.9643 -23.8913 -23.8913 7.9296 7.9296 13.7914 13.7914 13.8331 13.8331 14.4336 14.4336 19.9411 19.9411 19.9561 19.9561 20.1362 20.1362 22.3963 22.3963 22.4145 22.4145 k = 0.5000 0.0103 0.5978 ( 1340 PWs) bands (ev): -52.7161 -52.7161 -24.8988 -24.8988 -23.9640 -23.9640 -23.8905 -23.8905 7.9311 7.9311 13.7770 13.7770 13.8286 13.8286 14.4483 14.4483 19.9168 19.9168 19.9592 19.9592 20.1704 20.1704 22.4086 22.4086 22.4289 22.4289 k = 0.5000 0.0155 0.5905 ( 1340 PWs) bands (ev): -52.7162 -52.7162 -24.8987 -24.8987 -23.9642 -23.9642 -23.8899 -23.8899 7.9332 7.9332 13.7474 13.7474 13.8258 13.8258 14.4689 14.4689 19.8827 19.8827 19.9517 19.9517 20.2034 20.2034 22.4240 22.4240 22.4476 22.4476 k = 0.5000 0.0206 0.5832 ( 1338 PWs) bands (ev): -52.7157 -52.7157 -24.8984 -24.8984 -23.9643 -23.9643 -23.8889 -23.8889 7.9363 7.9363 13.7057 13.7057 13.8261 13.8261 14.4944 14.4944 19.8490 19.8490 19.9416 19.9416 20.2395 20.2395 22.4471 22.4471 22.4738 22.4738 k = 0.5000 0.0258 0.5759 ( 1338 PWs) bands (ev): -52.7159 -52.7159 -24.8981 -24.8981 -23.9646 -23.9646 -23.8878 -23.8878 7.9400 7.9400 13.6549 13.6549 13.8279 13.8279 14.5222 14.5222 19.8108 19.8108 19.9289 19.9289 20.2758 20.2758 22.4742 22.4742 22.5069 22.5069 k = 0.5000 0.0309 0.5686 ( 1334 PWs) bands (ev): -52.7149 -52.7149 -24.8977 -24.8977 -23.9647 -23.9647 -23.8863 -23.8863 7.9447 7.9447 13.5979 13.5979 13.8309 13.8309 14.5518 14.5518 19.7761 19.7761 19.9146 19.9146 20.3169 20.3169 22.5079 22.5079 22.5496 22.5496 k = 0.5000 0.0361 0.5613 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.8975 -24.8975 -23.9654 -23.9654 -23.8848 -23.8848 7.9501 7.9501 13.5352 13.5352 13.8344 13.8344 14.5792 14.5792 19.7369 19.7369 19.8969 19.8969 20.3445 20.3445 22.5446 22.5446 22.5945 22.5945 k = 0.5000 0.0412 0.5541 ( 1340 PWs) bands (ev): -52.7170 -52.7170 -24.8972 -24.8972 -23.9659 -23.9659 -23.8832 -23.8832 7.9563 7.9563 13.4685 13.4685 13.8384 13.8384 14.6061 14.6061 19.7005 19.7005 19.8751 19.8751 20.3763 20.3763 22.5873 22.5873 22.6476 22.6476 k = 0.5000 0.0464 0.5468 ( 1338 PWs) bands (ev): -52.7167 -52.7167 -24.8967 -24.8967 -23.9662 -23.9662 -23.8811 -23.8811 7.9633 7.9633 13.3988 13.3988 13.8435 13.8435 14.6319 14.6319 19.6693 19.6693 19.8551 19.8551 20.4109 20.4109 22.6350 22.6350 22.7079 22.7079 k = 0.5000 0.0515 0.5395 ( 1334 PWs) bands (ev): -52.7158 -52.7158 -24.8960 -24.8960 -23.9664 -23.9664 -23.8789 -23.8789 7.9712 7.9712 13.3267 13.3267 13.8497 13.8497 14.6551 14.6551 19.6411 19.6411 19.8383 19.8383 20.4427 20.4427 22.6897 22.6897 22.7737 22.7737 k = 0.5000 0.0567 0.5322 ( 1334 PWs) bands (ev): -52.7161 -52.7161 -24.8955 -24.8955 -23.9668 -23.9668 -23.8766 -23.8766 7.9797 7.9797 13.2525 13.2525 13.8559 13.8559 14.6749 14.6749 19.6129 19.6129 19.8161 19.8161 20.4706 20.4706 22.7457 22.7457 22.8442 22.8442 k = 0.5000 0.0619 0.5249 ( 1330 PWs) bands (ev): -52.7153 -52.7153 -24.8947 -24.8947 -23.9670 -23.9670 -23.8740 -23.8740 7.9891 7.9891 13.1768 13.1768 13.8629 13.8629 14.6918 14.6918 19.5903 19.5903 19.8009 19.8009 20.4969 20.4969 22.8075 22.8075 22.9199 22.9199 k = 0.5000 0.0670 0.5176 ( 1330 PWs) bands (ev): -52.7157 -52.7157 -24.8942 -24.8942 -23.9674 -23.9674 -23.8714 -23.8714 7.9990 7.9990 13.0997 13.0997 13.8700 13.8700 14.7054 14.7054 19.5675 19.5675 19.7777 19.7777 20.5216 20.5216 22.8708 22.8708 23.0001 23.0001 k = 0.5000 0.0722 0.5103 ( 1328 PWs) bands (ev): -52.7154 -52.7154 -24.8935 -24.8935 -23.9678 -23.9678 -23.8685 -23.8685 8.0096 8.0096 13.0220 13.0220 13.8776 13.8776 14.7159 14.7159 19.5531 19.5531 19.7544 19.7544 20.5449 20.5449 22.9375 22.9375 23.0849 23.0849 k = 0.5000 0.0773 0.5030 ( 1330 PWs) bands (ev): -52.7164 -52.7164 -24.8929 -24.8929 -23.9682 -23.9682 -23.8658 -23.8658 8.0208 8.0208 12.9431 12.9431 13.8850 13.8850 14.7225 14.7225 19.5357 19.5357 19.7294 19.7294 20.5656 20.5656 23.0064 23.0064 23.1706 23.1706 k = 0.5000 0.0825 0.4957 ( 1328 PWs) bands (ev): -52.7163 -52.7163 -24.8922 -24.8922 -23.9684 -23.9684 -23.8627 -23.8627 8.0326 8.0326 12.8638 12.8638 13.8932 13.8932 14.7275 14.7275 19.5229 19.5229 19.7066 19.7066 20.5889 20.5889 23.0791 23.0791 23.2637 23.2637 k = 0.5000 0.0876 0.4884 ( 1330 PWs) bands (ev): -52.7172 -52.7172 -24.8916 -24.8916 -23.9688 -23.9688 -23.8597 -23.8597 8.0447 8.0447 12.7840 12.7840 13.9016 13.9016 14.7280 14.7280 19.5099 19.5099 19.6817 19.6817 20.6083 20.6083 23.1524 23.1524 23.3576 23.3576 k = 0.5000 0.0928 0.4811 ( 1324 PWs) bands (ev): -52.7159 -52.7159 -24.8906 -24.8906 -23.9687 -23.9687 -23.8563 -23.8563 8.0578 8.0578 12.7053 12.7053 13.9110 13.9110 14.7266 14.7266 19.5010 19.5010 19.6660 19.6660 20.6317 20.6317 23.2344 23.2344 23.4578 23.4578 k = 0.5000 0.0979 0.4739 ( 1324 PWs) bands (ev): -52.7164 -52.7164 -24.8899 -24.8899 -23.9690 -23.9690 -23.8531 -23.8531 8.0712 8.0712 12.6258 12.6258 13.9199 13.9199 14.7216 14.7216 19.4938 19.4938 19.6451 19.6451 20.6498 20.6498 23.3142 23.3142 23.5572 23.5572 k = 0.5000 0.1031 0.4666 ( 1330 PWs) bands (ev): -52.7186 -52.7186 -24.8895 -24.8895 -23.9694 -23.9694 -23.8501 -23.8501 8.0845 8.0845 12.5464 12.5464 13.9273 13.9273 14.7132 14.7132 19.4883 19.4883 19.6214 19.6214 20.6646 20.6646 23.3850 23.3850 23.6568 23.6568 k = 0.5000 0.1083 0.4593 ( 1330 PWs) bands (ev): -52.7191 -52.7191 -24.8888 -24.8888 -23.9696 -23.9696 -23.8467 -23.8467 8.0988 8.0988 12.4676 12.4676 13.9364 13.9364 14.7029 14.7029 19.4853 19.4853 19.6024 19.6024 20.6817 20.6817 23.4686 23.4686 23.7595 23.7595 k = 0.5000 0.1134 0.4520 ( 1330 PWs) bands (ev): -52.7196 -52.7196 -24.8881 -24.8881 -23.9697 -23.9697 -23.8432 -23.8432 8.1136 8.1136 12.3893 12.3893 13.9466 13.9466 14.6900 14.6900 19.4827 19.4827 19.5832 19.5832 20.6973 20.6973 23.5582 23.5582 23.8623 23.8623 k = 0.5000 0.1186 0.4447 ( 1330 PWs) bands (ev): -52.7201 -52.7201 -24.8874 -24.8874 -23.9698 -23.9698 -23.8397 -23.8397 8.1285 8.1285 12.3119 12.3119 13.9558 13.9558 14.6752 14.6752 19.4829 19.4829 19.5666 19.5666 20.7140 20.7140 23.6451 23.6451 23.9669 23.9669 k = 0.5000 0.1237 0.4374 ( 1334 PWs) bands (ev): -52.7217 -52.7217 -24.8868 -24.8868 -23.9700 -23.9700 -23.8364 -23.8364 8.1435 8.1435 12.2349 12.2349 13.9642 13.9642 14.6584 14.6584 19.4811 19.4811 19.5478 19.5478 20.7302 20.7302 23.7286 23.7286 24.0715 24.0715 k = 0.5000 0.1289 0.4301 ( 1330 PWs) bands (ev): -52.7211 -52.7211 -24.8860 -24.8860 -23.9697 -23.9697 -23.8327 -23.8327 8.1590 8.1590 12.1601 12.1601 13.9734 13.9734 14.6407 14.6407 19.4857 19.4857 19.5377 19.5377 20.7497 20.7497 23.8188 23.8188 24.1802 24.1802 k = 0.5000 0.1340 0.4228 ( 1326 PWs) bands (ev): -52.7205 -52.7205 -24.8852 -24.8852 -23.9696 -23.9696 -23.8288 -23.8288 8.1748 8.1748 12.0857 12.0857 13.9840 13.9840 14.6213 14.6213 19.4909 19.4909 19.5286 19.5286 20.7675 20.7675 23.9145 23.9145 24.2867 24.2867 k = 0.5000 0.1392 0.4155 ( 1324 PWs) bands (ev): -52.7204 -52.7204 -24.8844 -24.8844 -23.9694 -23.9694 -23.8251 -23.8251 8.1908 8.1908 12.0125 12.0125 13.9936 13.9936 14.6011 14.6011 19.4954 19.4954 19.5177 19.5177 20.7853 20.7853 24.0094 24.0094 24.3931 24.3931 k = 0.5000 0.1443 0.4082 ( 1324 PWs) bands (ev): -52.7210 -52.7210 -24.8838 -24.8838 -23.9693 -23.9693 -23.8215 -23.8215 8.2067 8.2067 11.9407 11.9407 14.0023 14.0023 14.5789 14.5789 19.5002 19.5002 19.5083 19.5083 20.8022 20.8022 24.1019 24.1019 24.4974 24.4974 k = 0.5000 0.1495 0.4010 ( 1324 PWs) bands (ev): -52.7215 -52.7215 -24.8832 -24.8832 -23.9692 -23.9692 -23.8179 -23.8179 8.2227 8.2227 11.8704 11.8704 14.0107 14.0107 14.5559 14.5559 19.5002 19.5002 19.5056 19.5056 20.8193 20.8193 24.1952 24.1952 24.6008 24.6008 k = 0.5000 0.1546 0.3937 ( 1330 PWs) bands (ev): -52.7237 -52.7237 -24.8829 -24.8829 -23.9693 -23.9693 -23.8146 -23.8146 8.2383 8.2383 11.8017 11.8017 14.0177 14.0177 14.5303 14.5303 19.4917 19.4917 19.5083 19.5083 20.8329 20.8329 24.2823 24.2823 24.6980 24.6980 k = 0.5000 0.1598 0.3864 ( 1330 PWs) bands (ev): -52.7243 -52.7243 -24.8823 -24.8823 -23.9691 -23.9691 -23.8110 -23.8110 8.2543 8.2543 11.7347 11.7347 14.0256 14.0256 14.5061 14.5061 19.4866 19.4866 19.5138 19.5138 20.8502 20.8502 24.3767 24.3767 24.7987 24.7987 k = 0.5000 0.1650 0.3791 ( 1336 PWs) bands (ev): -52.7265 -52.7265 -24.8821 -24.8821 -23.9693 -23.9693 -23.8076 -23.8076 8.2697 8.2697 11.6678 11.6678 14.0330 14.0330 14.4812 14.4812 19.4765 19.4765 19.5167 19.5167 20.8629 20.8629 24.4691 24.4691 24.8961 24.8961 k = 0.5000 0.1701 0.3718 ( 1336 PWs) bands (ev): -52.7270 -52.7270 -24.8816 -24.8816 -23.9691 -23.9691 -23.8041 -23.8041 8.2854 8.2854 11.6045 11.6045 14.0402 14.0402 14.4566 14.4566 19.4742 19.4742 19.5221 19.5221 20.8803 20.8803 24.5642 24.5642 24.9932 24.9932 k = 0.5000 0.1753 0.3645 ( 1336 PWs) bands (ev): -52.7275 -52.7275 -24.8811 -24.8811 -23.9688 -23.9688 -23.8006 -23.8006 8.3009 8.3009 11.5433 11.5433 14.0471 14.0471 14.4322 14.4322 19.4733 19.4733 19.5274 19.5274 20.8976 20.8976 24.6593 24.6593 25.0882 25.0882 k = 0.5000 0.1804 0.3572 ( 1332 PWs) bands (ev): -52.7268 -52.7268 -24.8805 -24.8805 -23.9684 -23.9684 -23.7970 -23.7970 8.3160 8.3160 11.4841 11.4841 14.0537 14.0537 14.4094 14.4094 19.4796 19.4796 19.5358 19.5358 20.9168 20.9168 24.7537 24.7537 25.1826 25.1826 k = 0.5000 0.1856 0.3499 ( 1332 PWs) bands (ev): -52.7273 -52.7273 -24.8800 -24.8800 -23.9681 -23.9681 -23.7937 -23.7937 8.3309 8.3309 11.4270 11.4270 14.0598 14.0598 14.3854 14.3854 19.4810 19.4810 19.5405 19.5405 20.9340 20.9340 24.8485 24.8485 25.2726 25.2726 k = 0.5000 0.1907 0.3426 ( 1342 PWs) bands (ev): -52.7307 -52.7307 -24.8801 -24.8801 -23.9684 -23.9684 -23.7909 -23.7909 8.3453 8.3453 11.3705 11.3705 14.0654 14.0654 14.3589 14.3589 19.4790 19.4790 19.5363 19.5363 20.9422 20.9422 24.9412 24.9412 25.3514 25.3514 k = 0.5000 0.1959 0.3353 ( 1342 PWs) bands (ev): -52.7312 -52.7312 -24.8797 -24.8797 -23.9681 -23.9681 -23.7878 -23.7878 8.3594 8.3594 11.3183 11.3183 14.0708 14.0708 14.3351 14.3351 19.4852 19.4852 19.5400 19.5400 20.9584 20.9584 25.0350 25.0350 25.4331 25.4331 k = 0.5000 0.2010 0.3281 ( 1340 PWs) bands (ev): -52.7311 -52.7311 -24.8793 -24.8793 -23.9678 -23.9678 -23.7846 -23.7846 8.3731 8.3731 11.2684 11.2684 14.0759 14.0759 14.3143 14.3143 19.4904 19.4904 19.5447 19.5447 20.9747 20.9747 25.1284 25.1284 25.5185 25.5185 k = 0.5000 0.2062 0.3208 ( 1340 PWs) bands (ev): -52.7315 -52.7315 -24.8790 -24.8790 -23.9675 -23.9675 -23.7817 -23.7817 8.3863 8.3863 11.2208 11.2208 14.0805 14.0805 14.2928 14.2928 19.4955 19.4955 19.5482 19.5482 20.9906 20.9906 25.2208 25.2208 25.5957 25.5957 k = 0.5000 0.2114 0.3135 ( 1340 PWs) bands (ev): -52.7319 -52.7319 -24.8787 -24.8787 -23.9672 -23.9672 -23.7789 -23.7789 8.3990 8.3990 11.1759 11.1759 14.0848 14.0848 14.2722 14.2722 19.5011 19.5011 19.5513 19.5513 21.0060 21.0060 25.3122 25.3122 25.6692 25.6692 k = 0.5000 0.2165 0.3062 ( 1340 PWs) bands (ev): -52.7323 -52.7323 -24.8784 -24.8784 -23.9670 -23.9670 -23.7762 -23.7762 8.4111 8.4111 11.1335 11.1335 14.0888 14.0888 14.2526 14.2526 19.5073 19.5073 19.5541 19.5541 21.0208 21.0208 25.4023 25.4023 25.7389 25.7389 k = 0.5000 0.2217 0.2989 ( 1340 PWs) bands (ev): -52.7327 -52.7327 -24.8782 -24.8782 -23.9667 -23.9667 -23.7737 -23.7737 8.4226 8.4226 11.0938 11.0938 14.0924 14.0924 14.2340 14.2340 19.5139 19.5139 19.5566 19.5566 21.0350 21.0350 25.4909 25.4909 25.8046 25.8046 k = 0.5000 0.2268 0.2916 ( 1346 PWs) bands (ev): -52.7347 -52.7347 -24.8782 -24.8782 -23.9667 -23.9667 -23.7717 -23.7717 8.4333 8.4333 11.0568 11.0568 14.0929 14.0929 14.2159 14.2159 19.5146 19.5146 19.5572 19.5572 21.0450 21.0450 25.5704 25.5704 25.8642 25.8642 k = 0.5000 0.2320 0.2843 ( 1348 PWs) bands (ev): -52.7356 -52.7356 -24.8780 -24.8780 -23.9666 -23.9666 -23.7697 -23.7697 8.4434 8.4434 11.0226 11.0226 14.0951 14.0951 14.1990 14.1990 19.5205 19.5205 19.5583 19.5583 21.0556 21.0556 25.6535 25.6535 25.9199 25.9199 k = 0.5000 0.2371 0.2770 ( 1348 PWs) bands (ev): -52.7359 -52.7359 -24.8778 -24.8778 -23.9664 -23.9664 -23.7676 -23.7676 8.4527 8.4527 10.9912 10.9912 14.0976 14.0976 14.1840 14.1840 19.5273 19.5273 19.5599 19.5599 21.0673 21.0673 25.7353 25.7353 25.9726 25.9726 k = 0.5000 0.2423 0.2697 ( 1348 PWs) bands (ev): -52.7362 -52.7362 -24.8777 -24.8777 -23.9662 -23.9662 -23.7657 -23.7657 8.4612 8.4612 10.9627 10.9627 14.0998 14.0998 14.1704 14.1704 19.5339 19.5339 19.5614 19.5614 21.0781 21.0781 25.8140 25.8140 26.0207 26.0207 k = 0.5000 0.2474 0.2624 ( 1346 PWs) bands (ev): -52.7358 -52.7358 -24.8774 -24.8774 -23.9659 -23.9659 -23.7639 -23.7639 8.4690 8.4690 10.9371 10.9371 14.1029 14.1029 14.1583 14.1583 19.5404 19.5404 19.5650 19.5650 21.0880 21.0880 25.8921 25.8921 26.0647 26.0647 k = 0.5000 0.2526 0.2552 ( 1346 PWs) bands (ev): -52.7360 -52.7360 -24.8773 -24.8773 -23.9657 -23.9657 -23.7624 -23.7624 8.4759 8.4759 10.9144 10.9144 14.1044 14.1044 14.1476 14.1476 19.5463 19.5463 19.5661 19.5661 21.0968 21.0968 25.9625 25.9625 26.1033 26.1033 k = 0.5000 0.2577 0.2479 ( 1344 PWs) bands (ev): -52.7356 -52.7356 -24.8771 -24.8771 -23.9655 -23.9655 -23.7610 -23.7610 8.4819 8.4819 10.8949 10.8949 14.1055 14.1055 14.1384 14.1384 19.5567 19.5567 19.5688 19.5688 21.1047 21.1047 26.0276 26.0276 26.1371 26.1371 k = 0.5000 0.2629 0.2406 ( 1344 PWs) bands (ev): -52.7357 -52.7357 -24.8771 -24.8771 -23.9654 -23.9654 -23.7598 -23.7598 8.4870 8.4870 10.8778 10.8778 14.1065 14.1065 14.1311 14.1311 19.5616 19.5616 19.5674 19.5674 21.1124 21.1124 26.0866 26.0866 26.1657 26.1657 k = 0.5000 0.2681 0.2333 ( 1346 PWs) bands (ev): -52.7365 -52.7365 -24.8771 -24.8771 -23.9655 -23.9655 -23.7588 -23.7588 8.4912 8.4912 10.8638 10.8638 14.1058 14.1058 14.1253 14.1253 19.5610 19.5610 19.5679 19.5679 21.1189 21.1189 26.1336 26.1336 26.1892 26.1892 k = 0.5000 0.2732 0.2260 ( 1350 PWs) bands (ev): -52.7378 -52.7378 -24.8772 -24.8772 -23.9655 -23.9655 -23.7584 -23.7584 8.4945 8.4945 10.8530 10.8530 14.1032 14.1032 14.1201 14.1201 19.5630 19.5630 19.5679 19.5679 21.1194 21.1194 26.1683 26.1683 26.2059 26.2059 k = 0.5000 0.2784 0.2187 ( 1350 PWs) bands (ev): -52.7378 -52.7378 -24.8772 -24.8772 -23.9655 -23.9655 -23.7579 -23.7579 8.4969 8.4969 10.8454 10.8454 14.1023 14.1023 14.1177 14.1177 19.5648 19.5648 19.5686 19.5686 21.1224 21.1224 26.1975 26.1975 26.2207 26.2207 k = 0.5000 0.2835 0.2114 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8772 -24.8772 -23.9654 -23.9654 -23.7576 -23.7576 8.4983 8.4983 10.8408 10.8408 14.1015 14.1015 14.1165 14.1165 19.5657 19.5657 19.5691 19.5691 21.1242 21.1242 26.2137 26.2137 26.2315 26.2315 k = 0.5000 0.2887 0.2041 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8771 -24.8771 -23.9654 -23.9654 -23.7575 -23.7575 8.4988 8.4988 10.8393 10.8393 14.1012 14.1012 14.1162 14.1162 19.5659 19.5659 19.5694 19.5694 21.1248 21.1248 26.2185 26.2185 26.2358 26.2358 k = 0.5000 0.2887 0.2041 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8771 -24.8771 -23.9654 -23.9654 -23.7575 -23.7575 8.4988 8.4988 10.8393 10.8393 14.1012 14.1012 14.1162 14.1162 19.5659 19.5659 19.5694 19.5694 21.1248 21.1248 26.2185 26.2185 26.2358 26.2358 k = 0.4974 0.2872 0.2126 ( 1350 PWs) bands (ev): -52.7379 -52.7379 -24.8772 -24.8772 -23.9654 -23.9654 -23.7576 -23.7576 8.4983 8.4983 10.8408 10.8408 14.1015 14.1015 14.1165 14.1165 19.5657 19.5657 19.5691 19.5691 21.1242 21.1242 26.2136 26.2136 26.2314 26.2314 k = 0.4948 0.2857 0.2211 ( 1350 PWs) bands (ev): -52.7378 -52.7378 -24.8772 -24.8772 -23.9655 -23.9655 -23.7579 -23.7579 8.4968 8.4968 10.8455 10.8455 14.1023 14.1023 14.1178 14.1178 19.5647 19.5647 19.5686 19.5686 21.1223 21.1223 26.1970 26.1970 26.2204 26.2204 k = 0.4922 0.2842 0.2296 ( 1348 PWs) bands (ev): -52.7372 -52.7372 -24.8772 -24.8772 -23.9654 -23.9654 -23.7583 -23.7583 8.4944 8.4944 10.8533 10.8533 14.1044 14.1044 14.1207 14.1207 19.5633 19.5633 19.5681 19.5681 21.1212 21.1212 26.1710 26.1710 26.2058 26.2058 k = 0.4896 0.2827 0.2381 ( 1348 PWs) bands (ev): -52.7370 -52.7370 -24.8772 -24.8772 -23.9655 -23.9655 -23.7590 -23.7590 8.4910 8.4910 10.8643 10.8643 14.1050 14.1050 14.1247 14.1247 19.5605 19.5605 19.5675 19.5675 21.1168 21.1168 26.1295 26.1295 26.1864 26.1864 k = 0.4870 0.2812 0.2467 ( 1344 PWs) bands (ev): -52.7357 -52.7357 -24.8771 -24.8771 -23.9654 -23.9654 -23.7598 -23.7598 8.4867 8.4867 10.8786 10.8786 14.1059 14.1059 14.1321 14.1321 19.5606 19.5606 19.5681 19.5681 21.1121 21.1121 26.0818 26.0818 26.1662 26.1662 k = 0.4844 0.2797 0.2552 ( 1347 PWs) bands (ev): -52.7365 -52.7365 -24.8773 -24.8773 -23.9657 -23.9657 -23.7611 -23.7611 8.4815 8.4815 10.8956 10.8956 14.1038 14.1038 14.1398 14.1398 19.5512 19.5512 19.5661 19.5661 21.1053 21.1053 26.0181 26.0181 26.1374 26.1374 k = 0.4818 0.2782 0.2637 ( 1343 PWs) bands (ev): -52.7351 -52.7351 -24.8772 -24.8772 -23.9656 -23.9656 -23.7623 -23.7623 8.4754 8.4754 10.9161 10.9161 14.1030 14.1030 14.1505 14.1505 19.5487 19.5487 19.5703 19.5703 21.0980 21.0980 25.9530 25.9530 26.1073 26.1073 k = 0.4792 0.2766 0.2722 ( 1345 PWs) bands (ev): -52.7355 -52.7355 -24.8774 -24.8774 -23.9659 -23.9659 -23.7639 -23.7639 8.4684 8.4684 10.9392 10.9392 14.1018 14.1018 14.1605 14.1605 19.5400 19.5400 19.5665 19.5665 21.0893 21.0893 25.8814 25.8814 26.0668 26.0668 k = 0.4766 0.2751 0.2807 ( 1345 PWs) bands (ev): -52.7353 -52.7353 -24.8776 -24.8776 -23.9661 -23.9661 -23.7657 -23.7657 8.4605 8.4605 10.9653 10.9653 14.0996 14.0996 14.1732 14.1732 19.5331 19.5331 19.5657 19.5657 21.0793 21.0793 25.8039 25.8039 26.0243 26.0243 k = 0.4740 0.2736 0.2892 ( 1345 PWs) bands (ev): -52.7350 -52.7350 -24.8777 -24.8777 -23.9663 -23.9663 -23.7676 -23.7676 8.4517 8.4517 10.9944 10.9944 14.0971 14.0971 14.1875 14.1875 19.5256 19.5256 19.5650 19.5650 21.0683 21.0683 25.7222 25.7222 25.9777 25.9777 k = 0.4714 0.2721 0.2977 ( 1343 PWs) bands (ev): -52.7341 -52.7341 -24.8779 -24.8779 -23.9664 -23.9664 -23.7695 -23.7695 8.4422 8.4422 11.0265 11.0265 14.0953 14.0953 14.2033 14.2033 19.5192 19.5192 19.5643 19.5643 21.0585 21.0585 25.6395 25.6395 25.9273 25.9273 k = 0.4688 0.2706 0.3062 ( 1345 PWs) bands (ev): -52.7344 -52.7344 -24.8782 -24.8782 -23.9667 -23.9667 -23.7719 -23.7719 8.4319 8.4319 11.0612 11.0612 14.0924 14.0924 14.2202 14.2202 19.5107 19.5107 19.5562 19.5562 21.0448 21.0448 25.5528 25.5528 25.8724 25.8724 k = 0.4661 0.2691 0.3147 ( 1341 PWs) bands (ev): -52.7329 -52.7329 -24.8782 -24.8782 -23.9668 -23.9668 -23.7742 -23.7742 8.4210 8.4210 11.0993 11.0993 14.0889 14.0889 14.2400 14.2400 19.5031 19.5031 19.5619 19.5619 21.0319 21.0319 25.4628 25.4628 25.8184 25.8184 k = 0.4635 0.2676 0.3232 ( 1341 PWs) bands (ev): -52.7326 -52.7326 -24.8785 -24.8785 -23.9670 -23.9670 -23.7768 -23.7768 8.4092 8.4092 11.1398 11.1398 14.0844 14.0844 14.2600 14.2600 19.4940 19.4940 19.5612 19.5612 21.0178 21.0178 25.3690 25.3690 25.7573 25.7573 k = 0.4609 0.2661 0.3317 ( 1341 PWs) bands (ev): -52.7322 -52.7322 -24.8787 -24.8787 -23.9673 -23.9673 -23.7795 -23.7795 8.3968 8.3968 11.1830 11.1830 14.0794 14.0794 14.2814 14.2814 19.4847 19.4847 19.5606 19.5606 21.0031 21.0031 25.2730 25.2730 25.6932 25.6932 k = 0.4583 0.2646 0.3402 ( 1341 PWs) bands (ev): -52.7317 -52.7317 -24.8790 -24.8790 -23.9676 -23.9676 -23.7823 -23.7823 8.3838 8.3838 11.2289 11.2289 14.0738 14.0738 14.3041 14.3041 19.4751 19.4751 19.5602 19.5602 20.9881 20.9881 25.1751 25.1751 25.6262 25.6262 k = 0.4557 0.2631 0.3487 ( 1339 PWs) bands (ev): -52.7307 -52.7307 -24.8793 -24.8793 -23.9678 -23.9678 -23.7851 -23.7851 8.3702 8.3702 11.2773 11.2773 14.0677 14.0677 14.3291 14.3291 19.4655 19.4655 19.5619 19.5619 20.9746 20.9746 25.0757 25.0757 25.5589 25.5589 k = 0.4531 0.2616 0.3572 ( 1338 PWs) bands (ev): -52.7300 -52.7300 -24.8796 -24.8796 -23.9680 -23.9680 -23.7881 -23.7881 8.3561 8.3561 11.3288 11.3288 14.0609 14.0609 14.3543 14.3543 19.4556 19.4556 19.5619 19.5619 20.9617 20.9617 24.9748 24.9748 25.4868 25.4868 k = 0.4505 0.2601 0.3657 ( 1336 PWs) bands (ev): -52.7289 -52.7289 -24.8799 -24.8799 -23.9682 -23.9682 -23.7912 -23.7912 8.3415 8.3415 11.3827 11.3827 14.0536 14.0536 14.3809 14.3809 19.4498 19.4498 19.5621 19.5621 20.9467 20.9467 24.8733 24.8733 25.4128 25.4128 k = 0.4479 0.2586 0.3742 ( 1338 PWs) bands (ev): -52.7290 -52.7290 -24.8804 -24.8804 -23.9686 -23.9686 -23.7945 -23.7945 8.3264 8.3264 11.4382 11.4382 14.0455 14.0455 14.4081 14.4081 19.4348 19.4348 19.5625 19.5625 20.9310 20.9310 24.7697 24.7697 25.3353 25.3353 k = 0.4453 0.2571 0.3827 ( 1334 PWs) bands (ev): -52.7273 -52.7273 -24.8807 -24.8807 -23.9687 -23.9687 -23.7976 -23.7976 8.3111 8.3111 11.4964 11.4964 14.0386 14.0386 14.4372 14.4372 19.4248 19.4248 19.5656 19.5656 20.9165 20.9165 24.6750 24.6750 25.2576 25.2576 k = 0.4427 0.2556 0.3912 ( 1332 PWs) bands (ev): -52.7262 -52.7262 -24.8810 -24.8810 -23.9689 -23.9689 -23.8009 -23.8009 8.2953 8.2953 11.5573 11.5573 14.0280 14.0280 14.4681 14.4681 19.4129 19.4129 19.5703 19.5703 20.9032 20.9032 24.5690 24.5690 25.1810 25.1810 k = 0.4401 0.2541 0.3997 ( 1332 PWs) bands (ev): -52.7257 -52.7257 -24.8816 -24.8816 -23.9693 -23.9693 -23.8042 -23.8042 8.2790 8.2790 11.6195 11.6195 14.0177 14.0177 14.5002 14.5002 19.4005 19.4005 19.5692 19.5692 20.8892 20.8892 24.4636 24.4636 25.1027 25.1027 k = 0.4375 0.2526 0.4082 ( 1334 PWs) bands (ev): -52.7258 -52.7258 -24.8822 -24.8822 -23.9697 -23.9697 -23.8077 -23.8077 8.2624 8.2624 11.6839 11.6839 14.0068 14.0068 14.5312 14.5312 19.3844 19.3844 19.5709 19.5709 20.8745 20.8745 24.3591 24.3591 25.0175 25.0175 k = 0.4349 0.2511 0.4168 ( 1334 PWs) bands (ev): -52.7253 -52.7253 -24.8827 -24.8827 -23.9700 -23.9700 -23.8112 -23.8112 8.2455 8.2455 11.7502 11.7502 13.9953 13.9953 14.5640 14.5640 19.3706 19.3706 19.5730 19.5730 20.8618 20.8618 24.2551 24.2551 24.9331 24.9331 k = 0.4323 0.2496 0.4253 ( 1332 PWs) bands (ev): -52.7242 -52.7242 -24.8832 -24.8832 -23.9702 -23.9702 -23.8145 -23.8145 8.2284 8.2284 11.8187 11.8187 13.9833 13.9833 14.5981 14.5981 19.3567 19.3567 19.5758 19.5758 20.8536 20.8536 24.1519 24.1519 24.8488 24.8488 k = 0.4297 0.2481 0.4338 ( 1328 PWs) bands (ev): -52.7225 -52.7225 -24.8837 -24.8837 -23.9704 -23.9704 -23.8177 -23.8177 8.2111 8.2111 11.8885 11.8885 13.9720 13.9720 14.6332 14.6332 19.3426 19.3426 19.5800 19.5800 20.8469 20.8469 24.0548 24.0548 24.7635 24.7635 k = 0.4271 0.2466 0.4423 ( 1329 PWs) bands (ev): -52.7223 -52.7223 -24.8844 -24.8844 -23.9707 -23.9707 -23.8211 -23.8211 8.1934 8.1934 11.9601 11.9601 13.9571 13.9571 14.6686 14.6686 19.3277 19.3277 19.5833 19.5833 20.8369 20.8369 23.9490 23.9490 24.6760 24.6760 k = 0.4245 0.2451 0.4508 ( 1333 PWs) bands (ev): -52.7230 -52.7230 -24.8852 -24.8852 -23.9712 -23.9712 -23.8247 -23.8247 8.1756 8.1756 12.0329 12.0329 13.9430 13.9430 14.7029 14.7029 19.3072 19.3072 19.5825 19.5825 20.8277 20.8277 23.8486 23.8486 24.5838 24.5838 k = 0.4219 0.2436 0.4593 ( 1333 PWs) bands (ev): -52.7225 -52.7225 -24.8859 -24.8859 -23.9715 -23.9715 -23.8280 -23.8280 8.1577 8.1577 12.1071 12.1071 13.9284 13.9284 14.7398 14.7398 19.2871 19.2871 19.5870 19.5870 20.8211 20.8211 23.7511 23.7511 24.4948 24.4948 k = 0.4193 0.2421 0.4678 ( 1331 PWs) bands (ev): -52.7215 -52.7215 -24.8864 -24.8864 -23.9717 -23.9717 -23.8312 -23.8312 8.1397 8.1397 12.1834 12.1834 13.9133 13.9133 14.7775 14.7775 19.2663 19.2663 19.5923 19.5923 20.8195 20.8195 23.6565 23.6565 24.4054 24.4054 k = 0.4167 0.2406 0.4763 ( 1328 PWs) bands (ev): -52.7201 -52.7201 -24.8870 -24.8870 -23.9718 -23.9718 -23.8342 -23.8342 8.1219 8.1219 12.2599 12.2599 13.8978 13.8978 14.8174 14.8174 19.2442 19.2442 19.5981 19.5981 20.8161 20.8161 23.5680 23.5680 24.3195 24.3195 k = 0.4141 0.2391 0.4848 ( 1331 PWs) bands (ev): -52.7205 -52.7205 -24.8879 -24.8879 -23.9724 -23.9724 -23.8373 -23.8373 8.1036 8.1036 12.3363 12.3363 13.8814 13.8814 14.8562 14.8562 19.2162 19.2162 19.6045 19.6045 20.8100 20.8100 23.4768 23.4768 24.2287 24.2287 k = 0.4115 0.2376 0.4933 ( 1333 PWs) bands (ev): -52.7206 -52.7206 -24.8887 -24.8887 -23.9728 -23.9728 -23.8403 -23.8403 8.0853 8.0853 12.4143 12.4143 13.8643 13.8643 14.8944 14.8944 19.1898 19.1898 19.6098 19.6098 20.8077 20.8077 23.3898 23.3898 24.1351 24.1351 k = 0.4089 0.2361 0.5018 ( 1333 PWs) bands (ev): -52.7202 -52.7202 -24.8895 -24.8895 -23.9731 -23.9731 -23.8431 -23.8431 8.0670 8.0670 12.4930 12.4930 13.8471 13.8471 14.9343 14.9343 19.1621 19.1621 19.6176 19.6176 20.8061 20.8061 23.3088 23.3088 24.0438 24.0438 k = 0.4062 0.2345 0.5103 ( 1329 PWs) bands (ev): -52.7186 -52.7186 -24.8901 -24.8901 -23.9732 -23.9732 -23.8455 -23.8455 8.0488 8.0488 12.5720 12.5720 13.8295 13.8295 14.9762 14.9762 19.1337 19.1337 19.6312 19.6312 20.8074 20.8074 23.2332 23.2332 23.9566 23.9566 k = 0.4036 0.2330 0.5188 ( 1329 PWs) bands (ev): -52.7181 -52.7181 -24.8908 -24.8908 -23.9736 -23.9736 -23.8480 -23.8480 8.0305 8.0305 12.6514 12.6514 13.8114 13.8114 15.0169 15.0169 19.1032 19.1032 19.6403 19.6403 20.8060 20.8060 23.1622 23.1622 23.8648 23.8648 k = 0.4010 0.2315 0.5273 ( 1327 PWs) bands (ev): -52.7171 -52.7171 -24.8915 -24.8915 -23.9738 -23.9738 -23.8503 -23.8503 8.0121 8.0121 12.7309 12.7309 13.7932 13.7932 15.0586 15.0586 19.0723 19.0723 19.6507 19.6507 20.8072 20.8072 23.0970 23.0970 23.7747 23.7747 k = 0.3984 0.2300 0.5358 ( 1327 PWs) bands (ev): -52.7167 -52.7167 -24.8922 -24.8922 -23.9741 -23.9741 -23.8525 -23.8525 7.9938 7.9938 12.8103 12.8103 13.7743 13.7743 15.1000 15.1000 19.0395 19.0395 19.6612 19.6612 20.8046 20.8046 23.0381 23.0381 23.6828 23.6828 k = 0.3958 0.2285 0.5443 ( 1327 PWs) bands (ev): -52.7163 -52.7163 -24.8929 -24.8929 -23.9745 -23.9745 -23.8545 -23.8545 7.9754 7.9754 12.8895 12.8895 13.7550 13.7550 15.1416 15.1416 19.0058 19.0058 19.6723 19.6723 20.8007 20.8007 22.9859 22.9859 23.5910 23.5910 k = 0.3932 0.2270 0.5528 ( 1321 PWs) bands (ev): -52.7142 -52.7142 -24.8933 -24.8933 -23.9744 -23.9744 -23.8561 -23.8561 7.9574 7.9574 12.9693 12.9693 13.7356 13.7356 15.1845 15.1845 18.9729 18.9729 19.6902 19.6902 20.8002 20.8002 22.9440 22.9440 23.5023 23.5023 k = 0.3906 0.2255 0.5613 ( 1323 PWs) bands (ev): -52.7145 -52.7145 -24.8941 -24.8941 -23.9749 -23.9749 -23.8578 -23.8578 7.9390 7.9390 13.0474 13.0474 13.7152 13.7152 15.2264 15.2264 18.9345 18.9345 19.7024 19.7024 20.7915 20.7915 22.9059 22.9059 23.4106 23.4106 k = 0.3880 0.2240 0.5698 ( 1327 PWs) bands (ev): -52.7153 -52.7153 -24.8949 -24.8949 -23.9755 -23.9755 -23.8594 -23.8594 7.9205 7.9205 13.1242 13.1242 13.6941 13.6941 15.2684 15.2684 18.8975 18.8975 19.7142 19.7142 20.7736 20.7736 22.8758 22.8758 23.3189 23.3189 k = 0.3854 0.2225 0.5784 ( 1327 PWs) bands (ev): -52.7150 -52.7150 -24.8955 -24.8955 -23.9758 -23.9758 -23.8607 -23.8607 7.9020 7.9020 13.2006 13.2006 13.6736 13.6736 15.3107 15.3107 18.8617 18.8617 19.7275 19.7275 20.7619 20.7619 22.8540 22.8540 23.2281 23.2281 k = 0.3828 0.2210 0.5869 ( 1331 PWs) bands (ev): -52.7159 -52.7159 -24.8962 -24.8962 -23.9764 -23.9764 -23.8619 -23.8619 7.8833 7.8833 13.2747 13.2747 13.6531 13.6531 15.3526 15.3526 18.8231 18.8231 19.7401 19.7401 20.7437 20.7437 22.8371 22.8371 23.1365 23.1365 k = 0.3802 0.2195 0.5954 ( 1329 PWs) bands (ev): -52.7151 -52.7151 -24.8966 -24.8966 -23.9765 -23.9765 -23.8628 -23.8628 7.8650 7.8650 13.3483 13.3483 13.6334 13.6334 15.3939 15.3939 18.7876 18.7876 19.7563 19.7563 20.7312 20.7312 22.8329 22.8329 23.0451 23.0451 k = 0.3776 0.2180 0.6039 ( 1334 PWs) bands (ev): -52.7164 -52.7164 -24.8973 -24.8973 -23.9770 -23.9770 -23.8637 -23.8637 7.8460 7.8460 13.4182 13.4182 13.6140 13.6140 15.4353 15.4353 18.7512 18.7512 19.7652 19.7652 20.7072 20.7072 22.8332 22.8332 22.9539 22.9539 k = 0.3750 0.2165 0.6124 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9773 -23.9773 -23.8642 -23.8642 7.8271 7.8271 13.4799 13.4799 13.6020 13.6020 15.4777 15.4777 18.7150 18.7150 19.7795 19.7795 20.6877 20.6877 22.8420 22.8420 22.8659 22.8659 k = 0.6250-0.0722 0.4082 ( 1334 PWs) bands (ev): -52.7163 -52.7163 -24.8977 -24.8977 -23.9773 -23.9773 -23.8642 -23.8642 7.8271 7.8271 13.4799 13.4799 13.6020 13.6020 15.4777 15.4777 18.7150 18.7150 19.7795 19.7795 20.6877 20.6877 22.8420 22.8420 22.8659 22.8659 k = 0.6205-0.0799 0.4082 ( 1334 PWs) bands (ev): -52.7161 -52.7161 -24.8983 -24.8983 -23.9776 -23.9776 -23.8648 -23.8648 7.7942 7.7942 13.5650 13.5650 13.6015 13.6015 15.5517 15.5517 18.6538 18.6538 19.8037 19.8037 20.6535 20.6535 22.7138 22.7138 22.8647 22.8647 k = 0.6161-0.0876 0.4082 ( 1334 PWs) bands (ev): -52.7159 -52.7159 -24.8989 -24.8989 -23.9780 -23.9780 -23.8653 -23.8653 7.7609 7.7609 13.5789 13.5789 13.6732 13.6732 15.6281 15.6281 18.5939 18.5939 19.8272 19.8272 20.6199 20.6199 22.5620 22.5620 22.8859 22.8859 k = 0.6116-0.0954 0.4082 ( 1324 PWs) bands (ev): -52.7129 -52.7129 -24.8989 -24.8989 -23.9778 -23.9778 -23.8653 -23.8653 7.7279 7.7279 13.5733 13.5733 13.7668 13.7668 15.7087 15.7087 18.5357 18.5357 19.8536 19.8536 20.6035 20.6035 22.4152 22.4152 22.9137 22.9137 k = 0.6071-0.1031 0.4082 ( 1328 PWs) bands (ev): -52.7139 -52.7139 -24.8996 -24.8996 -23.9784 -23.9784 -23.8656 -23.8656 7.6943 7.6943 13.5660 13.5660 13.8597 13.8597 15.7892 15.7892 18.4791 18.4791 19.8718 19.8718 20.5646 20.5646 22.2614 22.2614 22.9325 22.9325 k = 0.6027-0.1108 0.4082 ( 1328 PWs) bands (ev): -52.7138 -52.7138 -24.9001 -24.9001 -23.9789 -23.9789 -23.8657 -23.8657 7.6612 7.6612 13.5598 13.5598 13.9522 13.9522 15.8725 15.8725 18.4243 18.4243 19.8927 19.8927 20.5328 20.5328 22.1088 22.1088 22.9517 22.9517 k = 0.5982-0.1186 0.4082 ( 1328 PWs) bands (ev): -52.7138 -52.7138 -24.9006 -24.9006 -23.9794 -23.9794 -23.8656 -23.8656 7.6284 7.6284 13.5542 13.5542 14.0436 14.0436 15.9580 15.9580 18.3716 18.3716 19.9127 19.9127 20.5018 20.5018 21.9564 21.9564 22.9700 22.9700 k = 0.5938-0.1263 0.4082 ( 1326 PWs) bands (ev): -52.7131 -52.7131 -24.9010 -24.9010 -23.9798 -23.9798 -23.8652 -23.8652 7.5963 7.5963 13.5490 13.5490 14.1335 14.1335 16.0470 16.0470 18.3211 18.3211 19.9320 19.9320 20.4717 20.4717 21.8082 21.8082 22.9898 22.9898 k = 0.5893-0.1340 0.4082 ( 1330 PWs) bands (ev): -52.7142 -52.7142 -24.9016 -24.9016 -23.9805 -23.9805 -23.8651 -23.8651 7.5647 7.5647 13.5443 13.5443 14.2213 14.2213 16.1342 16.1342 18.2721 18.2721 19.9494 19.9494 20.4404 20.4404 21.6511 21.6511 23.0039 23.0039 k = 0.5848-0.1418 0.4082 ( 1332 PWs) bands (ev): -52.7148 -52.7148 -24.9021 -24.9021 -23.9812 -23.9812 -23.8648 -23.8648 7.5340 7.5340 13.5398 13.5398 14.3067 14.3067 16.2258 16.2258 18.2261 18.2261 19.9669 19.9669 20.4070 20.4070 21.5000 21.5000 23.0192 23.0192 k = 0.5804-0.1495 0.4082 ( 1328 PWs) bands (ev): -52.7136 -52.7136 -24.9023 -24.9023 -23.9816 -23.9816 -23.8641 -23.8641 7.5043 7.5043 13.5362 13.5362 14.3918 14.3918 16.3199 16.3199 18.1843 18.1843 19.9840 19.9840 20.3846 20.3846 21.3514 21.3514 23.0359 23.0359 k = 0.5759-0.1572 0.4082 ( 1328 PWs) bands (ev): -52.7136 -52.7136 -24.9027 -24.9027 -23.9821 -23.9821 -23.8635 -23.8635 7.4756 7.4756 13.5330 13.5330 14.4722 14.4722 16.4151 16.4151 18.1435 18.1435 19.9997 19.9997 20.3585 20.3585 21.2020 21.2020 23.0502 23.0502 k = 0.5714-0.1650 0.4082 ( 1326 PWs) bands (ev): -52.7130 -52.7130 -24.9029 -24.9029 -23.9826 -23.9826 -23.8628 -23.8628 7.4482 7.4482 13.5302 13.5302 14.5503 14.5503 16.5119 16.5119 18.1056 18.1056 20.0146 20.0146 20.3390 20.3390 21.0538 21.0538 23.0637 23.0637 k = 0.5670-0.1727 0.4082 ( 1326 PWs) bands (ev): -52.7130 -52.7130 -24.9033 -24.9033 -23.9832 -23.9832 -23.8621 -23.8621 7.4219 7.4219 13.5277 13.5277 14.6240 14.6240 16.6101 16.6101 18.0702 18.0702 20.0285 20.0285 20.3152 20.3152 20.9071 20.9071 23.0762 23.0762 k = 0.5625-0.1804 0.4082 ( 1326 PWs) bands (ev): -52.7130 -52.7130 -24.9036 -24.9036 -23.9838 -23.9838 -23.8613 -23.8613 7.3970 7.3970 13.5255 13.5255 14.6941 14.6941 16.7097 16.7097 18.0375 18.0375 20.0415 20.0415 20.2928 20.2928 20.7622 20.7622 23.0879 23.0879 k = 0.5580-0.1882 0.4082 ( 1328 PWs) bands (ev): -52.7136 -52.7136 -24.9039 -24.9039 -23.9844 -23.9844 -23.8607 -23.8607 7.3736 7.3736 13.5235 13.5235 14.7588 14.7588 16.8102 16.8102 18.0066 18.0066 20.0536 20.0536 20.2689 20.2689 20.6193 20.6193 23.0979 23.0979 k = 0.5536-0.1959 0.4082 ( 1328 PWs) bands (ev): -52.7136 -52.7136 -24.9042 -24.9042 -23.9850 -23.9850 -23.8600 -23.8600 7.3516 7.3516 13.5219 13.5219 14.8206 14.8206 16.9115 16.9115 17.9795 17.9795 20.0646 20.0646 20.2488 20.2488 20.4792 20.4792 23.1079 23.1079 k = 0.5491-0.2036 0.4082 ( 1328 PWs) bands (ev): -52.7136 -52.7136 -24.9045 -24.9045 -23.9855 -23.9855 -23.8592 -23.8592 7.3311 7.3311 13.5205 13.5205 14.8780 14.8780 17.0132 17.0132 17.9551 17.9551 20.0746 20.0746 20.2288 20.2288 20.3432 20.3432 23.1171 23.1171 k = 0.5446-0.2114 0.4082 ( 1328 PWs) bands (ev): -52.7135 -52.7135 -24.9047 -24.9047 -23.9860 -23.9860 -23.8585 -23.8585 7.3123 7.3123 13.5194 13.5194 14.9308 14.9308 17.1147 17.1147 17.9333 17.9333 20.0829 20.0829 20.1886 20.1886 20.2329 20.2329 23.1254 23.1254 k = 0.5402-0.2191 0.4082 ( 1328 PWs) bands (ev): -52.7135 -52.7135 -24.9049 -24.9049 -23.9865 -23.9865 -23.8578 -23.8578 7.2951 7.2951 13.5184 13.5184 14.9789 14.9789 17.2155 17.2155 17.9142 17.9142 20.0627 20.0627 20.0983 20.0983 20.2056 20.2056 23.1330 23.1330 k = 0.5357-0.2268 0.4082 ( 1328 PWs) bands (ev): -52.7135 -52.7135 -24.9051 -24.9051 -23.9869 -23.9869 -23.8572 -23.8572 7.2796 7.2796 13.5176 13.5176 15.0222 15.0222 17.3149 17.3149 17.8975 17.8975 19.9423 19.9423 20.1006 20.1006 20.1913 20.1913 23.1397 23.1397 k = 0.5312-0.2345 0.4082 ( 1328 PWs) bands (ev): -52.7135 -52.7135 -24.9053 -24.9053 -23.9873 -23.9873 -23.8566 -23.8566 7.2658 7.2658 13.5169 13.5169 15.0605 15.0605 17.4116 17.4116 17.8832 17.8832 19.8223 19.8223 20.1059 20.1059 20.1800 20.1800 23.1456 23.1456 k = 0.5268-0.2423 0.4082 ( 1328 PWs) bands (ev): -52.7134 -52.7134 -24.9054 -24.9054 -23.9877 -23.9877 -23.8560 -23.8560 7.2538 7.2538 13.5163 13.5163 15.0939 15.0939 17.5043 17.5043 17.8713 17.8713 19.7089 19.7089 20.1100 20.1100 20.1710 20.1710 23.1508 23.1508 k = 0.5223-0.2500 0.4082 ( 1328 PWs) bands (ev): -52.7134 -52.7134 -24.9055 -24.9055 -23.9880 -23.9880 -23.8556 -23.8556 7.2436 7.2436 13.5159 13.5159 15.1222 15.1222 17.5909 17.5909 17.8618 17.8618 19.6043 19.6043 20.1128 20.1128 20.1644 20.1644 23.1551 23.1551 k = 0.5179-0.2577 0.4082 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9061 -24.9061 -23.9887 -23.9887 -23.8557 -23.8557 7.2351 7.2351 13.5154 13.5154 15.1427 15.1427 17.6673 17.6673 17.8548 17.8548 19.5031 19.5031 20.1032 20.1032 20.1528 20.1528 23.1545 23.1545 k = 0.5134-0.2655 0.4082 ( 1334 PWs) bands (ev): -52.7150 -52.7150 -24.9060 -24.9060 -23.9887 -23.9887 -23.8552 -23.8552 7.2286 7.2286 13.5152 13.5152 15.1609 15.1609 17.7331 17.7331 17.8510 17.8510 19.4287 19.4287 20.1094 20.1094 20.1541 20.1541 23.1574 23.1574 k = 0.5089-0.2732 0.4082 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9890 -23.9890 -23.8552 -23.8552 7.2237 7.2237 13.5150 13.5150 15.1711 15.1711 17.7803 17.7803 17.8516 17.8516 19.3649 19.3649 20.1086 20.1086 20.1510 20.1510 23.1549 23.1549 k = 0.5045-0.2809 0.4082 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9891 -23.9891 -23.8551 -23.8551 7.2209 7.2209 13.5149 13.5149 15.1788 15.1788 17.8048 17.8048 17.8584 17.8584 19.3262 19.3262 20.1082 20.1082 20.1503 20.1503 23.1560 23.1560 k = 0.5000-0.2887 0.4082 ( 1338 PWs) bands (ev): -52.7162 -52.7162 -24.9062 -24.9062 -23.9891 -23.9891 -23.8550 -23.8550 7.2200 7.2200 13.5148 13.5148 15.1814 15.1814 17.8109 17.8109 17.8631 17.8631 19.3129 19.3129 20.1080 20.1080 20.1500 20.1500 23.1564 23.1564 Writing output data file CrC.save init_run : 0.12s CPU 0.44s WALL ( 1 calls) electrons : 30.11s CPU 32.59s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.15s WALL ( 1 calls) potinit : 0.01s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 30.10s CPU 32.58s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.01s CPU 0.01s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.04s WALL ( 514 calls) cegterg : 26.51s CPU 27.22s WALL ( 514 calls) Called by sum_band: Called by *egterg: h_psi : 14.12s CPU 14.54s WALL ( 4762 calls) s_psi : 0.18s CPU 0.19s WALL ( 4762 calls) g_psi : 0.04s CPU 0.04s WALL ( 3734 calls) cdiaghg : 12.46s CPU 12.84s WALL ( 4248 calls) cegterg:over : 0.97s CPU 0.95s WALL ( 3734 calls) cegterg:upda : 0.62s CPU 0.61s WALL ( 3734 calls) cegterg:last : 0.31s CPU 0.32s WALL ( 1028 calls) cdiaghg:chol : 0.70s CPU 0.64s WALL ( 4248 calls) cdiaghg:inve : 0.21s CPU 0.20s WALL ( 4248 calls) cdiaghg:para : 0.79s CPU 0.84s WALL ( 8496 calls) Called by h_psi: h_psi:vloc : 12.92s CPU 13.23s WALL ( 4762 calls) h_psi:vnl : 1.18s CPU 1.29s WALL ( 4762 calls) add_vuspsi : 0.64s CPU 0.70s WALL ( 4762 calls) General routines calbec : 0.51s CPU 0.57s WALL ( 4762 calls) fft : 0.00s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 12.22s CPU 12.51s WALL ( 394228 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.09s CPU 0.11s WALL ( 1028 calls) Parallel routines fft_scatter : 7.57s CPU 7.87s WALL ( 394251 calls) PWSCF : 0m38.98s CPU 1m11.04s WALL This run was terminated on: 16:44:35 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=