Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 14:12:52 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./Cs2TeI6.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 74 74 19 3626 3626 496 Max 75 75 20 3634 3634 504 Sum 5389 5389 1429 261403 261403 36085 bravais-lattice index = 14 lattice parameter (alat) = 15.6340 a.u. unit-cell volume = 2702.0545 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 66.00 number of Kohn-Sham states= 80 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.633985 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 Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for I read from file: /users/gautes/Pseudo/I.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 7c65668ffc3f6431347fa26e98076fd5 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1247 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cs read from file: /users/gautes/Pseudo/Cs.rel-pbe-oncvpsp.UPF MD5 check sum: b26d75608c6aa7e713949ad9f7a49707 Pseudo is Norm-conserving, Zval = 9.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 2414 points, 14 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 atomic species valence mass pseudopotential Te 6.00 127.60000 Te( 1.00) I 7.00 126.90450 I( 1.00) Cs 9.00 132.90550 Cs( 1.00) 12 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) ( 1 -1 0 ) ( 1 0 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 3) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 4) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( -1 1 0 ) ( 0 1 0 ) ( 0 1 -1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 inversion cryst. s( 7) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 7) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s( 9) = ( 1 -1 0 ) ( 1 0 0 ) ( 1 0 -1 ) cart. s( 9) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(10) = ( 0 1 0 ) ( -1 1 0 ) ( 0 1 -1 ) cart. s(10) = ( 0.5000000 -0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group D_3d (-3m) there are 12 classes and 6 irreducible representations the character table: E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 2.00 -2.00 1.00 -1.00 0.00 0.00 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6+ 1.00 -1.00 -1.00 1.00 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 2.00 -2.00 1.00 -1.00 0.00 0.00 -2.00 2.00 -1.00 1.00 0.00 0.00 G_5- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 G_6- 1.00 -1.00 -1.00 1.00 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3C2' -3C2' i -i 2S6 -2S6 3s_v -3s_v G_4+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5+ 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_6+ 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_5- 0.00 0.00 0.00 0.00 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_6- 0.00 0.00 0.00 0.00 -1.00 1.00 0.00 0.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C3 3 4 120 deg rotation - cryst. axis [0,0,1] -2C3 -3 -4 120 deg rotation - cryst. axis [0,0,1] E 3C2' 2 5 -6 180 deg rotation - cart. axis [1,0,0] 3C2' 6 -5 -2 180 deg rotation - cryst. axis [1,1,0] i 7 inversion -i -7 inversion E 2S6 9 10 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -9 -10 inv. 120 deg rotation - cryst. axis [0,0,1] E 3s_v 8 11 -12 inv. 180 deg rotation - cart. axis [1,0,0] 3s_v 12 -11 -8 inv. 180 deg rotation - cryst. axis [1,1,0] Cartesian axes number of k points= 187 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053476 k( 2) = ( 0.0185185 -0.0106917 0.0151203), wk = 0.0053476 k( 3) = ( 0.0370370 -0.0213833 0.0302406), wk = 0.0053476 k( 4) = ( 0.0555556 -0.0320750 0.0453609), wk = 0.0053476 k( 5) = ( 0.0740741 -0.0427667 0.0604812), wk = 0.0053476 k( 6) = ( 0.0925926 -0.0534584 0.0756015), wk = 0.0053476 k( 7) = ( 0.1111111 -0.0641500 0.0907218), wk = 0.0053476 k( 8) = ( 0.1296296 -0.0748417 0.1058421), wk = 0.0053476 k( 9) = ( 0.1481482 -0.0855334 0.1209625), wk = 0.0053476 k( 10) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0053476 k( 11) = ( 0.1851852 -0.1069167 0.1512031), wk = 0.0053476 k( 12) = ( 0.2037037 -0.1176084 0.1663234), wk = 0.0053476 k( 13) = ( 0.2222222 -0.1283001 0.1814437), wk = 0.0053476 k( 14) = ( 0.2407407 -0.1389917 0.1965640), wk = 0.0053476 k( 15) = ( 0.2592593 -0.1496834 0.2116843), wk = 0.0053476 k( 16) = ( 0.2777778 -0.1603751 0.2268046), wk = 0.0053476 k( 17) = ( 0.2962963 -0.1710667 0.2419249), wk = 0.0053476 k( 18) = ( 0.3148148 -0.1817584 0.2570452), wk = 0.0053476 k( 19) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0053476 k( 20) = ( 0.3518519 -0.2031418 0.2872858), wk = 0.0053476 k( 21) = ( 0.3703704 -0.2138334 0.3024061), wk = 0.0053476 k( 22) = ( 0.3888889 -0.2245251 0.3175264), wk = 0.0053476 k( 23) = ( 0.4074074 -0.2352168 0.3326468), wk = 0.0053476 k( 24) = ( 0.4259259 -0.2459085 0.3477671), wk = 0.0053476 k( 25) = ( 0.4444444 -0.2566001 0.3628874), wk = 0.0053476 k( 26) = ( 0.4629630 -0.2672918 0.3780077), wk = 0.0053476 k( 27) = ( 0.4814815 -0.2779835 0.3931280), wk = 0.0053476 k( 28) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0053476 k( 29) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0053476 k( 30) = ( 0.5000000 -0.2680555 0.4228286), wk = 0.0053476 k( 31) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0053476 k( 32) = ( 0.5000000 -0.2268162 0.4519892), wk = 0.0053476 k( 33) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0053476 k( 34) = ( 0.5000000 -0.1855769 0.4811498), wk = 0.0053476 k( 35) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0053476 k( 36) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0053476 k( 37) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0053476 k( 38) = ( 0.5000000 -0.1030983 0.5394710), wk = 0.0053476 k( 39) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0053476 k( 40) = ( 0.5000000 -0.0618590 0.5686315), wk = 0.0053476 k( 41) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0053476 k( 42) = ( 0.5000000 -0.0206196 0.5977921), wk = 0.0053476 k( 43) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0053476 k( 44) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0053476 k( 45) = ( 0.4875000 0.0216506 0.6123724), wk = 0.0053476 k( 46) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0053476 k( 47) = ( 0.4625000 0.0649519 0.6123724), wk = 0.0053476 k( 48) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0053476 k( 49) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0053476 k( 50) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0053476 k( 51) = ( 0.4125000 0.1515544 0.6123724), wk = 0.0053476 k( 52) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0053476 k( 53) = ( 0.3875000 0.1948557 0.6123724), wk = 0.0053476 k( 54) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0053476 k( 55) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0053476 k( 56) = ( 0.3620690 0.2090406 0.5912561), wk = 0.0053476 k( 57) = ( 0.3491379 0.2015749 0.5701399), wk = 0.0053476 k( 58) = ( 0.3362069 0.1941091 0.5490236), wk = 0.0053476 k( 59) = ( 0.3232759 0.1866434 0.5279073), wk = 0.0053476 k( 60) = ( 0.3103448 0.1791777 0.5067910), wk = 0.0053476 k( 61) = ( 0.2974138 0.1717119 0.4856747), wk = 0.0053476 k( 62) = ( 0.2844828 0.1642462 0.4645584), wk = 0.0053476 k( 63) = ( 0.2715517 0.1567805 0.4434421), wk = 0.0053476 k( 64) = ( 0.2586207 0.1493147 0.4223258), wk = 0.0053476 k( 65) = ( 0.2456897 0.1418490 0.4012095), wk = 0.0053476 k( 66) = ( 0.2327586 0.1343833 0.3800932), wk = 0.0053476 k( 67) = ( 0.2198276 0.1269175 0.3589769), wk = 0.0053476 k( 68) = ( 0.2068966 0.1194518 0.3378607), wk = 0.0053476 k( 69) = ( 0.1939655 0.1119860 0.3167444), wk = 0.0053476 k( 70) = ( 0.1810345 0.1045203 0.2956281), wk = 0.0053476 k( 71) = ( 0.1681034 0.0970546 0.2745118), wk = 0.0053476 k( 72) = ( 0.1551724 0.0895888 0.2533955), wk = 0.0053476 k( 73) = ( 0.1422414 0.0821231 0.2322792), wk = 0.0053476 k( 74) = ( 0.1293103 0.0746574 0.2111629), wk = 0.0053476 k( 75) = ( 0.1163793 0.0671916 0.1900466), wk = 0.0053476 k( 76) = ( 0.1034483 0.0597259 0.1689303), wk = 0.0053476 k( 77) = ( 0.0905172 0.0522602 0.1478140), wk = 0.0053476 k( 78) = ( 0.0775862 0.0447944 0.1266977), wk = 0.0053476 k( 79) = ( 0.0646552 0.0373287 0.1055815), wk = 0.0053476 k( 80) = ( 0.0517241 0.0298629 0.0844652), wk = 0.0053476 k( 81) = ( 0.0387931 0.0223972 0.0633489), wk = 0.0053476 k( 82) = ( 0.0258621 0.0149315 0.0422326), wk = 0.0053476 k( 83) = ( 0.0129310 0.0074657 0.0211163), wk = 0.0053476 k( 84) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053476 k( 85) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053476 k( 86) = ( 0.0208333 0.0120281 0.0085052), wk = 0.0053476 k( 87) = ( 0.0416667 0.0240563 0.0170103), wk = 0.0053476 k( 88) = ( 0.0625000 0.0360844 0.0255155), wk = 0.0053476 k( 89) = ( 0.0833333 0.0481125 0.0340207), wk = 0.0053476 k( 90) = ( 0.1041667 0.0601407 0.0425259), wk = 0.0053476 k( 91) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0053476 k( 92) = ( 0.1458333 0.0841969 0.0595362), wk = 0.0053476 k( 93) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0053476 k( 94) = ( 0.1875000 0.1082532 0.0765466), wk = 0.0053476 k( 95) = ( 0.2083333 0.1202813 0.0850517), wk = 0.0053476 k( 96) = ( 0.2291667 0.1323094 0.0935569), wk = 0.0053476 k( 97) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0053476 k( 98) = ( 0.2708333 0.1563657 0.1105672), wk = 0.0053476 k( 99) = ( 0.2916667 0.1683938 0.1190724), wk = 0.0053476 k( 100) = ( 0.3125000 0.1804220 0.1275776), wk = 0.0053476 k( 101) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0053476 k( 102) = ( 0.3541667 0.2044782 0.1445879), wk = 0.0053476 k( 103) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0053476 k( 104) = ( 0.3958333 0.2285345 0.1615983), wk = 0.0053476 k( 105) = ( 0.4166667 0.2405626 0.1701035), wk = 0.0053476 k( 106) = ( 0.4375000 0.2525907 0.1786086), wk = 0.0053476 k( 107) = ( 0.4583333 0.2646189 0.1871138), wk = 0.0053476 k( 108) = ( 0.4791667 0.2766470 0.1956190), wk = 0.0053476 k( 109) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0053476 k( 110) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0053476 k( 111) = ( 0.5073529 0.2674490 0.2161314), wk = 0.0053476 k( 112) = ( 0.5147059 0.2462229 0.2281387), wk = 0.0053476 k( 113) = ( 0.5220588 0.2249968 0.2401461), wk = 0.0053476 k( 114) = ( 0.5294118 0.2037707 0.2521534), wk = 0.0053476 k( 115) = ( 0.5367647 0.1825446 0.2641607), wk = 0.0053476 k( 116) = ( 0.5441177 0.1613185 0.2761680), wk = 0.0053476 k( 117) = ( 0.5514706 0.1400923 0.2881753), wk = 0.0053476 k( 118) = ( 0.5588235 0.1188662 0.3001826), wk = 0.0053476 k( 119) = ( 0.5661765 0.0976401 0.3121899), wk = 0.0053476 k( 120) = ( 0.5735294 0.0764140 0.3241972), wk = 0.0053476 k( 121) = ( 0.5808823 0.0551879 0.3362045), wk = 0.0053476 k( 122) = ( 0.5882353 0.0339618 0.3482118), wk = 0.0053476 k( 123) = ( 0.5955882 0.0127357 0.3602191), wk = 0.0053476 k( 124) = ( 0.6029412 -0.0084904 0.3722264), wk = 0.0053476 k( 125) = ( 0.6102941 -0.0297166 0.3842337), wk = 0.0053476 k( 126) = ( 0.6176471 -0.0509427 0.3962410), wk = 0.0053476 k( 127) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0053476 k( 128) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0053476 k( 129) = ( 0.6125000 -0.0649519 0.4286607), wk = 0.0053476 k( 130) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0053476 k( 131) = ( 0.5875000 -0.0505181 0.4694855), wk = 0.0053476 k( 132) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0053476 k( 133) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0053476 k( 134) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0053476 k( 135) = ( 0.5375000 -0.0216506 0.5511352), wk = 0.0053476 k( 136) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0053476 k( 137) = ( 0.5125000 -0.0072169 0.5919600), wk = 0.0053476 k( 138) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0053476 k( 139) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0053476 k( 140) = ( 0.5000000 0.0151934 0.5908857), wk = 0.0053476 k( 141) = ( 0.5000000 0.0303869 0.5693989), wk = 0.0053476 k( 142) = ( 0.5000000 0.0455803 0.5479122), wk = 0.0053476 k( 143) = ( 0.5000000 0.0607737 0.5264254), wk = 0.0053476 k( 144) = ( 0.5000000 0.0759671 0.5049387), wk = 0.0053476 k( 145) = ( 0.5000000 0.0911606 0.4834519), wk = 0.0053476 k( 146) = ( 0.5000000 0.1063540 0.4619652), wk = 0.0053476 k( 147) = ( 0.5000000 0.1215474 0.4404784), wk = 0.0053476 k( 148) = ( 0.5000000 0.1367409 0.4189917), wk = 0.0053476 k( 149) = ( 0.5000000 0.1519343 0.3975049), wk = 0.0053476 k( 150) = ( 0.5000000 0.1671277 0.3760182), wk = 0.0053476 k( 151) = ( 0.5000000 0.1823211 0.3545314), wk = 0.0053476 k( 152) = ( 0.5000000 0.1975146 0.3330447), wk = 0.0053476 k( 153) = ( 0.5000000 0.2127080 0.3115579), wk = 0.0053476 k( 154) = ( 0.5000000 0.2279014 0.2900712), wk = 0.0053476 k( 155) = ( 0.5000000 0.2430949 0.2685844), wk = 0.0053476 k( 156) = ( 0.5000000 0.2582883 0.2470977), wk = 0.0053476 k( 157) = ( 0.5000000 0.2734817 0.2256109), wk = 0.0053476 k( 158) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0053476 k( 159) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0053476 k( 160) = ( 0.4926471 0.2844299 0.2281387), wk = 0.0053476 k( 161) = ( 0.4852941 0.2801847 0.2521533), wk = 0.0053476 k( 162) = ( 0.4779412 0.2759395 0.2761680), wk = 0.0053476 k( 163) = ( 0.4705882 0.2716942 0.3001826), wk = 0.0053476 k( 164) = ( 0.4632353 0.2674490 0.3241972), wk = 0.0053476 k( 165) = ( 0.4558823 0.2632038 0.3482118), wk = 0.0053476 k( 166) = ( 0.4485294 0.2589586 0.3722264), wk = 0.0053476 k( 167) = ( 0.4411765 0.2547134 0.3962410), wk = 0.0053476 k( 168) = ( 0.4338235 0.2504681 0.4202556), wk = 0.0053476 k( 169) = ( 0.4264706 0.2462229 0.4442702), wk = 0.0053476 k( 170) = ( 0.4191177 0.2419777 0.4682848), wk = 0.0053476 k( 171) = ( 0.4117647 0.2377325 0.4922994), wk = 0.0053476 k( 172) = ( 0.4044118 0.2334872 0.5163140), wk = 0.0053476 k( 173) = ( 0.3970588 0.2292420 0.5403286), wk = 0.0053476 k( 174) = ( 0.3897059 0.2249968 0.5643432), wk = 0.0053476 k( 175) = ( 0.3823529 0.2207516 0.5883578), wk = 0.0053476 k( 176) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0053476 k( 177) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0053476 k( 178) = ( 0.6125000 -0.0938194 0.4082483), wk = 0.0053476 k( 179) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0053476 k( 180) = ( 0.5875000 -0.1371207 0.4082483), wk = 0.0053476 k( 181) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0053476 k( 182) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0053476 k( 183) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0053476 k( 184) = ( 0.5375000 -0.2237232 0.4082483), wk = 0.0053476 k( 185) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0053476 k( 186) = ( 0.5125000 -0.2670245 0.4082483), wk = 0.0053476 k( 187) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0053476 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053476 k( 2) = ( 0.0185185 0.0000000 0.0185185), wk = 0.0053476 k( 3) = ( 0.0370370 0.0000000 0.0370370), wk = 0.0053476 k( 4) = ( 0.0555556 -0.0000000 0.0555556), wk = 0.0053476 k( 5) = ( 0.0740741 0.0000000 0.0740741), wk = 0.0053476 k( 6) = ( 0.0925926 -0.0000000 0.0925926), wk = 0.0053476 k( 7) = ( 0.1111111 -0.0000000 0.1111111), wk = 0.0053476 k( 8) = ( 0.1296296 0.0000000 0.1296296), wk = 0.0053476 k( 9) = ( 0.1481482 0.0000000 0.1481482), wk = 0.0053476 k( 10) = ( 0.1666667 0.0000000 0.1666667), wk = 0.0053476 k( 11) = ( 0.1851852 -0.0000000 0.1851852), wk = 0.0053476 k( 12) = ( 0.2037037 0.0000000 0.2037037), wk = 0.0053476 k( 13) = ( 0.2222222 -0.0000000 0.2222222), wk = 0.0053476 k( 14) = ( 0.2407407 0.0000000 0.2407407), wk = 0.0053476 k( 15) = ( 0.2592593 0.0000000 0.2592593), wk = 0.0053476 k( 16) = ( 0.2777778 0.0000000 0.2777778), wk = 0.0053476 k( 17) = ( 0.2962963 0.0000000 0.2962963), wk = 0.0053476 k( 18) = ( 0.3148148 0.0000000 0.3148148), wk = 0.0053476 k( 19) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0053476 k( 20) = ( 0.3518519 0.0000000 0.3518519), wk = 0.0053476 k( 21) = ( 0.3703704 0.0000000 0.3703704), wk = 0.0053476 k( 22) = ( 0.3888889 0.0000000 0.3888889), wk = 0.0053476 k( 23) = ( 0.4074074 -0.0000000 0.4074074), wk = 0.0053476 k( 24) = ( 0.4259259 -0.0000000 0.4259259), wk = 0.0053476 k( 25) = ( 0.4444444 -0.0000000 0.4444444), wk = 0.0053476 k( 26) = ( 0.4629630 0.0000000 0.4629630), wk = 0.0053476 k( 27) = ( 0.4814815 0.0000000 0.4814815), wk = 0.0053476 k( 28) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0053476 k( 29) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0053476 k( 30) = ( 0.5000000 0.0178571 0.5178571), wk = 0.0053476 k( 31) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0053476 k( 32) = ( 0.5000000 0.0535714 0.5535714), wk = 0.0053476 k( 33) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0053476 k( 34) = ( 0.5000000 0.0892857 0.5892857), wk = 0.0053476 k( 35) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0053476 k( 36) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0053476 k( 37) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0053476 k( 38) = ( 0.5000000 0.1607143 0.6607143), wk = 0.0053476 k( 39) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0053476 k( 40) = ( 0.5000000 0.1964286 0.6964286), wk = 0.0053476 k( 41) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0053476 k( 42) = ( 0.5000000 0.2321429 0.7321429), wk = 0.0053476 k( 43) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0053476 k( 44) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0053476 k( 45) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0053476 k( 46) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0053476 k( 47) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0053476 k( 48) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0053476 k( 49) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0053476 k( 50) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0053476 k( 51) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0053476 k( 52) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0053476 k( 53) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0053476 k( 54) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0053476 k( 55) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0053476 k( 56) = ( 0.3620690 0.3620690 0.7241379), wk = 0.0053476 k( 57) = ( 0.3491379 0.3491379 0.6982759), wk = 0.0053476 k( 58) = ( 0.3362069 0.3362069 0.6724138), wk = 0.0053476 k( 59) = ( 0.3232759 0.3232759 0.6465517), wk = 0.0053476 k( 60) = ( 0.3103448 0.3103448 0.6206897), wk = 0.0053476 k( 61) = ( 0.2974138 0.2974138 0.5948276), wk = 0.0053476 k( 62) = ( 0.2844828 0.2844828 0.5689655), wk = 0.0053476 k( 63) = ( 0.2715517 0.2715517 0.5431035), wk = 0.0053476 k( 64) = ( 0.2586207 0.2586207 0.5172414), wk = 0.0053476 k( 65) = ( 0.2456897 0.2456897 0.4913793), wk = 0.0053476 k( 66) = ( 0.2327586 0.2327586 0.4655172), wk = 0.0053476 k( 67) = ( 0.2198276 0.2198276 0.4396552), wk = 0.0053476 k( 68) = ( 0.2068966 0.2068966 0.4137931), wk = 0.0053476 k( 69) = ( 0.1939655 0.1939655 0.3879310), wk = 0.0053476 k( 70) = ( 0.1810345 0.1810345 0.3620690), wk = 0.0053476 k( 71) = ( 0.1681034 0.1681034 0.3362069), wk = 0.0053476 k( 72) = ( 0.1551724 0.1551724 0.3103448), wk = 0.0053476 k( 73) = ( 0.1422414 0.1422414 0.2844828), wk = 0.0053476 k( 74) = ( 0.1293103 0.1293103 0.2586207), wk = 0.0053476 k( 75) = ( 0.1163793 0.1163793 0.2327586), wk = 0.0053476 k( 76) = ( 0.1034483 0.1034483 0.2068966), wk = 0.0053476 k( 77) = ( 0.0905172 0.0905172 0.1810345), wk = 0.0053476 k( 78) = ( 0.0775862 0.0775862 0.1551724), wk = 0.0053476 k( 79) = ( 0.0646552 0.0646552 0.1293103), wk = 0.0053476 k( 80) = ( 0.0517241 0.0517241 0.1034483), wk = 0.0053476 k( 81) = ( 0.0387931 0.0387931 0.0775862), wk = 0.0053476 k( 82) = ( 0.0258621 0.0258621 0.0517241), wk = 0.0053476 k( 83) = ( 0.0129310 0.0129310 0.0258621), wk = 0.0053476 k( 84) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053476 k( 85) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053476 k( 86) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0053476 k( 87) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0053476 k( 88) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0053476 k( 89) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0053476 k( 90) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0053476 k( 91) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0053476 k( 92) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0053476 k( 93) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0053476 k( 94) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0053476 k( 95) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0053476 k( 96) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0053476 k( 97) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0053476 k( 98) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0053476 k( 99) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0053476 k( 100) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0053476 k( 101) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0053476 k( 102) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0053476 k( 103) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0053476 k( 104) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0053476 k( 105) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0053476 k( 106) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0053476 k( 107) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0053476 k( 108) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0053476 k( 109) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053476 k( 110) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053476 k( 111) = ( 0.5073529 0.4852941 0.5073529), wk = 0.0053476 k( 112) = ( 0.5147059 0.4705882 0.5147059), wk = 0.0053476 k( 113) = ( 0.5220588 0.4558824 0.5220588), wk = 0.0053476 k( 114) = ( 0.5294118 0.4411765 0.5294118), wk = 0.0053476 k( 115) = ( 0.5367647 0.4264706 0.5367647), wk = 0.0053476 k( 116) = ( 0.5441177 0.4117647 0.5441177), wk = 0.0053476 k( 117) = ( 0.5514706 0.3970588 0.5514706), wk = 0.0053476 k( 118) = ( 0.5588235 0.3823529 0.5588235), wk = 0.0053476 k( 119) = ( 0.5661765 0.3676471 0.5661765), wk = 0.0053476 k( 120) = ( 0.5735294 0.3529412 0.5735294), wk = 0.0053476 k( 121) = ( 0.5808823 0.3382353 0.5808823), wk = 0.0053476 k( 122) = ( 0.5882353 0.3235294 0.5882353), wk = 0.0053476 k( 123) = ( 0.5955882 0.3088235 0.5955882), wk = 0.0053476 k( 124) = ( 0.6029412 0.2941177 0.6029412), wk = 0.0053476 k( 125) = ( 0.6102941 0.2794118 0.6102941), wk = 0.0053476 k( 126) = ( 0.6176471 0.2647059 0.6176471), wk = 0.0053476 k( 127) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0053476 k( 128) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0053476 k( 129) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0053476 k( 130) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0053476 k( 131) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0053476 k( 132) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0053476 k( 133) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0053476 k( 134) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0053476 k( 135) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0053476 k( 136) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0053476 k( 137) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0053476 k( 138) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0053476 k( 139) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0053476 k( 140) = ( 0.5000000 0.2631579 0.7368421), wk = 0.0053476 k( 141) = ( 0.5000000 0.2763158 0.7236842), wk = 0.0053476 k( 142) = ( 0.5000000 0.2894737 0.7105263), wk = 0.0053476 k( 143) = ( 0.5000000 0.3026316 0.6973684), wk = 0.0053476 k( 144) = ( 0.5000000 0.3157895 0.6842105), wk = 0.0053476 k( 145) = ( 0.5000000 0.3289474 0.6710526), wk = 0.0053476 k( 146) = ( 0.5000000 0.3421053 0.6578947), wk = 0.0053476 k( 147) = ( 0.5000000 0.3552632 0.6447368), wk = 0.0053476 k( 148) = ( 0.5000000 0.3684211 0.6315789), wk = 0.0053476 k( 149) = ( 0.5000000 0.3815789 0.6184211), wk = 0.0053476 k( 150) = ( 0.5000000 0.3947368 0.6052632), wk = 0.0053476 k( 151) = ( 0.5000000 0.4078947 0.5921053), wk = 0.0053476 k( 152) = ( 0.5000000 0.4210526 0.5789474), wk = 0.0053476 k( 153) = ( 0.5000000 0.4342105 0.5657895), wk = 0.0053476 k( 154) = ( 0.5000000 0.4473684 0.5526316), wk = 0.0053476 k( 155) = ( 0.5000000 0.4605263 0.5394737), wk = 0.0053476 k( 156) = ( 0.5000000 0.4736842 0.5263158), wk = 0.0053476 k( 157) = ( 0.5000000 0.4868421 0.5131579), wk = 0.0053476 k( 158) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053476 k( 159) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053476 k( 160) = ( 0.4926471 0.4926471 0.5147059), wk = 0.0053476 k( 161) = ( 0.4852941 0.4852941 0.5294118), wk = 0.0053476 k( 162) = ( 0.4779412 0.4779412 0.5441177), wk = 0.0053476 k( 163) = ( 0.4705882 0.4705882 0.5588235), wk = 0.0053476 k( 164) = ( 0.4632353 0.4632353 0.5735294), wk = 0.0053476 k( 165) = ( 0.4558823 0.4558824 0.5882353), wk = 0.0053476 k( 166) = ( 0.4485294 0.4485294 0.6029412), wk = 0.0053476 k( 167) = ( 0.4411765 0.4411765 0.6176471), wk = 0.0053476 k( 168) = ( 0.4338235 0.4338235 0.6323529), wk = 0.0053476 k( 169) = ( 0.4264706 0.4264706 0.6470588), wk = 0.0053476 k( 170) = ( 0.4191177 0.4191177 0.6617647), wk = 0.0053476 k( 171) = ( 0.4117647 0.4117647 0.6764706), wk = 0.0053476 k( 172) = ( 0.4044118 0.4044118 0.6911765), wk = 0.0053476 k( 173) = ( 0.3970588 0.3970588 0.7058823), wk = 0.0053476 k( 174) = ( 0.3897059 0.3897059 0.7205882), wk = 0.0053476 k( 175) = ( 0.3823529 0.3823529 0.7352941), wk = 0.0053476 k( 176) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0053476 k( 177) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0053476 k( 178) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0053476 k( 179) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0053476 k( 180) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0053476 k( 181) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0053476 k( 182) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0053476 k( 183) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0053476 k( 184) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0053476 k( 185) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0053476 k( 186) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0053476 k( 187) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0053476 Dense grid: 261403 G-vectors FFT dimensions: ( 90, 90, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.12 Mb ( 918, 80) NL pseudopotentials 2.54 Mb ( 459, 362) Each V/rho on FFT grid 0.25 Mb ( 16200) Each G-vector array 0.03 Mb ( 3632) G-vector shells 0.01 Mb ( 1055) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 4.48 Mb ( 918, 320) Each subspace H/S matrix 0.04 Mb ( 53, 53) Each matrix 0.88 Mb ( 362, 2, 80) The potential is recalculated from file : ./Cs2TeI6.save/charge-density.dat Starting wfc are 76 randomized atomic wfcs + 4 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.9 secs Computing kpt #: 2 total cpu time spent up to now is 11.7 secs Computing kpt #: 3 total cpu time spent up to now is 16.5 secs Computing kpt #: 4 total cpu time spent up to now is 21.2 secs Computing kpt #: 5 total cpu time spent up to now is 25.1 secs Computing kpt #: 6 total cpu time spent up to now is 29.1 secs Computing kpt #: 7 total cpu time spent up to now is 32.9 secs Computing kpt #: 8 total cpu time spent up to now is 36.8 secs Computing kpt #: 9 total cpu time spent up to now is 40.6 secs Computing kpt #: 10 total cpu time spent up to now is 44.5 secs Computing kpt #: 11 total cpu time spent up to now is 48.3 secs Computing kpt #: 12 total cpu time spent up to now is 52.2 secs Computing kpt #: 13 total cpu time spent up to now is 56.3 secs Computing kpt #: 14 total cpu time spent up to now is 60.2 secs Computing kpt #: 15 total cpu time spent up to now is 64.1 secs Computing kpt #: 16 total cpu time spent up to now is 68.0 secs Computing kpt #: 17 total cpu time spent up to now is 72.0 secs Computing kpt #: 18 total cpu time spent up to now is 76.0 secs Computing kpt #: 19 total cpu time spent up to now is 80.1 secs Computing kpt #: 20 total cpu time spent up to now is 84.2 secs Computing kpt #: 21 total cpu time spent up to now is 88.4 secs Computing kpt #: 22 total cpu time spent up to now is 92.5 secs Computing kpt #: 23 total cpu time spent up to now is 96.8 secs Computing kpt #: 24 total cpu time spent up to now is 104.1 secs Computing kpt #: 25 total cpu time spent up to now is 108.4 secs Computing kpt #: 26 total cpu time spent up to now is 112.8 secs Computing kpt #: 27 total cpu time spent up to now is 117.0 secs Computing kpt #: 28 total cpu time spent up to now is 122.1 secs Computing kpt #: 29 total cpu time spent up to now is 127.2 secs Computing kpt #: 30 total cpu time spent up to now is 132.6 secs Computing kpt #: 31 total cpu time spent up to now is 139.0 secs Computing kpt #: 32 total cpu time spent up to now is 145.1 secs Computing kpt #: 33 total cpu time spent up to now is 150.2 secs Computing kpt #: 34 total cpu time spent up to now is 157.3 secs Computing kpt #: 35 total cpu time spent up to now is 164.4 secs Computing kpt #: 36 total cpu time spent up to now is 172.5 secs Computing kpt #: 37 total cpu time spent up to now is 178.2 secs Computing kpt #: 38 total cpu time spent up to now is 183.8 secs Computing kpt #: 39 total cpu time spent up to now is 189.3 secs Computing kpt #: 40 total cpu time spent up to now is 195.7 secs Computing kpt #: 41 total cpu time spent up to now is 201.5 secs Computing kpt #: 42 total cpu time spent up to now is 208.1 secs Computing kpt #: 43 total cpu time spent up to now is 214.6 secs Computing kpt #: 44 total cpu time spent up to now is 221.3 secs Computing kpt #: 45 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 230.4 secs Computing kpt #: 46 total cpu time spent up to now is 236.8 secs Computing kpt #: 47 total cpu time spent up to now is 242.5 secs Computing kpt #: 48 total cpu time spent up to now is 247.8 secs Computing kpt #: 49 total cpu time spent up to now is 253.0 secs Computing kpt #: 50 total cpu time spent up to now is 257.6 secs Computing kpt #: 51 total cpu time spent up to now is 262.1 secs Computing kpt #: 52 total cpu time spent up to now is 266.6 secs Computing kpt #: 53 total cpu time spent up to now is 271.1 secs Computing kpt #: 54 total cpu time spent up to now is 275.6 secs Computing kpt #: 55 total cpu time spent up to now is 280.1 secs Computing kpt #: 56 total cpu time spent up to now is 284.6 secs Computing kpt #: 57 total cpu time spent up to now is 289.4 secs Computing kpt #: 58 total cpu time spent up to now is 294.5 secs Computing kpt #: 59 total cpu time spent up to now is 302.5 secs Computing kpt #: 60 total cpu time spent up to now is 310.5 secs Computing kpt #: 61 total cpu time spent up to now is 315.9 secs Computing kpt #: 62 total cpu time spent up to now is 320.9 secs Computing kpt #: 63 total cpu time spent up to now is 325.1 secs Computing kpt #: 64 total cpu time spent up to now is 329.2 secs Computing kpt #: 65 total cpu time spent up to now is 333.3 secs Computing kpt #: 66 total cpu time spent up to now is 337.3 secs Computing kpt #: 67 total cpu time spent up to now is 341.2 secs Computing kpt #: 68 total cpu time spent up to now is 345.5 secs Computing kpt #: 69 total cpu time spent up to now is 349.4 secs Computing kpt #: 70 total cpu time spent up to now is 353.4 secs Computing kpt #: 71 total cpu time spent up to now is 357.5 secs Computing kpt #: 72 total cpu time spent up to now is 361.3 secs Computing kpt #: 73 total cpu time spent up to now is 365.2 secs Computing kpt #: 74 total cpu time spent up to now is 369.1 secs Computing kpt #: 75 total cpu time spent up to now is 373.1 secs Computing kpt #: 76 total cpu time spent up to now is 377.0 secs Computing kpt #: 77 total cpu time spent up to now is 381.8 secs Computing kpt #: 78 total cpu time spent up to now is 386.7 secs Computing kpt #: 79 total cpu time spent up to now is 391.4 secs Computing kpt #: 80 total cpu time spent up to now is 396.2 secs Computing kpt #: 81 total cpu time spent up to now is 401.0 secs Computing kpt #: 82 total cpu time spent up to now is 405.8 secs Computing kpt #: 83 total cpu time spent up to now is 410.7 secs Computing kpt #: 84 total cpu time spent up to now is 414.8 secs Computing kpt #: 85 total cpu time spent up to now is 418.8 secs Computing kpt #: 86 total cpu time spent up to now is 423.7 secs Computing kpt #: 87 total cpu time spent up to now is 428.6 secs Computing kpt #: 88 total cpu time spent up to now is 433.4 secs Computing kpt #: 89 total cpu time spent up to now is 438.2 secs Computing kpt #: 90 total cpu time spent up to now is 443.0 secs Computing kpt #: 91 total cpu time spent up to now is 447.0 secs Computing kpt #: 92 total cpu time spent up to now is 450.9 secs Computing kpt #: 93 total cpu time spent up to now is 454.8 secs Computing kpt #: 94 total cpu time spent up to now is 458.7 secs Computing kpt #: 95 total cpu time spent up to now is 462.5 secs Computing kpt #: 96 total cpu time spent up to now is 466.5 secs Computing kpt #: 97 total cpu time spent up to now is 470.2 secs Computing kpt #: 98 total cpu time spent up to now is 474.2 secs Computing kpt #: 99 total cpu time spent up to now is 478.0 secs Computing kpt #: 100 total cpu time spent up to now is 481.8 secs Computing kpt #: 101 total cpu time spent up to now is 485.8 secs Computing kpt #: 102 total cpu time spent up to now is 489.7 secs Computing kpt #: 103 total cpu time spent up to now is 493.8 secs Computing kpt #: 104 total cpu time spent up to now is 497.7 secs Computing kpt #: 105 total cpu time spent up to now is 501.6 secs Computing kpt #: 106 total cpu time spent up to now is 505.4 secs Computing kpt #: 107 total cpu time spent up to now is 509.5 secs Computing kpt #: 108 total cpu time spent up to now is 513.6 secs Computing kpt #: 109 total cpu time spent up to now is 517.5 secs Computing kpt #: 110 total cpu time spent up to now is 521.4 secs Computing kpt #: 111 total cpu time spent up to now is 525.1 secs Computing kpt #: 112 total cpu time spent up to now is 529.1 secs Computing kpt #: 113 total cpu time spent up to now is 532.9 secs Computing kpt #: 114 total cpu time spent up to now is 536.8 secs Computing kpt #: 115 total cpu time spent up to now is 540.7 secs Computing kpt #: 116 total cpu time spent up to now is 544.6 secs Computing kpt #: 117 total cpu time spent up to now is 548.6 secs Computing kpt #: 118 total cpu time spent up to now is 552.6 secs Computing kpt #: 119 total cpu time spent up to now is 556.8 secs Computing kpt #: 120 total cpu time spent up to now is 561.0 secs Computing kpt #: 121 total cpu time spent up to now is 565.2 secs Computing kpt #: 122 total cpu time spent up to now is 570.2 secs Computing kpt #: 123 total cpu time spent up to now is 574.7 secs Computing kpt #: 124 total cpu time spent up to now is 579.0 secs Computing kpt #: 125 total cpu time spent up to now is 583.4 secs Computing kpt #: 126 total cpu time spent up to now is 588.2 secs Computing kpt #: 127 total cpu time spent up to now is 592.7 secs Computing kpt #: 128 total cpu time spent up to now is 597.2 secs Computing kpt #: 129 total cpu time spent up to now is 601.7 secs Computing kpt #: 130 total cpu time spent up to now is 606.2 secs Computing kpt #: 131 total cpu time spent up to now is 610.8 secs Computing kpt #: 132 total cpu time spent up to now is 615.3 secs Computing kpt #: 133 total cpu time spent up to now is 620.6 secs Computing kpt #: 134 total cpu time spent up to now is 625.9 secs Computing kpt #: 135 total cpu time spent up to now is 631.6 secs Computing kpt #: 136 total cpu time spent up to now is 638.0 secs Computing kpt #: 137 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 646.9 secs Computing kpt #: 138 total cpu time spent up to now is 653.3 secs Computing kpt #: 139 total cpu time spent up to now is 659.4 secs Computing kpt #: 140 total cpu time spent up to now is 666.0 secs Computing kpt #: 141 total cpu time spent up to now is 671.6 secs Computing kpt #: 142 total cpu time spent up to now is 677.1 secs Computing kpt #: 143 total cpu time spent up to now is 682.4 secs Computing kpt #: 144 total cpu time spent up to now is 687.2 secs Computing kpt #: 145 total cpu time spent up to now is 691.5 secs Computing kpt #: 146 total cpu time spent up to now is 695.9 secs Computing kpt #: 147 total cpu time spent up to now is 700.3 secs Computing kpt #: 148 total cpu time spent up to now is 704.8 secs Computing kpt #: 149 total cpu time spent up to now is 709.0 secs Computing kpt #: 150 total cpu time spent up to now is 713.4 secs Computing kpt #: 151 total cpu time spent up to now is 718.2 secs Computing kpt #: 152 total cpu time spent up to now is 722.2 secs Computing kpt #: 153 total cpu time spent up to now is 726.1 secs Computing kpt #: 154 total cpu time spent up to now is 730.1 secs Computing kpt #: 155 total cpu time spent up to now is 734.0 secs Computing kpt #: 156 total cpu time spent up to now is 737.8 secs Computing kpt #: 157 total cpu time spent up to now is 741.6 secs Computing kpt #: 158 total cpu time spent up to now is 745.5 secs Computing kpt #: 159 total cpu time spent up to now is 749.4 secs Computing kpt #: 160 total cpu time spent up to now is 753.3 secs Computing kpt #: 161 total cpu time spent up to now is 757.2 secs Computing kpt #: 162 total cpu time spent up to now is 761.1 secs Computing kpt #: 163 total cpu time spent up to now is 765.0 secs Computing kpt #: 164 total cpu time spent up to now is 768.8 secs Computing kpt #: 165 total cpu time spent up to now is 772.7 secs Computing kpt #: 166 total cpu time spent up to now is 776.8 secs Computing kpt #: 167 total cpu time spent up to now is 781.0 secs Computing kpt #: 168 total cpu time spent up to now is 785.2 secs Computing kpt #: 169 total cpu time spent up to now is 789.3 secs Computing kpt #: 170 total cpu time spent up to now is 793.5 secs Computing kpt #: 171 total cpu time spent up to now is 797.9 secs Computing kpt #: 172 total cpu time spent up to now is 802.2 secs Computing kpt #: 173 total cpu time spent up to now is 806.6 secs Computing kpt #: 174 total cpu time spent up to now is 811.0 secs Computing kpt #: 175 total cpu time spent up to now is 815.5 secs Computing kpt #: 176 total cpu time spent up to now is 819.9 secs Computing kpt #: 177 total cpu time spent up to now is 824.3 secs Computing kpt #: 178 total cpu time spent up to now is 828.8 secs Computing kpt #: 179 total cpu time spent up to now is 834.1 secs Computing kpt #: 180 total cpu time spent up to now is 839.4 secs Computing kpt #: 181 total cpu time spent up to now is 844.5 secs Computing kpt #: 182 total cpu time spent up to now is 849.8 secs Computing kpt #: 183 total cpu time spent up to now is 854.9 secs Computing kpt #: 184 total cpu time spent up to now is 859.5 secs Computing kpt #: 185 total cpu time spent up to now is 865.0 secs Computing kpt #: 186 total cpu time spent up to now is 870.1 secs Computing kpt #: 187 total cpu time spent up to now is 875.5 secs ethr = 1.52E-08, avg # of iterations = 38.3 total cpu time spent up to now is 875.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 32647 PWs) bands (ev): -15.9596 -15.9596 -15.9540 -15.9540 -9.8738 -9.8738 -8.2552 -8.2552 -8.2377 -8.2377 -8.2377 -8.2377 -7.9112 -7.9112 -7.9112 -7.9112 -6.7909 -6.7909 -4.7733 -4.7733 -4.7358 -4.7358 -3.3796 -3.3796 -3.3796 -3.3796 -3.3108 -3.3108 -3.3108 -3.3108 -1.0284 -1.0284 -0.8748 -0.8748 -0.8748 -0.8748 0.9529 0.9529 0.9529 0.9529 1.3797 1.3797 1.5544 1.5544 1.8961 1.8961 2.1493 2.1493 2.1493 2.1493 2.3959 2.3959 2.3959 2.3959 2.6704 2.6704 2.8796 2.8796 2.8796 2.8796 2.9124 2.9124 3.4180 3.4180 3.4180 3.4180 4.9090 4.9090 5.4200 5.4200 5.4200 5.4200 7.4016 7.4016 7.6771 7.6771 7.6771 7.6771 8.0385 8.0385 k = 0.0185-0.0107 0.0151 ( 32671 PWs) bands (ev): -15.9596 -15.9596 -15.9540 -15.9540 -9.8736 -9.8736 -8.2554 -8.2554 -8.2379 -8.2379 -8.2378 -8.2378 -7.9119 -7.9119 -7.9111 -7.9111 -6.7900 -6.7900 -4.7732 -4.7732 -4.7356 -4.7356 -3.3794 -3.3794 -3.3793 -3.3793 -3.3106 -3.3106 -3.3105 -3.3105 -1.0282 -1.0282 -0.8747 -0.8747 -0.8745 -0.8745 0.9523 0.9523 0.9534 0.9534 1.3801 1.3801 1.5551 1.5551 1.8955 1.8955 2.1476 2.1476 2.1487 2.1487 2.3913 2.3913 2.3958 2.3958 2.6693 2.6693 2.8784 2.8784 2.8784 2.8784 2.9132 2.9132 3.4153 3.4153 3.4165 3.4165 4.9112 4.9112 5.4214 5.4214 5.4215 5.4215 7.4063 7.4063 7.6797 7.6797 7.6811 7.6811 8.0408 8.0408 k = 0.0370-0.0214 0.0302 ( 32663 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8731 -9.8731 -8.2558 -8.2558 -8.2386 -8.2386 -8.2380 -8.2380 -7.9140 -7.9140 -7.9111 -7.9111 -6.7872 -6.7872 -4.7726 -4.7726 -4.7353 -4.7353 -3.3785 -3.3785 -3.3782 -3.3782 -3.3103 -3.3103 -3.3098 -3.3098 -1.0279 -1.0279 -0.8744 -0.8744 -0.8736 -0.8736 0.9506 0.9506 0.9551 0.9551 1.3814 1.3814 1.5572 1.5572 1.8939 1.8939 2.1423 2.1423 2.1466 2.1466 2.3781 2.3781 2.3952 2.3952 2.6662 2.6662 2.8745 2.8745 2.8750 2.8750 2.9158 2.9158 3.4071 3.4071 3.4120 3.4120 4.9176 4.9176 5.4253 5.4253 5.4257 5.4257 7.4204 7.4204 7.6875 7.6875 7.6929 7.6929 8.0469 8.0469 k = 0.0556-0.0321 0.0454 ( 32695 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8722 -9.8722 -8.2566 -8.2566 -8.2398 -8.2398 -8.2383 -8.2383 -7.9175 -7.9175 -7.9110 -7.9110 -6.7827 -6.7827 -4.7716 -4.7716 -4.7348 -4.7348 -3.3771 -3.3771 -3.3763 -3.3763 -3.3097 -3.3097 -3.3086 -3.3086 -1.0272 -1.0272 -0.8739 -0.8739 -0.8720 -0.8720 0.9477 0.9477 0.9578 0.9578 1.3837 1.3837 1.5605 1.5605 1.8914 1.8914 2.1331 2.1331 2.1433 2.1433 2.3579 2.3579 2.3944 2.3944 2.6611 2.6611 2.8670 2.8670 2.8694 2.8694 2.9205 2.9205 3.3936 3.3936 3.4047 3.4047 4.9279 4.9279 5.4318 5.4318 5.4327 5.4327 7.4437 7.4437 7.7004 7.7004 7.7124 7.7124 8.0557 8.0557 k = 0.0741-0.0428 0.0605 ( 32703 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8709 -9.8709 -8.2577 -8.2577 -8.2412 -8.2412 -8.2388 -8.2388 -7.9224 -7.9224 -7.9108 -7.9108 -6.7765 -6.7765 -4.7703 -4.7703 -4.7340 -4.7340 -3.3751 -3.3751 -3.3738 -3.3738 -3.3088 -3.3088 -3.3070 -3.3070 -1.0263 -1.0263 -0.8733 -0.8733 -0.8698 -0.8698 0.9437 0.9437 0.9615 0.9615 1.3871 1.3871 1.5645 1.5645 1.8880 1.8880 2.1191 2.1191 2.1388 2.1388 2.3328 2.3328 2.3932 2.3932 2.6540 2.6540 2.8556 2.8556 2.8617 2.8617 2.9266 2.9266 3.3749 3.3749 3.3951 3.3951 4.9417 4.9417 5.4405 5.4405 5.4423 5.4423 7.4759 7.4759 7.7185 7.7185 7.7395 7.7395 8.0663 8.0663 k = 0.0926-0.0535 0.0756 ( 32703 PWs) bands (ev): -15.9594 -15.9594 -15.9542 -15.9542 -9.8693 -9.8693 -8.2592 -8.2592 -8.2429 -8.2429 -8.2394 -8.2394 -7.9285 -7.9285 -7.9106 -7.9106 -6.7687 -6.7687 -4.7686 -4.7686 -4.7331 -4.7331 -3.3727 -3.3727 -3.3706 -3.3706 -3.3078 -3.3078 -3.3049 -3.3049 -1.0251 -1.0251 -0.8725 -0.8725 -0.8669 -0.8669 0.9383 0.9383 0.9661 0.9661 1.3917 1.3917 1.5689 1.5689 1.8838 1.8838 2.0994 2.0994 2.1330 2.1330 2.3059 2.3059 2.3917 2.3917 2.6451 2.6451 2.8405 2.8405 2.8520 2.8520 2.9333 2.9333 3.3515 3.3515 3.3835 3.3835 4.9584 4.9584 5.4514 5.4514 5.4545 5.4545 7.5168 7.5168 7.7416 7.7416 7.7741 7.7741 8.0788 8.0788 k = 0.1111-0.0642 0.0907 ( 32695 PWs) bands (ev): -15.9593 -15.9593 -15.9542 -15.9542 -9.8674 -9.8674 -8.2610 -8.2610 -8.2447 -8.2447 -8.2401 -8.2401 -7.9360 -7.9360 -7.9104 -7.9104 -6.7595 -6.7595 -4.7666 -4.7666 -4.7319 -4.7319 -3.3697 -3.3697 -3.3667 -3.3667 -3.3065 -3.3065 -3.3024 -3.3024 -1.0236 -1.0236 -0.8715 -0.8715 -0.8632 -0.8632 0.9316 0.9316 0.9715 0.9715 1.3977 1.3977 1.5729 1.5729 1.8789 1.8789 2.0728 2.0728 2.1262 2.1262 2.2800 2.2800 2.3899 2.3899 2.6344 2.6344 2.8219 2.8219 2.8406 2.8406 2.9402 2.9402 3.3237 3.3237 3.3707 3.3707 4.9773 4.9773 5.4640 5.4640 5.4689 5.4689 7.5658 7.5658 7.7697 7.7697 7.8157 7.8157 8.0935 8.0935 k = 0.1296-0.0748 0.1058 ( 32707 PWs) bands (ev): -15.9592 -15.9592 -15.9543 -15.9543 -9.8652 -9.8652 -8.2633 -8.2633 -8.2464 -8.2464 -8.2409 -8.2409 -7.9446 -7.9446 -7.9101 -7.9101 -6.7489 -6.7489 -4.7643 -4.7643 -4.7306 -4.7306 -3.3664 -3.3664 -3.3622 -3.3622 -3.3050 -3.3050 -3.2996 -3.2996 -1.0219 -1.0219 -0.8704 -0.8704 -0.8587 -0.8587 0.9235 0.9235 0.9775 0.9775 1.4053 1.4053 1.5759 1.5759 1.8735 1.8735 2.0389 2.0389 2.1184 2.1184 2.2572 2.2572 2.3879 2.3879 2.6221 2.6221 2.7999 2.7999 2.8276 2.8276 2.9468 2.9468 3.2918 3.2918 3.3571 3.3571 4.9979 4.9979 5.4780 5.4780 5.4852 5.4852 7.6224 7.6224 7.8027 7.8027 7.8642 7.8642 8.1104 8.1104 k = 0.1481-0.0855 0.1210 ( 32687 PWs) bands (ev): -15.9591 -15.9591 -15.9543 -15.9543 -9.8628 -9.8628 -8.2659 -8.2659 -8.2482 -8.2482 -8.2418 -8.2418 -7.9543 -7.9543 -7.9098 -7.9098 -6.7372 -6.7372 -4.7618 -4.7618 -4.7292 -4.7292 -3.3626 -3.3626 -3.3573 -3.3573 -3.3034 -3.3034 -3.2964 -3.2964 -1.0198 -1.0198 -0.8691 -0.8691 -0.8533 -0.8533 0.9141 0.9141 0.9839 0.9839 1.4147 1.4147 1.5775 1.5775 1.8676 1.8676 1.9982 1.9982 2.1098 2.1098 2.2386 2.2386 2.3856 2.3856 2.6084 2.6084 2.7748 2.7748 2.8133 2.8133 2.9530 2.9530 3.2563 3.2563 3.3433 3.3433 5.0195 5.0195 5.4933 5.4933 5.5032 5.5032 7.6862 7.6862 7.8406 7.8406 7.9190 7.9190 8.1297 8.1297 k = 0.1667-0.0962 0.1361 ( 32675 PWs) bands (ev): -15.9590 -15.9590 -15.9544 -15.9544 -9.8601 -9.8601 -8.2688 -8.2688 -8.2498 -8.2498 -8.2428 -8.2428 -7.9650 -7.9650 -7.9095 -7.9095 -6.7245 -6.7245 -4.7590 -4.7590 -4.7276 -4.7276 -3.3584 -3.3584 -3.3518 -3.3518 -3.3016 -3.3016 -3.2930 -3.2930 -1.0174 -1.0174 -0.8678 -0.8678 -0.8470 -0.8470 0.9034 0.9034 0.9905 0.9905 1.4259 1.4259 1.5771 1.5771 1.8612 1.8612 1.9524 1.9524 2.1005 2.1005 2.2241 2.2241 2.3830 2.3830 2.5935 2.5935 2.7468 2.7468 2.7979 2.7979 2.9588 2.9588 3.2177 3.2177 3.3300 3.3300 5.0414 5.0414 5.5093 5.5093 5.5223 5.5223 7.7565 7.7565 7.8831 7.8831 7.9798 7.9798 8.1515 8.1515 k = 0.1852-0.1069 0.1512 ( 32651 PWs) bands (ev): -15.9589 -15.9589 -15.9545 -15.9545 -9.8572 -9.8572 -8.2717 -8.2717 -8.2513 -8.2513 -8.2439 -8.2439 -7.9767 -7.9767 -7.9091 -7.9091 -6.7110 -6.7110 -4.7560 -4.7560 -4.7259 -4.7259 -3.3540 -3.3540 -3.3459 -3.3459 -3.2997 -3.2997 -3.2894 -3.2894 -1.0147 -1.0147 -0.8663 -0.8663 -0.8399 -0.8399 0.8914 0.8914 0.9967 0.9967 1.4391 1.4391 1.5746 1.5746 1.8540 1.8540 1.9037 1.9037 2.0906 2.0906 2.2129 2.2129 2.3802 2.3802 2.5776 2.5776 2.7164 2.7164 2.7815 2.7815 2.9645 2.9645 3.1765 3.1765 3.3176 3.3176 5.0634 5.0634 5.5258 5.5258 5.5422 5.5422 7.8328 7.8328 7.9303 7.9303 8.0460 8.0460 8.1757 8.1757 k = 0.2037-0.1176 0.1663 ( 32631 PWs) bands (ev): -15.9588 -15.9588 -15.9546 -15.9546 -9.8542 -9.8542 -8.2747 -8.2747 -8.2528 -8.2528 -8.2450 -8.2450 -7.9892 -7.9892 -7.9088 -7.9088 -6.6969 -6.6969 -4.7529 -4.7529 -4.7241 -4.7241 -3.3494 -3.3494 -3.3398 -3.3398 -3.2977 -3.2977 -3.2856 -3.2856 -1.0117 -1.0117 -0.8648 -0.8648 -0.8318 -0.8318 0.8784 0.8784 1.0022 1.0022 1.4542 1.4542 1.5698 1.5698 1.8441 1.8441 1.8558 1.8558 2.0804 2.0804 2.2040 2.2040 2.3772 2.3772 2.5609 2.5609 2.6840 2.6840 2.7645 2.7645 2.9703 2.9703 3.1332 3.1332 3.3066 3.3066 5.0848 5.0848 5.5425 5.5425 5.5623 5.5623 7.9142 7.9142 7.9820 7.9820 8.1171 8.1171 8.2025 8.2025 k = 0.2222-0.1283 0.1814 ( 32607 PWs) bands (ev): -15.9587 -15.9587 -15.9547 -15.9547 -9.8510 -9.8510 -8.2774 -8.2774 -8.2541 -8.2541 -8.2462 -8.2462 -8.0024 -8.0024 -7.9084 -7.9084 -6.6825 -6.6825 -4.7496 -4.7496 -4.7223 -4.7223 -3.3446 -3.3446 -3.3333 -3.3333 -3.2956 -3.2956 -3.2817 -3.2817 -1.0084 -1.0084 -0.8632 -0.8632 -0.8227 -0.8227 0.8644 0.8644 1.0063 1.0063 1.4714 1.4714 1.5631 1.5631 1.8029 1.8029 1.8390 1.8390 2.0698 2.0698 2.1964 2.1964 2.3740 2.3740 2.5435 2.5435 2.6500 2.6500 2.7471 2.7471 2.9765 2.9765 3.0882 3.0882 3.2975 3.2975 5.1055 5.1055 5.5592 5.5592 5.5822 5.5822 7.9997 7.9997 8.0385 8.0385 8.1917 8.1917 8.2325 8.2325 k = 0.2407-0.1390 0.1966 ( 32623 PWs) bands (ev): -15.9585 -15.9585 -15.9548 -15.9548 -9.8478 -9.8478 -8.2799 -8.2799 -8.2554 -8.2554 -8.2473 -8.2473 -8.0162 -8.0162 -7.9080 -7.9080 -6.6678 -6.6678 -4.7463 -4.7463 -4.7204 -4.7204 -3.3396 -3.3396 -3.3267 -3.3267 -3.2935 -3.2935 -3.2778 -3.2778 -1.0049 -1.0049 -0.8616 -0.8616 -0.8128 -0.8128 0.8498 0.8498 1.0083 1.0083 1.4906 1.4906 1.5548 1.5548 1.7561 1.7561 1.8292 1.8292 2.0591 2.0591 2.1893 2.1893 2.3705 2.3705 2.5258 2.5258 2.6152 2.6152 2.7293 2.7293 2.9833 2.9833 3.0422 3.0422 3.2904 3.2904 5.1253 5.1253 5.5755 5.5755 5.6014 5.6014 8.0853 8.0853 8.1028 8.1028 8.2563 8.2563 8.2787 8.2787 k = 0.2593-0.1497 0.2117 ( 32619 PWs) bands (ev): -15.9584 -15.9584 -15.9548 -15.9548 -9.8445 -9.8445 -8.2820 -8.2820 -8.2567 -8.2567 -8.2485 -8.2485 -8.0305 -8.0305 -7.9076 -7.9076 -6.6532 -6.6532 -4.7429 -4.7429 -4.7186 -4.7186 -3.3347 -3.3347 -3.3200 -3.3200 -3.2913 -3.2913 -3.2738 -3.2738 -1.0012 -1.0012 -0.8599 -0.8599 -0.8020 -0.8020 0.8346 0.8346 1.0075 1.0075 1.5117 1.5117 1.5457 1.5457 1.7128 1.7128 1.8188 1.8188 2.0484 2.0484 2.1815 2.1815 2.3669 2.3669 2.5080 2.5080 2.5803 2.5803 2.7114 2.7114 2.9908 2.9908 2.9956 2.9956 3.2857 3.2857 5.1439 5.1439 5.5913 5.5913 5.6196 5.6196 8.1569 8.1569 8.1879 8.1879 8.2936 8.2936 8.3576 8.3576 k = 0.2778-0.1604 0.2268 ( 32648 PWs) bands (ev): -15.9583 -15.9583 -15.9549 -15.9549 -9.8413 -9.8413 -8.2835 -8.2835 -8.2578 -8.2578 -8.2497 -8.2497 -8.0451 -8.0451 -7.9072 -7.9072 -6.6388 -6.6388 -4.7396 -4.7396 -4.7167 -4.7167 -3.3297 -3.3297 -3.3133 -3.3133 -3.2892 -3.2892 -3.2699 -3.2699 -0.9974 -0.9974 -0.8583 -0.8583 -0.7905 -0.7905 0.8193 0.8193 1.0032 1.0032 1.5346 1.5346 1.5362 1.5362 1.6746 1.6746 1.8077 1.8077 2.0379 2.0379 2.1719 2.1719 2.3630 2.3630 2.4901 2.4901 2.5460 2.5460 2.6935 2.6935 2.9493 2.9493 2.9989 2.9989 3.2836 3.2836 5.1612 5.1612 5.6064 5.6064 5.6365 5.6365 8.2249 8.2249 8.2823 8.2823 8.3301 8.3301 8.4419 8.4419 k = 0.2963-0.1711 0.2419 ( 32664 PWs) bands (ev): -15.9582 -15.9582 -15.9550 -15.9550 -9.8381 -9.8381 -8.2845 -8.2845 -8.2589 -8.2589 -8.2508 -8.2508 -8.0599 -8.0599 -7.9068 -7.9068 -6.6247 -6.6247 -4.7363 -4.7363 -4.7149 -4.7149 -3.3249 -3.3249 -3.3068 -3.3068 -3.2871 -3.2871 -3.2661 -3.2661 -0.9935 -0.9935 -0.8567 -0.8567 -0.7784 -0.7784 0.8040 0.8040 0.9947 0.9947 1.5265 1.5265 1.5591 1.5591 1.6431 1.6431 1.7962 1.7962 2.0275 2.0275 2.1595 2.1595 2.3588 2.3588 2.4725 2.4725 2.5133 2.5133 2.6756 2.6756 2.9037 2.9037 3.0074 3.0074 3.2842 3.2842 5.1772 5.1772 5.6207 5.6207 5.6518 5.6518 8.2950 8.2950 8.3684 8.3684 8.3787 8.3787 8.5279 8.5279 k = 0.3148-0.1818 0.2570 ( 32668 PWs) bands (ev): -15.9580 -15.9580 -15.9551 -15.9551 -9.8350 -9.8350 -8.2848 -8.2848 -8.2599 -8.2599 -8.2519 -8.2519 -8.0748 -8.0748 -7.9065 -7.9065 -6.6113 -6.6113 -4.7332 -4.7332 -4.7131 -4.7131 -3.3202 -3.3202 -3.3004 -3.3004 -3.2850 -3.2850 -3.2624 -3.2624 -0.9896 -0.9896 -0.8552 -0.8552 -0.7657 -0.7657 0.7891 0.7891 0.9819 0.9819 1.5162 1.5162 1.5851 1.5851 1.6201 1.6201 1.7843 1.7843 2.0174 2.0174 2.1434 2.1434 2.3543 2.3543 2.4553 2.4553 2.4830 2.4830 2.6577 2.6577 2.8598 2.8598 3.0161 3.0161 3.2874 3.2874 5.1919 5.1919 5.6339 5.6339 5.6654 5.6654 8.3675 8.3675 8.4089 8.4089 8.4754 8.4754 8.6143 8.6143 k = 0.3333-0.1925 0.2722 ( 32628 PWs) bands (ev): -15.9579 -15.9579 -15.9552 -15.9552 -9.8320 -9.8320 -8.2844 -8.2844 -8.2607 -8.2607 -8.2530 -8.2530 -8.0896 -8.0896 -7.9061 -7.9061 -6.5985 -6.5985 -4.7302 -4.7302 -4.7114 -4.7114 -3.3158 -3.3158 -3.2943 -3.2943 -3.2830 -3.2830 -3.2589 -3.2589 -0.9858 -0.9858 -0.8538 -0.8538 -0.7529 -0.7529 0.7746 0.7746 0.9651 0.9651 1.5044 1.5044 1.6072 1.6072 1.6123 1.6123 1.7726 1.7726 2.0077 2.0077 2.1231 2.1231 2.3495 2.3495 2.4385 2.4385 2.4559 2.4559 2.6399 2.6399 2.8183 2.8183 3.0244 3.0244 3.2933 3.2933 5.2051 5.2051 5.6461 5.6461 5.6773 5.6773 8.4418 8.4418 8.4515 8.4515 8.5708 8.5708 8.6999 8.6999 k = 0.3519-0.2031 0.2873 ( 32656 PWs) bands (ev): -15.9578 -15.9578 -15.9552 -15.9552 -9.8293 -9.8293 -8.2833 -8.2833 -8.2614 -8.2614 -8.2540 -8.2540 -8.1042 -8.1042 -7.9058 -7.9058 -6.5867 -6.5867 -4.7273 -4.7273 -4.7099 -4.7099 -3.3116 -3.3116 -3.2886 -3.2886 -3.2812 -3.2812 -3.2557 -3.2557 -0.9822 -0.9822 -0.8524 -0.8524 -0.7400 -0.7400 0.7610 0.7610 0.9452 0.9452 1.4908 1.4908 1.6048 1.6048 1.6403 1.6403 1.7611 1.7611 1.9984 1.9984 2.0982 2.0982 2.3444 2.3444 2.4223 2.4223 2.4325 2.4325 2.6221 2.6221 2.7803 2.7803 3.0320 3.0320 3.3014 3.3014 5.2170 5.2170 5.6572 5.6572 5.6873 5.6873 8.4961 8.4961 8.5171 8.5171 8.6635 8.6635 8.7834 8.7834 k = 0.3704-0.2138 0.3024 ( 32664 PWs) bands (ev): -15.9577 -15.9577 -15.9553 -15.9553 -9.8267 -9.8267 -8.2816 -8.2816 -8.2618 -8.2618 -8.2549 -8.2549 -8.1184 -8.1184 -7.9055 -7.9055 -6.5759 -6.5759 -4.7248 -4.7248 -4.7084 -4.7084 -3.3078 -3.3078 -3.2834 -3.2834 -3.2794 -3.2794 -3.2528 -3.2528 -0.9789 -0.9789 -0.8511 -0.8511 -0.7275 -0.7275 0.7484 0.7484 0.9233 0.9233 1.4764 1.4764 1.6118 1.6118 1.6688 1.6688 1.7503 1.7503 1.9895 1.9895 2.0691 2.0691 2.3389 2.3389 2.4067 2.4067 2.4128 2.4128 2.6042 2.6042 2.7467 2.7467 3.0387 3.0387 3.3113 3.3113 5.2274 5.2274 5.6670 5.6670 5.6957 5.6957 8.5427 8.5427 8.5925 8.5925 8.7515 8.7515 8.8633 8.8633 k = 0.3889-0.2245 0.3175 ( 32668 PWs) bands (ev): -15.9576 -15.9576 -15.9554 -15.9554 -9.8244 -9.8244 -8.2795 -8.2795 -8.2620 -8.2620 -8.2557 -8.2557 -8.1320 -8.1320 -7.9052 -7.9052 -6.5663 -6.5663 -4.7225 -4.7225 -4.7071 -4.7071 -3.3043 -3.3043 -3.2792 -3.2792 -3.2774 -3.2774 -3.2501 -3.2501 -0.9758 -0.9758 -0.8500 -0.8500 -0.7155 -0.7155 0.7371 0.7371 0.9008 0.9008 1.4623 1.4623 1.6263 1.6263 1.6973 1.6973 1.7403 1.7403 1.9809 1.9809 2.0363 2.0363 2.3331 2.3331 2.3918 2.3918 2.3968 2.3968 2.5865 2.5865 2.7182 2.7182 3.0444 3.0444 3.3222 3.3222 5.2364 5.2364 5.6755 5.6755 5.7026 5.7026 8.5911 8.5911 8.6666 8.6666 8.8328 8.8328 8.9378 8.9378 k = 0.4074-0.2352 0.3326 ( 32664 PWs) bands (ev): -15.9575 -15.9575 -15.9554 -15.9554 -9.8224 -9.8224 -8.2771 -8.2771 -8.2616 -8.2616 -8.2564 -8.2564 -8.1449 -8.1449 -7.9050 -7.9050 -6.5579 -6.5579 -4.7204 -4.7204 -4.7060 -4.7060 -3.3014 -3.3014 -3.2771 -3.2771 -3.2740 -3.2740 -3.2478 -3.2478 -0.9731 -0.9731 -0.8491 -0.8491 -0.7046 -0.7046 0.7272 0.7272 0.8791 0.8791 1.4495 1.4495 1.6468 1.6468 1.7252 1.7252 1.7315 1.7315 1.9726 1.9726 2.0006 2.0006 2.3268 2.3268 2.3779 2.3779 2.3841 2.3841 2.5696 2.5696 2.6950 2.6950 3.0489 3.0489 3.3333 3.3333 5.2440 5.2440 5.6828 5.6828 5.7080 5.7080 8.6412 8.6412 8.7378 8.7378 8.9052 8.9052 9.0051 9.0051 k = 0.4259-0.2459 0.3478 ( 32664 PWs) bands (ev): -15.9575 -15.9575 -15.9555 -15.9555 -9.8208 -9.8208 -8.2749 -8.2749 -8.2604 -8.2604 -8.2570 -8.2570 -8.1566 -8.1566 -7.9048 -7.9048 -6.5510 -6.5510 -4.7188 -4.7188 -4.7051 -4.7051 -3.2989 -3.2989 -3.2759 -3.2759 -3.2707 -3.2707 -3.2459 -3.2459 -0.9708 -0.9708 -0.8482 -0.8482 -0.6950 -0.6950 0.7188 0.7188 0.8596 0.8596 1.4386 1.4386 1.6719 1.6719 1.7241 1.7241 1.7514 1.7514 1.9631 1.9631 1.9647 1.9647 2.3202 2.3202 2.3656 2.3656 2.3742 2.3742 2.5544 2.5544 2.6771 2.6771 3.0524 3.0524 3.3439 3.3439 5.2503 5.2503 5.6888 5.6888 5.7121 5.7121 8.6927 8.6927 8.8038 8.8038 8.9663 8.9663 9.0564 9.0565 k = 0.4444-0.2566 0.3629 ( 32692 PWs) bands (ev): -15.9574 -15.9574 -15.9555 -15.9555 -9.8194 -9.8194 -8.2732 -8.2732 -8.2585 -8.2585 -8.2574 -8.2574 -8.1668 -8.1668 -7.9046 -7.9046 -6.5455 -6.5455 -4.7174 -4.7174 -4.7043 -4.7043 -3.2969 -3.2969 -3.2750 -3.2750 -3.2680 -3.2680 -3.2444 -3.2444 -0.9690 -0.9690 -0.8476 -0.8476 -0.6871 -0.6871 0.7122 0.7122 0.8432 0.8432 1.4299 1.4299 1.7003 1.7003 1.7186 1.7186 1.7749 1.7749 1.9244 1.9244 1.9572 1.9572 2.3134 2.3134 2.3556 2.3556 2.3669 2.3669 2.5417 2.5417 2.6640 2.6640 3.0550 3.0550 3.3530 3.3530 5.2551 5.2551 5.6934 5.6934 5.7152 5.7152 8.7455 8.7455 8.8619 8.8619 9.0142 9.0142 9.0391 9.0391 k = 0.4630-0.2673 0.3780 ( 32704 PWs) bands (ev): -15.9574 -15.9574 -15.9555 -15.9555 -9.8185 -9.8185 -8.2722 -8.2722 -8.2578 -8.2578 -8.2560 -8.2560 -8.1750 -8.1750 -7.9045 -7.9045 -6.5415 -6.5415 -4.7165 -4.7165 -4.7038 -4.7038 -3.2954 -3.2954 -3.2743 -3.2743 -3.2660 -3.2660 -3.2433 -3.2433 -0.9677 -0.9677 -0.8471 -0.8471 -0.6812 -0.6812 0.7073 0.7073 0.8308 0.8308 1.4236 1.4236 1.7126 1.7126 1.7337 1.7337 1.7941 1.7941 1.8857 1.8857 1.9506 1.9506 2.3071 2.3071 2.3484 2.3484 2.3619 2.3619 2.5323 2.5323 2.6551 2.6551 3.0568 3.0568 3.3601 3.3601 5.2585 5.2585 5.6968 5.6968 5.7172 5.7172 8.7989 8.7989 8.9083 8.9083 9.0014 9.0014 9.0477 9.0477 k = 0.4815-0.2780 0.3931 ( 32732 PWs) bands (ev): -15.9574 -15.9574 -15.9555 -15.9555 -9.8179 -9.8179 -8.2717 -8.2717 -8.2580 -8.2580 -8.2540 -8.2540 -8.1804 -8.1804 -7.9044 -7.9044 -6.5391 -6.5391 -4.7159 -4.7159 -4.7034 -4.7034 -3.2946 -3.2946 -3.2739 -3.2739 -3.2648 -3.2648 -3.2426 -3.2426 -0.9669 -0.9669 -0.8469 -0.8469 -0.6775 -0.6775 0.7044 0.7044 0.8232 0.8232 1.4197 1.4197 1.7104 1.7104 1.7665 1.7665 1.8071 1.8071 1.8482 1.8482 1.9458 1.9458 2.3026 2.3026 2.3442 2.3442 2.3589 2.3589 2.5266 2.5266 2.6499 2.6499 3.0578 3.0578 3.3645 3.3645 5.2606 5.2606 5.6988 5.6988 5.7184 5.7184 8.8524 8.8524 8.9389 8.9389 8.9556 8.9556 9.0670 9.0670 k = 0.5000-0.2887 0.4082 ( 32804 PWs) bands (ev): -15.9574 -15.9574 -15.9555 -15.9555 -9.8177 -9.8177 -8.2716 -8.2716 -8.2580 -8.2580 -8.2532 -8.2532 -8.1823 -8.1823 -7.9044 -7.9044 -6.5383 -6.5383 -4.7157 -4.7157 -4.7033 -4.7033 -3.2943 -3.2943 -3.2738 -3.2738 -3.2644 -3.2644 -3.2424 -3.2424 -0.9666 -0.9666 -0.8468 -0.8468 -0.6763 -0.6763 0.7034 0.7034 0.8206 0.8206 1.4185 1.4185 1.7095 1.7095 1.7904 1.7904 1.8117 1.8117 1.8228 1.8228 1.9440 1.9440 2.3009 2.3009 2.3428 2.3428 2.3580 2.3580 2.5247 2.5247 2.6482 2.6482 3.0582 3.0582 3.3660 3.3660 5.2613 5.2613 5.6994 5.6994 5.7188 5.7188 8.9031 8.9031 8.9072 8.9072 8.9497 8.9497 9.0732 9.0732 k = 0.5000-0.2887 0.4082 ( 32804 PWs) bands (ev): -15.9574 -15.9574 -15.9555 -15.9555 -9.8177 -9.8177 -8.2716 -8.2716 -8.2580 -8.2580 -8.2532 -8.2532 -8.1823 -8.1823 -7.9044 -7.9044 -6.5383 -6.5383 -4.7157 -4.7157 -4.7033 -4.7033 -3.2943 -3.2943 -3.2738 -3.2738 -3.2644 -3.2644 -3.2424 -3.2424 -0.9666 -0.9666 -0.8468 -0.8468 -0.6763 -0.6763 0.7034 0.7034 0.8206 0.8206 1.4185 1.4185 1.7095 1.7095 1.7904 1.7904 1.8117 1.8117 1.8228 1.8228 1.9440 1.9440 2.3009 2.3009 2.3428 2.3428 2.3580 2.3580 2.5247 2.5247 2.6482 2.6482 3.0582 3.0582 3.3660 3.3660 5.2613 5.2613 5.6994 5.6994 5.7188 5.7188 8.9031 8.9031 8.9072 8.9072 8.9497 8.9497 9.0732 9.0732 k = 0.5000-0.2681 0.4228 ( 32732 PWs) bands (ev): -15.9574 -15.9574 -15.9556 -15.9556 -9.8177 -9.8177 -8.2725 -8.2725 -8.2593 -8.2593 -8.2534 -8.2534 -8.1794 -8.1794 -7.9049 -7.9049 -6.5383 -6.5383 -4.7156 -4.7156 -4.7034 -4.7034 -3.2941 -3.2941 -3.2738 -3.2738 -3.2644 -3.2644 -3.2425 -3.2425 -0.9667 -0.9667 -0.8466 -0.8466 -0.6768 -0.6768 0.7046 0.7046 0.8223 0.8223 1.4161 1.4161 1.7084 1.7084 1.7875 1.7875 1.8123 1.8123 1.8262 1.8262 1.9440 1.9440 2.2908 2.2908 2.3428 2.3428 2.3678 2.3678 2.5261 2.5261 2.6480 2.6480 3.0577 3.0577 3.3649 3.3649 5.2619 5.2619 5.6995 5.6995 5.7188 5.7188 8.9056 8.9056 8.9089 8.9089 8.9517 8.9517 9.0749 9.0749 k = 0.5000-0.2474 0.4374 ( 32716 PWs) bands (ev): -15.9573 -15.9573 -15.9556 -15.9556 -9.8176 -9.8176 -8.2760 -8.2760 -8.2618 -8.2618 -8.2537 -8.2537 -8.1716 -8.1716 -7.9063 -7.9063 -6.5386 -6.5386 -4.7155 -4.7155 -4.7035 -4.7035 -3.2937 -3.2937 -3.2738 -3.2738 -3.2644 -3.2644 -3.2430 -3.2430 -0.9670 -0.9670 -0.8459 -0.8459 -0.6784 -0.6784 0.7083 0.7083 0.8276 0.8276 1.4090 1.4090 1.7051 1.7051 1.7813 1.7813 1.8134 1.8134 1.8344 1.8344 1.9441 1.9441 2.2704 2.2704 2.3404 2.3404 2.3892 2.3892 2.5301 2.5301 2.6475 2.6475 3.0562 3.0562 3.3614 3.3614 5.2637 5.2637 5.6996 5.6996 5.7187 5.7187 8.9132 8.9132 8.9138 8.9138 8.9577 8.9577 9.0799 9.0799 k = 0.5000-0.2268 0.4520 ( 32676 PWs) bands (ev): -15.9573 -15.9573 -15.9556 -15.9556 -9.8176 -9.8176 -8.2825 -8.2825 -8.2636 -8.2636 -8.2539 -8.2539 -8.1605 -8.1605 -7.9087 -7.9087 -6.5389 -6.5389 -4.7153 -4.7153 -4.7036 -4.7036 -3.2931 -3.2931 -3.2738 -3.2738 -3.2644 -3.2644 -3.2436 -3.2436 -0.9674 -0.9674 -0.8449 -0.8449 -0.6810 -0.6810 0.7142 0.7142 0.8361 0.8361 1.3979 1.3979 1.6994 1.6994 1.7747 1.7747 1.8145 1.8145 1.8445 1.8445 1.9446 1.9446 2.2474 2.2474 2.3363 2.3363 2.4145 2.4145 2.5365 2.5365 2.6469 2.6469 3.0536 3.0536 3.3559 3.3559 5.2665 5.2665 5.6998 5.6998 5.7186 5.7186 8.9216 8.9216 8.9259 8.9259 8.9674 8.9674 9.0882 9.0882 k = 0.5000-0.2062 0.4666 ( 32654 PWs) bands (ev): -15.9573 -15.9573 -15.9556 -15.9556 -9.8175 -9.8175 -8.2910 -8.2910 -8.2645 -8.2645 -8.2540 -8.2540 -8.1476 -8.1476 -7.9119 -7.9119 -6.5394 -6.5394 -4.7151 -4.7151 -4.7038 -4.7038 -3.2922 -3.2922 -3.2738 -3.2738 -3.2645 -3.2645 -3.2446 -3.2446 -0.9681 -0.9681 -0.8435 -0.8435 -0.6844 -0.6844 0.7225 0.7225 0.8474 0.8474 1.3835 1.3835 1.6913 1.6913 1.7689 1.7689 1.8154 1.8154 1.8553 1.8553 1.9459 1.9459 2.2238 2.2238 2.3309 2.3309 2.4408 2.4408 2.5447 2.5447 2.6468 2.6468 3.0496 3.0496 3.3485 3.3485 5.2704 5.2704 5.7002 5.7002 5.7184 5.7184 8.9322 8.9322 8.9435 8.9435 8.9807 8.9807 9.0994 9.0994 k = 0.5000-0.1856 0.4811 ( 32658 PWs) bands (ev): -15.9572 -15.9572 -15.9557 -15.9557 -9.8174 -9.8174 -8.3000 -8.3000 -8.2649 -8.2649 -8.2541 -8.2541 -8.1336 -8.1336 -7.9161 -7.9161 -6.5400 -6.5400 -4.7148 -4.7148 -4.7041 -4.7041 -3.2910 -3.2910 -3.2738 -3.2738 -3.2645 -3.2645 -3.2458 -3.2458 -0.9688 -0.9688 -0.8417 -0.8417 -0.6887 -0.6887 0.7330 0.7330 0.8607 0.8607 1.3668 1.3668 1.6805 1.6805 1.7644 1.7644 1.8158 1.8158 1.8660 1.8660 1.9483 1.9483 2.2000 2.2000 2.3247 2.3247 2.4666 2.4666 2.5545 2.5545 2.6477 2.6477 3.0440 3.0440 3.3397 3.3397 5.2749 5.2749 5.7006 5.7006 5.7181 5.7181 8.9452 8.9452 8.9658 8.9658 8.9969 8.9969 9.1132 9.1132 k = 0.5000-0.1650 0.4957 ( 32654 PWs) bands (ev): -15.9572 -15.9572 -15.9557 -15.9557 -9.8173 -9.8173 -8.3088 -8.3088 -8.2650 -8.2650 -8.2542 -8.2542 -8.1191 -8.1191 -7.9212 -7.9212 -6.5406 -6.5406 -4.7144 -4.7144 -4.7044 -4.7044 -3.2897 -3.2897 -3.2738 -3.2738 -3.2645 -3.2645 -3.2472 -3.2472 -0.9697 -0.9697 -0.8394 -0.8394 -0.6935 -0.6935 0.7455 0.7455 0.8753 0.8753 1.3491 1.3491 1.6669 1.6669 1.7613 1.7613 1.8153 1.8153 1.8766 1.8766 1.9522 1.9522 2.1766 2.1766 2.3180 2.3180 2.4901 2.4901 2.5657 2.5657 2.6512 2.6512 3.0364 3.0364 3.3300 3.3300 5.2800 5.2800 5.7012 5.7012 5.7177 5.7177 8.9600 8.9600 8.9928 8.9928 9.0152 9.0152 9.1291 9.1291 k = 0.5000-0.1443 0.5103 ( 32676 PWs) bands (ev): -15.9571 -15.9571 -15.9558 -15.9558 -9.8171 -9.8171 -8.3171 -8.3171 -8.2651 -8.2651 -8.2542 -8.2542 -8.1043 -8.1043 -7.9271 -7.9271 -6.5412 -6.5412 -4.7140 -4.7140 -4.7047 -4.7047 -3.2882 -3.2882 -3.2738 -3.2738 -3.2645 -3.2645 -3.2487 -3.2487 -0.9707 -0.9707 -0.8369 -0.8369 -0.6987 -0.6987 0.7599 0.7599 0.8899 0.8899 1.3319 1.3319 1.6504 1.6504 1.7598 1.7598 1.8139 1.8139 1.8868 1.8868 1.9577 1.9577 2.1539 2.1539 2.3110 2.3110 2.5092 2.5092 2.5773 2.5773 2.6594 2.6594 3.0264 3.0264 3.3200 3.3200 5.2854 5.2854 5.7019 5.7019 5.7172 5.7172 8.9761 8.9761 9.0239 9.0239 9.0344 9.0344 9.1463 9.1463 k = 0.5000-0.1237 0.5249 ( 32660 PWs) bands (ev): -15.9570 -15.9570 -15.9559 -15.9559 -9.8170 -9.8170 -8.3246 -8.3246 -8.2651 -8.2651 -8.2543 -8.2543 -8.0896 -8.0896 -7.9338 -7.9338 -6.5419 -6.5419 -4.7135 -4.7135 -4.7051 -4.7051 -3.2865 -3.2865 -3.2738 -3.2738 -3.2645 -3.2645 -3.2504 -3.2504 -0.9717 -0.9717 -0.8340 -0.8340 -0.7042 -0.7042 0.7761 0.7761 0.9032 0.9032 1.3164 1.3164 1.6315 1.6315 1.7597 1.7597 1.8112 1.8112 1.8967 1.8967 1.9647 1.9647 2.1321 2.1321 2.3040 2.3040 2.5233 2.5233 2.5872 2.5872 2.6748 2.6748 3.0136 3.0136 3.3101 3.3101 5.2908 5.2908 5.7027 5.7027 5.7165 5.7165 8.9926 8.9926 9.0516 9.0516 9.0600 9.0600 9.1641 9.1641 k = 0.5000-0.1031 0.5395 ( 32654 PWs) bands (ev): -15.9569 -15.9569 -15.9560 -15.9560 -9.8169 -9.8169 -8.3312 -8.3312 -8.2651 -8.2651 -8.2544 -8.2544 -8.0752 -8.0752 -7.9413 -7.9413 -6.5425 -6.5425 -4.7130 -4.7130 -4.7055 -4.7055 -3.2847 -3.2847 -3.2739 -3.2739 -3.2644 -3.2644 -3.2522 -3.2522 -0.9727 -0.9727 -0.8311 -0.8311 -0.7096 -0.7096 0.7936 0.7936 0.9135 0.9135 1.3043 1.3043 1.6108 1.6108 1.7610 1.7610 1.8076 1.8076 1.9063 1.9063 1.9729 1.9729 2.1116 2.1116 2.2971 2.2971 2.5329 2.5329 2.5939 2.5939 2.6977 2.6977 2.9980 2.9980 3.3010 3.3010 5.2959 5.2959 5.7037 5.7037 5.7157 5.7157 9.0088 9.0088 9.0663 9.0663 9.0985 9.0985 9.1823 9.1823 k = 0.5000-0.0825 0.5541 ( 32668 PWs) bands (ev): -15.9569 -15.9569 -15.9561 -15.9561 -9.8168 -9.8168 -8.3367 -8.3367 -8.2650 -8.2650 -8.2545 -8.2545 -8.0614 -8.0614 -7.9493 -7.9493 -6.5431 -6.5431 -4.7126 -4.7126 -4.7060 -4.7060 -3.2830 -3.2830 -3.2741 -3.2741 -3.2643 -3.2643 -3.2541 -3.2541 -0.9736 -0.9736 -0.8281 -0.8281 -0.7146 -0.7146 0.8122 0.8122 0.9194 0.9194 1.2964 1.2964 1.5896 1.5896 1.7634 1.7634 1.8031 1.8031 1.9154 1.9154 1.9817 1.9817 2.0924 2.0924 2.2908 2.2908 2.5391 2.5391 2.5979 2.5979 2.7260 2.7260 2.9793 2.9793 3.2931 3.2931 5.3006 5.3006 5.7047 5.7047 5.7148 5.7148 9.0240 9.0240 9.0756 9.0756 9.1399 9.1399 9.2022 9.2022 k = 0.5000-0.0619 0.5686 ( 32644 PWs) bands (ev): -15.9568 -15.9568 -15.9562 -15.9562 -9.8167 -9.8167 -8.3410 -8.3410 -8.2650 -8.2650 -8.2546 -8.2546 -8.0485 -8.0485 -7.9575 -7.9575 -6.5436 -6.5436 -4.7121 -4.7121 -4.7064 -4.7064 -3.2812 -3.2812 -3.2744 -3.2744 -3.2640 -3.2640 -3.2558 -3.2558 -0.9744 -0.9744 -0.8255 -0.8255 -0.7191 -0.7191 0.8313 0.8313 0.9199 0.9199 1.2930 1.2930 1.5693 1.5693 1.7668 1.7668 1.7980 1.7980 1.9236 1.9236 1.9909 1.9909 2.0749 2.0749 2.2854 2.2854 2.5429 2.5429 2.6003 2.6003 2.7570 2.7570 2.9578 2.9578 3.2867 3.2867 5.3044 5.3044 5.7059 5.7059 5.7137 5.7137 9.0375 9.0375 9.0800 9.0800 9.1821 9.1821 9.2238 9.2238 k = 0.5000-0.0412 0.5832 ( 32636 PWs) bands (ev): -15.9567 -15.9567 -15.9563 -15.9563 -9.8167 -9.8167 -8.3442 -8.3442 -8.2650 -8.2650 -8.2546 -8.2546 -8.0372 -8.0372 -7.9655 -7.9655 -6.5439 -6.5439 -4.7117 -4.7117 -4.7067 -4.7067 -3.2796 -3.2796 -3.2749 -3.2749 -3.2636 -3.2636 -3.2574 -3.2574 -0.9750 -0.9750 -0.8233 -0.8233 -0.7226 -0.7226 0.8502 0.8502 0.9150 0.9150 1.2931 1.2931 1.5520 1.5520 1.7710 1.7710 1.7925 1.7925 1.9303 1.9303 2.0002 2.0002 2.0594 2.0594 2.2811 2.2811 2.5452 2.5452 2.6017 2.6017 2.7878 2.7878 2.9347 2.9347 3.2820 3.2820 5.3073 5.3073 5.7072 5.7072 5.7125 5.7125 9.0487 9.0487 9.0808 9.0808 9.2203 9.2203 9.2479 9.2479 k = 0.5000-0.0206 0.5978 ( 32630 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8166 -9.8166 -8.3461 -8.3461 -8.2650 -8.2650 -8.2546 -8.2546 -8.0288 -8.0288 -7.9719 -7.9719 -6.5441 -6.5441 -4.7115 -4.7115 -4.7070 -4.7070 -3.2783 -3.2783 -3.2754 -3.2754 -3.2632 -3.2632 -3.2587 -3.2587 -0.9754 -0.9754 -0.8218 -0.8218 -0.7248 -0.7248 0.8675 0.8675 0.9059 0.9059 1.2946 1.2946 1.5402 1.5402 1.7757 1.7757 1.7871 1.7871 1.9348 1.9348 2.0086 2.0086 2.0470 2.0470 2.2784 2.2784 2.5463 2.5463 2.6024 2.6024 2.8148 2.8148 2.9126 2.9126 3.2792 3.2792 5.3091 5.3091 5.7085 5.7085 5.7112 5.7112 9.0567 9.0567 9.0796 9.0796 9.2454 9.2454 9.2738 9.2738 k = 0.5000-0.0000 0.6124 ( 32596 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8166 -9.8166 -8.3467 -8.3467 -8.2650 -8.2650 -8.2546 -8.2546 -8.0255 -8.0255 -7.9745 -7.9745 -6.5442 -6.5442 -4.7114 -4.7114 -4.7070 -4.7070 -3.2776 -3.2776 -3.2758 -3.2758 -3.2630 -3.2630 -3.2592 -3.2592 -0.9755 -0.9755 -0.8213 -0.8213 -0.7256 -0.7256 0.8772 0.8772 0.8989 0.8989 1.2954 1.2954 1.5360 1.5360 1.7794 1.7794 1.7831 1.7831 1.9364 1.9364 2.0128 2.0128 2.0414 2.0414 2.2775 2.2775 2.5467 2.5467 2.6027 2.6027 2.8276 2.8276 2.9015 2.9015 3.2783 3.2783 5.3098 5.3098 5.7097 5.7097 5.7101 5.7101 9.0600 9.0600 9.0786 9.0786 9.2554 9.2554 9.2758 9.2758 k = 0.5000-0.0000 0.6124 ( 32596 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8166 -9.8166 -8.3467 -8.3467 -8.2650 -8.2650 -8.2546 -8.2546 -8.0255 -8.0255 -7.9745 -7.9745 -6.5442 -6.5442 -4.7114 -4.7114 -4.7070 -4.7070 -3.2776 -3.2776 -3.2758 -3.2758 -3.2630 -3.2630 -3.2592 -3.2592 -0.9755 -0.9755 -0.8213 -0.8213 -0.7256 -0.7256 0.8772 0.8772 0.8989 0.8989 1.2954 1.2954 1.5360 1.5360 1.7794 1.7794 1.7831 1.7831 1.9364 1.9364 2.0128 2.0128 2.0414 2.0414 2.2775 2.2775 2.5467 2.5467 2.6027 2.6027 2.8276 2.8276 2.9015 2.9015 3.2783 3.2783 5.3098 5.3098 5.7097 5.7097 5.7101 5.7101 9.0600 9.0600 9.0786 9.0786 9.2554 9.2554 9.2758 9.2758 k = 0.4875 0.0217 0.6124 ( 32640 PWs) bands (ev): -15.9565 -15.9565 -15.9564 -15.9564 -9.8167 -9.8167 -8.3470 -8.3470 -8.2645 -8.2645 -8.2542 -8.2542 -8.0271 -8.0271 -7.9733 -7.9733 -6.5444 -6.5444 -4.7114 -4.7114 -4.7070 -4.7070 -3.2780 -3.2780 -3.2757 -3.2757 -3.2631 -3.2631 -3.2589 -3.2589 -0.9765 -0.9765 -0.8214 -0.8214 -0.7244 -0.7244 0.8717 0.8717 0.9037 0.9037 1.2950 1.2950 1.5382 1.5382 1.7747 1.7747 1.7867 1.7867 1.9359 1.9359 2.0103 2.0103 2.0453 2.0453 2.2782 2.2782 2.5471 2.5471 2.6033 2.6033 2.8211 2.8211 2.9077 2.9077 3.2783 3.2783 5.3070 5.3070 5.6945 5.6945 5.7273 5.7273 9.0520 9.0520 9.0766 9.0766 9.2446 9.2446 9.2749 9.2750 k = 0.4750 0.0433 0.6124 ( 32639 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8168 -9.8168 -8.3478 -8.3478 -8.2634 -8.2634 -8.2529 -8.2529 -8.0313 -8.0313 -7.9701 -7.9701 -6.5447 -6.5447 -4.7116 -4.7116 -4.7070 -4.7070 -3.2789 -3.2789 -3.2757 -3.2757 -3.2633 -3.2633 -3.2583 -3.2583 -0.9794 -0.9794 -0.8214 -0.8214 -0.7212 -0.7212 0.8609 0.8609 0.9120 0.9120 1.2940 1.2940 1.5443 1.5443 1.7669 1.7669 1.7918 1.7918 1.9342 1.9342 2.0055 2.0055 2.0538 2.0538 2.2806 2.2806 2.5479 2.5479 2.6055 2.6055 2.8060 2.8060 2.9218 2.9218 3.2785 3.2785 5.2989 5.2989 5.6823 5.6823 5.7453 5.7453 9.0271 9.0271 9.0734 9.0734 9.2100 9.2100 9.2445 9.2445 k = 0.4625 0.0650 0.6124 ( 32653 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8169 -9.8169 -8.3492 -8.3492 -8.2621 -8.2621 -8.2504 -8.2504 -8.0373 -8.0373 -7.9659 -7.9659 -6.5453 -6.5453 -4.7119 -4.7119 -4.7070 -4.7070 -3.2800 -3.2800 -3.2760 -3.2760 -3.2636 -3.2636 -3.2575 -3.2575 -0.9838 -0.9838 -0.8209 -0.8209 -0.7165 -0.7165 0.8492 0.8492 0.9200 0.9200 1.2927 1.2927 1.5532 1.5532 1.7580 1.7580 1.7970 1.7970 1.9314 1.9314 2.0003 2.0003 2.0640 2.0640 2.2846 2.2846 2.5482 2.5482 2.6094 2.6094 2.7877 2.7877 2.9380 2.9380 3.2792 3.2792 5.2863 5.2863 5.6735 5.6735 5.7636 5.7636 8.9928 8.9928 9.0617 9.0617 9.1704 9.1704 9.2165 9.2165 k = 0.4500 0.0866 0.6124 ( 32639 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8171 -9.8171 -8.3508 -8.3508 -8.2610 -8.2610 -8.2467 -8.2467 -8.0440 -8.0440 -7.9614 -7.9614 -6.5459 -6.5459 -4.7122 -4.7122 -4.7070 -4.7070 -3.2812 -3.2812 -3.2764 -3.2764 -3.2638 -3.2638 -3.2566 -3.2566 -0.9893 -0.9893 -0.8199 -0.8199 -0.7111 -0.7111 0.8377 0.8377 0.9266 0.9266 1.2918 1.2918 1.5632 1.5632 1.7490 1.7490 1.8023 1.8023 1.9281 1.9281 1.9949 1.9949 2.0743 2.0743 2.2903 2.2903 2.5476 2.5476 2.6152 2.6152 2.7687 2.7687 2.9536 2.9536 3.2805 3.2805 5.2706 5.2706 5.6673 5.6673 5.7815 5.7815 8.9558 8.9558 9.0335 9.0335 9.1501 9.1501 9.1871 9.1871 k = 0.4375 0.1083 0.6124 ( 32646 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8173 -9.8173 -8.3525 -8.3525 -8.2602 -8.2602 -8.2422 -8.2422 -8.0510 -8.0510 -7.9571 -7.9571 -6.5466 -6.5466 -4.7125 -4.7125 -4.7071 -4.7071 -3.2824 -3.2824 -3.2769 -3.2769 -3.2639 -3.2639 -3.2558 -3.2558 -0.9952 -0.9952 -0.8186 -0.8186 -0.7054 -0.7054 0.8270 0.8270 0.9317 0.9317 1.2918 1.2918 1.5730 1.5730 1.7407 1.7407 1.8073 1.8073 1.9252 1.9252 1.9894 1.9894 2.0837 2.0837 2.2974 2.2974 2.5459 2.5459 2.6222 2.6222 2.7505 2.7505 2.9673 2.9673 3.2824 3.2824 5.2535 5.2535 5.6634 5.6634 5.7982 5.7982 8.9200 8.9200 8.9957 8.9957 9.1439 9.1439 9.1600 9.1600 k = 0.4250 0.1299 0.6124 ( 32655 PWs) bands (ev): -15.9568 -15.9568 -15.9562 -15.9562 -9.8175 -9.8175 -8.3541 -8.3541 -8.2597 -8.2597 -8.2374 -8.2374 -8.0576 -8.0576 -7.9534 -7.9534 -6.5472 -6.5472 -4.7128 -4.7128 -4.7071 -4.7071 -3.2834 -3.2834 -3.2774 -3.2774 -3.2641 -3.2641 -3.2550 -3.2550 -1.0008 -1.0008 -0.8172 -0.8172 -0.7001 -0.7001 0.8176 0.8176 0.9353 0.9353 1.2926 1.2926 1.5814 1.5814 1.7338 1.7338 1.8119 1.8119 1.9230 1.9230 1.9837 1.9837 2.0916 2.0916 2.3054 2.3054 2.5433 2.5433 2.6297 2.6297 2.7340 2.7340 2.9785 2.9785 3.2849 3.2849 5.2368 5.2368 5.6610 5.6610 5.8131 5.8131 8.8882 8.8882 8.9592 8.9592 9.1247 9.1247 9.1550 9.1550 k = 0.4125 0.1516 0.6124 ( 32648 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8177 -9.8177 -8.3555 -8.3555 -8.2593 -8.2593 -8.2328 -8.2328 -8.0635 -8.0635 -7.9503 -7.9503 -6.5477 -6.5477 -4.7130 -4.7130 -4.7071 -4.7071 -3.2843 -3.2843 -3.2778 -3.2778 -3.2641 -3.2641 -3.2544 -3.2544 -1.0058 -1.0058 -0.8159 -0.8159 -0.6955 -0.6955 0.8100 0.8100 0.9377 0.9377 1.2940 1.2940 1.5876 1.5876 1.7287 1.7287 1.8158 1.8158 1.9218 1.9218 1.9783 1.9783 2.0978 2.0978 2.3134 2.3134 2.5403 2.5403 2.6368 2.6368 2.7198 2.7198 2.9870 2.9870 3.2876 3.2876 5.2221 5.2221 5.6596 5.6596 5.8255 5.8255 8.8621 8.8621 8.9286 8.9286 9.1014 9.1014 9.1605 9.1605 k = 0.4000 0.1732 0.6124 ( 32641 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8178 -9.8178 -8.3566 -8.3566 -8.2591 -8.2591 -8.2290 -8.2290 -8.0681 -8.0681 -7.9480 -7.9480 -6.5481 -6.5481 -4.7132 -4.7132 -4.7071 -4.7071 -3.2850 -3.2850 -3.2782 -3.2782 -3.2642 -3.2642 -3.2540 -3.2540 -1.0096 -1.0096 -0.8148 -0.8148 -0.6919 -0.6919 0.8043 0.8043 0.9390 0.9390 1.2956 1.2956 1.5916 1.5916 1.7254 1.7254 1.8188 1.8188 1.9214 1.9214 1.9736 1.9736 2.1020 2.1020 2.3205 2.3205 2.5374 2.5374 2.6428 2.6428 2.7089 2.7089 2.9928 2.9928 3.2899 3.2899 5.2106 5.2106 5.6588 5.6588 5.8347 5.8347 8.8427 8.8427 8.9060 8.9060 9.0832 9.0832 9.1664 9.1664 k = 0.3875 0.1949 0.6124 ( 32652 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8179 -9.8179 -8.3572 -8.3572 -8.2589 -8.2589 -8.2265 -8.2265 -8.0711 -8.0711 -7.9467 -7.9467 -6.5484 -6.5484 -4.7133 -4.7133 -4.7071 -4.7071 -3.2854 -3.2854 -3.2784 -3.2784 -3.2642 -3.2642 -3.2537 -3.2537 -1.0119 -1.0119 -0.8141 -0.8141 -0.6897 -0.6897 0.8008 0.8008 0.9397 0.9397 1.2968 1.2968 1.5937 1.5937 1.7237 1.7237 1.8206 1.8206 1.9216 1.9216 1.9703 1.9703 2.1045 2.1045 2.3253 2.3253 2.5354 2.5354 2.6468 2.6468 2.7018 2.7018 2.9963 2.9963 3.2916 3.2916 5.2033 5.2033 5.6584 5.6584 5.8404 5.8404 8.8308 8.8308 8.8922 8.8922 9.0719 9.0719 9.1708 9.1708 k = 0.3750 0.2165 0.6124 ( 32632 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8180 -9.8180 -8.3575 -8.3575 -8.2589 -8.2589 -8.2256 -8.2256 -8.0721 -8.0721 -7.9462 -7.9462 -6.5485 -6.5485 -4.7134 -4.7134 -4.7072 -4.7072 -3.2855 -3.2855 -3.2785 -3.2785 -3.2642 -3.2642 -3.2536 -3.2536 -1.0128 -1.0128 -0.8139 -0.8139 -0.6889 -0.6889 0.7996 0.7996 0.9399 0.9399 1.2973 1.2973 1.5944 1.5944 1.7232 1.7232 1.8212 1.8212 1.9218 1.9218 1.9691 1.9691 2.1053 2.1053 2.3270 2.3270 2.5346 2.5346 2.6483 2.6483 2.6994 2.6994 2.9974 2.9974 3.2921 3.2921 5.2008 5.2008 5.6583 5.6583 5.8424 5.8424 8.8268 8.8268 8.8876 8.8876 9.0680 9.0680 9.1724 9.1724 k = 0.3750 0.2165 0.6124 ( 32632 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8180 -9.8180 -8.3575 -8.3575 -8.2589 -8.2589 -8.2256 -8.2256 -8.0721 -8.0721 -7.9462 -7.9462 -6.5485 -6.5485 -4.7134 -4.7134 -4.7072 -4.7072 -3.2855 -3.2855 -3.2785 -3.2785 -3.2642 -3.2642 -3.2536 -3.2536 -1.0128 -1.0128 -0.8139 -0.8139 -0.6889 -0.6889 0.7996 0.7996 0.9399 0.9399 1.2973 1.2973 1.5944 1.5944 1.7232 1.7232 1.8212 1.8212 1.9218 1.9218 1.9691 1.9691 2.1053 2.1053 2.3270 2.3270 2.5346 2.5346 2.6483 2.6483 2.6994 2.6994 2.9974 2.9974 3.2921 3.2921 5.2008 5.2008 5.6583 5.6583 5.8424 5.8424 8.8268 8.8268 8.8876 8.8876 9.0680 9.0680 9.1724 9.1724 k = 0.3621 0.2090 0.5913 ( 32664 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8184 -9.8184 -8.3656 -8.3656 -8.2589 -8.2589 -8.2187 -8.2187 -8.0598 -8.0598 -7.9541 -7.9541 -6.5514 -6.5514 -4.7132 -4.7132 -4.7081 -4.7081 -3.2847 -3.2847 -3.2806 -3.2806 -3.2640 -3.2640 -3.2555 -3.2555 -1.0239 -1.0239 -0.8124 -0.8124 -0.6826 -0.6826 0.8161 0.8161 0.9507 0.9507 1.2898 1.2898 1.5808 1.5808 1.7108 1.7108 1.8224 1.8224 1.9304 1.9304 1.9727 1.9727 2.0955 2.0955 2.3287 2.3287 2.5411 2.5411 2.6740 2.6740 2.7206 2.7206 2.9849 2.9849 3.2805 3.2805 5.1777 5.1777 5.6500 5.6500 5.8710 5.8710 8.7862 8.7862 8.8771 8.8771 9.0476 9.0476 9.1760 9.1760 k = 0.3491 0.2016 0.5701 ( 32678 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8190 -9.8190 -8.3727 -8.3727 -8.2588 -8.2588 -8.2114 -8.2114 -8.0479 -8.0479 -7.9622 -7.9622 -6.5549 -6.5549 -4.7133 -4.7133 -4.7091 -4.7091 -3.2843 -3.2843 -3.2830 -3.2830 -3.2638 -3.2638 -3.2575 -3.2575 -1.0351 -1.0351 -0.8132 -0.8132 -0.6741 -0.6741 0.8327 0.8327 0.9576 0.9576 1.2860 1.2860 1.5705 1.5705 1.6981 1.6981 1.8239 1.8239 1.9360 1.9360 1.9768 1.9768 2.0898 2.0898 2.3331 2.3331 2.5459 2.5459 2.6999 2.6999 2.7452 2.7452 2.9724 2.9724 3.2680 3.2680 5.1533 5.1533 5.6409 5.6409 5.8992 5.8992 8.7404 8.7404 8.8652 8.8652 9.0256 9.0256 9.1800 9.1800 k = 0.3362 0.1941 0.5490 ( 32686 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8198 -9.8198 -8.3784 -8.3784 -8.2588 -8.2588 -8.2039 -8.2039 -8.0366 -8.0366 -7.9705 -7.9705 -6.5590 -6.5590 -4.7138 -4.7138 -4.7100 -4.7100 -3.2864 -3.2864 -3.2836 -3.2836 -3.2637 -3.2637 -3.2594 -3.2594 -1.0461 -1.0461 -0.8160 -0.8160 -0.6641 -0.6641 0.8490 0.8490 0.9605 0.9605 1.2857 1.2857 1.5641 1.5641 1.6855 1.6855 1.8260 1.8260 1.9374 1.9374 1.9820 1.9820 2.0888 2.0888 2.3404 2.3404 2.5492 2.5492 2.7261 2.7261 2.7723 2.7723 2.9606 2.9606 3.2545 3.2545 5.1285 5.1285 5.6310 5.6310 5.9259 5.9259 8.6910 8.6910 8.8514 8.8514 9.0002 9.0002 9.1826 9.1826 k = 0.3233 0.1866 0.5279 ( 32678 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8208 -9.8208 -8.3829 -8.3829 -8.2587 -8.2587 -8.1964 -8.1964 -8.0259 -8.0259 -7.9786 -7.9786 -6.5637 -6.5637 -4.7147 -4.7147 -4.7107 -4.7107 -3.2898 -3.2898 -3.2837 -3.2837 -3.2642 -3.2642 -3.2610 -3.2610 -1.0564 -1.0564 -0.8203 -0.8203 -0.6538 -0.6538 0.8645 0.8645 0.9600 0.9600 1.2884 1.2884 1.5621 1.5621 1.6736 1.6736 1.8291 1.8291 1.9345 1.9345 1.9888 1.9888 2.0925 2.0925 2.3506 2.3506 2.5514 2.5514 2.7528 2.7528 2.8006 2.8006 2.9500 2.9500 3.2400 3.2400 5.1041 5.1041 5.6203 5.6203 5.9499 5.9499 8.6392 8.6392 8.8355 8.8355 8.9687 8.9687 9.1685 9.1685 k = 0.3103 0.1792 0.5068 ( 32672 PWs) bands (ev): -15.9567 -15.9567 -15.9563 -15.9563 -9.8220 -9.8220 -8.3860 -8.3860 -8.2585 -8.2585 -8.1891 -8.1891 -8.0157 -8.0157 -7.9863 -7.9863 -6.5692 -6.5692 -4.7162 -4.7162 -4.7113 -4.7113 -3.2937 -3.2937 -3.2840 -3.2840 -3.2661 -3.2661 -3.2616 -3.2616 -1.0658 -1.0658 -0.8255 -0.8255 -0.6442 -0.6442 0.8788 0.8788 0.9569 0.9569 1.2937 1.2937 1.5642 1.5642 1.6627 1.6627 1.8332 1.8332 1.9287 1.9287 1.9972 1.9972 2.1002 2.1002 2.3636 2.3636 2.5528 2.5528 2.7800 2.7800 2.8285 2.8285 2.9416 2.9416 3.2244 3.2244 5.0811 5.0811 5.6088 5.6088 5.9702 5.9702 8.5859 8.5859 8.8171 8.8171 8.9273 8.9273 9.1178 9.1178 k = 0.2974 0.1717 0.4857 ( 32644 PWs) bands (ev): -15.9569 -15.9569 -15.9561 -15.9561 -9.8235 -9.8235 -8.3878 -8.3878 -8.2583 -8.2583 -8.1823 -8.1823 -8.0061 -8.0061 -7.9934 -7.9934 -6.5754 -6.5754 -4.7181 -4.7181 -4.7117 -4.7117 -3.2979 -3.2979 -3.2845 -3.2845 -3.2690 -3.2690 -3.2618 -3.2618 -1.0740 -1.0740 -0.8314 -0.8314 -0.6362 -0.6362 0.8916 0.8916 0.9526 0.9526 1.3013 1.3013 1.5700 1.5700 1.6529 1.6529 1.8378 1.8378 1.9227 1.9227 2.0071 2.0071 2.1109 2.1109 2.3788 2.3788 2.5535 2.5535 2.8075 2.8075 2.8541 2.8541 2.9375 2.9375 3.2079 3.2079 5.0599 5.0599 5.5965 5.5965 5.9861 5.9861 8.5319 8.5319 8.7957 8.7957 8.8729 8.8729 9.0275 9.0275 k = 0.2845 0.1642 0.4646 ( 32636 PWs) bands (ev): -15.9570 -15.9570 -15.9560 -15.9560 -9.8252 -9.8252 -8.3882 -8.3882 -8.2580 -8.2580 -8.1763 -8.1763 -7.9996 -7.9996 -7.9970 -7.9970 -6.5824 -6.5824 -4.7202 -4.7202 -4.7123 -4.7123 -3.3023 -3.3023 -3.2853 -3.2853 -3.2724 -3.2724 -3.2621 -3.2621 -1.0809 -1.0809 -0.8377 -0.8377 -0.6305 -0.6305 0.9022 0.9022 0.9482 0.9482 1.3110 1.3110 1.5786 1.5786 1.6441 1.6441 1.8416 1.8416 1.9199 1.9199 2.0181 2.0181 2.1235 2.1235 2.3961 2.3961 2.5538 2.5538 2.8340 2.8340 2.8744 2.8744 2.9415 2.9415 3.1908 3.1908 5.0410 5.0410 5.5835 5.5835 5.9968 5.9968 8.4778 8.4778 8.7709 8.7709 8.8061 8.8061 8.9248 8.9248 k = 0.2716 0.1568 0.4434 ( 32654 PWs) bands (ev): -15.9572 -15.9572 -15.9559 -15.9559 -9.8271 -9.8271 -8.3872 -8.3872 -8.2576 -8.2576 -8.1713 -8.1713 -8.0045 -8.0045 -7.9885 -7.9885 -6.5902 -6.5902 -4.7226 -4.7226 -4.7129 -4.7129 -3.3070 -3.3070 -3.2863 -3.2863 -3.2764 -3.2764 -3.2626 -3.2626 -1.0862 -1.0862 -0.8441 -0.8441 -0.6278 -0.6278 0.9099 0.9099 0.9455 0.9455 1.3228 1.3228 1.5893 1.5893 1.6362 1.6362 1.8434 1.8434 1.9232 1.9232 2.0302 2.0302 2.1373 2.1373 2.4149 2.4149 2.5540 2.5540 2.8545 2.8545 2.8911 2.8911 2.9564 2.9564 3.1735 3.1735 5.0249 5.0249 5.5697 5.5697 6.0019 6.0019 8.4241 8.4241 8.7302 8.7302 8.7422 8.7422 8.8249 8.8249 k = 0.2586 0.1493 0.4223 ( 32644 PWs) bands (ev): -15.9574 -15.9574 -15.9557 -15.9557 -9.8293 -9.8293 -8.3848 -8.3848 -8.2571 -8.2571 -8.1678 -8.1678 -8.0077 -8.0077 -7.9806 -7.9806 -6.5987 -6.5987 -4.7252 -4.7252 -4.7136 -4.7136 -3.3118 -3.3118 -3.2874 -3.2874 -3.2807 -3.2807 -3.2634 -3.2634 -1.0899 -1.0899 -0.8505 -0.8505 -0.6283 -0.6283 0.9136 0.9136 0.9459 0.9459 1.3365 1.3365 1.6009 1.6009 1.6295 1.6295 1.8434 1.8434 1.9335 1.9335 2.0431 2.0431 2.1514 2.1514 2.4348 2.4348 2.5546 2.5546 2.8624 2.8624 2.9135 2.9135 2.9786 2.9786 3.1568 3.1568 5.0116 5.0116 5.5555 5.5555 6.0010 6.0010 8.3711 8.3711 8.6488 8.6488 8.7066 8.7066 8.7309 8.7309 k = 0.2457 0.1418 0.4012 ( 32616 PWs) bands (ev): -15.9575 -15.9575 -15.9556 -15.9556 -9.8316 -9.8316 -8.3812 -8.3812 -8.2566 -8.2566 -8.1660 -8.1660 -8.0090 -8.0090 -7.9732 -7.9732 -6.6081 -6.6081 -4.7280 -4.7280 -4.7145 -4.7145 -3.3167 -3.3167 -3.2889 -3.2889 -3.2854 -3.2854 -3.2646 -3.2646 -1.0919 -1.0919 -0.8567 -0.8567 -0.6322 -0.6322 0.9139 0.9139 0.9494 0.9494 1.3517 1.3517 1.6079 1.6079 1.6292 1.6292 1.8434 1.8434 1.9496 1.9496 2.0567 2.0567 2.1655 2.1655 2.4555 2.4555 2.5561 2.5561 2.8622 2.8622 2.9413 2.9413 3.0031 3.0031 3.1418 3.1418 5.0012 5.0012 5.5408 5.5408 5.9939 5.9939 8.3190 8.3190 8.5644 8.5644 8.6298 8.6298 8.6770 8.6770 k = 0.2328 0.1344 0.3801 ( 32610 PWs) bands (ev): -15.9577 -15.9577 -15.9554 -15.9554 -9.8342 -9.8342 -8.3763 -8.3763 -8.2560 -8.2560 -8.1661 -8.1661 -8.0083 -8.0083 -7.9663 -7.9663 -6.6182 -6.6182 -4.7310 -4.7310 -4.7155 -4.7155 -3.3217 -3.3217 -3.2919 -3.2919 -3.2892 -3.2892 -3.2661 -3.2661 -1.0922 -1.0922 -0.8627 -0.8627 -0.6396 -0.6396 0.9127 0.9127 0.9545 0.9545 1.3679 1.3679 1.6028 1.6028 1.6428 1.6428 1.8448 1.8448 1.9695 1.9695 2.0710 2.0710 2.1792 2.1792 2.4761 2.4761 2.5594 2.5594 2.8594 2.8594 2.9701 2.9701 3.0267 3.0267 3.1306 3.1306 4.9936 4.9936 5.5258 5.5258 5.9806 5.9806 8.2680 8.2680 8.4786 8.4786 8.5397 8.5397 8.6360 8.6360 k = 0.2198 0.1269 0.3590 ( 32626 PWs) bands (ev): -15.9578 -15.9578 -15.9553 -15.9553 -9.8369 -9.8369 -8.3703 -8.3703 -8.2553 -8.2553 -8.1680 -8.1680 -8.0055 -8.0055 -7.9599 -7.9599 -6.6290 -6.6290 -4.7341 -4.7341 -4.7166 -4.7166 -3.3267 -3.3267 -3.2972 -3.2972 -3.2910 -3.2910 -3.2681 -3.2681 -1.0908 -1.0908 -0.8683 -0.8683 -0.6502 -0.6502 0.9115 0.9115 0.9597 0.9597 1.3842 1.3842 1.5934 1.5934 1.6633 1.6633 1.8483 1.8483 1.9916 1.9916 2.0857 2.0857 2.1923 2.1923 2.4959 2.4959 2.5654 2.5654 2.8563 2.8563 2.9965 2.9965 3.0469 3.0469 3.1269 3.1269 4.9886 4.9886 5.5107 5.5107 5.9612 5.9612 8.2182 8.2182 8.3923 8.3923 8.4524 8.4524 8.5922 8.5922 k = 0.2069 0.1195 0.3379 ( 32626 PWs) bands (ev): -15.9580 -15.9580 -15.9552 -15.9552 -9.8398 -9.8398 -8.3633 -8.3633 -8.2545 -8.2545 -8.1714 -8.1714 -8.0011 -8.0011 -7.9540 -7.9540 -6.6404 -6.6404 -4.7372 -4.7372 -4.7178 -4.7178 -3.3317 -3.3317 -3.3032 -3.3032 -3.2926 -3.2926 -3.2704 -3.2704 -1.0879 -1.0879 -0.8736 -0.8736 -0.6637 -0.6637 0.9110 0.9110 0.9643 0.9643 1.3995 1.3995 1.5835 1.5835 1.6880 1.6880 1.8537 1.8537 2.0149 2.0149 2.1007 2.1007 2.2049 2.2049 2.5137 2.5137 2.5756 2.5756 2.8537 2.8537 3.0142 3.0142 3.0657 3.0657 3.1346 3.1346 4.9859 4.9859 5.4958 5.4958 5.9360 5.9360 8.1694 8.1694 8.3065 8.3065 8.3687 8.3687 8.5458 8.5458 k = 0.1940 0.1120 0.3167 ( 32644 PWs) bands (ev): -15.9582 -15.9582 -15.9551 -15.9551 -9.8428 -9.8428 -8.3553 -8.3553 -8.2537 -8.2537 -8.1760 -8.1760 -7.9952 -7.9952 -7.9485 -7.9485 -6.6524 -6.6524 -4.7405 -4.7405 -4.7191 -4.7191 -3.3366 -3.3366 -3.3096 -3.3096 -3.2942 -3.2942 -3.2730 -3.2730 -1.0836 -1.0836 -0.8784 -0.8784 -0.6795 -0.6795 0.9115 0.9115 0.9680 0.9680 1.4128 1.4128 1.5747 1.5747 1.7161 1.7161 1.8604 1.8604 2.0385 2.0385 2.1157 2.1157 2.2172 2.2172 2.5287 2.5287 2.5908 2.5908 2.8521 2.8521 3.0177 3.0177 3.0895 3.0895 3.1521 3.1521 4.9849 4.9849 5.4812 5.4812 5.9054 5.9054 8.1213 8.1213 8.2224 8.2224 8.2890 8.2890 8.4975 8.4975 k = 0.1810 0.1045 0.2956 ( 32646 PWs) bands (ev): -15.9583 -15.9583 -15.9549 -15.9549 -9.8458 -9.8458 -8.3466 -8.3466 -8.2528 -8.2528 -8.1816 -8.1816 -7.9883 -7.9883 -7.9434 -7.9434 -6.6648 -6.6648 -4.7438 -4.7438 -4.7206 -4.7206 -3.3414 -3.3414 -3.3161 -3.3161 -3.2958 -3.2958 -3.2759 -3.2759 -1.0781 -1.0781 -0.8826 -0.8826 -0.6972 -0.6972 0.9130 0.9130 0.9707 0.9707 1.4225 1.4225 1.5684 1.5684 1.7472 1.7472 1.8682 1.8682 2.0619 2.0619 2.1302 2.1302 2.2298 2.2298 2.5414 2.5414 2.6103 2.6103 2.8517 2.8517 3.0120 3.0120 3.1180 3.1180 3.1746 3.1746 4.9853 4.9853 5.4673 5.4673 5.8702 5.8702 8.0723 8.0723 8.1418 8.1418 8.2135 8.2135 8.4484 8.4484 k = 0.1681 0.0971 0.2745 ( 32622 PWs) bands (ev): -15.9585 -15.9585 -15.9548 -15.9548 -9.8489 -9.8489 -8.3373 -8.3373 -8.2519 -8.2519 -8.1877 -8.1877 -7.9807 -7.9807 -7.9388 -7.9388 -6.6775 -6.6775 -4.7471 -4.7471 -4.7220 -4.7220 -3.3461 -3.3461 -3.3228 -3.3228 -3.2975 -3.2975 -3.2791 -3.2791 -1.0716 -1.0716 -0.8863 -0.8863 -0.7163 -0.7163 0.9153 0.9153 0.9723 0.9723 1.4278 1.4278 1.5655 1.5655 1.7798 1.7798 1.8772 1.8772 2.0846 2.0846 2.1441 2.1441 2.2432 2.2432 2.5532 2.5532 2.6329 2.6329 2.8525 2.8525 3.0027 3.0027 3.1480 3.1480 3.1991 3.1991 4.9863 4.9863 5.4544 5.4544 5.8309 5.8309 8.0178 8.0178 8.0701 8.0701 8.1423 8.1423 8.3993 8.3993 k = 0.1552 0.0896 0.2534 ( 32628 PWs) bands (ev): -15.9586 -15.9586 -15.9547 -15.9547 -9.8519 -9.8519 -8.3276 -8.3276 -8.2510 -8.2510 -8.1941 -8.1941 -7.9727 -7.9727 -7.9345 -7.9345 -6.6904 -6.6904 -4.7503 -4.7503 -4.7236 -4.7236 -3.3506 -3.3506 -3.3296 -3.3296 -3.2991 -3.2991 -3.2824 -3.2824 -1.0645 -1.0645 -0.8892 -0.8892 -0.7360 -0.7360 0.9184 0.9184 0.9728 0.9728 1.4285 1.4285 1.5659 1.5659 1.8115 1.8115 1.8888 1.8888 2.1055 2.1055 2.1579 2.1579 2.2578 2.2578 2.5648 2.5648 2.6571 2.6571 2.8547 2.8547 2.9923 2.9923 3.1783 3.1783 3.2241 3.2241 4.9873 4.9873 5.4427 5.4427 5.7886 5.7886 7.9516 7.9516 8.0139 8.0139 8.0758 8.0758 8.3514 8.3514 k = 0.1422 0.0821 0.2323 ( 32652 PWs) bands (ev): -15.9588 -15.9588 -15.9546 -15.9546 -9.8549 -9.8549 -8.3176 -8.3176 -8.2501 -8.2501 -8.2006 -8.2006 -7.9646 -7.9646 -7.9307 -7.9307 -6.7032 -6.7032 -4.7535 -4.7535 -4.7251 -4.7251 -3.3548 -3.3548 -3.3362 -3.3362 -3.3007 -3.3007 -3.2858 -3.2858 -1.0573 -1.0573 -0.8913 -0.8913 -0.7558 -0.7558 0.9221 0.9221 0.9724 0.9724 1.4255 1.4255 1.5685 1.5685 1.8377 1.8377 1.9067 1.9067 2.1227 2.1227 2.1735 2.1735 2.2737 2.2737 2.5769 2.5769 2.6822 2.6822 2.8582 2.8582 2.9817 2.9817 3.2081 3.2081 3.2492 3.2492 4.9876 4.9876 5.4327 5.4327 5.7441 5.7441 7.8790 7.8790 7.9683 7.9683 8.0140 8.0140 8.3053 8.3053 k = 0.1293 0.0747 0.2112 ( 32658 PWs) bands (ev): -15.9589 -15.9589 -15.9545 -15.9545 -9.8578 -9.8578 -8.3076 -8.3076 -8.2492 -8.2492 -8.2068 -8.2068 -7.9566 -7.9566 -7.9272 -7.9272 -6.7159 -6.7159 -4.7565 -4.7565 -4.7266 -4.7266 -3.3589 -3.3589 -3.3427 -3.3427 -3.3022 -3.3022 -3.2893 -3.2893 -1.0501 -1.0501 -0.8926 -0.8926 -0.7752 -0.7752 0.9261 0.9261 0.9712 0.9712 1.4201 1.4201 1.5716 1.5716 1.8546 1.8546 1.9337 1.9337 2.1346 2.1346 2.1929 2.1929 2.2904 2.2904 2.5892 2.5892 2.7076 2.7076 2.8626 2.8626 2.9712 2.9712 3.2372 3.2372 3.2737 3.2737 4.9866 4.9866 5.4245 5.4245 5.6986 5.6986 7.8068 7.8068 7.9273 7.9273 7.9571 7.9571 8.2618 8.2618 k = 0.1164 0.0672 0.1900 ( 32675 PWs) bands (ev): -15.9590 -15.9590 -15.9544 -15.9544 -9.8605 -9.8605 -8.2978 -8.2978 -8.2483 -8.2483 -8.2128 -8.2128 -7.9489 -7.9489 -7.9241 -7.9241 -6.7281 -6.7281 -4.7594 -4.7594 -4.7281 -4.7281 -3.3626 -3.3626 -3.3490 -3.3490 -3.3036 -3.3036 -3.2927 -3.2927 -1.0436 -1.0436 -0.8929 -0.8929 -0.7936 -0.7936 0.9303 0.9303 0.9694 0.9694 1.4137 1.4137 1.5740 1.5740 1.8644 1.8644 1.9667 1.9667 2.1417 2.1417 2.2161 2.2161 2.3073 2.3073 2.6016 2.6016 2.7328 2.7328 2.8677 2.8677 2.9609 2.9609 3.2652 3.2652 3.2974 3.2974 4.9836 4.9836 5.4183 5.4183 5.6533 5.6533 7.7375 7.7375 7.8887 7.8887 7.9053 7.9053 8.2213 8.2213 k = 0.1034 0.0597 0.1689 ( 32685 PWs) bands (ev): -15.9591 -15.9591 -15.9544 -15.9544 -9.8631 -9.8631 -8.2884 -8.2884 -8.2474 -8.2474 -8.2183 -8.2183 -7.9416 -7.9416 -7.9213 -7.9213 -6.7398 -6.7398 -4.7621 -4.7621 -4.7295 -4.7295 -3.3660 -3.3660 -3.3549 -3.3549 -3.3050 -3.3050 -3.2960 -3.2960 -1.0379 -1.0379 -0.8923 -0.8923 -0.8107 -0.8107 0.9345 0.9345 0.9672 0.9672 1.4071 1.4071 1.5748 1.5748 1.8709 1.8709 2.0012 2.0012 2.1456 2.1456 2.2418 2.2418 2.3238 2.3238 2.6139 2.6139 2.7574 2.7574 2.8732 2.8732 2.9511 2.9511 3.2920 3.2920 3.3199 3.3199 4.9782 4.9782 5.4142 5.4142 5.6094 5.6094 7.6726 7.6726 7.8513 7.8513 7.8593 7.8593 8.1842 8.1842 k = 0.0905 0.0523 0.1478 ( 32691 PWs) bands (ev): -15.9592 -15.9592 -15.9543 -15.9543 -9.8655 -9.8655 -8.2796 -8.2796 -8.2465 -8.2465 -8.2233 -8.2233 -7.9349 -7.9349 -7.9189 -7.9189 -6.7508 -6.7508 -4.7646 -4.7646 -4.7309 -4.7309 -3.3691 -3.3691 -3.3603 -3.3603 -3.3063 -3.3063 -3.2992 -3.2992 -1.0335 -1.0335 -0.8906 -0.8906 -0.8260 -0.8260 0.9384 0.9384 0.9647 0.9647 1.4008 1.4008 1.5740 1.5740 1.8760 1.8760 2.0343 2.0343 2.1477 2.1477 2.2687 2.2687 2.3394 2.3394 2.6256 2.6256 2.7809 2.7809 2.8783 2.8783 2.9417 2.9417 3.3174 3.3174 3.3410 3.3410 4.9705 4.9705 5.4122 5.4122 5.5681 5.5681 7.6130 7.6130 7.8139 7.8139 7.8203 7.8203 8.1508 8.1508 k = 0.0776 0.0448 0.1267 ( 32699 PWs) bands (ev): -15.9593 -15.9593 -15.9542 -15.9542 -9.8676 -9.8676 -8.2719 -8.2719 -8.2456 -8.2456 -8.2276 -8.2276 -7.9289 -7.9289 -7.9168 -7.9168 -6.7607 -6.7607 -4.7668 -4.7668 -4.7321 -4.7321 -3.3719 -3.3719 -3.3652 -3.3652 -3.3074 -3.3074 -3.3020 -3.3020 -1.0305 -1.0305 -0.8882 -0.8882 -0.8393 -0.8393 0.9421 0.9421 0.9621 0.9621 1.3952 1.3952 1.5716 1.5716 1.8805 1.8805 2.0642 2.0642 2.1488 2.1488 2.2958 2.2958 2.3536 2.3536 2.6365 2.6365 2.8030 2.8030 2.8827 2.8827 2.9332 2.9332 3.3410 3.3410 3.3601 3.3601 4.9606 4.9606 5.4118 5.4118 5.5305 5.5305 7.5595 7.5595 7.7785 7.7785 7.7867 7.7867 8.1214 8.1214 k = 0.0647 0.0373 0.1056 ( 32687 PWs) bands (ev): -15.9594 -15.9594 -15.9542 -15.9542 -9.8694 -9.8694 -8.2654 -8.2654 -8.2445 -8.2445 -8.2311 -8.2311 -7.9236 -7.9236 -7.9151 -7.9151 -6.7695 -6.7695 -4.7688 -4.7688 -4.7332 -4.7332 -3.3742 -3.3742 -3.3695 -3.3695 -3.3084 -3.3084 -3.3046 -3.3046 -1.0286 -1.0286 -0.8853 -0.8853 -0.8505 -0.8505 0.9453 0.9453 0.9596 0.9596 1.3904 1.3904 1.5681 1.5681 1.8847 1.8847 2.0902 2.0902 2.1493 2.1493 2.3220 2.3220 2.3660 2.3660 2.6463 2.6463 2.8233 2.8233 2.8855 2.8855 2.9260 2.9260 3.3624 3.3624 3.3770 3.3770 4.9493 4.9493 5.4128 5.4128 5.4975 5.4975 7.5128 7.5128 7.7478 7.7478 7.7564 7.7564 8.0963 8.0963 k = 0.0517 0.0299 0.0845 ( 32689 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8710 -9.8710 -8.2606 -8.2606 -8.2431 -8.2431 -8.2338 -8.2338 -7.9192 -7.9192 -7.9137 -7.9137 -6.7770 -6.7770 -4.7704 -4.7704 -4.7341 -4.7341 -3.3761 -3.3761 -3.3730 -3.3730 -3.3092 -3.3092 -3.3067 -3.3067 -1.0278 -1.0278 -0.8822 -0.8822 -0.8594 -0.8594 0.9480 0.9480 0.9574 0.9574 1.3865 1.3865 1.5641 1.5641 1.8884 1.8884 2.1115 2.1115 2.1494 2.1494 2.3461 2.3461 2.3766 2.3766 2.6547 2.6547 2.8412 2.8412 2.8861 2.8861 2.9206 2.9206 3.3812 3.3812 3.3913 3.3913 4.9374 4.9374 5.4145 5.4145 5.4699 5.4699 7.4736 7.4736 7.7225 7.7225 7.7297 7.7297 8.0755 8.0755 k = 0.0388 0.0224 0.0633 ( 32671 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8722 -9.8722 -8.2575 -8.2575 -8.2413 -8.2413 -8.2357 -8.2357 -7.9157 -7.9157 -7.9126 -7.9126 -6.7830 -6.7830 -4.7717 -4.7717 -4.7348 -4.7348 -3.3777 -3.3777 -3.3759 -3.3759 -3.3099 -3.3099 -3.3085 -3.3085 -1.0277 -1.0277 -0.8792 -0.8792 -0.8663 -0.8663 0.9501 0.9501 0.9555 0.9555 1.3835 1.3835 1.5603 1.5603 1.8916 1.8916 2.1281 2.1281 2.1495 2.1495 2.3666 2.3666 2.3849 2.3849 2.6614 2.6614 2.8565 2.8565 2.8847 2.8847 2.9171 2.9171 3.3967 3.3967 3.4028 3.4028 4.9263 4.9263 5.4165 5.4165 5.4482 5.4482 7.4425 7.4425 7.7027 7.7027 7.7076 7.7076 8.0593 8.0593 k = 0.0259 0.0149 0.0422 ( 32675 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8731 -9.8731 -8.2560 -8.2560 -8.2395 -8.2395 -8.2369 -8.2369 -7.9132 -7.9132 -7.9118 -7.9118 -6.7873 -6.7873 -4.7726 -4.7726 -4.7353 -4.7353 -3.3788 -3.3788 -3.3780 -3.3780 -3.3104 -3.3104 -3.3097 -3.3097 -1.0280 -1.0280 -0.8769 -0.8769 -0.8710 -0.8710 0.9516 0.9516 0.9541 0.9541 1.3814 1.3814 1.5572 1.5572 1.8940 1.8940 2.1399 2.1399 2.1494 2.1494 2.3825 2.3825 2.3910 2.3910 2.6664 2.6664 2.8686 2.8686 2.8824 2.8824 2.9147 2.9147 3.4083 3.4083 3.4112 3.4112 4.9171 4.9171 5.4183 5.4183 5.4326 5.4326 7.4199 7.4199 7.6885 7.6885 7.6910 7.6910 8.0477 8.0477 k = 0.0129 0.0075 0.0211 ( 32663 PWs) bands (ev): -15.9596 -15.9596 -15.9540 -15.9540 -9.8736 -9.8736 -8.2554 -8.2554 -8.2382 -8.2382 -8.2375 -8.2375 -7.9117 -7.9117 -7.9113 -7.9113 -6.7900 -6.7900 -4.7732 -4.7732 -4.7356 -4.7356 -3.3794 -3.3794 -3.3792 -3.3792 -3.3107 -3.3107 -3.3105 -3.3105 -1.0282 -1.0282 -0.8753 -0.8753 -0.8739 -0.8739 0.9526 0.9526 0.9532 0.9532 1.3801 1.3801 1.5551 1.5551 1.8955 1.8955 2.1470 2.1470 2.1494 2.1494 2.3925 2.3925 2.3947 2.3947 2.6694 2.6694 2.8766 2.8766 2.8803 2.8803 2.9131 2.9131 3.4156 3.4156 3.4163 3.4163 4.9111 4.9111 5.4196 5.4196 5.4232 5.4232 7.4062 7.4062 7.6800 7.6800 7.6806 7.6806 8.0408 8.0408 k = 0.0000 0.0000 0.0000 ( 32647 PWs) bands (ev): -15.9596 -15.9596 -15.9540 -15.9540 -9.8738 -9.8738 -8.2552 -8.2552 -8.2377 -8.2377 -8.2377 -8.2377 -7.9112 -7.9112 -7.9112 -7.9112 -6.7909 -6.7909 -4.7733 -4.7733 -4.7358 -4.7358 -3.3796 -3.3796 -3.3796 -3.3796 -3.3108 -3.3108 -3.3108 -3.3108 -1.0284 -1.0284 -0.8748 -0.8748 -0.8748 -0.8748 0.9529 0.9529 0.9529 0.9529 1.3797 1.3797 1.5544 1.5544 1.8961 1.8961 2.1493 2.1493 2.1493 2.1493 2.3959 2.3959 2.3959 2.3959 2.6704 2.6704 2.8796 2.8796 2.8796 2.8796 2.9124 2.9124 3.4180 3.4180 3.4180 3.4180 4.9090 4.9090 5.4200 5.4200 5.4200 5.4200 7.4016 7.4016 7.6771 7.6771 7.6771 7.6771 8.0385 8.0385 k = 0.0000 0.0000 0.0000 ( 32647 PWs) bands (ev): -15.9596 -15.9596 -15.9540 -15.9540 -9.8738 -9.8738 -8.2552 -8.2552 -8.2377 -8.2377 -8.2377 -8.2377 -7.9112 -7.9112 -7.9112 -7.9112 -6.7909 -6.7909 -4.7733 -4.7733 -4.7358 -4.7358 -3.3796 -3.3796 -3.3796 -3.3796 -3.3108 -3.3108 -3.3108 -3.3108 -1.0284 -1.0284 -0.8748 -0.8748 -0.8748 -0.8748 0.9529 0.9529 0.9529 0.9529 1.3797 1.3797 1.5544 1.5544 1.8961 1.8961 2.1493 2.1493 2.1493 2.1493 2.3959 2.3959 2.3959 2.3959 2.6704 2.6704 2.8796 2.8796 2.8796 2.8796 2.9124 2.9124 3.4180 3.4180 3.4180 3.4180 4.9090 4.9090 5.4200 5.4200 5.4200 5.4200 7.4016 7.4016 7.6771 7.6771 7.6771 7.6771 8.0385 8.0385 k = 0.0208 0.0120 0.0085 ( 32665 PWs) bands (ev): -15.9596 -15.9596 -15.9540 -15.9540 -9.8736 -9.8736 -8.2554 -8.2554 -8.2382 -8.2382 -8.2375 -8.2375 -7.9115 -7.9115 -7.9115 -7.9115 -6.7900 -6.7900 -4.7732 -4.7732 -4.7356 -4.7356 -3.3794 -3.3794 -3.3792 -3.3792 -3.3107 -3.3107 -3.3105 -3.3105 -1.0283 -1.0283 -0.8754 -0.8754 -0.8738 -0.8738 0.9527 0.9527 0.9530 0.9530 1.3801 1.3801 1.5551 1.5551 1.8955 1.8955 2.1469 2.1469 2.1495 2.1495 2.3934 2.3934 2.3939 2.3939 2.6694 2.6694 2.8765 2.8765 2.8806 2.8806 2.9130 2.9130 3.4157 3.4157 3.4163 3.4163 4.9111 4.9111 5.4194 5.4194 5.4234 5.4234 7.4061 7.4061 7.6801 7.6801 7.6803 7.6803 8.0408 8.0408 k = 0.0417 0.0241 0.0170 ( 32659 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8731 -9.8731 -8.2560 -8.2560 -8.2395 -8.2395 -8.2368 -8.2368 -7.9125 -7.9125 -7.9125 -7.9125 -6.7874 -6.7874 -4.7726 -4.7726 -4.7353 -4.7353 -3.3788 -3.3788 -3.3780 -3.3780 -3.3104 -3.3104 -3.3097 -3.3097 -1.0280 -1.0280 -0.8772 -0.8772 -0.8708 -0.8708 0.9522 0.9522 0.9535 0.9535 1.3813 1.3813 1.5571 1.5571 1.8941 1.8941 2.1397 2.1397 2.1500 2.1500 2.3861 2.3861 2.3878 2.3878 2.6665 2.6665 2.8679 2.8679 2.8837 2.8837 2.9143 2.9143 3.4090 3.4090 3.4110 3.4110 4.9168 4.9168 5.4175 5.4175 5.4332 5.4332 7.4194 7.4194 7.6890 7.6890 7.6897 7.6897 8.0477 8.0477 k = 0.0625 0.0361 0.0255 ( 32689 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8722 -9.8722 -8.2579 -8.2579 -8.2409 -8.2409 -8.2356 -8.2356 -7.9141 -7.9141 -7.9140 -7.9140 -6.7832 -6.7832 -4.7717 -4.7717 -4.7348 -4.7348 -3.3778 -3.3778 -3.3759 -3.3759 -3.3100 -3.3100 -3.3085 -3.3085 -1.0279 -1.0279 -0.8797 -0.8797 -0.8658 -0.8658 0.9513 0.9513 0.9543 0.9543 1.3834 1.3834 1.5601 1.5601 1.8917 1.8917 2.1276 2.1276 2.1507 2.1507 2.3742 2.3742 2.3779 2.3779 2.6617 2.6617 2.8553 2.8553 2.8885 2.8885 2.9153 2.9153 3.3981 3.3981 3.4025 3.4025 4.9254 4.9254 5.4151 5.4151 5.4493 5.4493 7.4414 7.4414 7.7035 7.7035 7.7050 7.7050 8.0595 8.0595 k = 0.0833 0.0481 0.0340 ( 32668 PWs) bands (ev): -15.9595 -15.9595 -15.9541 -15.9541 -9.8711 -9.8711 -8.2617 -8.2617 -8.2415 -8.2415 -8.2340 -8.2340 -7.9164 -7.9164 -7.9162 -7.9162 -6.7774 -6.7774 -4.7705 -4.7705 -4.7341 -4.7341 -3.3764 -3.3764 -3.3730 -3.3730 -3.3094 -3.3094 -3.3067 -3.3067 -1.0284 -1.0284 -0.8824 -0.8824 -0.8588 -0.8588 0.9501 0.9501 0.9553 0.9553 1.3862 1.3862 1.5638 1.5638 1.8887 1.8887 2.1110 2.1110 2.1514 2.1514 2.3586 2.3586 2.3644 2.3644 2.6551 2.6551 2.8393 2.8393 2.8946 2.8946 2.9158 2.9158 3.3835 3.3835 3.3911 3.3911 4.9351 4.9351 5.4133 5.4133 5.4712 5.4712 7.4716 7.4716 7.7230 7.7230 7.7256 7.7256 8.0763 8.0763 k = 0.1042 0.0601 0.0425 ( 32674 PWs) bands (ev): -15.9594 -15.9594 -15.9542 -15.9542 -9.8696 -9.8696 -8.2678 -8.2678 -8.2409 -8.2409 -8.2319 -8.2319 -7.9192 -7.9192 -7.9190 -7.9190 -6.7701 -6.7701 -4.7689 -4.7689 -4.7332 -4.7332 -3.3747 -3.3747 -3.3694 -3.3694 -3.3087 -3.3087 -3.3045 -3.3045 -1.0302 -1.0302 -0.8844 -0.8844 -0.8500 -0.8500 0.9485 0.9485 0.9565 0.9565 1.3900 1.3900 1.5675 1.5675 1.8852 1.8852 2.0901 2.0901 2.1521 2.1521 2.3397 2.3397 2.3476 2.3476 2.6470 2.6470 2.8208 2.8208 2.9017 2.9017 2.9159 2.9159 3.3657 3.3657 3.3771 3.3771 4.9440 4.9440 5.4136 5.4136 5.4984 5.4984 7.5096 7.5096 7.7468 7.7468 7.7508 7.7508 8.0976 8.0976 k = 0.1250 0.0722 0.0510 ( 32677 PWs) bands (ev): -15.9593 -15.9593 -15.9542 -15.9542 -9.8678 -9.8678 -8.2758 -8.2758 -8.2392 -8.2392 -8.2294 -8.2294 -7.9227 -7.9227 -7.9224 -7.9224 -6.7616 -6.7616 -4.7670 -4.7670 -4.7322 -4.7322 -3.3726 -3.3726 -3.3651 -3.3651 -3.3079 -3.3079 -3.3020 -3.3020 -1.0340 -1.0340 -0.8849 -0.8849 -0.8393 -0.8393 0.9465 0.9465 0.9579 0.9579 1.3946 1.3946 1.5705 1.5705 1.8815 1.8815 2.0651 2.0651 2.1523 2.1523 2.3182 2.3182 2.3283 2.3283 2.6374 2.6374 2.8003 2.8003 2.9092 2.9092 2.9159 2.9159 3.3454 3.3454 3.3610 3.3610 4.9497 4.9497 5.4175 5.4175 5.5301 5.5301 7.5546 7.5546 7.7741 7.7741 7.7797 7.7797 8.1229 8.1229 k = 0.1458 0.0842 0.0595 ( 32659 PWs) bands (ev): -15.9592 -15.9592 -15.9543 -15.9543 -9.8657 -9.8657 -8.2853 -8.2853 -8.2368 -8.2368 -8.2265 -8.2265 -7.9267 -7.9267 -7.9263 -7.9263 -6.7521 -6.7521 -4.7648 -4.7648 -4.7310 -4.7310 -3.3701 -3.3701 -3.3601 -3.3601 -3.3070 -3.3070 -3.2990 -3.2990 -1.0402 -1.0402 -0.8832 -0.8832 -0.8270 -0.8270 0.9441 0.9441 0.9594 0.9594 1.4002 1.4002 1.5720 1.5720 1.8777 1.8777 2.0366 2.0366 2.1519 2.1519 2.2947 2.2947 2.3072 2.3072 2.6266 2.6266 2.7787 2.7787 2.9163 2.9163 2.9170 2.9170 3.3230 3.3230 3.3434 3.3434 4.9500 4.9500 5.4268 5.4268 5.5657 5.5657 7.6059 7.6059 7.8043 7.8043 7.8116 7.8116 8.1514 8.1514 k = 0.1667 0.0962 0.0680 ( 32680 PWs) bands (ev): -15.9591 -15.9591 -15.9544 -15.9544 -9.8634 -9.8634 -8.2960 -8.2960 -8.2339 -8.2339 -8.2232 -8.2232 -7.9312 -7.9312 -7.9307 -7.9307 -6.7416 -6.7416 -4.7624 -4.7624 -4.7298 -4.7298 -3.3674 -3.3674 -3.3546 -3.3546 -3.3060 -3.3060 -3.2958 -3.2958 -1.0491 -1.0491 -0.8788 -0.8788 -0.8131 -0.8131 0.9413 0.9413 0.9610 0.9610 1.4067 1.4067 1.5714 1.5714 1.8738 1.8738 2.0051 2.0051 2.1503 2.1503 2.2697 2.2697 2.2851 2.2851 2.6144 2.6144 2.7569 2.7569 2.9175 2.9175 2.9246 2.9246 3.2992 3.2992 3.3247 3.3247 4.9436 4.9436 5.4423 5.4423 5.6043 5.6043 7.6628 7.6628 7.8366 7.8366 7.8457 7.8457 8.1822 8.1822 k = 0.1875 0.1083 0.0765 ( 32679 PWs) bands (ev): -15.9590 -15.9590 -15.9544 -15.9544 -9.8609 -9.8609 -8.3075 -8.3075 -8.2304 -8.2304 -8.2195 -8.2195 -7.9362 -7.9362 -7.9356 -7.9356 -6.7304 -6.7304 -4.7598 -4.7598 -4.7284 -4.7284 -3.3643 -3.3643 -3.3485 -3.3485 -3.3051 -3.3051 -3.2923 -3.2923 -1.0605 -1.0605 -0.8717 -0.8717 -0.7978 -0.7978 0.9382 0.9382 0.9624 0.9624 1.4142 1.4142 1.5681 1.5681 1.8695 1.8695 1.9714 1.9714 2.1472 2.1472 2.2436 2.2436 2.2632 2.2632 2.6008 2.6008 2.7362 2.7362 2.9198 2.9198 2.9319 2.9319 3.2741 3.2741 3.3053 3.3053 4.9296 4.9296 5.4642 5.4642 5.6452 5.6452 7.7240 7.7240 7.8707 7.8707 7.8814 7.8814 8.2140 8.2140 k = 0.2083 0.1203 0.0851 ( 32664 PWs) bands (ev): -15.9589 -15.9589 -15.9545 -15.9545 -9.8583 -9.8583 -8.3196 -8.3196 -8.2265 -8.2265 -8.2155 -8.2155 -7.9416 -7.9416 -7.9409 -7.9409 -6.7188 -6.7188 -4.7570 -4.7570 -4.7270 -4.7270 -3.3611 -3.3611 -3.3421 -3.3421 -3.3041 -3.3041 -3.2887 -3.2887 -1.0740 -1.0740 -0.8621 -0.8621 -0.7813 -0.7813 0.9349 0.9349 0.9636 0.9636 1.4225 1.4225 1.5620 1.5620 1.8642 1.8642 1.9361 1.9361 2.1424 2.1424 2.2168 2.2168 2.2424 2.2424 2.5857 2.5857 2.7180 2.7180 2.9235 2.9235 2.9388 2.9388 3.2483 3.2483 3.2857 3.2857 4.9087 4.9087 5.4916 5.4916 5.6876 5.6876 7.7887 7.7887 7.9061 7.9061 7.9185 7.9185 8.2456 8.2456 k = 0.2292 0.1323 0.0936 ( 32652 PWs) bands (ev): -15.9588 -15.9588 -15.9546 -15.9546 -9.8555 -9.8555 -8.3320 -8.3320 -8.2223 -8.2223 -8.2111 -8.2111 -7.9473 -7.9473 -7.9465 -7.9465 -6.7068 -6.7068 -4.7541 -4.7541 -4.7257 -4.7257 -3.3576 -3.3576 -3.3354 -3.3354 -3.3033 -3.3033 -3.2849 -3.2849 -1.0889 -1.0889 -0.8506 -0.8506 -0.7637 -0.7637 0.9314 0.9314 0.9645 0.9645 1.4313 1.4313 1.5535 1.5535 1.8570 1.8570 1.9001 1.9001 2.1362 2.1362 2.1895 2.1895 2.2233 2.2233 2.5687 2.5687 2.7037 2.7037 2.9288 2.9288 2.9451 2.9451 3.2220 3.2220 3.2663 3.2663 4.8817 4.8817 5.5233 5.5233 5.7307 5.7307 7.8557 7.8557 7.9429 7.9429 7.9566 7.9566 8.2757 8.2757 k = 0.2500 0.1443 0.1021 ( 32634 PWs) bands (ev): -15.9586 -15.9586 -15.9547 -15.9547 -9.8527 -9.8527 -8.3446 -8.3446 -8.2178 -8.2178 -8.2065 -8.2065 -7.9533 -7.9533 -7.9524 -7.9524 -6.6949 -6.6949 -4.7510 -4.7510 -4.7243 -4.7243 -3.3539 -3.3539 -3.3284 -3.3284 -3.3025 -3.3025 -3.2812 -3.2812 -1.1048 -1.1048 -0.8376 -0.8376 -0.7453 -0.7453 0.9279 0.9279 0.9650 0.9650 1.4396 1.4396 1.5437 1.5437 1.8472 1.8472 1.8641 1.8641 2.1288 2.1288 2.1621 2.1621 2.2061 2.2061 2.5501 2.5501 2.6940 2.6940 2.9358 2.9358 2.9509 2.9509 3.1955 3.1955 3.2473 3.2473 4.8499 4.8499 5.5579 5.5579 5.7738 5.7738 7.9236 7.9236 7.9809 7.9809 7.9959 7.9959 8.3034 8.3034 k = 0.2708 0.1564 0.1106 ( 32646 PWs) bands (ev): -15.9585 -15.9585 -15.9548 -15.9548 -9.8498 -9.8498 -8.3570 -8.3570 -8.2131 -8.2131 -8.2017 -8.2017 -7.9595 -7.9595 -7.9586 -7.9586 -6.6831 -6.6831 -4.7479 -4.7479 -4.7230 -4.7230 -3.3502 -3.3502 -3.3214 -3.3214 -3.3018 -3.3018 -3.2775 -3.2775 -1.1210 -1.1210 -0.8236 -0.8236 -0.7264 -0.7264 0.9244 0.9244 0.9649 0.9649 1.4459 1.4459 1.5346 1.5346 1.8289 1.8289 1.8343 1.8343 2.1205 2.1205 2.1348 2.1348 2.1910 2.1910 2.5305 2.5305 2.6893 2.6893 2.9444 2.9444 2.9562 2.9562 3.1689 3.1689 3.2291 3.2291 4.8146 4.8146 5.5940 5.5940 5.8163 5.8163 7.9911 7.9911 8.0201 8.0201 8.0363 8.0363 8.3281 8.3281 k = 0.2917 0.1684 0.1191 ( 32649 PWs) bands (ev): -15.9583 -15.9583 -15.9550 -15.9550 -9.8469 -9.8469 -8.3691 -8.3691 -8.2082 -8.2082 -8.1967 -8.1967 -7.9659 -7.9659 -7.9648 -7.9648 -6.6716 -6.6716 -4.7448 -4.7448 -4.7217 -4.7217 -3.3463 -3.3463 -3.3143 -3.3143 -3.3014 -3.3014 -3.2740 -3.2740 -1.1371 -1.1371 -0.8089 -0.8089 -0.7073 -0.7073 0.9211 0.9211 0.9641 0.9641 1.4473 1.4473 1.5297 1.5297 1.7952 1.7952 1.8184 1.8184 2.1080 2.1080 2.1104 2.1104 2.1788 2.1788 2.5108 2.5108 2.6895 2.6895 2.9544 2.9544 2.9608 2.9608 3.1428 3.1428 3.2119 3.2119 4.7770 4.7770 5.6302 5.6302 5.8574 5.8574 8.0567 8.0567 8.0605 8.0605 8.0782 8.0782 8.3499 8.3499 k = 0.3125 0.1804 0.1276 ( 32619 PWs) bands (ev): -15.9582 -15.9582 -15.9551 -15.9551 -9.8442 -9.8442 -8.3807 -8.3807 -8.2032 -8.2032 -8.1917 -8.1917 -7.9723 -7.9723 -7.9712 -7.9712 -6.6607 -6.6607 -4.7417 -4.7417 -4.7206 -4.7206 -3.3424 -3.3424 -3.3074 -3.3074 -3.3011 -3.3011 -3.2707 -3.2707 -1.1528 -1.1528 -0.7940 -0.7940 -0.6883 -0.6883 0.9182 0.9182 0.9626 0.9626 1.4413 1.4413 1.5316 1.5316 1.7636 1.7636 1.8005 1.8005 2.0821 2.0821 2.0967 2.0967 2.1709 2.1709 2.4916 2.4916 2.6939 2.6939 2.9650 2.9650 2.9651 2.9651 3.1175 3.1175 3.1958 3.1958 4.7384 4.7384 5.6657 5.6657 5.8966 5.8966 8.1022 8.1022 8.1157 8.1157 8.1248 8.1248 8.3689 8.3689 k = 0.3333 0.1925 0.1361 ( 32607 PWs) bands (ev): -15.9580 -15.9580 -15.9552 -15.9552 -9.8415 -9.8415 -8.3916 -8.3916 -8.1982 -8.1982 -8.1866 -8.1866 -7.9786 -7.9786 -7.9774 -7.9774 -6.6504 -6.6504 -4.7387 -4.7387 -4.7197 -4.7197 -3.3385 -3.3385 -3.3011 -3.3011 -3.3006 -3.3006 -3.2677 -3.2677 -1.1676 -1.1676 -0.7793 -0.7793 -0.6697 -0.6697 0.9157 0.9157 0.9604 0.9604 1.4290 1.4290 1.5398 1.5398 1.7347 1.7347 1.7820 1.7820 2.0574 2.0574 2.0781 2.0781 2.1677 2.1677 2.4737 2.4737 2.7020 2.7020 2.9686 2.9686 2.9755 2.9755 3.0941 3.0941 3.1810 3.1810 4.6998 4.6998 5.6995 5.6995 5.9333 5.9333 8.1450 8.1450 8.1620 8.1620 8.1809 8.1809 8.3853 8.3853 k = 0.3542 0.2045 0.1446 ( 32643 PWs) bands (ev): -15.9578 -15.9578 -15.9554 -15.9554 -9.8390 -9.8390 -8.4017 -8.4017 -8.1933 -8.1933 -8.1816 -8.1816 -7.9847 -7.9847 -7.9835 -7.9835 -6.6410 -6.6410 -4.7358 -4.7358 -4.7189 -4.7189 -3.3346 -3.3346 -3.3013 -3.3013 -3.2942 -3.2942 -3.2651 -3.2651 -1.1813 -1.1813 -0.7652 -0.7652 -0.6520 -0.6520 0.9136 0.9136 0.9575 0.9575 1.4133 1.4133 1.5512 1.5512 1.7090 1.7090 1.7648 1.7648 2.0342 2.0342 2.0551 2.0551 2.1683 2.1683 2.4574 2.4574 2.7132 2.7132 2.9717 2.9717 2.9829 2.9829 3.0748 3.0748 3.1677 3.1677 4.6623 4.6623 5.7309 5.7309 5.9670 5.9670 8.1889 8.1889 8.2068 8.2068 8.2343 8.2343 8.3995 8.3995 k = 0.3750 0.2165 0.1531 ( 32613 PWs) bands (ev): -15.9576 -15.9576 -15.9555 -15.9555 -9.8368 -9.8368 -8.4107 -8.4107 -8.1886 -8.1886 -8.1768 -8.1768 -7.9905 -7.9905 -7.9893 -7.9893 -6.6326 -6.6326 -4.7330 -4.7330 -4.7184 -4.7184 -3.3308 -3.3308 -3.3018 -3.3018 -3.2881 -3.2881 -3.2630 -3.2630 -1.1936 -1.1936 -0.7521 -0.7521 -0.6355 -0.6355 0.9120 0.9120 0.9540 0.9540 1.3965 1.3965 1.5632 1.5632 1.6867 1.6867 1.7507 1.7507 2.0130 2.0130 2.0291 2.0291 2.1714 2.1714 2.4429 2.4429 2.7270 2.7270 2.9744 2.9744 2.9829 2.9829 3.0637 3.0637 3.1559 3.1559 4.6270 4.6270 5.7593 5.7593 5.9972 5.9972 8.2335 8.2335 8.2519 8.2519 8.2820 8.2820 8.4117 8.4117 k = 0.3958 0.2285 0.1616 ( 32616 PWs) bands (ev): -15.9575 -15.9575 -15.9557 -15.9557 -9.8348 -9.8348 -8.4186 -8.4186 -8.1842 -8.1842 -8.1723 -8.1723 -7.9958 -7.9958 -7.9946 -7.9946 -6.6252 -6.6252 -4.7304 -4.7304 -4.7181 -4.7181 -3.3271 -3.3271 -3.3026 -3.3026 -3.2825 -3.2825 -3.2613 -3.2613 -1.2044 -1.2044 -0.7403 -0.7403 -0.6207 -0.6207 0.9109 0.9109 0.9503 0.9503 1.3803 1.3803 1.5736 1.5736 1.6680 1.6680 1.7420 1.7420 1.9941 1.9941 2.0013 2.0013 2.1756 2.1756 2.4304 2.4304 2.7427 2.7427 2.9725 2.9725 2.9766 2.9766 3.0631 3.0631 3.1458 3.1458 4.5948 4.5948 5.7841 5.7841 6.0235 6.0235 8.2785 8.2785 8.2970 8.2970 8.3234 8.3234 8.4217 8.4217 k = 0.4167 0.2406 0.1701 ( 32613 PWs) bands (ev): -15.9573 -15.9573 -15.9559 -15.9559 -9.8331 -9.8331 -8.4252 -8.4252 -8.1803 -8.1803 -8.1683 -8.1683 -8.0005 -8.0005 -7.9993 -7.9993 -6.6191 -6.6191 -4.7280 -4.7280 -4.7180 -4.7180 -3.3235 -3.3235 -3.3037 -3.3037 -3.2774 -3.2774 -3.2603 -3.2603 -1.2134 -1.2134 -0.7301 -0.7301 -0.6079 -0.6079 0.9102 0.9102 0.9466 0.9466 1.3657 1.3657 1.5808 1.5808 1.6530 1.6530 1.7400 1.7400 1.9730 1.9730 1.9780 1.9780 2.1801 2.1801 2.4199 2.4199 2.7599 2.7599 2.9549 2.9549 2.9785 2.9785 3.0692 3.0692 3.1374 3.1374 4.5668 4.5668 5.8050 5.8050 6.0455 6.0455 8.3231 8.3231 8.3412 8.3412 8.3585 8.3585 8.4295 8.4295 k = 0.4375 0.2526 0.1786 ( 32613 PWs) bands (ev): -15.9571 -15.9571 -15.9560 -15.9560 -9.8317 -9.8317 -8.4305 -8.4305 -8.1771 -8.1771 -8.1650 -8.1650 -8.0043 -8.0043 -8.0032 -8.0032 -6.6142 -6.6142 -4.7259 -4.7259 -4.7182 -4.7182 -3.3202 -3.3202 -3.3051 -3.3051 -3.2730 -3.2730 -3.2598 -3.2598 -1.2205 -1.2205 -0.7219 -0.7219 -0.5975 -0.5975 0.9099 0.9099 0.9432 0.9432 1.3534 1.3534 1.5842 1.5842 1.6415 1.6415 1.7447 1.7447 1.9457 1.9457 1.9650 1.9650 2.1843 2.1843 2.4116 2.4116 2.7777 2.7777 2.9347 2.9347 2.9799 2.9799 3.0773 3.0773 3.1308 3.1308 4.5439 4.5439 5.8216 5.8216 6.0630 6.0630 8.3660 8.3660 8.3802 8.3802 8.3904 8.3904 8.4348 8.4348 k = 0.4583 0.2646 0.1871 ( 32592 PWs) bands (ev): -15.9569 -15.9569 -15.9562 -15.9562 -9.8307 -9.8307 -8.4343 -8.4343 -8.1747 -8.1747 -8.1625 -8.1625 -8.0072 -8.0072 -8.0062 -8.0062 -6.6107 -6.6107 -4.7241 -4.7241 -4.7186 -4.7186 -3.3170 -3.3170 -3.3068 -3.3068 -3.2693 -3.2693 -3.2600 -3.2600 -1.2257 -1.2257 -0.7158 -0.7158 -0.5899 -0.5899 0.9097 0.9097 0.9405 0.9405 1.3442 1.3442 1.5850 1.5850 1.6335 1.6335 1.7541 1.7541 1.9214 1.9214 1.9555 1.9555 2.1876 2.1876 2.4055 2.4055 2.7952 2.7952 2.9149 2.9149 2.9809 2.9809 3.0845 3.0845 3.1260 3.1260 4.5269 4.5269 5.8336 5.8336 6.0756 6.0756 8.4047 8.4047 8.4048 8.4048 8.4259 8.4259 8.4371 8.4371 k = 0.4792 0.2766 0.1956 ( 32595 PWs) bands (ev): -15.9567 -15.9567 -15.9564 -15.9564 -9.8301 -9.8301 -8.4366 -8.4366 -8.1732 -8.1732 -8.1609 -8.1609 -8.0090 -8.0090 -8.0080 -8.0080 -6.6085 -6.6085 -4.7226 -4.7226 -4.7192 -4.7192 -3.3142 -3.3142 -3.3088 -3.3088 -3.2665 -3.2665 -3.2606 -3.2606 -1.2289 -1.2289 -0.7121 -0.7121 -0.5852 -0.5852 0.9096 0.9096 0.9387 0.9387 1.3385 1.3385 1.5846 1.5846 1.6288 1.6288 1.7637 1.7637 1.9035 1.9035 1.9497 1.9497 2.1897 2.1897 2.4018 2.4018 2.8098 2.8098 2.8987 2.8987 2.9815 2.9815 3.0894 3.0894 3.1231 3.1231 4.5164 4.5164 5.8409 5.8409 6.0833 6.0833 8.4205 8.4205 8.4341 8.4341 8.4360 8.4360 8.4545 8.4545 k = 0.5000 0.2887 0.2041 ( 32586 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8299 -9.8299 -8.4373 -8.4373 -8.1726 -8.1726 -8.1604 -8.1604 -8.0097 -8.0097 -8.0086 -8.0086 -6.6078 -6.6078 -4.7219 -4.7219 -4.7196 -4.7196 -3.3125 -3.3125 -3.3103 -3.3103 -3.2653 -3.2653 -3.2611 -3.2611 -1.2299 -1.2299 -0.7109 -0.7109 -0.5836 -0.5836 0.9096 0.9096 0.9381 0.9381 1.3365 1.3365 1.5843 1.5843 1.6272 1.6272 1.7680 1.7680 1.8965 1.8965 1.9477 1.9477 2.1905 2.1905 2.4006 2.4006 2.8161 2.8161 2.8918 2.8918 2.9817 2.9817 3.0910 3.0910 3.1222 3.1222 4.5128 4.5128 5.8433 5.8433 6.0858 6.0858 8.4298 8.4298 8.4316 8.4316 8.4457 8.4457 8.4658 8.4658 k = 0.5000 0.2887 0.2041 ( 32586 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8299 -9.8299 -8.4373 -8.4373 -8.1726 -8.1726 -8.1604 -8.1604 -8.0097 -8.0097 -8.0086 -8.0086 -6.6078 -6.6078 -4.7219 -4.7219 -4.7196 -4.7196 -3.3125 -3.3125 -3.3103 -3.3103 -3.2653 -3.2653 -3.2611 -3.2611 -1.2299 -1.2299 -0.7109 -0.7109 -0.5836 -0.5836 0.9096 0.9096 0.9381 0.9381 1.3365 1.3365 1.5843 1.5843 1.6272 1.6272 1.7680 1.7680 1.8965 1.8965 1.9477 1.9477 2.1905 2.1905 2.4006 2.4006 2.8161 2.8161 2.8918 2.8918 2.9817 2.9817 3.0910 3.0910 3.1222 3.1222 4.5128 4.5128 5.8433 5.8433 6.0858 6.0858 8.4298 8.4298 8.4316 8.4316 8.4457 8.4457 8.4658 8.4658 k = 0.5074 0.2674 0.2161 ( 32605 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8298 -9.8298 -8.4370 -8.4370 -8.1732 -8.1732 -8.1610 -8.1610 -8.0096 -8.0096 -8.0084 -8.0084 -6.6074 -6.6074 -4.7218 -4.7218 -4.7195 -4.7195 -3.3122 -3.3122 -3.3101 -3.3101 -3.2653 -3.2653 -3.2611 -3.2611 -1.2286 -1.2286 -0.7116 -0.7116 -0.5844 -0.5844 0.9100 0.9100 0.9379 0.9379 1.3360 1.3360 1.5848 1.5848 1.6256 1.6256 1.7705 1.7705 1.8946 1.8946 1.9500 1.9500 2.1890 2.1890 2.4004 2.4004 2.8149 2.8149 2.8899 2.8899 2.9787 2.9787 3.0934 3.0934 3.1191 3.1191 4.5187 4.5187 5.8421 5.8421 6.0843 6.0843 8.4334 8.4334 8.4357 8.4357 8.4494 8.4494 8.4694 8.4694 k = 0.5147 0.2462 0.2281 ( 32623 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8296 -9.8296 -8.4358 -8.4358 -8.1749 -8.1749 -8.1627 -8.1627 -8.0097 -8.0097 -8.0075 -8.0075 -6.6062 -6.6062 -4.7216 -4.7216 -4.7193 -4.7193 -3.3116 -3.3116 -3.3094 -3.3094 -3.2652 -3.2652 -3.2611 -3.2611 -1.2247 -1.2247 -0.7137 -0.7137 -0.5866 -0.5866 0.9109 0.9109 0.9372 0.9372 1.3344 1.3344 1.5862 1.5862 1.6212 1.6212 1.7778 1.7778 1.8897 1.8897 1.9560 1.9560 2.1845 2.1845 2.3999 2.3999 2.8111 2.8111 2.8840 2.8840 2.9706 2.9706 3.0980 3.0980 3.1118 3.1118 4.5362 4.5362 5.8385 5.8385 6.0800 6.0800 8.4438 8.4438 8.4481 8.4481 8.4598 8.4598 8.4809 8.4809 k = 0.5221 0.2250 0.2401 ( 32623 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8292 -9.8292 -8.4340 -8.4340 -8.1778 -8.1778 -8.1653 -8.1653 -8.0103 -8.0103 -8.0057 -8.0057 -6.6042 -6.6042 -4.7213 -4.7213 -4.7189 -4.7189 -3.3106 -3.3106 -3.3084 -3.3084 -3.2652 -3.2652 -3.2610 -3.2610 -1.2182 -1.2182 -0.7172 -0.7172 -0.5904 -0.5904 0.9119 0.9119 0.9364 0.9364 1.3318 1.3318 1.5885 1.5885 1.6148 1.6148 1.7888 1.7888 1.8831 1.8831 1.9642 1.9642 2.1774 2.1774 2.3988 2.3988 2.8046 2.8046 2.8743 2.8743 2.9591 2.9591 3.0904 3.0904 3.1145 3.1145 4.5642 4.5642 5.8325 5.8325 6.0728 6.0728 8.4595 8.4595 8.4682 8.4682 8.4767 8.4767 8.5018 8.5018 k = 0.5294 0.2038 0.2522 ( 32633 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8286 -9.8286 -8.4314 -8.4314 -8.1819 -8.1819 -8.1686 -8.1686 -8.0113 -8.0113 -8.0032 -8.0032 -6.6014 -6.6014 -4.7209 -4.7209 -4.7183 -4.7183 -3.3091 -3.3091 -3.3069 -3.3069 -3.2650 -3.2650 -3.2610 -3.2610 -1.2093 -1.2093 -0.7220 -0.7220 -0.5953 -0.5953 0.9124 0.9124 0.9361 0.9361 1.3285 1.3285 1.5915 1.5915 1.6079 1.6079 1.8024 1.8024 1.8758 1.8758 1.9735 1.9735 2.1679 2.1679 2.3968 2.3968 2.7951 2.7951 2.8608 2.8608 2.9459 2.9459 3.0724 3.0724 3.1256 3.1256 4.6015 4.6015 5.8240 5.8240 6.0632 6.0632 8.4780 8.4780 8.4948 8.4948 8.5022 8.5022 8.5324 8.5324 k = 0.5368 0.1825 0.2642 ( 32649 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8279 -9.8279 -8.4281 -8.4281 -8.1871 -8.1871 -8.1724 -8.1724 -8.0127 -8.0127 -8.0001 -8.0001 -6.5980 -6.5980 -4.7203 -4.7203 -4.7177 -4.7177 -3.3073 -3.3073 -3.3051 -3.3051 -3.2649 -3.2649 -3.2609 -3.2609 -1.1981 -1.1981 -0.7281 -0.7281 -0.6014 -0.6014 0.9111 0.9111 0.9370 0.9370 1.3246 1.3246 1.5931 1.5931 1.6031 1.6031 1.8177 1.8177 1.8686 1.8686 1.9832 1.9832 2.1566 2.1566 2.3937 2.3937 2.7823 2.7823 2.8443 2.8443 2.9317 2.9317 3.0517 3.0517 3.1386 3.1386 4.6463 4.6463 5.8132 5.8132 6.0513 6.0513 8.4980 8.4980 8.5270 8.5270 8.5369 8.5369 8.5722 8.5722 k = 0.5441 0.1613 0.2762 ( 32655 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8271 -9.8271 -8.4241 -8.4241 -8.1934 -8.1934 -8.1766 -8.1766 -8.0146 -8.0146 -7.9966 -7.9966 -6.5941 -6.5941 -4.7197 -4.7197 -4.7169 -4.7169 -3.3052 -3.3052 -3.3030 -3.3030 -3.2647 -3.2647 -3.2608 -3.2608 -1.1848 -1.1848 -0.7354 -0.7354 -0.6084 -0.6084 0.9076 0.9076 0.9394 0.9394 1.3204 1.3204 1.5887 1.5887 1.6056 1.6056 1.8334 1.8334 1.8621 1.8621 1.9923 1.9923 2.1442 2.1442 2.3893 2.3893 2.7658 2.7658 2.8260 2.8260 2.9165 2.9165 3.0310 3.0310 3.1525 3.1525 4.6970 4.6970 5.8000 5.8000 6.0376 6.0376 8.5199 8.5199 8.5644 8.5644 8.5792 8.5792 8.6201 8.6201 k = 0.5515 0.1401 0.2882 ( 32647 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8262 -9.8262 -8.4195 -8.4195 -8.2005 -8.2005 -8.1809 -8.1809 -8.0171 -8.0171 -7.9926 -7.9926 -6.5897 -6.5897 -4.7190 -4.7190 -4.7160 -4.7160 -3.3029 -3.3029 -3.3007 -3.3007 -3.2646 -3.2646 -3.2606 -3.2606 -1.1696 -1.1696 -0.7437 -0.7437 -0.6161 -0.6161 0.9020 0.9020 0.9430 0.9430 1.3161 1.3161 1.5824 1.5824 1.6120 1.6120 1.8453 1.8453 1.8604 1.8604 2.0002 2.0002 2.1315 2.1315 2.3834 2.3834 2.7451 2.7451 2.8071 2.8071 2.9000 2.9000 3.0121 3.0121 3.1668 3.1668 4.7520 4.7520 5.7846 5.7846 6.0223 6.0223 8.5439 8.5439 8.6054 8.6054 8.6275 8.6275 8.6751 8.6751 k = 0.5588 0.1189 0.3002 ( 32658 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8252 -9.8252 -8.4143 -8.4143 -8.2082 -8.2082 -8.1854 -8.1854 -8.0202 -8.0202 -7.9884 -7.9884 -6.5849 -6.5849 -4.7182 -4.7182 -4.7150 -4.7150 -3.3003 -3.3003 -3.2982 -3.2982 -3.2644 -3.2644 -3.2604 -3.2604 -1.1528 -1.1528 -0.7527 -0.7527 -0.6243 -0.6243 0.8947 0.8947 0.9471 0.9471 1.3118 1.3118 1.5765 1.5765 1.6200 1.6200 1.8440 1.8440 1.8724 1.8724 2.0058 2.0058 2.1196 2.1196 2.3762 2.3762 2.7208 2.7208 2.7885 2.7885 2.8817 2.8817 2.9966 2.9966 3.1814 3.1814 4.8096 4.8096 5.7673 5.7673 6.0059 6.0059 8.5699 8.5699 8.6481 8.6481 8.6803 8.6803 8.7361 8.7361 k = 0.5662 0.0976 0.3122 ( 32650 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8242 -9.8242 -8.4086 -8.4086 -8.2162 -8.2162 -8.1900 -8.1900 -8.0239 -8.0239 -7.9839 -7.9839 -6.5800 -6.5800 -4.7174 -4.7174 -4.7141 -4.7141 -3.2977 -3.2977 -3.2956 -3.2956 -3.2643 -3.2643 -3.2601 -3.2601 -1.1348 -1.1348 -0.7623 -0.7623 -0.6328 -0.6328 0.8860 0.8860 0.9512 0.9512 1.3075 1.3075 1.5717 1.5717 1.6294 1.6294 1.8391 1.8391 1.8883 1.8883 2.0076 2.0076 2.1099 2.1099 2.3680 2.3680 2.6941 2.6941 2.7705 2.7705 2.8614 2.8614 2.9853 2.9853 3.1962 3.1962 4.8683 4.8683 5.7487 5.7487 5.9886 5.9886 8.5974 8.5974 8.6900 8.6900 8.7362 8.7362 8.8016 8.8016 k = 0.5735 0.0764 0.3242 ( 32660 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8232 -9.8232 -8.4024 -8.4024 -8.2242 -8.2242 -8.1947 -8.1947 -8.0282 -8.0282 -7.9792 -7.9792 -6.5749 -6.5749 -4.7166 -4.7166 -4.7130 -4.7130 -3.2950 -3.2950 -3.2929 -3.2929 -3.2642 -3.2642 -3.2597 -3.2597 -1.1160 -1.1160 -0.7721 -0.7721 -0.6414 -0.6414 0.8761 0.8761 0.9547 0.9547 1.3034 1.3034 1.5684 1.5684 1.6399 1.6399 1.8344 1.8344 1.9040 1.9040 2.0048 2.0048 2.1033 2.1033 2.3592 2.3592 2.6663 2.6663 2.7531 2.7531 2.8394 2.8394 2.9782 2.9782 3.2109 3.2109 4.9266 4.9266 5.7293 5.7293 5.9707 5.9707 8.6261 8.6261 8.7293 8.7293 8.7935 8.7935 8.8698 8.8698 k = 0.5809 0.0552 0.3362 ( 32664 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8221 -9.8221 -8.3959 -8.3959 -8.2319 -8.2319 -8.1994 -8.1994 -8.0332 -8.0332 -7.9744 -7.9744 -6.5699 -6.5699 -4.7158 -4.7158 -4.7120 -4.7120 -3.2924 -3.2924 -3.2902 -3.2902 -3.2642 -3.2642 -3.2592 -3.2592 -1.0969 -1.0969 -0.7816 -0.7816 -0.6500 -0.6500 0.8655 0.8655 0.9573 0.9573 1.2995 1.2995 1.5668 1.5668 1.6514 1.6514 1.8305 1.8305 1.9187 1.9187 1.9974 1.9974 2.0998 2.0998 2.3507 2.3507 2.6387 2.6387 2.7365 2.7365 2.8164 2.8164 2.9746 2.9746 3.2254 3.2254 4.9831 4.9831 5.7100 5.7100 5.9523 5.9523 8.6555 8.6555 8.7650 8.7650 8.8503 8.8503 8.9381 8.9381 k = 0.5882 0.0340 0.3482 ( 32672 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8211 -9.8211 -8.3891 -8.3891 -8.2392 -8.2392 -8.2041 -8.2041 -8.0387 -8.0387 -7.9696 -7.9696 -6.5651 -6.5651 -4.7151 -4.7151 -4.7110 -4.7110 -3.2901 -3.2901 -3.2877 -3.2877 -3.2642 -3.2642 -3.2585 -3.2585 -1.0782 -1.0782 -0.7904 -0.7904 -0.6584 -0.6584 0.8542 0.8542 0.9586 0.9586 1.2960 1.2960 1.5671 1.5671 1.6638 1.6638 1.8275 1.8275 1.9315 1.9315 1.9869 1.9869 2.0984 2.0984 2.3430 2.3430 2.6125 2.6125 2.7206 2.7206 2.7931 2.7931 2.9741 2.9741 3.2393 3.2393 5.0361 5.0361 5.6920 5.6920 5.9336 5.9336 8.6854 8.6854 8.7969 8.7969 8.9044 8.9044 9.0035 9.0035 k = 0.5956 0.0127 0.3602 ( 32664 PWs) bands (ev): -15.9567 -15.9567 -15.9563 -15.9563 -9.8202 -9.8202 -8.3822 -8.3822 -8.2457 -8.2457 -8.2087 -8.2087 -8.0447 -8.0447 -7.9648 -7.9648 -6.5606 -6.5606 -4.7144 -4.7144 -4.7101 -4.7101 -3.2881 -3.2881 -3.2853 -3.2853 -3.2642 -3.2642 -3.2577 -3.2577 -1.0605 -1.0605 -0.7982 -0.7982 -0.6664 -0.6664 0.8427 0.8427 0.9583 0.9583 1.2933 1.2933 1.5693 1.5693 1.6767 1.6767 1.8254 1.8254 1.9412 1.9412 1.9758 1.9758 2.0978 2.0978 2.3368 2.3368 2.5888 2.5888 2.7056 2.7056 2.7702 2.7702 2.9759 2.9759 3.2525 3.2525 5.0841 5.0841 5.6764 5.6764 5.9148 5.9148 8.7154 8.7154 8.8248 8.8248 8.9536 8.9536 9.0624 9.0624 k = 0.6029-0.0085 0.3722 ( 32673 PWs) bands (ev): -15.9567 -15.9567 -15.9563 -15.9563 -9.8194 -9.8194 -8.3754 -8.3754 -8.2512 -8.2512 -8.2132 -8.2132 -8.0511 -8.0511 -7.9600 -7.9600 -6.5566 -6.5566 -4.7139 -4.7139 -4.7092 -4.7092 -3.2866 -3.2866 -3.2832 -3.2832 -3.2642 -3.2642 -3.2568 -3.2568 -1.0445 -1.0445 -0.8045 -0.8045 -0.6737 -0.6737 0.8312 0.8312 0.9562 0.9562 1.2915 1.2915 1.5734 1.5734 1.6899 1.6899 1.8239 1.8239 1.9443 1.9443 1.9686 1.9686 2.0976 2.0976 2.3322 2.3322 2.5685 2.5685 2.6912 2.6912 2.7484 2.7484 2.9795 2.9795 3.2647 3.2647 5.1256 5.1256 5.6645 5.6645 5.8959 5.8959 8.7452 8.7452 8.8485 8.8485 8.9955 8.9955 9.1110 9.1110 k = 0.6103-0.0297 0.3842 ( 32676 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8188 -9.8188 -8.3688 -8.3688 -8.2554 -8.2554 -8.2175 -8.2175 -8.0579 -8.0579 -7.9553 -7.9553 -6.5532 -6.5532 -4.7136 -4.7136 -4.7084 -4.7084 -3.2856 -3.2856 -3.2813 -3.2813 -3.2642 -3.2642 -3.2558 -3.2558 -1.0310 -1.0310 -0.8090 -0.8090 -0.6801 -0.6801 0.8200 0.8200 0.9523 0.9523 1.2914 1.2914 1.5791 1.5791 1.7028 1.7028 1.8228 1.8228 1.9380 1.9380 1.9686 1.9686 2.0981 2.0981 2.3293 2.3293 2.5524 2.5524 2.6771 2.6771 2.7288 2.7288 2.9845 2.9845 3.2755 3.2755 5.1593 5.1593 5.6574 5.6574 5.8773 5.8773 8.7745 8.7745 8.8671 8.8671 9.0287 9.0287 9.1464 9.1464 k = 0.6176-0.0509 0.3962 ( 32650 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8183 -9.8183 -8.3628 -8.3628 -8.2580 -8.2580 -8.2217 -8.2217 -8.0650 -8.0650 -7.9507 -7.9507 -6.5504 -6.5504 -4.7134 -4.7134 -4.7077 -4.7077 -3.2852 -3.2852 -3.2797 -3.2797 -3.2642 -3.2642 -3.2547 -3.2547 -1.0204 -1.0204 -0.8120 -0.8120 -0.6853 -0.6853 0.8094 0.8094 0.9467 0.9467 1.2932 1.2932 1.5863 1.5863 1.7143 1.7143 1.8220 1.8220 1.9290 1.9290 1.9699 1.9699 2.1003 2.1003 2.3277 2.3277 2.5411 2.5411 2.6628 2.6628 2.7122 2.7122 2.9906 2.9906 3.2847 3.2847 5.1843 5.1843 5.6555 5.6555 5.8593 5.8593 8.8023 8.8023 8.8801 8.8801 9.0527 9.0527 9.1670 9.1670 k = 0.6250-0.0722 0.4082 ( 32632 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8180 -9.8180 -8.3575 -8.3575 -8.2589 -8.2589 -8.2256 -8.2256 -8.0721 -8.0721 -7.9462 -7.9462 -6.5485 -6.5485 -4.7134 -4.7134 -4.7072 -4.7072 -3.2855 -3.2855 -3.2785 -3.2785 -3.2642 -3.2642 -3.2536 -3.2536 -1.0128 -1.0128 -0.8139 -0.8139 -0.6889 -0.6889 0.7996 0.7996 0.9399 0.9399 1.2973 1.2973 1.5944 1.5944 1.7232 1.7232 1.8212 1.8212 1.9218 1.9218 1.9691 1.9691 2.1053 2.1053 2.3270 2.3270 2.5346 2.5346 2.6483 2.6483 2.6994 2.6994 2.9974 2.9974 3.2921 3.2921 5.2008 5.2008 5.6583 5.6583 5.8424 5.8424 8.8268 8.8268 8.8876 8.8876 9.0680 9.0680 9.1724 9.1724 k = 0.6250-0.0722 0.4082 ( 32632 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8180 -9.8180 -8.3575 -8.3575 -8.2589 -8.2589 -8.2256 -8.2256 -8.0721 -8.0721 -7.9462 -7.9462 -6.5485 -6.5485 -4.7134 -4.7134 -4.7072 -4.7072 -3.2855 -3.2855 -3.2785 -3.2785 -3.2642 -3.2642 -3.2536 -3.2536 -1.0128 -1.0128 -0.8139 -0.8139 -0.6889 -0.6889 0.7996 0.7996 0.9399 0.9399 1.2973 1.2973 1.5944 1.5944 1.7232 1.7232 1.8212 1.8212 1.9218 1.9218 1.9691 1.9691 2.1053 2.1053 2.3270 2.3270 2.5346 2.5346 2.6483 2.6483 2.6994 2.6994 2.9974 2.9974 3.2921 3.2921 5.2008 5.2008 5.6583 5.6583 5.8424 5.8424 8.8268 8.8268 8.8876 8.8876 9.0680 9.0680 9.1724 9.1724 k = 0.6125-0.0650 0.4287 ( 32652 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8179 -9.8179 -8.3572 -8.3572 -8.2589 -8.2589 -8.2265 -8.2265 -8.0711 -8.0711 -7.9467 -7.9467 -6.5484 -6.5484 -4.7133 -4.7133 -4.7071 -4.7071 -3.2854 -3.2854 -3.2784 -3.2784 -3.2642 -3.2642 -3.2537 -3.2537 -1.0119 -1.0119 -0.8141 -0.8141 -0.6897 -0.6897 0.8008 0.8008 0.9397 0.9397 1.2968 1.2968 1.5937 1.5937 1.7237 1.7237 1.8206 1.8206 1.9216 1.9216 1.9703 1.9703 2.1045 2.1045 2.3253 2.3253 2.5354 2.5354 2.6468 2.6468 2.7018 2.7018 2.9963 2.9963 3.2916 3.2916 5.2033 5.2033 5.6584 5.6584 5.8404 5.8404 8.8308 8.8308 8.8922 8.8922 9.0719 9.0719 9.1708 9.1708 k = 0.6000-0.0577 0.4491 ( 32641 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8178 -9.8178 -8.3566 -8.3566 -8.2591 -8.2591 -8.2290 -8.2290 -8.0681 -8.0681 -7.9480 -7.9480 -6.5481 -6.5481 -4.7132 -4.7132 -4.7071 -4.7071 -3.2850 -3.2850 -3.2782 -3.2782 -3.2642 -3.2642 -3.2540 -3.2540 -1.0096 -1.0096 -0.8148 -0.8148 -0.6919 -0.6919 0.8043 0.8043 0.9390 0.9390 1.2956 1.2956 1.5916 1.5916 1.7254 1.7254 1.8188 1.8188 1.9214 1.9214 1.9736 1.9736 2.1020 2.1020 2.3205 2.3205 2.5374 2.5374 2.6428 2.6428 2.7089 2.7089 2.9928 2.9928 3.2899 3.2899 5.2106 5.2106 5.6588 5.6588 5.8347 5.8347 8.8427 8.8427 8.9060 8.9060 9.0832 9.0832 9.1664 9.1664 k = 0.5875-0.0505 0.4695 ( 32648 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8177 -9.8177 -8.3555 -8.3555 -8.2593 -8.2593 -8.2328 -8.2328 -8.0635 -8.0635 -7.9503 -7.9503 -6.5477 -6.5477 -4.7130 -4.7130 -4.7071 -4.7071 -3.2843 -3.2843 -3.2778 -3.2778 -3.2641 -3.2641 -3.2544 -3.2544 -1.0058 -1.0058 -0.8159 -0.8159 -0.6955 -0.6955 0.8100 0.8100 0.9377 0.9377 1.2940 1.2940 1.5876 1.5876 1.7287 1.7287 1.8158 1.8158 1.9218 1.9218 1.9783 1.9783 2.0978 2.0978 2.3134 2.3134 2.5403 2.5403 2.6368 2.6368 2.7198 2.7198 2.9870 2.9870 3.2876 3.2876 5.2221 5.2221 5.6596 5.6596 5.8255 5.8255 8.8621 8.8621 8.9286 8.9286 9.1014 9.1014 9.1605 9.1605 k = 0.5750-0.0433 0.4899 ( 32655 PWs) bands (ev): -15.9568 -15.9568 -15.9562 -15.9562 -9.8175 -9.8175 -8.3541 -8.3541 -8.2597 -8.2597 -8.2374 -8.2374 -8.0576 -8.0576 -7.9534 -7.9534 -6.5472 -6.5472 -4.7128 -4.7128 -4.7071 -4.7071 -3.2834 -3.2834 -3.2774 -3.2774 -3.2641 -3.2641 -3.2550 -3.2550 -1.0008 -1.0008 -0.8172 -0.8172 -0.7001 -0.7001 0.8176 0.8176 0.9353 0.9353 1.2926 1.2926 1.5814 1.5814 1.7338 1.7338 1.8119 1.8119 1.9230 1.9230 1.9837 1.9837 2.0916 2.0916 2.3054 2.3054 2.5433 2.5433 2.6297 2.6297 2.7340 2.7340 2.9785 2.9785 3.2849 3.2849 5.2368 5.2368 5.6610 5.6610 5.8131 5.8131 8.8882 8.8882 8.9592 8.9592 9.1247 9.1247 9.1550 9.1550 k = 0.5625-0.0361 0.5103 ( 32646 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8173 -9.8173 -8.3525 -8.3525 -8.2602 -8.2602 -8.2422 -8.2422 -8.0510 -8.0510 -7.9571 -7.9571 -6.5466 -6.5466 -4.7125 -4.7125 -4.7071 -4.7071 -3.2824 -3.2824 -3.2769 -3.2769 -3.2639 -3.2639 -3.2558 -3.2558 -0.9952 -0.9952 -0.8186 -0.8186 -0.7054 -0.7054 0.8270 0.8270 0.9317 0.9317 1.2918 1.2918 1.5730 1.5730 1.7407 1.7407 1.8073 1.8073 1.9252 1.9252 1.9894 1.9894 2.0837 2.0837 2.2974 2.2974 2.5459 2.5459 2.6222 2.6222 2.7505 2.7505 2.9673 2.9673 3.2824 3.2824 5.2535 5.2535 5.6634 5.6634 5.7982 5.7982 8.9200 8.9200 8.9957 8.9957 9.1439 9.1439 9.1600 9.1600 k = 0.5500-0.0289 0.5307 ( 32639 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8171 -9.8171 -8.3508 -8.3508 -8.2610 -8.2610 -8.2467 -8.2467 -8.0440 -8.0440 -7.9614 -7.9614 -6.5459 -6.5459 -4.7122 -4.7122 -4.7070 -4.7070 -3.2812 -3.2812 -3.2764 -3.2764 -3.2638 -3.2638 -3.2566 -3.2566 -0.9893 -0.9893 -0.8199 -0.8199 -0.7111 -0.7111 0.8377 0.8377 0.9266 0.9266 1.2918 1.2918 1.5632 1.5632 1.7490 1.7490 1.8023 1.8023 1.9281 1.9281 1.9949 1.9949 2.0743 2.0743 2.2903 2.2903 2.5476 2.5476 2.6152 2.6152 2.7687 2.7687 2.9536 2.9536 3.2805 3.2805 5.2706 5.2706 5.6673 5.6673 5.7815 5.7815 8.9558 8.9558 9.0335 9.0335 9.1501 9.1501 9.1871 9.1871 k = 0.5375-0.0217 0.5511 ( 32653 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8169 -9.8169 -8.3492 -8.3492 -8.2621 -8.2621 -8.2504 -8.2504 -8.0373 -8.0373 -7.9659 -7.9659 -6.5453 -6.5453 -4.7119 -4.7119 -4.7070 -4.7070 -3.2800 -3.2800 -3.2760 -3.2760 -3.2636 -3.2636 -3.2575 -3.2575 -0.9838 -0.9838 -0.8209 -0.8209 -0.7165 -0.7165 0.8492 0.8492 0.9200 0.9200 1.2927 1.2927 1.5532 1.5532 1.7580 1.7580 1.7970 1.7970 1.9314 1.9314 2.0003 2.0003 2.0640 2.0640 2.2846 2.2846 2.5482 2.5482 2.6094 2.6094 2.7877 2.7877 2.9380 2.9380 3.2792 3.2792 5.2863 5.2863 5.6735 5.6735 5.7636 5.7636 8.9928 8.9928 9.0617 9.0617 9.1704 9.1704 9.2165 9.2165 k = 0.5250-0.0144 0.5715 ( 32639 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8168 -9.8168 -8.3478 -8.3478 -8.2634 -8.2634 -8.2529 -8.2529 -8.0313 -8.0313 -7.9701 -7.9701 -6.5447 -6.5447 -4.7116 -4.7116 -4.7070 -4.7070 -3.2789 -3.2789 -3.2757 -3.2757 -3.2633 -3.2633 -3.2583 -3.2583 -0.9794 -0.9794 -0.8214 -0.8214 -0.7212 -0.7212 0.8609 0.8609 0.9120 0.9120 1.2940 1.2940 1.5443 1.5443 1.7669 1.7669 1.7918 1.7918 1.9342 1.9342 2.0055 2.0055 2.0538 2.0538 2.2806 2.2806 2.5479 2.5479 2.6055 2.6055 2.8060 2.8060 2.9218 2.9218 3.2785 3.2785 5.2989 5.2989 5.6823 5.6823 5.7453 5.7453 9.0271 9.0271 9.0734 9.0734 9.2100 9.2100 9.2445 9.2445 k = 0.5125-0.0072 0.5920 ( 32640 PWs) bands (ev): -15.9565 -15.9565 -15.9564 -15.9564 -9.8167 -9.8167 -8.3470 -8.3470 -8.2645 -8.2645 -8.2542 -8.2542 -8.0271 -8.0271 -7.9733 -7.9733 -6.5444 -6.5444 -4.7114 -4.7114 -4.7070 -4.7070 -3.2780 -3.2780 -3.2757 -3.2757 -3.2631 -3.2631 -3.2589 -3.2589 -0.9765 -0.9765 -0.8214 -0.8214 -0.7244 -0.7244 0.8717 0.8717 0.9037 0.9037 1.2950 1.2950 1.5382 1.5382 1.7747 1.7747 1.7867 1.7867 1.9359 1.9359 2.0103 2.0103 2.0453 2.0453 2.2782 2.2782 2.5471 2.5471 2.6033 2.6033 2.8211 2.8211 2.9077 2.9077 3.2783 3.2783 5.3070 5.3070 5.6945 5.6945 5.7273 5.7273 9.0520 9.0520 9.0766 9.0766 9.2446 9.2446 9.2749 9.2750 k = 0.5000-0.0000 0.6124 ( 32596 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8166 -9.8166 -8.3467 -8.3467 -8.2650 -8.2650 -8.2546 -8.2546 -8.0255 -8.0255 -7.9745 -7.9745 -6.5442 -6.5442 -4.7114 -4.7114 -4.7070 -4.7070 -3.2776 -3.2776 -3.2758 -3.2758 -3.2630 -3.2630 -3.2592 -3.2592 -0.9755 -0.9755 -0.8213 -0.8213 -0.7256 -0.7256 0.8772 0.8772 0.8989 0.8989 1.2954 1.2954 1.5360 1.5360 1.7794 1.7794 1.7831 1.7831 1.9364 1.9364 2.0128 2.0128 2.0414 2.0414 2.2775 2.2775 2.5467 2.5467 2.6027 2.6027 2.8276 2.8276 2.9015 2.9015 3.2783 3.2783 5.3098 5.3098 5.7097 5.7097 5.7101 5.7101 9.0600 9.0600 9.0786 9.0786 9.2554 9.2554 9.2758 9.2758 k = 0.5000-0.0000 0.6124 ( 32596 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8166 -9.8166 -8.3467 -8.3467 -8.2650 -8.2650 -8.2546 -8.2546 -8.0255 -8.0255 -7.9745 -7.9745 -6.5442 -6.5442 -4.7114 -4.7114 -4.7070 -4.7070 -3.2776 -3.2776 -3.2758 -3.2758 -3.2630 -3.2630 -3.2592 -3.2592 -0.9755 -0.9755 -0.8213 -0.8213 -0.7256 -0.7256 0.8772 0.8772 0.8989 0.8989 1.2954 1.2954 1.5360 1.5360 1.7794 1.7794 1.7831 1.7831 1.9364 1.9364 2.0128 2.0128 2.0414 2.0414 2.2775 2.2775 2.5467 2.5467 2.6027 2.6027 2.8276 2.8276 2.9015 2.9015 3.2783 3.2783 5.3098 5.3098 5.7097 5.7097 5.7101 5.7101 9.0600 9.0600 9.0786 9.0786 9.2554 9.2554 9.2758 9.2758 k = 0.5000 0.0152 0.5909 ( 32628 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8167 -9.8167 -8.3480 -8.3480 -8.2640 -8.2640 -8.2537 -8.2537 -8.0254 -8.0254 -7.9746 -7.9746 -6.5446 -6.5446 -4.7114 -4.7114 -4.7071 -4.7071 -3.2778 -3.2778 -3.2761 -3.2761 -3.2630 -3.2630 -3.2592 -3.2592 -0.9778 -0.9778 -0.8211 -0.8211 -0.7237 -0.7237 0.8766 0.8766 0.9006 0.9006 1.2956 1.2956 1.5363 1.5363 1.7740 1.7740 1.7856 1.7856 1.9374 1.9374 2.0115 2.0115 2.0443 2.0443 2.2782 2.2782 2.5482 2.5482 2.6043 2.6043 2.8281 2.8281 2.9024 2.9024 3.2772 3.2772 5.3044 5.3044 5.6872 5.6872 5.7368 5.7368 9.0494 9.0494 9.0700 9.0700 9.2450 9.2450 9.2717 9.2717 k = 0.5000 0.0304 0.5694 ( 32634 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8170 -9.8170 -8.3516 -8.3516 -8.2616 -8.2616 -8.2509 -8.2509 -8.0251 -8.0251 -7.9751 -7.9751 -6.5459 -6.5459 -4.7116 -4.7116 -4.7074 -4.7074 -3.2785 -3.2785 -3.2768 -3.2768 -3.2630 -3.2630 -3.2593 -3.2593 -0.9846 -0.9846 -0.8204 -0.8204 -0.7183 -0.7183 0.8754 0.8754 0.9049 0.9049 1.2961 1.2961 1.5373 1.5373 1.7630 1.7630 1.7887 1.7887 1.9398 1.9398 2.0084 2.0084 2.0516 2.0516 2.2804 2.2804 2.5526 2.5526 2.6090 2.6090 2.8296 2.8296 2.9051 2.9051 3.2739 3.2739 5.2883 5.2883 5.6706 5.6706 5.7662 5.7662 9.0159 9.0159 9.0540 9.0540 9.2112 9.2112 9.2374 9.2374 k = 0.5000 0.0456 0.5479 ( 32640 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8174 -9.8174 -8.3570 -8.3570 -8.2580 -8.2580 -8.2463 -8.2463 -8.0246 -8.0246 -7.9758 -7.9758 -6.5480 -6.5480 -4.7120 -4.7120 -4.7078 -4.7078 -3.2797 -3.2797 -3.2780 -3.2780 -3.2630 -3.2630 -3.2594 -3.2594 -0.9954 -0.9954 -0.8184 -0.8184 -0.7103 -0.7103 0.8746 0.8746 0.9106 0.9106 1.2968 1.2968 1.5388 1.5388 1.7481 1.7481 1.7925 1.7925 1.9428 1.9428 2.0046 2.0046 2.0612 2.0612 2.2846 2.2846 2.5600 2.5600 2.6170 2.6170 2.8319 2.8319 2.9095 2.9095 3.2686 3.2686 5.2617 5.2617 5.6613 5.6613 5.7965 5.7965 8.9697 8.9697 9.0325 9.0325 9.1599 9.1599 9.1963 9.1963 k = 0.5000 0.0608 0.5264 ( 32642 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8180 -9.8180 -8.3635 -8.3635 -8.2538 -8.2538 -8.2402 -8.2402 -8.0239 -8.0239 -7.9768 -7.9768 -6.5508 -6.5508 -4.7125 -4.7125 -4.7083 -4.7083 -3.2813 -3.2813 -3.2796 -3.2796 -3.2631 -3.2631 -3.2595 -3.2595 -1.0098 -1.0098 -0.8149 -0.8149 -0.7006 -0.7006 0.8747 0.8747 0.9169 0.9169 1.2978 1.2978 1.5409 1.5409 1.7309 1.7309 1.7971 1.7971 1.9450 1.9450 2.0010 2.0010 2.0711 2.0711 2.2909 2.2909 2.5704 2.5704 2.6282 2.6282 2.8352 2.8352 2.9155 2.9155 3.2613 3.2613 5.2255 5.2255 5.6595 5.6595 5.8266 5.8266 8.9188 8.9188 9.0046 9.0046 9.1017 9.1017 9.1478 9.1478 k = 0.5000 0.0760 0.5049 ( 32650 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8188 -9.8188 -8.3707 -8.3707 -8.2489 -8.2489 -8.2332 -8.2332 -8.0230 -8.0230 -7.9781 -7.9781 -6.5544 -6.5544 -4.7131 -4.7131 -4.7090 -4.7090 -3.2833 -3.2833 -3.2816 -3.2816 -3.2632 -3.2632 -3.2596 -3.2596 -1.0269 -1.0269 -0.8096 -0.8096 -0.6901 -0.6901 0.8760 0.8760 0.9231 0.9231 1.2990 1.2990 1.5436 1.5436 1.7127 1.7127 1.8025 1.8025 1.9451 1.9451 1.9988 1.9988 2.0798 2.0798 2.2996 2.2996 2.5840 2.5840 2.6425 2.6425 2.8393 2.8393 2.9230 2.9230 3.2524 3.2524 5.1811 5.1811 5.6644 5.6644 5.8558 5.8558 8.8668 8.8668 8.9706 8.9706 9.0407 9.0407 9.0933 9.0933 k = 0.5000 0.0912 0.4835 ( 32642 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8197 -9.8197 -8.3782 -8.3782 -8.2433 -8.2433 -8.2257 -8.2257 -8.0220 -8.0220 -7.9796 -7.9796 -6.5585 -6.5585 -4.7138 -4.7138 -4.7098 -4.7098 -3.2856 -3.2856 -3.2838 -3.2838 -3.2633 -3.2633 -3.2598 -3.2598 -1.0460 -1.0460 -0.8026 -0.8026 -0.6791 -0.6791 0.8784 0.8784 0.9288 0.9288 1.3003 1.3003 1.5469 1.5469 1.6947 1.6947 1.8086 1.8086 1.9413 1.9413 1.9992 1.9992 2.0866 2.0866 2.3104 2.3104 2.6009 2.6009 2.6596 2.6596 2.8444 2.8444 2.9318 2.9318 3.2422 3.2422 5.1300 5.1300 5.6748 5.6748 5.8837 5.8837 8.8154 8.8154 8.9310 8.9310 8.9788 8.9788 9.0354 9.0354 k = 0.5000 0.1064 0.4620 ( 32650 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8206 -9.8206 -8.3857 -8.3857 -8.2370 -8.2370 -8.2181 -8.2181 -8.0209 -8.0209 -7.9815 -7.9815 -6.5631 -6.5631 -4.7145 -4.7145 -4.7107 -4.7107 -3.2882 -3.2882 -3.2863 -3.2863 -3.2635 -3.2635 -3.2599 -3.2599 -1.0664 -1.0664 -0.7944 -0.7944 -0.6682 -0.6682 0.8819 0.8819 0.9336 0.9336 1.3019 1.3019 1.5508 1.5508 1.6775 1.6775 1.8151 1.8151 1.9333 1.9333 2.0025 2.0025 2.0914 2.0914 2.3229 2.3229 2.6209 2.6209 2.6793 2.6793 2.8504 2.8504 2.9418 2.9418 3.2308 3.2308 5.0740 5.0740 5.6893 5.6893 5.9100 5.9100 8.7656 8.7656 8.8860 8.8860 8.9172 8.9172 8.9766 8.9766 k = 0.5000 0.1215 0.4405 ( 32660 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8217 -9.8217 -8.3930 -8.3930 -8.2303 -8.2303 -8.2106 -8.2106 -8.0196 -8.0196 -7.9836 -7.9836 -6.5680 -6.5680 -4.7154 -4.7154 -4.7117 -4.7117 -3.2910 -3.2910 -3.2890 -3.2890 -3.2636 -3.2636 -3.2601 -3.2601 -1.0872 -1.0872 -0.7851 -0.7851 -0.6574 -0.6574 0.8861 0.8861 0.9372 0.9372 1.3037 1.3037 1.5552 1.5552 1.6616 1.6616 1.8219 1.8219 1.9217 1.9217 2.0070 2.0070 2.0954 2.0954 2.3361 2.3361 2.6436 2.6436 2.7009 2.7009 2.8575 2.8575 2.9530 2.9530 3.2186 3.2186 5.0145 5.0145 5.7065 5.7065 5.9347 5.9347 8.7182 8.7182 8.8356 8.8356 8.8569 8.8569 8.9188 8.9188 k = 0.5000 0.1367 0.4190 ( 32652 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8228 -9.8228 -8.4001 -8.4001 -8.2232 -8.2232 -8.2033 -8.2033 -8.0183 -8.0183 -7.9861 -7.9861 -6.5732 -6.5732 -4.7162 -4.7162 -4.7127 -4.7127 -3.2939 -3.2939 -3.2918 -3.2918 -3.2638 -3.2638 -3.2602 -3.2602 -1.1081 -1.1081 -0.7752 -0.7752 -0.6469 -0.6469 0.8910 0.8910 0.9394 0.9394 1.3060 1.3060 1.5604 1.5604 1.6472 1.6472 1.8288 1.8288 1.9075 1.9075 2.0106 2.0106 2.1001 2.1001 2.3491 2.3491 2.6684 2.6684 2.7241 2.7241 2.8658 2.8658 2.9653 2.9653 3.2057 3.2057 4.9527 4.9527 5.7253 5.7253 5.9578 5.9578 8.6737 8.6737 8.7813 8.7813 8.7981 8.7981 8.8618 8.8618 k = 0.5000 0.1519 0.3975 ( 32648 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8239 -9.8239 -8.4067 -8.4067 -8.2158 -8.2158 -8.1963 -8.1963 -8.0170 -8.0170 -7.9887 -7.9887 -6.5784 -6.5784 -4.7171 -4.7171 -4.7138 -4.7138 -3.2967 -3.2967 -3.2947 -3.2947 -3.2641 -3.2641 -3.2604 -3.2604 -1.1284 -1.1284 -0.7651 -0.7651 -0.6369 -0.6369 0.8961 0.8961 0.9403 0.9403 1.3088 1.3088 1.5662 1.5662 1.6345 1.6345 1.8359 1.8359 1.8916 1.8916 2.0114 2.0114 2.1071 2.1071 2.3613 2.3613 2.6940 2.6940 2.7483 2.7483 2.8756 2.8756 2.9791 2.9791 3.1925 3.1925 4.8899 4.8899 5.7446 5.7446 5.9793 5.9793 8.6325 8.6325 8.7260 8.7260 8.7404 8.7404 8.8035 8.8035 k = 0.5000 0.1671 0.3760 ( 32658 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8250 -9.8250 -8.4128 -8.4128 -8.2083 -8.2083 -8.1898 -8.1898 -8.0156 -8.0156 -7.9915 -7.9915 -6.5836 -6.5836 -4.7180 -4.7180 -4.7148 -4.7148 -3.2996 -3.2996 -3.2974 -3.2974 -3.2643 -3.2643 -3.2605 -3.2605 -1.1477 -1.1477 -0.7551 -0.7551 -0.6274 -0.6274 0.9012 0.9012 0.9400 0.9400 1.3121 1.3121 1.5726 1.5726 1.6236 1.6236 1.8429 1.8429 1.8747 1.8747 2.0086 2.0086 2.1169 2.1169 2.3719 2.3719 2.7193 2.7193 2.7728 2.7728 2.8870 2.8870 2.9943 2.9943 3.1791 3.1791 4.8273 4.8273 5.7635 5.7635 5.9992 5.9992 8.5949 8.5949 8.6722 8.6722 8.6843 8.6843 8.7434 8.7434 k = 0.5000 0.1823 0.3545 ( 32654 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8260 -9.8260 -8.4184 -8.4184 -8.2010 -8.2010 -8.1839 -8.1839 -8.0143 -8.0143 -7.9945 -7.9945 -6.5886 -6.5886 -4.7188 -4.7188 -4.7158 -4.7158 -3.3023 -3.3023 -3.3001 -3.3001 -3.2645 -3.2645 -3.2606 -3.2606 -1.1657 -1.1657 -0.7456 -0.7456 -0.6184 -0.6184 0.9058 0.9058 0.9388 0.9388 1.3159 1.3159 1.5796 1.5796 1.6143 1.6143 1.8482 1.8482 1.8591 1.8591 2.0026 2.0026 2.1288 2.1288 2.3808 2.3808 2.7428 2.7428 2.7968 2.7968 2.9000 2.9000 3.0114 3.0114 3.1656 3.1656 4.7663 4.7663 5.7813 5.7813 6.0175 6.0175 8.5610 8.5610 8.6217 8.6217 8.6312 8.6312 8.6841 8.6841 k = 0.5000 0.1975 0.3330 ( 32658 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8269 -9.8269 -8.4233 -8.4233 -8.1941 -8.1941 -8.1784 -8.1784 -8.0131 -8.0131 -7.9975 -7.9975 -6.5933 -6.5933 -4.7195 -4.7195 -4.7167 -4.7167 -3.3048 -3.3048 -3.3026 -3.3026 -3.2647 -3.2647 -3.2608 -3.2608 -1.1819 -1.1819 -0.7369 -0.7369 -0.6101 -0.6101 0.9096 0.9096 0.9372 0.9372 1.3199 1.3199 1.5869 1.5869 1.6070 1.6070 1.8373 1.8373 1.8599 1.8599 1.9944 1.9944 2.1418 2.1418 2.3878 2.3878 2.7633 2.7633 2.8197 2.8197 2.9142 2.9142 3.0303 3.0303 3.1522 3.1522 4.7081 4.7081 5.7973 5.7973 6.0342 6.0342 8.5310 8.5310 8.5756 8.5756 8.5825 8.5825 8.6284 8.6284 k = 0.5000 0.2127 0.3116 ( 32666 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8278 -9.8278 -8.4275 -8.4275 -8.1878 -8.1878 -8.1735 -8.1735 -8.0120 -8.0120 -8.0005 -8.0005 -6.5974 -6.5974 -4.7202 -4.7202 -4.7175 -4.7175 -3.3070 -3.3070 -3.3048 -3.3048 -3.2649 -3.2649 -3.2609 -3.2609 -1.1960 -1.1960 -0.7292 -0.7292 -0.6026 -0.6026 0.9120 0.9120 0.9360 0.9360 1.3241 1.3241 1.5926 1.5926 1.6030 1.6030 1.8205 1.8205 1.8671 1.8671 1.9849 1.9849 2.1547 2.1547 2.3930 2.3930 2.7803 2.7803 2.8406 2.8406 2.9291 2.9291 3.0506 3.0506 3.1389 3.1389 4.6545 4.6545 5.8112 5.8112 6.0490 6.0490 8.5048 8.5048 8.5349 8.5349 8.5395 8.5395 8.5788 8.5788 k = 0.5000 0.2279 0.2901 ( 32638 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8285 -9.8285 -8.4310 -8.4310 -8.1824 -8.1824 -8.1693 -8.1693 -8.0110 -8.0110 -8.0032 -8.0032 -6.6010 -6.6010 -4.7208 -4.7208 -4.7183 -4.7183 -3.3089 -3.3089 -3.3067 -3.3067 -3.2650 -3.2650 -3.2610 -3.2610 -1.2080 -1.2080 -0.7227 -0.7227 -0.5961 -0.5961 0.9127 0.9127 0.9357 0.9357 1.3280 1.3280 1.5919 1.5919 1.6070 1.6070 1.8044 1.8044 1.8748 1.8748 1.9749 1.9749 2.1665 2.1665 2.3965 2.3965 2.7937 2.7937 2.8586 2.8586 2.9439 2.9439 3.0711 3.0711 3.1262 3.1262 4.6071 4.6071 5.8228 5.8228 6.0617 6.0617 8.4819 8.4819 8.4998 8.4998 8.5043 8.5043 8.5369 8.5369 k = 0.5000 0.2431 0.2686 ( 32634 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8291 -9.8291 -8.4338 -8.4338 -8.1781 -8.1781 -8.1656 -8.1656 -8.0102 -8.0102 -8.0056 -8.0056 -6.6039 -6.6039 -4.7213 -4.7213 -4.7188 -4.7188 -3.3104 -3.3104 -3.3082 -3.3082 -3.2651 -3.2651 -3.2610 -3.2610 -1.2175 -1.2175 -0.7176 -0.7176 -0.5908 -0.5908 0.9121 0.9121 0.9363 0.9363 1.3315 1.3315 1.5888 1.5888 1.6141 1.6141 1.7900 1.7900 1.8823 1.8823 1.9651 1.9651 2.1765 2.1765 2.3986 2.3986 2.8038 2.8038 2.8731 2.8731 2.9578 2.9578 3.0895 3.0895 3.1149 3.1149 4.5675 4.5675 5.8318 5.8318 6.0720 6.0720 8.4616 8.4616 8.4708 8.4708 8.4784 8.4784 8.5043 8.5043 k = 0.5000 0.2583 0.2471 ( 32628 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8296 -9.8296 -8.4357 -8.4357 -8.1751 -8.1751 -8.1628 -8.1628 -8.0097 -8.0097 -8.0074 -8.0074 -6.6061 -6.6061 -4.7216 -4.7216 -4.7193 -4.7193 -3.3115 -3.3115 -3.3094 -3.3094 -3.2652 -3.2652 -3.2611 -3.2611 -1.2243 -1.2243 -0.7139 -0.7139 -0.5868 -0.5868 0.9110 0.9110 0.9372 0.9372 1.3342 1.3342 1.5864 1.5864 1.6208 1.6208 1.7784 1.7784 1.8893 1.8893 1.9565 1.9565 2.1841 2.1841 2.3999 2.3999 2.8107 2.8107 2.8835 2.8835 2.9699 2.9699 3.0983 3.0983 3.1113 3.1113 4.5377 4.5377 5.8382 5.8382 6.0796 6.0796 8.4447 8.4447 8.4492 8.4492 8.4607 8.4607 8.4820 8.4820 k = 0.5000 0.2735 0.2256 ( 32610 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8298 -9.8298 -8.4369 -8.4369 -8.1732 -8.1732 -8.1610 -8.1610 -8.0096 -8.0096 -8.0084 -8.0084 -6.6074 -6.6074 -4.7218 -4.7218 -4.7195 -4.7195 -3.3122 -3.3122 -3.3101 -3.3101 -3.2653 -3.2653 -3.2611 -3.2611 -1.2285 -1.2285 -0.7116 -0.7116 -0.5844 -0.5844 0.9100 0.9100 0.9379 0.9379 1.3360 1.3360 1.5848 1.5848 1.6255 1.6255 1.7707 1.7707 1.8945 1.8945 1.9501 1.9501 2.1889 2.1889 2.4004 2.4004 2.8148 2.8148 2.8897 2.8897 2.9786 2.9786 3.0935 3.0935 3.1189 3.1189 4.5191 4.5191 5.8421 5.8421 6.0842 6.0842 8.4336 8.4336 8.4360 8.4360 8.4496 8.4496 8.4697 8.4697 k = 0.5000 0.2887 0.2041 ( 32586 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8299 -9.8299 -8.4373 -8.4373 -8.1726 -8.1726 -8.1604 -8.1604 -8.0097 -8.0097 -8.0086 -8.0086 -6.6078 -6.6078 -4.7219 -4.7219 -4.7196 -4.7196 -3.3125 -3.3125 -3.3103 -3.3103 -3.2653 -3.2653 -3.2611 -3.2611 -1.2299 -1.2299 -0.7109 -0.7109 -0.5836 -0.5836 0.9096 0.9096 0.9381 0.9381 1.3365 1.3365 1.5843 1.5843 1.6272 1.6272 1.7680 1.7680 1.8965 1.8965 1.9477 1.9477 2.1905 2.1905 2.4006 2.4006 2.8161 2.8161 2.8918 2.8918 2.9817 2.9817 3.0910 3.0910 3.1222 3.1222 4.5128 4.5128 5.8433 5.8433 6.0858 6.0858 8.4298 8.4298 8.4316 8.4316 8.4457 8.4457 8.4658 8.4658 k = 0.5000 0.2887 0.2041 ( 32586 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8299 -9.8299 -8.4373 -8.4373 -8.1726 -8.1726 -8.1604 -8.1604 -8.0097 -8.0097 -8.0086 -8.0086 -6.6078 -6.6078 -4.7219 -4.7219 -4.7196 -4.7196 -3.3125 -3.3125 -3.3103 -3.3103 -3.2653 -3.2653 -3.2611 -3.2611 -1.2299 -1.2299 -0.7109 -0.7109 -0.5836 -0.5836 0.9096 0.9096 0.9381 0.9381 1.3365 1.3365 1.5843 1.5843 1.6272 1.6272 1.7680 1.7680 1.8965 1.8965 1.9477 1.9477 2.1905 2.1905 2.4006 2.4006 2.8161 2.8161 2.8918 2.8918 2.9817 2.9817 3.0910 3.0910 3.1222 3.1222 4.5128 4.5128 5.8433 5.8433 6.0858 6.0858 8.4298 8.4298 8.4316 8.4316 8.4457 8.4457 8.4658 8.4658 k = 0.4926 0.2844 0.2281 ( 32605 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8298 -9.8298 -8.4370 -8.4370 -8.1732 -8.1732 -8.1610 -8.1610 -8.0096 -8.0096 -8.0084 -8.0084 -6.6074 -6.6074 -4.7218 -4.7218 -4.7195 -4.7195 -3.3122 -3.3122 -3.3101 -3.3101 -3.2653 -3.2653 -3.2611 -3.2611 -1.2286 -1.2286 -0.7116 -0.7116 -0.5844 -0.5844 0.9100 0.9100 0.9379 0.9379 1.3360 1.3360 1.5848 1.5848 1.6256 1.6256 1.7705 1.7705 1.8946 1.8946 1.9500 1.9500 2.1890 2.1890 2.4004 2.4004 2.8149 2.8149 2.8899 2.8899 2.9787 2.9787 3.0934 3.0934 3.1191 3.1191 4.5187 4.5187 5.8421 5.8421 6.0843 6.0843 8.4334 8.4334 8.4357 8.4357 8.4494 8.4494 8.4694 8.4694 k = 0.4853 0.2802 0.2522 ( 32623 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8296 -9.8296 -8.4358 -8.4358 -8.1749 -8.1749 -8.1627 -8.1627 -8.0097 -8.0097 -8.0075 -8.0075 -6.6062 -6.6062 -4.7216 -4.7216 -4.7193 -4.7193 -3.3116 -3.3116 -3.3094 -3.3094 -3.2652 -3.2652 -3.2611 -3.2611 -1.2247 -1.2247 -0.7137 -0.7137 -0.5866 -0.5866 0.9109 0.9109 0.9372 0.9372 1.3344 1.3344 1.5862 1.5862 1.6212 1.6212 1.7778 1.7778 1.8897 1.8897 1.9560 1.9560 2.1845 2.1845 2.3999 2.3999 2.8111 2.8111 2.8840 2.8840 2.9706 2.9706 3.0980 3.0980 3.1118 3.1118 4.5362 4.5362 5.8385 5.8385 6.0800 6.0800 8.4438 8.4438 8.4481 8.4481 8.4598 8.4598 8.4809 8.4809 k = 0.4779 0.2759 0.2762 ( 32623 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8292 -9.8292 -8.4340 -8.4340 -8.1778 -8.1778 -8.1653 -8.1653 -8.0103 -8.0103 -8.0057 -8.0057 -6.6042 -6.6042 -4.7213 -4.7213 -4.7189 -4.7189 -3.3106 -3.3106 -3.3084 -3.3084 -3.2652 -3.2652 -3.2610 -3.2610 -1.2182 -1.2182 -0.7172 -0.7172 -0.5904 -0.5904 0.9119 0.9119 0.9364 0.9364 1.3318 1.3318 1.5885 1.5885 1.6148 1.6148 1.7888 1.7888 1.8831 1.8831 1.9642 1.9642 2.1774 2.1774 2.3988 2.3988 2.8046 2.8046 2.8743 2.8743 2.9591 2.9591 3.0904 3.0904 3.1145 3.1145 4.5642 4.5642 5.8325 5.8325 6.0728 6.0728 8.4595 8.4595 8.4682 8.4682 8.4767 8.4767 8.5018 8.5018 k = 0.4706 0.2717 0.3002 ( 32633 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8286 -9.8286 -8.4314 -8.4314 -8.1819 -8.1819 -8.1686 -8.1686 -8.0113 -8.0113 -8.0032 -8.0032 -6.6014 -6.6014 -4.7209 -4.7209 -4.7183 -4.7183 -3.3091 -3.3091 -3.3069 -3.3069 -3.2650 -3.2650 -3.2610 -3.2610 -1.2093 -1.2093 -0.7220 -0.7220 -0.5953 -0.5953 0.9124 0.9124 0.9361 0.9361 1.3285 1.3285 1.5915 1.5915 1.6079 1.6079 1.8024 1.8024 1.8758 1.8758 1.9735 1.9735 2.1679 2.1679 2.3968 2.3968 2.7951 2.7951 2.8608 2.8608 2.9459 2.9459 3.0724 3.0724 3.1256 3.1256 4.6015 4.6015 5.8240 5.8240 6.0632 6.0632 8.4780 8.4780 8.4948 8.4948 8.5022 8.5022 8.5324 8.5324 k = 0.4632 0.2674 0.3242 ( 32649 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8279 -9.8279 -8.4281 -8.4281 -8.1871 -8.1871 -8.1724 -8.1724 -8.0127 -8.0127 -8.0001 -8.0001 -6.5980 -6.5980 -4.7203 -4.7203 -4.7177 -4.7177 -3.3073 -3.3073 -3.3051 -3.3051 -3.2649 -3.2649 -3.2609 -3.2609 -1.1981 -1.1981 -0.7281 -0.7281 -0.6014 -0.6014 0.9111 0.9111 0.9370 0.9370 1.3246 1.3246 1.5931 1.5931 1.6031 1.6031 1.8177 1.8177 1.8686 1.8686 1.9832 1.9832 2.1566 2.1566 2.3937 2.3937 2.7823 2.7823 2.8443 2.8443 2.9317 2.9317 3.0517 3.0517 3.1386 3.1386 4.6463 4.6463 5.8132 5.8132 6.0513 6.0513 8.4980 8.4980 8.5270 8.5270 8.5369 8.5369 8.5722 8.5722 k = 0.4559 0.2632 0.3482 ( 32655 PWs) bands (ev): -15.9565 -15.9565 -15.9565 -15.9565 -9.8271 -9.8271 -8.4241 -8.4241 -8.1934 -8.1934 -8.1766 -8.1766 -8.0146 -8.0146 -7.9966 -7.9966 -6.5941 -6.5941 -4.7197 -4.7197 -4.7169 -4.7169 -3.3052 -3.3052 -3.3030 -3.3030 -3.2647 -3.2647 -3.2608 -3.2608 -1.1848 -1.1848 -0.7354 -0.7354 -0.6084 -0.6084 0.9076 0.9076 0.9394 0.9394 1.3204 1.3204 1.5887 1.5887 1.6056 1.6056 1.8334 1.8334 1.8621 1.8621 1.9923 1.9923 2.1442 2.1442 2.3893 2.3893 2.7658 2.7658 2.8260 2.8260 2.9165 2.9165 3.0310 3.0310 3.1525 3.1525 4.6970 4.6970 5.8000 5.8000 6.0376 6.0376 8.5199 8.5199 8.5644 8.5644 8.5792 8.5792 8.6201 8.6201 k = 0.4485 0.2590 0.3722 ( 32647 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8262 -9.8262 -8.4195 -8.4195 -8.2005 -8.2005 -8.1809 -8.1809 -8.0171 -8.0171 -7.9926 -7.9926 -6.5897 -6.5897 -4.7190 -4.7190 -4.7160 -4.7160 -3.3029 -3.3029 -3.3007 -3.3007 -3.2646 -3.2646 -3.2606 -3.2606 -1.1696 -1.1696 -0.7437 -0.7437 -0.6161 -0.6161 0.9020 0.9020 0.9430 0.9430 1.3161 1.3161 1.5824 1.5824 1.6120 1.6120 1.8453 1.8453 1.8604 1.8604 2.0002 2.0002 2.1315 2.1315 2.3834 2.3834 2.7451 2.7451 2.8071 2.8071 2.9000 2.9000 3.0121 3.0121 3.1668 3.1668 4.7520 4.7520 5.7846 5.7846 6.0223 6.0223 8.5439 8.5439 8.6054 8.6054 8.6275 8.6275 8.6751 8.6751 k = 0.4412 0.2547 0.3962 ( 32658 PWs) bands (ev): -15.9566 -15.9566 -15.9565 -15.9565 -9.8252 -9.8252 -8.4143 -8.4143 -8.2082 -8.2082 -8.1854 -8.1854 -8.0202 -8.0202 -7.9884 -7.9884 -6.5849 -6.5849 -4.7182 -4.7182 -4.7150 -4.7150 -3.3003 -3.3003 -3.2982 -3.2982 -3.2644 -3.2644 -3.2604 -3.2604 -1.1528 -1.1528 -0.7527 -0.7527 -0.6243 -0.6243 0.8947 0.8947 0.9471 0.9471 1.3118 1.3118 1.5765 1.5765 1.6200 1.6200 1.8440 1.8440 1.8724 1.8724 2.0058 2.0058 2.1196 2.1196 2.3762 2.3762 2.7208 2.7208 2.7885 2.7885 2.8817 2.8817 2.9966 2.9966 3.1814 3.1814 4.8096 4.8096 5.7673 5.7673 6.0059 6.0059 8.5699 8.5699 8.6481 8.6481 8.6803 8.6803 8.7361 8.7361 k = 0.4338 0.2505 0.4203 ( 32650 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8242 -9.8242 -8.4086 -8.4086 -8.2162 -8.2162 -8.1900 -8.1900 -8.0239 -8.0239 -7.9839 -7.9839 -6.5800 -6.5800 -4.7174 -4.7174 -4.7141 -4.7141 -3.2977 -3.2977 -3.2956 -3.2956 -3.2643 -3.2643 -3.2601 -3.2601 -1.1348 -1.1348 -0.7623 -0.7623 -0.6328 -0.6328 0.8860 0.8860 0.9512 0.9512 1.3075 1.3075 1.5717 1.5717 1.6294 1.6294 1.8391 1.8391 1.8883 1.8883 2.0076 2.0076 2.1099 2.1099 2.3680 2.3680 2.6941 2.6941 2.7705 2.7705 2.8614 2.8614 2.9853 2.9853 3.1962 3.1962 4.8683 4.8683 5.7487 5.7487 5.9886 5.9886 8.5974 8.5974 8.6900 8.6900 8.7362 8.7362 8.8016 8.8016 k = 0.4265 0.2462 0.4443 ( 32660 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8232 -9.8232 -8.4024 -8.4024 -8.2242 -8.2242 -8.1947 -8.1947 -8.0282 -8.0282 -7.9792 -7.9792 -6.5749 -6.5749 -4.7166 -4.7166 -4.7130 -4.7130 -3.2950 -3.2950 -3.2929 -3.2929 -3.2642 -3.2642 -3.2597 -3.2597 -1.1160 -1.1160 -0.7721 -0.7721 -0.6414 -0.6414 0.8761 0.8761 0.9547 0.9547 1.3034 1.3034 1.5684 1.5684 1.6399 1.6399 1.8344 1.8344 1.9040 1.9040 2.0048 2.0048 2.1033 2.1033 2.3592 2.3592 2.6663 2.6663 2.7531 2.7531 2.8394 2.8394 2.9782 2.9782 3.2109 3.2109 4.9266 4.9266 5.7293 5.7293 5.9707 5.9707 8.6261 8.6261 8.7293 8.7293 8.7935 8.7935 8.8698 8.8698 k = 0.4191 0.2420 0.4683 ( 32664 PWs) bands (ev): -15.9566 -15.9566 -15.9564 -15.9564 -9.8221 -9.8221 -8.3959 -8.3959 -8.2319 -8.2319 -8.1994 -8.1994 -8.0332 -8.0332 -7.9744 -7.9744 -6.5699 -6.5699 -4.7158 -4.7158 -4.7120 -4.7120 -3.2924 -3.2924 -3.2902 -3.2902 -3.2642 -3.2642 -3.2592 -3.2592 -1.0969 -1.0969 -0.7816 -0.7816 -0.6500 -0.6500 0.8655 0.8655 0.9573 0.9573 1.2995 1.2995 1.5668 1.5668 1.6514 1.6514 1.8305 1.8305 1.9187 1.9187 1.9974 1.9974 2.0998 2.0998 2.3507 2.3507 2.6387 2.6387 2.7365 2.7365 2.8164 2.8164 2.9746 2.9746 3.2254 3.2254 4.9831 4.9831 5.7100 5.7100 5.9523 5.9523 8.6555 8.6555 8.7650 8.7650 8.8503 8.8503 8.9381 8.9381 k = 0.4118 0.2377 0.4923 ( 32672 PWs) bands (ev): -15.9566 -15.9566 -15.9563 -15.9563 -9.8211 -9.8211 -8.3891 -8.3891 -8.2392 -8.2392 -8.2041 -8.2041 -8.0387 -8.0387 -7.9696 -7.9696 -6.5651 -6.5651 -4.7151 -4.7151 -4.7110 -4.7110 -3.2901 -3.2901 -3.2877 -3.2877 -3.2642 -3.2642 -3.2585 -3.2585 -1.0782 -1.0782 -0.7904 -0.7904 -0.6584 -0.6584 0.8542 0.8542 0.9586 0.9586 1.2960 1.2960 1.5671 1.5671 1.6638 1.6638 1.8275 1.8275 1.9315 1.9315 1.9869 1.9869 2.0984 2.0984 2.3430 2.3430 2.6125 2.6125 2.7206 2.7206 2.7931 2.7931 2.9741 2.9741 3.2393 3.2393 5.0361 5.0361 5.6920 5.6920 5.9336 5.9336 8.6854 8.6854 8.7969 8.7969 8.9044 8.9044 9.0035 9.0035 k = 0.4044 0.2335 0.5163 ( 32664 PWs) bands (ev): -15.9567 -15.9567 -15.9563 -15.9563 -9.8202 -9.8202 -8.3822 -8.3822 -8.2457 -8.2457 -8.2087 -8.2087 -8.0447 -8.0447 -7.9648 -7.9648 -6.5606 -6.5606 -4.7144 -4.7144 -4.7101 -4.7101 -3.2881 -3.2881 -3.2853 -3.2853 -3.2642 -3.2642 -3.2577 -3.2577 -1.0605 -1.0605 -0.7982 -0.7982 -0.6664 -0.6664 0.8427 0.8427 0.9583 0.9583 1.2933 1.2933 1.5693 1.5693 1.6767 1.6767 1.8254 1.8254 1.9412 1.9412 1.9758 1.9758 2.0978 2.0978 2.3368 2.3368 2.5888 2.5888 2.7056 2.7056 2.7702 2.7702 2.9759 2.9759 3.2525 3.2525 5.0841 5.0841 5.6764 5.6764 5.9148 5.9148 8.7154 8.7154 8.8248 8.8248 8.9536 8.9536 9.0624 9.0624 k = 0.3971 0.2292 0.5403 ( 32673 PWs) bands (ev): -15.9567 -15.9567 -15.9563 -15.9563 -9.8194 -9.8194 -8.3754 -8.3754 -8.2512 -8.2512 -8.2132 -8.2132 -8.0511 -8.0511 -7.9600 -7.9600 -6.5566 -6.5566 -4.7139 -4.7139 -4.7092 -4.7092 -3.2866 -3.2866 -3.2832 -3.2832 -3.2642 -3.2642 -3.2568 -3.2568 -1.0445 -1.0445 -0.8045 -0.8045 -0.6737 -0.6737 0.8312 0.8312 0.9562 0.9562 1.2915 1.2915 1.5734 1.5734 1.6899 1.6899 1.8239 1.8239 1.9443 1.9443 1.9686 1.9686 2.0976 2.0976 2.3322 2.3322 2.5685 2.5685 2.6912 2.6912 2.7484 2.7484 2.9795 2.9795 3.2647 3.2647 5.1256 5.1256 5.6645 5.6645 5.8959 5.8959 8.7452 8.7452 8.8485 8.8485 8.9955 8.9955 9.1110 9.1110 k = 0.3897 0.2250 0.5643 ( 32676 PWs) bands (ev): -15.9567 -15.9567 -15.9562 -15.9562 -9.8188 -9.8188 -8.3688 -8.3688 -8.2554 -8.2554 -8.2175 -8.2175 -8.0579 -8.0579 -7.9553 -7.9553 -6.5532 -6.5532 -4.7136 -4.7136 -4.7084 -4.7084 -3.2856 -3.2856 -3.2813 -3.2813 -3.2642 -3.2642 -3.2558 -3.2558 -1.0310 -1.0310 -0.8090 -0.8090 -0.6801 -0.6801 0.8200 0.8200 0.9523 0.9523 1.2914 1.2914 1.5791 1.5791 1.7028 1.7028 1.8228 1.8228 1.9380 1.9380 1.9686 1.9686 2.0981 2.0981 2.3293 2.3293 2.5524 2.5524 2.6771 2.6771 2.7288 2.7288 2.9845 2.9845 3.2755 3.2755 5.1593 5.1593 5.6574 5.6574 5.8773 5.8773 8.7745 8.7745 8.8671 8.8671 9.0287 9.0287 9.1464 9.1464 k = 0.3824 0.2208 0.5884 ( 32650 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8183 -9.8183 -8.3628 -8.3628 -8.2580 -8.2580 -8.2217 -8.2217 -8.0650 -8.0650 -7.9507 -7.9507 -6.5504 -6.5504 -4.7134 -4.7134 -4.7077 -4.7077 -3.2852 -3.2852 -3.2797 -3.2797 -3.2642 -3.2642 -3.2547 -3.2547 -1.0204 -1.0204 -0.8120 -0.8120 -0.6853 -0.6853 0.8094 0.8094 0.9467 0.9467 1.2932 1.2932 1.5863 1.5863 1.7143 1.7143 1.8220 1.8220 1.9290 1.9290 1.9699 1.9699 2.1003 2.1003 2.3277 2.3277 2.5411 2.5411 2.6628 2.6628 2.7122 2.7122 2.9906 2.9906 3.2847 3.2847 5.1843 5.1843 5.6555 5.6555 5.8593 5.8593 8.8023 8.8023 8.8801 8.8801 9.0527 9.0527 9.1670 9.1670 k = 0.3750 0.2165 0.6124 ( 32632 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8180 -9.8180 -8.3575 -8.3575 -8.2589 -8.2589 -8.2256 -8.2256 -8.0721 -8.0721 -7.9462 -7.9462 -6.5485 -6.5485 -4.7134 -4.7134 -4.7072 -4.7072 -3.2855 -3.2855 -3.2785 -3.2785 -3.2642 -3.2642 -3.2536 -3.2536 -1.0128 -1.0128 -0.8139 -0.8139 -0.6889 -0.6889 0.7996 0.7996 0.9399 0.9399 1.2973 1.2973 1.5944 1.5944 1.7232 1.7232 1.8212 1.8212 1.9218 1.9218 1.9691 1.9691 2.1053 2.1053 2.3270 2.3270 2.5346 2.5346 2.6483 2.6483 2.6994 2.6994 2.9974 2.9974 3.2921 3.2921 5.2008 5.2008 5.6583 5.6583 5.8424 5.8424 8.8268 8.8268 8.8876 8.8876 9.0680 9.0680 9.1724 9.1724 k = 0.6250-0.0722 0.4082 ( 32632 PWs) bands (ev): -15.9568 -15.9568 -15.9561 -15.9561 -9.8180 -9.8180 -8.3575 -8.3575 -8.2589 -8.2589 -8.2256 -8.2256 -8.0721 -8.0721 -7.9462 -7.9462 -6.5485 -6.5485 -4.7134 -4.7134 -4.7072 -4.7072 -3.2855 -3.2855 -3.2785 -3.2785 -3.2642 -3.2642 -3.2536 -3.2536 -1.0128 -1.0128 -0.8139 -0.8139 -0.6889 -0.6889 0.7996 0.7996 0.9399 0.9399 1.2973 1.2973 1.5944 1.5944 1.7232 1.7232 1.8212 1.8212 1.9218 1.9218 1.9691 1.9691 2.1053 2.1053 2.3270 2.3270 2.5346 2.5346 2.6483 2.6483 2.6994 2.6994 2.9974 2.9974 3.2921 3.2921 5.2008 5.2008 5.6583 5.6583 5.8424 5.8424 8.8268 8.8268 8.8876 8.8876 9.0680 9.0680 9.1724 9.1724 k = 0.6125-0.0938 0.4082 ( 32654 PWs) bands (ev): -15.9569 -15.9569 -15.9560 -15.9560 -9.8177 -9.8177 -8.3486 -8.3486 -8.2589 -8.2589 -8.2318 -8.2318 -8.0845 -8.0845 -7.9390 -7.9390 -6.5461 -6.5461 -4.7136 -4.7136 -4.7063 -4.7063 -3.2865 -3.2865 -3.2769 -3.2769 -3.2644 -3.2644 -3.2518 -3.2518 -1.0025 -1.0025 -0.8174 -0.8174 -0.6923 -0.6923 0.7840 0.7840 0.9263 0.9263 1.3079 1.3079 1.6097 1.6097 1.7344 1.7344 1.8203 1.8203 1.9114 1.9114 1.9655 1.9655 2.1184 2.1184 2.3275 2.3275 2.5260 2.5260 2.6244 2.6244 2.6825 2.6825 3.0090 3.0090 3.3028 3.3028 5.2207 5.2207 5.6657 5.6657 5.8157 5.8157 8.8597 8.8597 8.8967 8.8967 9.0867 9.0867 9.1697 9.1697 k = 0.6000-0.1155 0.4082 ( 32646 PWs) bands (ev): -15.9570 -15.9570 -15.9559 -15.9559 -9.8175 -9.8175 -8.3388 -8.3388 -8.2590 -8.2590 -8.2375 -8.2375 -8.0973 -8.0973 -7.9322 -7.9322 -6.5442 -6.5442 -4.7139 -4.7139 -4.7056 -4.7056 -3.2877 -3.2877 -3.2757 -3.2757 -3.2645 -3.2645 -3.2501 -3.2501 -0.9931 -0.9931 -0.8225 -0.8225 -0.6933 -0.6933 0.7691 0.7691 0.9106 0.9106 1.3213 1.3213 1.6264 1.6264 1.7444 1.7444 1.8195 1.8195 1.9001 1.9001 1.9616 1.9616 2.1346 2.1346 2.3293 2.3293 2.5142 2.5142 2.6024 2.6024 2.6693 2.6693 3.0199 3.0199 3.3130 3.3130 5.2375 5.2375 5.6726 5.6726 5.7910 5.7910 8.8844 8.8844 8.9057 8.9057 9.1037 9.1037 9.1666 9.1666 k = 0.5875-0.1371 0.4082 ( 32660 PWs) bands (ev): -15.9571 -15.9571 -15.9558 -15.9558 -9.8174 -9.8174 -8.3283 -8.3283 -8.2593 -8.2593 -8.2424 -8.2424 -8.1103 -8.1103 -7.9260 -7.9260 -6.5426 -6.5426 -4.7142 -4.7142 -4.7050 -4.7050 -3.2889 -3.2889 -3.2749 -3.2749 -3.2645 -3.2645 -3.2485 -3.2485 -0.9850 -0.9850 -0.8282 -0.8282 -0.6923 -0.6923 0.7552 0.7552 0.8938 0.8938 1.3367 1.3367 1.6434 1.6434 1.7529 1.7529 1.8189 1.8189 1.8882 1.8882 1.9574 1.9574 2.1537 2.1537 2.3318 2.3318 2.4987 2.4987 2.5834 2.5834 2.6597 2.6597 3.0296 3.0296 3.3229 3.3229 5.2505 5.2505 5.6790 5.6790 5.7693 5.7693 8.8996 8.8996 8.9157 8.9157 9.1160 9.1160 9.1418 9.1418 k = 0.5750-0.1588 0.4082 ( 32666 PWs) bands (ev): -15.9572 -15.9572 -15.9557 -15.9557 -9.8174 -9.8174 -8.3173 -8.3173 -8.2597 -8.2597 -8.2465 -8.2465 -8.1234 -8.1234 -7.9205 -7.9205 -6.5413 -6.5413 -4.7145 -4.7145 -4.7045 -4.7045 -3.2901 -3.2901 -3.2744 -3.2744 -3.2645 -3.2645 -3.2470 -3.2470 -0.9783 -0.9783 -0.8338 -0.8338 -0.6899 -0.6899 0.7425 0.7425 0.8770 0.8770 1.3531 1.3531 1.6599 1.6599 1.7598 1.7598 1.8184 1.8184 1.8764 1.8764 1.9532 1.9532 2.1751 2.1751 2.3346 2.3346 2.4795 2.4795 2.5679 2.5679 2.6532 2.6532 3.0378 3.0378 3.3324 3.3324 5.2592 5.2592 5.6849 5.6849 5.7514 5.7514 8.9074 8.9074 8.9243 8.9243 9.0886 9.0886 9.1207 9.1207 k = 0.5625-0.1804 0.4082 ( 32658 PWs) bands (ev): -15.9572 -15.9572 -15.9557 -15.9557 -9.8175 -9.8175 -8.3060 -8.3060 -8.2603 -8.2603 -8.2496 -8.2496 -8.1366 -8.1366 -7.9157 -7.9157 -6.5403 -6.5403 -4.7148 -4.7148 -4.7041 -4.7041 -3.2913 -3.2913 -3.2741 -3.2741 -3.2645 -3.2645 -3.2457 -3.2457 -0.9734 -0.9734 -0.8385 -0.8385 -0.6868 -0.6868 0.7312 0.7312 0.8613 0.8613 1.3695 1.3695 1.6751 1.6751 1.7654 1.7654 1.8177 1.8177 1.8648 1.8648 1.9495 1.9495 2.1982 2.1982 2.3372 2.3372 2.4575 2.4575 2.5552 2.5552 2.6494 2.6494 3.0446 3.0446 3.3413 3.3413 5.2640 5.2640 5.6903 5.6903 5.7376 5.7376 8.9118 8.9118 8.9279 8.9279 9.0420 9.0420 9.1137 9.1137 k = 0.5500-0.2021 0.4082 ( 32644 PWs) bands (ev): -15.9573 -15.9573 -15.9556 -15.9556 -9.8175 -9.8175 -8.2949 -8.2949 -8.2611 -8.2611 -8.2517 -8.2517 -8.1494 -8.1494 -7.9117 -7.9117 -6.5395 -6.5395 -4.7151 -4.7151 -4.7038 -4.7038 -3.2923 -3.2923 -3.2739 -3.2739 -3.2645 -3.2645 -3.2445 -3.2445 -0.9701 -0.9701 -0.8421 -0.8421 -0.6836 -0.6836 0.7216 0.7216 0.8474 0.8474 1.3851 1.3851 1.6881 1.6881 1.7703 1.7703 1.8168 1.8168 1.8538 1.8538 1.9467 1.9467 2.2223 2.2223 2.3395 2.3395 2.4341 2.4341 2.5448 2.5448 2.6477 2.6477 3.0499 3.0499 3.3494 3.3494 5.2656 5.2656 5.6947 5.6947 5.7278 5.7278 8.9139 8.9139 8.9263 8.9263 9.0041 9.0041 9.1011 9.1011 k = 0.5375-0.2237 0.4082 ( 32678 PWs) bands (ev): -15.9573 -15.9573 -15.9556 -15.9556 -9.8176 -9.8176 -8.2846 -8.2846 -8.2617 -8.2617 -8.2528 -8.2528 -8.1614 -8.1614 -7.9085 -7.9085 -6.5390 -6.5390 -4.7154 -4.7154 -4.7036 -4.7036 -3.2931 -3.2931 -3.2738 -3.2738 -3.2644 -3.2644 -3.2436 -3.2436 -0.9681 -0.9681 -0.8445 -0.8445 -0.6807 -0.6807 0.7138 0.7138 0.8360 0.8360 1.3987 1.3987 1.6981 1.6981 1.7756 1.7756 1.8153 1.8153 1.8434 1.8434 1.9450 1.9450 2.2466 2.2466 2.3413 2.3413 2.4103 2.4103 2.5364 2.5364 2.6473 2.6473 3.0537 3.0537 3.3563 3.3563 5.2649 5.2649 5.6977 5.6977 5.7220 5.7220 8.9134 8.9134 8.9206 8.9206 8.9764 8.9764 9.0889 9.0889 k = 0.5250-0.2454 0.4082 ( 32714 PWs) bands (ev): -15.9573 -15.9573 -15.9556 -15.9556 -9.8176 -9.8176 -8.2766 -8.2766 -8.2612 -8.2612 -8.2534 -8.2534 -8.1719 -8.1719 -7.9063 -7.9063 -6.5386 -6.5386 -4.7155 -4.7155 -4.7035 -4.7035 -3.2938 -3.2938 -3.2738 -3.2738 -3.2644 -3.2644 -3.2430 -3.2430 -0.9671 -0.9671 -0.8459 -0.8459 -0.6783 -0.6783 0.7081 0.7081 0.8275 0.8275 1.4093 1.4093 1.7048 1.7048 1.7816 1.7816 1.8138 1.8138 1.8338 1.8338 1.9442 1.9442 2.2702 2.2702 2.3426 2.3426 2.3873 2.3873 2.5301 2.5301 2.6476 2.6476 3.0562 3.0562 3.3615 3.3615 5.2633 5.2633 5.6992 5.6992 5.7194 5.7194 8.9103 8.9103 8.9136 8.9136 8.9596 8.9596 9.0800 9.0800 k = 0.5125-0.2670 0.4082 ( 32744 PWs) bands (ev): -15.9574 -15.9574 -15.9556 -15.9556 -9.8177 -9.8177 -8.2725 -8.2725 -8.2592 -8.2592 -8.2534 -8.2534 -8.1795 -8.1795 -7.9049 -7.9049 -6.5383 -6.5383 -4.7156 -4.7156 -4.7034 -4.7034 -3.2941 -3.2941 -3.2738 -3.2738 -3.2644 -3.2644 -3.2425 -3.2425 -0.9667 -0.9667 -0.8466 -0.8466 -0.6768 -0.6768 0.7046 0.7046 0.8223 0.8223 1.4161 1.4161 1.7084 1.7084 1.7875 1.7875 1.8124 1.8124 1.8261 1.8261 1.9440 1.9440 2.2908 2.2908 2.3431 2.3431 2.3673 2.3673 2.5261 2.5261 2.6480 2.6480 3.0577 3.0577 3.3649 3.3649 5.2619 5.2619 5.6995 5.6995 5.7188 5.7188 8.9054 8.9054 8.9088 8.9088 8.9518 8.9518 9.0749 9.0749 k = 0.5000-0.2887 0.4082 ( 32804 PWs) bands (ev): -15.9574 -15.9574 -15.9555 -15.9555 -9.8177 -9.8177 -8.2716 -8.2716 -8.2580 -8.2580 -8.2532 -8.2532 -8.1823 -8.1823 -7.9044 -7.9044 -6.5383 -6.5383 -4.7157 -4.7157 -4.7033 -4.7033 -3.2943 -3.2943 -3.2738 -3.2738 -3.2644 -3.2644 -3.2424 -3.2424 -0.9666 -0.9666 -0.8468 -0.8468 -0.6763 -0.6763 0.7034 0.7034 0.8206 0.8206 1.4185 1.4185 1.7095 1.7095 1.7904 1.7904 1.8117 1.8117 1.8228 1.8228 1.9440 1.9440 2.3009 2.3009 2.3428 2.3428 2.3580 2.3580 2.5247 2.5247 2.6482 2.6482 3.0582 3.0582 3.3660 3.3660 5.2613 5.2613 5.6994 5.6994 5.7188 5.7188 8.9031 8.9031 8.9072 8.9072 8.9497 8.9497 9.0732 9.0732 Writing output data file Cs2TeI6.save init_run : 0.86s CPU 1.05s WALL ( 1 calls) electrons : 862.70s CPU 872.64s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.06s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 862.70s CPU 872.63s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.31s CPU 0.36s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.37s CPU 0.37s WALL ( 187 calls) cegterg : 806.72s CPU 815.57s WALL ( 468 calls) Called by sum_band: Called by *egterg: h_psi : 560.80s CPU 565.22s WALL ( 7809 calls) s_psi : 29.62s CPU 29.34s WALL ( 7809 calls) g_psi : 0.95s CPU 1.01s WALL ( 7154 calls) cdiaghg : 158.64s CPU 159.20s WALL ( 7341 calls) cegterg:over : 36.97s CPU 37.10s WALL ( 7154 calls) cegterg:upda : 34.78s CPU 34.86s WALL ( 7154 calls) cegterg:last : 17.71s CPU 17.73s WALL ( 970 calls) cdiaghg:chol : 6.40s CPU 6.61s WALL ( 7341 calls) cdiaghg:inve : 4.96s CPU 4.90s WALL ( 7341 calls) cdiaghg:para : 10.18s CPU 9.99s WALL ( 14682 calls) Called by h_psi: h_psi:vloc : 484.58s CPU 488.55s WALL ( 7809 calls) h_psi:vnl : 74.92s CPU 75.42s WALL ( 7809 calls) add_vuspsi : 39.97s CPU 40.65s WALL ( 7809 calls) General routines calbec : 34.88s CPU 34.74s WALL ( 7809 calls) fft : 0.03s CPU 0.03s WALL ( 15 calls) fftw : 465.46s CPU 469.16s WALL ( 885636 calls) davcio : 0.18s CPU 0.35s WALL ( 374 calls) Parallel routines fft_scatter : 203.74s CPU 206.06s WALL ( 885651 calls) PWSCF : 15m42.89s CPU 16m14.41s WALL This run was terminated on: 14:29: 7 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=