Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 14:13: 3 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: ./Cs2PtI6.save/ file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 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 95 70 19 5223 3303 461 Max 96 71 20 5229 3340 464 Sum 6877 5089 1369 376199 239441 33319 bravais-lattice index = 14 lattice parameter (alat) = 15.1810 a.u. unit-cell volume = 2473.9231 (a.u.)^3 number of atoms/cell = 9 number of atomic types = 3 number of electrons = 70.00 number of Kohn-Sham states= 84 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.181001 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 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. # 2 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 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 I 7.00 126.90450 I( 1.00) Pt 10.00 195.08400 Pt( 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= 190 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0052632 k( 2) = ( 0.0178571 -0.0103098 0.0145803), wk = 0.0052632 k( 3) = ( 0.0357143 -0.0206197 0.0291606), wk = 0.0052632 k( 4) = ( 0.0535714 -0.0309295 0.0437409), wk = 0.0052632 k( 5) = ( 0.0714286 -0.0412393 0.0583212), wk = 0.0052632 k( 6) = ( 0.0892857 -0.0515491 0.0729015), wk = 0.0052632 k( 7) = ( 0.1071429 -0.0618590 0.0874818), wk = 0.0052632 k( 8) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0052632 k( 9) = ( 0.1428571 -0.0824786 0.1166424), wk = 0.0052632 k( 10) = ( 0.1607143 -0.0927884 0.1312227), wk = 0.0052632 k( 11) = ( 0.1785714 -0.1030983 0.1458030), wk = 0.0052632 k( 12) = ( 0.1964286 -0.1134081 0.1603833), wk = 0.0052632 k( 13) = ( 0.2142857 -0.1237179 0.1749635), wk = 0.0052632 k( 14) = ( 0.2321429 -0.1340277 0.1895439), wk = 0.0052632 k( 15) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0052632 k( 16) = ( 0.2678571 -0.1546474 0.2187044), wk = 0.0052632 k( 17) = ( 0.2857143 -0.1649572 0.2332847), wk = 0.0052632 k( 18) = ( 0.3035714 -0.1752670 0.2478650), wk = 0.0052632 k( 19) = ( 0.3214286 -0.1855769 0.2624453), wk = 0.0052632 k( 20) = ( 0.3392857 -0.1958867 0.2770256), wk = 0.0052632 k( 21) = ( 0.3571429 -0.2061965 0.2916059), wk = 0.0052632 k( 22) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0052632 k( 23) = ( 0.3928571 -0.2268162 0.3207665), wk = 0.0052632 k( 24) = ( 0.4107143 -0.2371260 0.3353468), wk = 0.0052632 k( 25) = ( 0.4285714 -0.2474358 0.3499271), wk = 0.0052632 k( 26) = ( 0.4464286 -0.2577457 0.3645074), wk = 0.0052632 k( 27) = ( 0.4642857 -0.2680555 0.3790877), wk = 0.0052632 k( 28) = ( 0.4821429 -0.2783653 0.3936680), wk = 0.0052632 k( 29) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0052632 k( 30) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0052632 k( 31) = ( 0.5000000 -0.2680555 0.4228286), wk = 0.0052632 k( 32) = ( 0.5000000 -0.2474358 0.4374089), wk = 0.0052632 k( 33) = ( 0.5000000 -0.2268162 0.4519892), wk = 0.0052632 k( 34) = ( 0.5000000 -0.2061965 0.4665695), wk = 0.0052632 k( 35) = ( 0.5000000 -0.1855769 0.4811498), wk = 0.0052632 k( 36) = ( 0.5000000 -0.1649572 0.4957301), wk = 0.0052632 k( 37) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0052632 k( 38) = ( 0.5000000 -0.1237179 0.5248907), wk = 0.0052632 k( 39) = ( 0.5000000 -0.1030983 0.5394710), wk = 0.0052632 k( 40) = ( 0.5000000 -0.0824786 0.5540513), wk = 0.0052632 k( 41) = ( 0.5000000 -0.0618590 0.5686315), wk = 0.0052632 k( 42) = ( 0.5000000 -0.0412393 0.5832118), wk = 0.0052632 k( 43) = ( 0.5000000 -0.0206196 0.5977921), wk = 0.0052632 k( 44) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0052632 k( 45) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0052632 k( 46) = ( 0.4875000 0.0216506 0.6123724), wk = 0.0052632 k( 47) = ( 0.4750000 0.0433013 0.6123724), wk = 0.0052632 k( 48) = ( 0.4625000 0.0649519 0.6123724), wk = 0.0052632 k( 49) = ( 0.4500000 0.0866025 0.6123724), wk = 0.0052632 k( 50) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0052632 k( 51) = ( 0.4250000 0.1299038 0.6123724), wk = 0.0052632 k( 52) = ( 0.4125000 0.1515544 0.6123724), wk = 0.0052632 k( 53) = ( 0.4000000 0.1732051 0.6123724), wk = 0.0052632 k( 54) = ( 0.3875000 0.1948557 0.6123724), wk = 0.0052632 k( 55) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0052632 k( 56) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0052632 k( 57) = ( 0.3625000 0.2092895 0.5919600), wk = 0.0052632 k( 58) = ( 0.3500000 0.2020726 0.5715476), wk = 0.0052632 k( 59) = ( 0.3375000 0.1948557 0.5511352), wk = 0.0052632 k( 60) = ( 0.3250000 0.1876388 0.5307228), wk = 0.0052632 k( 61) = ( 0.3125000 0.1804220 0.5103104), wk = 0.0052632 k( 62) = ( 0.3000000 0.1732051 0.4898979), wk = 0.0052632 k( 63) = ( 0.2875000 0.1659882 0.4694855), wk = 0.0052632 k( 64) = ( 0.2750000 0.1587713 0.4490731), wk = 0.0052632 k( 65) = ( 0.2625000 0.1515544 0.4286607), wk = 0.0052632 k( 66) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0052632 k( 67) = ( 0.2375000 0.1371207 0.3878359), wk = 0.0052632 k( 68) = ( 0.2250000 0.1299038 0.3674235), wk = 0.0052632 k( 69) = ( 0.2125000 0.1226869 0.3470110), wk = 0.0052632 k( 70) = ( 0.2000000 0.1154701 0.3265986), wk = 0.0052632 k( 71) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0052632 k( 72) = ( 0.1750000 0.1010363 0.2857738), wk = 0.0052632 k( 73) = ( 0.1625000 0.0938194 0.2653614), wk = 0.0052632 k( 74) = ( 0.1500000 0.0866025 0.2449490), wk = 0.0052632 k( 75) = ( 0.1375000 0.0793857 0.2245366), wk = 0.0052632 k( 76) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0052632 k( 77) = ( 0.1125000 0.0649519 0.1837117), wk = 0.0052632 k( 78) = ( 0.1000000 0.0577350 0.1632993), wk = 0.0052632 k( 79) = ( 0.0875000 0.0505181 0.1428869), wk = 0.0052632 k( 80) = ( 0.0750000 0.0433013 0.1224745), wk = 0.0052632 k( 81) = ( 0.0625000 0.0360844 0.1020621), wk = 0.0052632 k( 82) = ( 0.0500000 0.0288675 0.0816497), wk = 0.0052632 k( 83) = ( 0.0375000 0.0216506 0.0612372), wk = 0.0052632 k( 84) = ( 0.0250000 0.0144338 0.0408248), wk = 0.0052632 k( 85) = ( 0.0125000 0.0072169 0.0204124), wk = 0.0052632 k( 86) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0052632 k( 87) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0052632 k( 88) = ( 0.0208333 0.0120281 0.0085052), wk = 0.0052632 k( 89) = ( 0.0416667 0.0240563 0.0170103), wk = 0.0052632 k( 90) = ( 0.0625000 0.0360844 0.0255155), wk = 0.0052632 k( 91) = ( 0.0833333 0.0481125 0.0340207), wk = 0.0052632 k( 92) = ( 0.1041667 0.0601407 0.0425259), wk = 0.0052632 k( 93) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0052632 k( 94) = ( 0.1458333 0.0841969 0.0595362), wk = 0.0052632 k( 95) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0052632 k( 96) = ( 0.1875000 0.1082532 0.0765466), wk = 0.0052632 k( 97) = ( 0.2083333 0.1202813 0.0850517), wk = 0.0052632 k( 98) = ( 0.2291667 0.1323094 0.0935569), wk = 0.0052632 k( 99) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0052632 k( 100) = ( 0.2708333 0.1563657 0.1105672), wk = 0.0052632 k( 101) = ( 0.2916667 0.1683938 0.1190724), wk = 0.0052632 k( 102) = ( 0.3125000 0.1804220 0.1275776), wk = 0.0052632 k( 103) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0052632 k( 104) = ( 0.3541667 0.2044782 0.1445879), wk = 0.0052632 k( 105) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0052632 k( 106) = ( 0.3958333 0.2285345 0.1615983), wk = 0.0052632 k( 107) = ( 0.4166667 0.2405626 0.1701035), wk = 0.0052632 k( 108) = ( 0.4375000 0.2525907 0.1786086), wk = 0.0052632 k( 109) = ( 0.4583333 0.2646189 0.1871138), wk = 0.0052632 k( 110) = ( 0.4791667 0.2766470 0.1956190), wk = 0.0052632 k( 111) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0052632 k( 112) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0052632 k( 113) = ( 0.5073529 0.2674490 0.2161314), wk = 0.0052632 k( 114) = ( 0.5147059 0.2462229 0.2281387), wk = 0.0052632 k( 115) = ( 0.5220588 0.2249968 0.2401461), wk = 0.0052632 k( 116) = ( 0.5294118 0.2037707 0.2521534), wk = 0.0052632 k( 117) = ( 0.5367647 0.1825446 0.2641607), wk = 0.0052632 k( 118) = ( 0.5441177 0.1613185 0.2761680), wk = 0.0052632 k( 119) = ( 0.5514706 0.1400923 0.2881753), wk = 0.0052632 k( 120) = ( 0.5588235 0.1188662 0.3001826), wk = 0.0052632 k( 121) = ( 0.5661765 0.0976401 0.3121899), wk = 0.0052632 k( 122) = ( 0.5735294 0.0764140 0.3241972), wk = 0.0052632 k( 123) = ( 0.5808823 0.0551879 0.3362045), wk = 0.0052632 k( 124) = ( 0.5882353 0.0339618 0.3482118), wk = 0.0052632 k( 125) = ( 0.5955882 0.0127357 0.3602191), wk = 0.0052632 k( 126) = ( 0.6029412 -0.0084904 0.3722264), wk = 0.0052632 k( 127) = ( 0.6102941 -0.0297166 0.3842337), wk = 0.0052632 k( 128) = ( 0.6176471 -0.0509427 0.3962410), wk = 0.0052632 k( 129) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0052632 k( 130) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0052632 k( 131) = ( 0.6125000 -0.0649519 0.4286607), wk = 0.0052632 k( 132) = ( 0.6000000 -0.0577350 0.4490731), wk = 0.0052632 k( 133) = ( 0.5875000 -0.0505181 0.4694855), wk = 0.0052632 k( 134) = ( 0.5750000 -0.0433013 0.4898979), wk = 0.0052632 k( 135) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0052632 k( 136) = ( 0.5500000 -0.0288675 0.5307228), wk = 0.0052632 k( 137) = ( 0.5375000 -0.0216506 0.5511352), wk = 0.0052632 k( 138) = ( 0.5250000 -0.0144338 0.5715476), wk = 0.0052632 k( 139) = ( 0.5125000 -0.0072169 0.5919600), wk = 0.0052632 k( 140) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0052632 k( 141) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0052632 k( 142) = ( 0.5000000 0.0144338 0.5919600), wk = 0.0052632 k( 143) = ( 0.5000000 0.0288675 0.5715476), wk = 0.0052632 k( 144) = ( 0.5000000 0.0433013 0.5511352), wk = 0.0052632 k( 145) = ( 0.5000000 0.0577350 0.5307228), wk = 0.0052632 k( 146) = ( 0.5000000 0.0721688 0.5103104), wk = 0.0052632 k( 147) = ( 0.5000000 0.0866025 0.4898979), wk = 0.0052632 k( 148) = ( 0.5000000 0.1010363 0.4694855), wk = 0.0052632 k( 149) = ( 0.5000000 0.1154701 0.4490731), wk = 0.0052632 k( 150) = ( 0.5000000 0.1299038 0.4286607), wk = 0.0052632 k( 151) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0052632 k( 152) = ( 0.5000000 0.1587713 0.3878359), wk = 0.0052632 k( 153) = ( 0.5000000 0.1732051 0.3674235), wk = 0.0052632 k( 154) = ( 0.5000000 0.1876388 0.3470110), wk = 0.0052632 k( 155) = ( 0.5000000 0.2020726 0.3265986), wk = 0.0052632 k( 156) = ( 0.5000000 0.2165064 0.3061862), wk = 0.0052632 k( 157) = ( 0.5000000 0.2309401 0.2857738), wk = 0.0052632 k( 158) = ( 0.5000000 0.2453739 0.2653614), wk = 0.0052632 k( 159) = ( 0.5000000 0.2598076 0.2449490), wk = 0.0052632 k( 160) = ( 0.5000000 0.2742414 0.2245366), wk = 0.0052632 k( 161) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0052632 k( 162) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0052632 k( 163) = ( 0.4926471 0.2844299 0.2281387), wk = 0.0052632 k( 164) = ( 0.4852941 0.2801847 0.2521533), wk = 0.0052632 k( 165) = ( 0.4779412 0.2759395 0.2761680), wk = 0.0052632 k( 166) = ( 0.4705882 0.2716942 0.3001826), wk = 0.0052632 k( 167) = ( 0.4632353 0.2674490 0.3241972), wk = 0.0052632 k( 168) = ( 0.4558823 0.2632038 0.3482118), wk = 0.0052632 k( 169) = ( 0.4485294 0.2589586 0.3722264), wk = 0.0052632 k( 170) = ( 0.4411765 0.2547134 0.3962410), wk = 0.0052632 k( 171) = ( 0.4338235 0.2504681 0.4202556), wk = 0.0052632 k( 172) = ( 0.4264706 0.2462229 0.4442702), wk = 0.0052632 k( 173) = ( 0.4191177 0.2419777 0.4682848), wk = 0.0052632 k( 174) = ( 0.4117647 0.2377325 0.4922994), wk = 0.0052632 k( 175) = ( 0.4044118 0.2334872 0.5163140), wk = 0.0052632 k( 176) = ( 0.3970588 0.2292420 0.5403286), wk = 0.0052632 k( 177) = ( 0.3897059 0.2249968 0.5643432), wk = 0.0052632 k( 178) = ( 0.3823529 0.2207516 0.5883578), wk = 0.0052632 k( 179) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0052632 k( 180) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0052632 k( 181) = ( 0.6125000 -0.0938194 0.4082483), wk = 0.0052632 k( 182) = ( 0.6000000 -0.1154701 0.4082483), wk = 0.0052632 k( 183) = ( 0.5875000 -0.1371207 0.4082483), wk = 0.0052632 k( 184) = ( 0.5750000 -0.1587713 0.4082483), wk = 0.0052632 k( 185) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0052632 k( 186) = ( 0.5500000 -0.2020726 0.4082483), wk = 0.0052632 k( 187) = ( 0.5375000 -0.2237232 0.4082483), wk = 0.0052632 k( 188) = ( 0.5250000 -0.2453739 0.4082483), wk = 0.0052632 k( 189) = ( 0.5125000 -0.2670245 0.4082483), wk = 0.0052632 k( 190) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0052632 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0052632 k( 2) = ( 0.0178571 0.0000000 0.0178571), wk = 0.0052632 k( 3) = ( 0.0357143 0.0000000 0.0357143), wk = 0.0052632 k( 4) = ( 0.0535714 -0.0000000 0.0535714), wk = 0.0052632 k( 5) = ( 0.0714286 0.0000000 0.0714286), wk = 0.0052632 k( 6) = ( 0.0892857 -0.0000000 0.0892857), wk = 0.0052632 k( 7) = ( 0.1071429 -0.0000000 0.1071429), wk = 0.0052632 k( 8) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0052632 k( 9) = ( 0.1428571 0.0000000 0.1428571), wk = 0.0052632 k( 10) = ( 0.1607143 0.0000000 0.1607143), wk = 0.0052632 k( 11) = ( 0.1785714 0.0000000 0.1785714), wk = 0.0052632 k( 12) = ( 0.1964286 -0.0000000 0.1964286), wk = 0.0052632 k( 13) = ( 0.2142857 -0.0000000 0.2142857), wk = 0.0052632 k( 14) = ( 0.2321429 -0.0000000 0.2321429), wk = 0.0052632 k( 15) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0052632 k( 16) = ( 0.2678571 0.0000000 0.2678571), wk = 0.0052632 k( 17) = ( 0.2857143 0.0000000 0.2857143), wk = 0.0052632 k( 18) = ( 0.3035714 0.0000000 0.3035714), wk = 0.0052632 k( 19) = ( 0.3214286 0.0000000 0.3214286), wk = 0.0052632 k( 20) = ( 0.3392857 0.0000000 0.3392857), wk = 0.0052632 k( 21) = ( 0.3571429 0.0000000 0.3571429), wk = 0.0052632 k( 22) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0052632 k( 23) = ( 0.3928571 -0.0000000 0.3928571), wk = 0.0052632 k( 24) = ( 0.4107143 0.0000000 0.4107143), wk = 0.0052632 k( 25) = ( 0.4285714 0.0000000 0.4285714), wk = 0.0052632 k( 26) = ( 0.4464286 0.0000000 0.4464286), wk = 0.0052632 k( 27) = ( 0.4642857 -0.0000000 0.4642857), wk = 0.0052632 k( 28) = ( 0.4821429 0.0000000 0.4821429), wk = 0.0052632 k( 29) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0052632 k( 30) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0052632 k( 31) = ( 0.5000000 0.0178571 0.5178571), wk = 0.0052632 k( 32) = ( 0.5000000 0.0357143 0.5357143), wk = 0.0052632 k( 33) = ( 0.5000000 0.0535714 0.5535714), wk = 0.0052632 k( 34) = ( 0.5000000 0.0714286 0.5714286), wk = 0.0052632 k( 35) = ( 0.5000000 0.0892857 0.5892857), wk = 0.0052632 k( 36) = ( 0.5000000 0.1071429 0.6071429), wk = 0.0052632 k( 37) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0052632 k( 38) = ( 0.5000000 0.1428571 0.6428571), wk = 0.0052632 k( 39) = ( 0.5000000 0.1607143 0.6607143), wk = 0.0052632 k( 40) = ( 0.5000000 0.1785714 0.6785714), wk = 0.0052632 k( 41) = ( 0.5000000 0.1964286 0.6964286), wk = 0.0052632 k( 42) = ( 0.5000000 0.2142857 0.7142857), wk = 0.0052632 k( 43) = ( 0.5000000 0.2321429 0.7321429), wk = 0.0052632 k( 44) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0052632 k( 45) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0052632 k( 46) = ( 0.4875000 0.2625000 0.7500000), wk = 0.0052632 k( 47) = ( 0.4750000 0.2750000 0.7500000), wk = 0.0052632 k( 48) = ( 0.4625000 0.2875000 0.7500000), wk = 0.0052632 k( 49) = ( 0.4500000 0.3000000 0.7500000), wk = 0.0052632 k( 50) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0052632 k( 51) = ( 0.4250000 0.3250000 0.7500000), wk = 0.0052632 k( 52) = ( 0.4125000 0.3375000 0.7500000), wk = 0.0052632 k( 53) = ( 0.4000000 0.3500000 0.7500000), wk = 0.0052632 k( 54) = ( 0.3875000 0.3625000 0.7500000), wk = 0.0052632 k( 55) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0052632 k( 56) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0052632 k( 57) = ( 0.3625000 0.3625000 0.7250000), wk = 0.0052632 k( 58) = ( 0.3500000 0.3500000 0.7000000), wk = 0.0052632 k( 59) = ( 0.3375000 0.3375000 0.6750000), wk = 0.0052632 k( 60) = ( 0.3250000 0.3250000 0.6500000), wk = 0.0052632 k( 61) = ( 0.3125000 0.3125000 0.6250000), wk = 0.0052632 k( 62) = ( 0.3000000 0.3000000 0.6000000), wk = 0.0052632 k( 63) = ( 0.2875000 0.2875000 0.5750000), wk = 0.0052632 k( 64) = ( 0.2750000 0.2750000 0.5500000), wk = 0.0052632 k( 65) = ( 0.2625000 0.2625000 0.5250000), wk = 0.0052632 k( 66) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0052632 k( 67) = ( 0.2375000 0.2375000 0.4750000), wk = 0.0052632 k( 68) = ( 0.2250000 0.2250000 0.4500000), wk = 0.0052632 k( 69) = ( 0.2125000 0.2125000 0.4250000), wk = 0.0052632 k( 70) = ( 0.2000000 0.2000000 0.4000000), wk = 0.0052632 k( 71) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0052632 k( 72) = ( 0.1750000 0.1750000 0.3500000), wk = 0.0052632 k( 73) = ( 0.1625000 0.1625000 0.3250000), wk = 0.0052632 k( 74) = ( 0.1500000 0.1500000 0.3000000), wk = 0.0052632 k( 75) = ( 0.1375000 0.1375000 0.2750000), wk = 0.0052632 k( 76) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0052632 k( 77) = ( 0.1125000 0.1125000 0.2250000), wk = 0.0052632 k( 78) = ( 0.1000000 0.1000000 0.2000000), wk = 0.0052632 k( 79) = ( 0.0875000 0.0875000 0.1750000), wk = 0.0052632 k( 80) = ( 0.0750000 0.0750000 0.1500000), wk = 0.0052632 k( 81) = ( 0.0625000 0.0625000 0.1250000), wk = 0.0052632 k( 82) = ( 0.0500000 0.0500000 0.1000000), wk = 0.0052632 k( 83) = ( 0.0375000 0.0375000 0.0750000), wk = 0.0052632 k( 84) = ( 0.0250000 0.0250000 0.0500000), wk = 0.0052632 k( 85) = ( 0.0125000 0.0125000 0.0250000), wk = 0.0052632 k( 86) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0052632 k( 87) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0052632 k( 88) = ( 0.0208333 0.0208333 0.0208333), wk = 0.0052632 k( 89) = ( 0.0416667 0.0416667 0.0416667), wk = 0.0052632 k( 90) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0052632 k( 91) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0052632 k( 92) = ( 0.1041667 0.1041667 0.1041667), wk = 0.0052632 k( 93) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0052632 k( 94) = ( 0.1458333 0.1458333 0.1458333), wk = 0.0052632 k( 95) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0052632 k( 96) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0052632 k( 97) = ( 0.2083333 0.2083333 0.2083333), wk = 0.0052632 k( 98) = ( 0.2291667 0.2291667 0.2291667), wk = 0.0052632 k( 99) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0052632 k( 100) = ( 0.2708333 0.2708333 0.2708333), wk = 0.0052632 k( 101) = ( 0.2916667 0.2916667 0.2916667), wk = 0.0052632 k( 102) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0052632 k( 103) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0052632 k( 104) = ( 0.3541667 0.3541667 0.3541667), wk = 0.0052632 k( 105) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0052632 k( 106) = ( 0.3958333 0.3958333 0.3958333), wk = 0.0052632 k( 107) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0052632 k( 108) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0052632 k( 109) = ( 0.4583333 0.4583333 0.4583333), wk = 0.0052632 k( 110) = ( 0.4791667 0.4791667 0.4791667), wk = 0.0052632 k( 111) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0052632 k( 112) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0052632 k( 113) = ( 0.5073529 0.4852941 0.5073529), wk = 0.0052632 k( 114) = ( 0.5147059 0.4705882 0.5147059), wk = 0.0052632 k( 115) = ( 0.5220588 0.4558824 0.5220588), wk = 0.0052632 k( 116) = ( 0.5294118 0.4411765 0.5294118), wk = 0.0052632 k( 117) = ( 0.5367647 0.4264706 0.5367647), wk = 0.0052632 k( 118) = ( 0.5441177 0.4117647 0.5441177), wk = 0.0052632 k( 119) = ( 0.5514706 0.3970588 0.5514706), wk = 0.0052632 k( 120) = ( 0.5588235 0.3823529 0.5588235), wk = 0.0052632 k( 121) = ( 0.5661765 0.3676471 0.5661765), wk = 0.0052632 k( 122) = ( 0.5735294 0.3529412 0.5735294), wk = 0.0052632 k( 123) = ( 0.5808823 0.3382353 0.5808823), wk = 0.0052632 k( 124) = ( 0.5882353 0.3235294 0.5882353), wk = 0.0052632 k( 125) = ( 0.5955882 0.3088235 0.5955882), wk = 0.0052632 k( 126) = ( 0.6029412 0.2941177 0.6029412), wk = 0.0052632 k( 127) = ( 0.6102941 0.2794118 0.6102941), wk = 0.0052632 k( 128) = ( 0.6176471 0.2647059 0.6176471), wk = 0.0052632 k( 129) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0052632 k( 130) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0052632 k( 131) = ( 0.6125000 0.2500000 0.6375000), wk = 0.0052632 k( 132) = ( 0.6000000 0.2500000 0.6500000), wk = 0.0052632 k( 133) = ( 0.5875000 0.2500000 0.6625000), wk = 0.0052632 k( 134) = ( 0.5750000 0.2500000 0.6750000), wk = 0.0052632 k( 135) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0052632 k( 136) = ( 0.5500000 0.2500000 0.7000000), wk = 0.0052632 k( 137) = ( 0.5375000 0.2500000 0.7125000), wk = 0.0052632 k( 138) = ( 0.5250000 0.2500000 0.7250000), wk = 0.0052632 k( 139) = ( 0.5125000 0.2500000 0.7375000), wk = 0.0052632 k( 140) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0052632 k( 141) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0052632 k( 142) = ( 0.5000000 0.2625000 0.7375000), wk = 0.0052632 k( 143) = ( 0.5000000 0.2750000 0.7250000), wk = 0.0052632 k( 144) = ( 0.5000000 0.2875000 0.7125000), wk = 0.0052632 k( 145) = ( 0.5000000 0.3000000 0.7000000), wk = 0.0052632 k( 146) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0052632 k( 147) = ( 0.5000000 0.3250000 0.6750000), wk = 0.0052632 k( 148) = ( 0.5000000 0.3375000 0.6625000), wk = 0.0052632 k( 149) = ( 0.5000000 0.3500000 0.6500000), wk = 0.0052632 k( 150) = ( 0.5000000 0.3625000 0.6375000), wk = 0.0052632 k( 151) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0052632 k( 152) = ( 0.5000000 0.3875000 0.6125000), wk = 0.0052632 k( 153) = ( 0.5000000 0.4000000 0.6000000), wk = 0.0052632 k( 154) = ( 0.5000000 0.4125000 0.5875000), wk = 0.0052632 k( 155) = ( 0.5000000 0.4250000 0.5750000), wk = 0.0052632 k( 156) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0052632 k( 157) = ( 0.5000000 0.4500000 0.5500000), wk = 0.0052632 k( 158) = ( 0.5000000 0.4625000 0.5375000), wk = 0.0052632 k( 159) = ( 0.5000000 0.4750000 0.5250000), wk = 0.0052632 k( 160) = ( 0.5000000 0.4875000 0.5125000), wk = 0.0052632 k( 161) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0052632 k( 162) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0052632 k( 163) = ( 0.4926471 0.4926471 0.5147059), wk = 0.0052632 k( 164) = ( 0.4852941 0.4852941 0.5294118), wk = 0.0052632 k( 165) = ( 0.4779412 0.4779412 0.5441177), wk = 0.0052632 k( 166) = ( 0.4705882 0.4705882 0.5588235), wk = 0.0052632 k( 167) = ( 0.4632353 0.4632353 0.5735294), wk = 0.0052632 k( 168) = ( 0.4558823 0.4558824 0.5882353), wk = 0.0052632 k( 169) = ( 0.4485294 0.4485294 0.6029412), wk = 0.0052632 k( 170) = ( 0.4411765 0.4411765 0.6176471), wk = 0.0052632 k( 171) = ( 0.4338235 0.4338235 0.6323529), wk = 0.0052632 k( 172) = ( 0.4264706 0.4264706 0.6470588), wk = 0.0052632 k( 173) = ( 0.4191177 0.4191177 0.6617647), wk = 0.0052632 k( 174) = ( 0.4117647 0.4117647 0.6764706), wk = 0.0052632 k( 175) = ( 0.4044118 0.4044118 0.6911765), wk = 0.0052632 k( 176) = ( 0.3970588 0.3970588 0.7058823), wk = 0.0052632 k( 177) = ( 0.3897059 0.3897059 0.7205882), wk = 0.0052632 k( 178) = ( 0.3823529 0.3823529 0.7352941), wk = 0.0052632 k( 179) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0052632 k( 180) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0052632 k( 181) = ( 0.6125000 0.2250000 0.6125000), wk = 0.0052632 k( 182) = ( 0.6000000 0.2000000 0.6000000), wk = 0.0052632 k( 183) = ( 0.5875000 0.1750000 0.5875000), wk = 0.0052632 k( 184) = ( 0.5750000 0.1500000 0.5750000), wk = 0.0052632 k( 185) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0052632 k( 186) = ( 0.5500000 0.1000000 0.5500000), wk = 0.0052632 k( 187) = ( 0.5375000 0.0750000 0.5375000), wk = 0.0052632 k( 188) = ( 0.5250000 0.0500000 0.5250000), wk = 0.0052632 k( 189) = ( 0.5125000 0.0250000 0.5125000), wk = 0.0052632 k( 190) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0052632 Dense grid: 376199 G-vectors FFT dimensions: ( 108, 108, 108) Smooth grid: 239441 G-vectors FFT dimensions: ( 90, 90, 90) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.07 Mb ( 832, 84) NL pseudopotentials 2.30 Mb ( 416, 362) Each V/rho on FFT grid 0.36 Mb ( 23328) Each G-vector array 0.04 Mb ( 5227) G-vector shells 0.01 Mb ( 1397) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 4.27 Mb ( 832, 336) Each subspace H/S matrix 0.05 Mb ( 56, 56) Each matrix 0.93 Mb ( 362, 2, 84) The potential is recalculated from file : ./Cs2PtI6.save/charge-density.dat Starting wfc are 86 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 8.5 secs Computing kpt #: 2 total cpu time spent up to now is 13.8 secs Computing kpt #: 3 total cpu time spent up to now is 19.2 secs Computing kpt #: 4 total cpu time spent up to now is 24.6 secs Computing kpt #: 5 total cpu time spent up to now is 30.1 secs Computing kpt #: 6 total cpu time spent up to now is 35.8 secs Computing kpt #: 7 total cpu time spent up to now is 41.3 secs Computing kpt #: 8 total cpu time spent up to now is 46.7 secs Computing kpt #: 9 total cpu time spent up to now is 52.2 secs Computing kpt #: 10 total cpu time spent up to now is 57.6 secs Computing kpt #: 11 total cpu time spent up to now is 63.1 secs Computing kpt #: 12 total cpu time spent up to now is 68.5 secs Computing kpt #: 13 total cpu time spent up to now is 73.5 secs Computing kpt #: 14 total cpu time spent up to now is 78.4 secs Computing kpt #: 15 total cpu time spent up to now is 83.3 secs Computing kpt #: 16 total cpu time spent up to now is 88.3 secs Computing kpt #: 17 total cpu time spent up to now is 93.3 secs Computing kpt #: 18 total cpu time spent up to now is 98.2 secs Computing kpt #: 19 total cpu time spent up to now is 103.6 secs Computing kpt #: 20 total cpu time spent up to now is 108.6 secs Computing kpt #: 21 total cpu time spent up to now is 113.6 secs Computing kpt #: 22 total cpu time spent up to now is 119.2 secs Computing kpt #: 23 total cpu time spent up to now is 124.7 secs Computing kpt #: 24 total cpu time spent up to now is 130.3 secs Computing kpt #: 25 total cpu time spent up to now is 136.0 secs Computing kpt #: 26 total cpu time spent up to now is 141.7 secs Computing kpt #: 27 total cpu time spent up to now is 147.4 secs Computing kpt #: 28 total cpu time spent up to now is 153.3 secs Computing kpt #: 29 total cpu time spent up to now is 159.4 secs Computing kpt #: 30 total cpu time spent up to now is 166.2 secs Computing kpt #: 31 total cpu time spent up to now is 173.0 secs Computing kpt #: 32 total cpu time spent up to now is 180.8 secs Computing kpt #: 33 total cpu time spent up to now is 188.7 secs Computing kpt #: 34 total cpu time spent up to now is 196.9 secs Computing kpt #: 35 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 206.3 secs Computing kpt #: 36 total cpu time spent up to now is 212.2 secs Computing kpt #: 37 total cpu time spent up to now is 218.0 secs Computing kpt #: 38 total cpu time spent up to now is 223.7 secs Computing kpt #: 39 total cpu time spent up to now is 229.3 secs Computing kpt #: 40 total cpu time spent up to now is 235.1 secs Computing kpt #: 41 total cpu time spent up to now is 240.8 secs Computing kpt #: 42 total cpu time spent up to now is 246.6 secs Computing kpt #: 43 total cpu time spent up to now is 252.7 secs Computing kpt #: 44 total cpu time spent up to now is 258.6 secs Computing kpt #: 45 total cpu time spent up to now is 264.8 secs Computing kpt #: 46 total cpu time spent up to now is 270.7 secs Computing kpt #: 47 total cpu time spent up to now is 276.6 secs Computing kpt #: 48 total cpu time spent up to now is 282.5 secs Computing kpt #: 49 total cpu time spent up to now is 288.6 secs Computing kpt #: 50 total cpu time spent up to now is 294.6 secs Computing kpt #: 51 total cpu time spent up to now is 300.6 secs Computing kpt #: 52 total cpu time spent up to now is 306.7 secs Computing kpt #: 53 total cpu time spent up to now is 312.5 secs Computing kpt #: 54 total cpu time spent up to now is 318.2 secs Computing kpt #: 55 total cpu time spent up to now is 324.0 secs Computing kpt #: 56 total cpu time spent up to now is 329.9 secs Computing kpt #: 57 total cpu time spent up to now is 335.8 secs Computing kpt #: 58 total cpu time spent up to now is 341.8 secs Computing kpt #: 59 total cpu time spent up to now is 349.7 secs Computing kpt #: 60 total cpu time spent up to now is 358.8 secs Computing kpt #: 61 total cpu time spent up to now is 364.5 secs Computing kpt #: 62 total cpu time spent up to now is 370.1 secs Computing kpt #: 63 total cpu time spent up to now is 375.7 secs Computing kpt #: 64 total cpu time spent up to now is 380.8 secs Computing kpt #: 65 total cpu time spent up to now is 385.9 secs Computing kpt #: 66 total cpu time spent up to now is 391.5 secs Computing kpt #: 67 total cpu time spent up to now is 396.5 secs Computing kpt #: 68 total cpu time spent up to now is 401.5 secs Computing kpt #: 69 total cpu time spent up to now is 406.4 secs Computing kpt #: 70 total cpu time spent up to now is 411.4 secs Computing kpt #: 71 total cpu time spent up to now is 416.2 secs Computing kpt #: 72 total cpu time spent up to now is 421.1 secs Computing kpt #: 73 total cpu time spent up to now is 426.0 secs Computing kpt #: 74 total cpu time spent up to now is 430.9 secs Computing kpt #: 75 total cpu time spent up to now is 435.9 secs Computing kpt #: 76 total cpu time spent up to now is 440.8 secs Computing kpt #: 77 total cpu time spent up to now is 445.7 secs Computing kpt #: 78 total cpu time spent up to now is 451.1 secs Computing kpt #: 79 total cpu time spent up to now is 456.7 secs Computing kpt #: 80 total cpu time spent up to now is 462.1 secs Computing kpt #: 81 total cpu time spent up to now is 467.5 secs Computing kpt #: 82 total cpu time spent up to now is 472.9 secs Computing kpt #: 83 total cpu time spent up to now is 478.3 secs Computing kpt #: 84 total cpu time spent up to now is 483.7 secs Computing kpt #: 85 total cpu time spent up to now is 489.1 secs Computing kpt #: 86 total cpu time spent up to now is 494.3 secs Computing kpt #: 87 total cpu time spent up to now is 499.9 secs Computing kpt #: 88 total cpu time spent up to now is 505.6 secs Computing kpt #: 89 total cpu time spent up to now is 510.9 secs Computing kpt #: 90 total cpu time spent up to now is 516.4 secs Computing kpt #: 91 total cpu time spent up to now is 521.8 secs Computing kpt #: 92 total cpu time spent up to now is 527.1 secs Computing kpt #: 93 total cpu time spent up to now is 532.5 secs Computing kpt #: 94 total cpu time spent up to now is 538.0 secs Computing kpt #: 95 total cpu time spent up to now is 543.4 secs Computing kpt #: 96 total cpu time spent up to now is 548.8 secs Computing kpt #: 97 total cpu time spent up to now is 554.2 secs Computing kpt #: 98 total cpu time spent up to now is 559.2 secs Computing kpt #: 99 total cpu time spent up to now is 564.0 secs Computing kpt #: 100 total cpu time spent up to now is 568.8 secs Computing kpt #: 101 total cpu time spent up to now is 573.6 secs Computing kpt #: 102 total cpu time spent up to now is 578.5 secs Computing kpt #: 103 total cpu time spent up to now is 583.4 secs Computing kpt #: 104 total cpu time spent up to now is 588.4 secs Computing kpt #: 105 total cpu time spent up to now is 594.0 secs Computing kpt #: 106 total cpu time spent up to now is 599.8 secs Computing kpt #: 107 total cpu time spent up to now is 605.6 secs Computing kpt #: 108 total cpu time spent up to now is 611.3 secs Computing kpt #: 109 total cpu time spent up to now is 616.4 secs Computing kpt #: 110 total cpu time spent up to now is 622.2 secs Computing kpt #: 111 total cpu time spent up to now is 627.9 secs Computing kpt #: 112 total cpu time spent up to now is 633.6 secs Computing kpt #: 113 total cpu time spent up to now is 639.3 secs Computing kpt #: 114 total cpu time spent up to now is 645.1 secs Computing kpt #: 115 total cpu time spent up to now is 650.7 secs Computing kpt #: 116 total cpu time spent up to now is 656.5 secs Computing kpt #: 117 total cpu time spent up to now is 662.3 secs Computing kpt #: 118 total cpu time spent up to now is 668.1 secs Computing kpt #: 119 total cpu time spent up to now is 674.7 secs Computing kpt #: 120 total cpu time spent up to now is 680.6 secs Computing kpt #: 121 total cpu time spent up to now is 686.4 secs Computing kpt #: 122 total cpu time spent up to now is 692.2 secs Computing kpt #: 123 total cpu time spent up to now is 697.9 secs Computing kpt #: 124 total cpu time spent up to now is 704.0 secs Computing kpt #: 125 total cpu time spent up to now is 709.6 secs Computing kpt #: 126 total cpu time spent up to now is 715.3 secs Computing kpt #: 127 total cpu time spent up to now is 721.1 secs Computing kpt #: 128 total cpu time spent up to now is 726.7 secs Computing kpt #: 129 total cpu time spent up to now is 732.7 secs Computing kpt #: 130 total cpu time spent up to now is 738.5 secs Computing kpt #: 131 total cpu time spent up to now is 744.3 secs Computing kpt #: 132 total cpu time spent up to now is 750.4 secs Computing kpt #: 133 total cpu time spent up to now is 756.3 secs Computing kpt #: 134 total cpu time spent up to now is 762.3 secs Computing kpt #: 135 total cpu time spent up to now is 768.1 secs Computing kpt #: 136 total cpu time spent up to now is 774.0 secs Computing kpt #: 137 total cpu time spent up to now is 780.1 secs Computing kpt #: 138 total cpu time spent up to now is 786.1 secs Computing kpt #: 139 total cpu time spent up to now is 792.8 secs Computing kpt #: 140 total cpu time spent up to now is 799.1 secs Computing kpt #: 141 total cpu time spent up to now is 805.1 secs Computing kpt #: 142 total cpu time spent up to now is 811.9 secs Computing kpt #: 143 total cpu time spent up to now is 818.9 secs Computing kpt #: 144 total cpu time spent up to now is 825.1 secs Computing kpt #: 145 total cpu time spent up to now is 830.9 secs Computing kpt #: 146 total cpu time spent up to now is 836.9 secs Computing kpt #: 147 total cpu time spent up to now is 842.7 secs Computing kpt #: 148 total cpu time spent up to now is 848.6 secs Computing kpt #: 149 total cpu time spent up to now is 854.8 secs Computing kpt #: 150 total cpu time spent up to now is 860.7 secs Computing kpt #: 151 total cpu time spent up to now is 867.4 secs Computing kpt #: 152 total cpu time spent up to now is 873.3 secs Computing kpt #: 153 total cpu time spent up to now is 880.1 secs Computing kpt #: 154 total cpu time spent up to now is 889.0 secs Computing kpt #: 155 total cpu time spent up to now is 897.1 secs Computing kpt #: 156 total cpu time spent up to now is 903.6 secs Computing kpt #: 157 total cpu time spent up to now is 909.3 secs Computing kpt #: 158 total cpu time spent up to now is 915.0 secs Computing kpt #: 159 total cpu time spent up to now is 920.7 secs Computing kpt #: 160 total cpu time spent up to now is 926.4 secs Computing kpt #: 161 total cpu time spent up to now is 932.0 secs Computing kpt #: 162 total cpu time spent up to now is 937.7 secs Computing kpt #: 163 total cpu time spent up to now is 943.3 secs Computing kpt #: 164 total cpu time spent up to now is 949.0 secs Computing kpt #: 165 total cpu time spent up to now is 954.7 secs Computing kpt #: 166 total cpu time spent up to now is 960.5 secs Computing kpt #: 167 total cpu time spent up to now is 966.2 secs Computing kpt #: 168 total cpu time spent up to now is 972.3 secs Computing kpt #: 169 total cpu time spent up to now is 978.1 secs Computing kpt #: 170 total cpu time spent up to now is 983.9 secs Computing kpt #: 171 total cpu time spent up to now is 989.7 secs Computing kpt #: 172 total cpu time spent up to now is 995.5 secs Computing kpt #: 173 total cpu time spent up to now is 1001.3 secs Computing kpt #: 174 total cpu time spent up to now is 1006.9 secs Computing kpt #: 175 total cpu time spent up to now is 1012.6 secs Computing kpt #: 176 total cpu time spent up to now is 1018.2 secs Computing kpt #: 177 total cpu time spent up to now is 1023.7 secs Computing kpt #: 178 total cpu time spent up to now is 1029.5 secs Computing kpt #: 179 total cpu time spent up to now is 1035.4 secs Computing kpt #: 180 total cpu time spent up to now is 1041.0 secs Computing kpt #: 181 total cpu time spent up to now is 1046.7 secs Computing kpt #: 182 total cpu time spent up to now is 1052.6 secs Computing kpt #: 183 total cpu time spent up to now is 1058.3 secs Computing kpt #: 184 total cpu time spent up to now is 1064.2 secs Computing kpt #: 185 total cpu time spent up to now is 1070.1 secs Computing kpt #: 186 total cpu time spent up to now is 1075.9 secs Computing kpt #: 187 total cpu time spent up to now is 1081.8 secs Computing kpt #: 188 total cpu time spent up to now is 1087.8 secs Computing kpt #: 189 total cpu time spent up to now is 1093.6 secs Computing kpt #: 190 total cpu time spent up to now is 1100.6 secs ethr = 1.43E-08, avg # of iterations = 47.6 total cpu time spent up to now is 1100.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 29939 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4302 -8.4302 -7.6034 -7.6034 -7.5578 -7.5578 -7.5578 -7.5578 -7.4269 -7.4269 -7.4269 -7.4269 -3.8927 -3.8927 -3.8293 -3.8293 -2.5557 -2.5557 -2.5557 -2.5557 -2.4235 -2.4235 -2.4235 -2.4235 -1.1274 -1.1274 -0.4239 -0.4239 -0.4239 -0.4239 0.2083 0.2083 0.2083 0.2083 0.6080 0.6080 0.9536 0.9536 0.9536 0.9536 1.1611 1.1611 2.7408 2.7408 2.7408 2.7408 2.8853 2.8853 2.9685 2.9685 2.9685 2.9685 3.2018 3.2018 3.3813 3.3813 3.6590 3.6590 4.1174 4.1174 4.1174 4.1174 4.2590 4.2590 4.2590 4.2590 5.9203 5.9203 5.9203 5.9203 7.1038 7.1038 8.3998 8.3998 8.3998 8.3998 8.5138 8.5138 8.9010 8.9010 k = 0.0179-0.0103 0.0146 ( 29939 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4299 -8.4299 -7.6036 -7.6036 -7.5580 -7.5580 -7.5579 -7.5579 -7.4273 -7.4273 -7.4269 -7.4269 -3.8924 -3.8924 -3.8292 -3.8292 -2.5552 -2.5552 -2.5551 -2.5551 -2.4234 -2.4234 -2.4233 -2.4233 -1.1259 -1.1259 -0.4248 -0.4248 -0.4239 -0.4239 0.2078 0.2078 0.2080 0.2080 0.6080 0.6080 0.9537 0.9537 0.9548 0.9548 1.1619 1.1619 2.7389 2.7389 2.7398 2.7398 2.8852 2.8852 2.9676 2.9676 2.9687 2.9687 3.2011 3.2011 3.3819 3.3819 3.6574 3.6574 4.1135 4.1135 4.1166 4.1166 4.2564 4.2564 4.2581 4.2581 5.9159 5.9159 5.9201 5.9201 7.1081 7.1081 8.4025 8.4025 8.4039 8.4039 8.5190 8.5190 8.9042 8.9042 k = 0.0357-0.0206 0.0292 ( 29955 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4290 -8.4290 -7.6039 -7.6039 -7.5586 -7.5586 -7.5582 -7.5582 -7.4285 -7.4285 -7.4268 -7.4268 -3.8915 -3.8915 -3.8288 -3.8288 -2.5538 -2.5538 -2.5534 -2.5534 -2.4230 -2.4230 -2.4226 -2.4226 -1.1215 -1.1215 -0.4273 -0.4273 -0.4241 -0.4241 0.2064 0.2064 0.2069 0.2069 0.6082 0.6082 0.9538 0.9538 0.9584 0.9584 1.1641 1.1641 2.7335 2.7335 2.7368 2.7368 2.8846 2.8846 2.9647 2.9647 2.9692 2.9692 3.1987 3.1987 3.3835 3.3835 3.6526 3.6526 4.1019 4.1019 4.1142 4.1142 4.2487 4.2487 4.2554 4.2554 5.9029 5.9029 5.9195 5.9195 7.1210 7.1210 8.4105 8.4105 8.4162 8.4162 8.5346 8.5346 8.9137 8.9137 k = 0.0536-0.0309 0.0437 ( 29943 PWs) bands (ev): -15.0227 -15.0227 -15.0132 -15.0132 -8.4276 -8.4276 -7.6045 -7.6045 -7.5596 -7.5596 -7.5586 -7.5586 -7.4304 -7.4304 -7.4267 -7.4267 -3.8901 -3.8901 -3.8282 -3.8282 -2.5515 -2.5515 -2.5506 -2.5506 -2.4222 -2.4222 -2.4214 -2.4214 -1.1141 -1.1141 -0.4314 -0.4314 -0.4242 -0.4242 0.2041 0.2041 0.2051 0.2051 0.6084 0.6084 0.9541 0.9541 0.9644 0.9644 1.1677 1.1677 2.7247 2.7247 2.7321 2.7321 2.8831 2.8831 2.9601 2.9601 2.9703 2.9703 3.1948 3.1948 3.3863 3.3863 3.6445 3.6445 4.0830 4.0830 4.1102 4.1102 4.2361 4.2361 4.2509 4.2509 5.8813 5.8813 5.9186 5.9186 7.1423 7.1423 8.4238 8.4238 8.4366 8.4366 8.5605 8.5605 8.9293 8.9293 k = 0.0714-0.0412 0.0583 ( 29967 PWs) bands (ev): -15.0226 -15.0226 -15.0132 -15.0132 -8.4256 -8.4256 -7.6052 -7.6052 -7.5609 -7.5609 -7.5593 -7.5593 -7.4330 -7.4330 -7.4265 -7.4265 -3.8880 -3.8880 -3.8274 -3.8274 -2.5483 -2.5483 -2.5467 -2.5467 -2.4213 -2.4213 -2.4197 -2.4197 -1.1040 -1.1040 -0.4371 -0.4371 -0.4245 -0.4245 0.2010 0.2010 0.2026 0.2026 0.6087 0.6087 0.9545 0.9545 0.9725 0.9725 1.1728 1.1728 2.7131 2.7131 2.7256 2.7256 2.8803 2.8803 2.9537 2.9537 2.9720 2.9720 3.1891 3.1891 3.3903 3.3903 3.6332 3.6332 4.0575 4.0575 4.1045 4.1045 4.2188 4.2188 4.2448 4.2448 5.8517 5.8517 5.9174 5.9174 7.1720 7.1720 8.4424 8.4424 8.4649 8.4649 8.5964 8.5964 8.9509 8.9509 k = 0.0893-0.0515 0.0729 ( 29979 PWs) bands (ev): -15.0225 -15.0225 -15.0133 -15.0133 -8.4230 -8.4230 -7.6062 -7.6062 -7.5625 -7.5625 -7.5601 -7.5601 -7.4363 -7.4363 -7.4263 -7.4263 -3.8855 -3.8855 -3.8264 -3.8264 -2.5442 -2.5442 -2.5418 -2.5418 -2.4200 -2.4200 -2.4176 -2.4176 -1.0911 -1.0911 -0.4442 -0.4442 -0.4248 -0.4248 0.1972 0.1972 0.1995 0.1995 0.6092 0.6092 0.9549 0.9549 0.9827 0.9827 1.1793 1.1793 2.6989 2.6989 2.7175 2.7175 2.8759 2.8759 2.9458 2.9458 2.9746 2.9746 3.1817 3.1817 3.3956 3.3956 3.6185 3.6185 4.0262 4.0262 4.0969 4.0969 4.1973 4.1973 4.2373 4.2373 5.8143 5.8143 5.9158 5.9158 7.2096 7.2096 8.4663 8.4663 8.5009 8.5009 8.6419 8.6419 8.9781 8.9781 k = 0.1071-0.0619 0.0875 ( 29967 PWs) bands (ev): -15.0224 -15.0224 -15.0134 -15.0134 -8.4200 -8.4200 -7.6074 -7.6074 -7.5645 -7.5645 -7.5610 -7.5610 -7.4404 -7.4404 -7.4260 -7.4260 -3.8824 -3.8824 -3.8252 -3.8252 -2.5394 -2.5394 -2.5358 -2.5358 -2.4185 -2.4185 -2.4151 -2.4151 -1.0755 -1.0755 -0.4526 -0.4526 -0.4251 -0.4251 0.1929 0.1929 0.1956 0.1956 0.6097 0.6097 0.9554 0.9554 0.9947 0.9947 1.1870 1.1870 2.6825 2.6825 2.7082 2.7082 2.8695 2.8695 2.9367 2.9367 2.9779 2.9779 3.1725 3.1725 3.4022 3.4022 3.6006 3.6006 3.9899 3.9899 4.0870 4.0870 4.1722 4.1722 4.2285 4.2285 5.7700 5.7700 5.9140 5.9140 7.2550 7.2550 8.4953 8.4953 8.5444 8.5444 8.6965 8.6965 9.0105 9.0105 k = 0.1250-0.0722 0.1021 ( 29947 PWs) bands (ev): -15.0222 -15.0222 -15.0135 -15.0135 -8.4164 -8.4164 -7.6088 -7.6088 -7.5667 -7.5667 -7.5621 -7.5621 -7.4451 -7.4451 -7.4257 -7.4257 -3.8789 -3.8789 -3.8238 -3.8238 -2.5337 -2.5337 -2.5289 -2.5289 -2.4168 -2.4168 -2.4122 -2.4122 -1.0575 -1.0575 -0.4621 -0.4621 -0.4256 -0.4256 0.1883 0.1883 0.1911 0.1911 0.6104 0.6104 0.9560 0.9560 1.0083 1.0083 1.1960 1.1960 2.6642 2.6642 2.6978 2.6978 2.8612 2.8612 2.9264 2.9264 2.9819 2.9819 3.1617 3.1617 3.4101 3.4101 3.5794 3.5794 3.9496 3.9496 4.0741 4.0741 4.1449 4.1449 4.2188 4.2188 5.7193 5.7193 5.9119 5.9119 7.3075 7.3075 8.5294 8.5294 8.5951 8.5951 8.7597 8.7597 9.0474 9.0474 k = 0.1429-0.0825 0.1166 ( 29955 PWs) bands (ev): -15.0221 -15.0221 -15.0136 -15.0136 -8.4124 -8.4124 -7.6104 -7.6104 -7.5691 -7.5691 -7.5634 -7.5634 -7.4504 -7.4504 -7.4253 -7.4253 -3.8750 -3.8750 -3.8222 -3.8222 -2.5274 -2.5274 -2.5211 -2.5211 -2.4148 -2.4148 -2.4090 -2.4090 -1.0372 -1.0372 -0.4725 -0.4725 -0.4261 -0.4261 0.1834 0.1834 0.1859 0.1859 0.6113 0.6113 0.9566 0.9566 1.0234 1.0234 1.2061 1.2061 2.6442 2.6442 2.6865 2.6865 2.8512 2.8512 2.9153 2.9153 2.9864 2.9864 3.1495 3.1495 3.4191 3.4191 3.5551 3.5551 3.9062 3.9062 4.0561 4.0561 4.1175 4.1175 4.2084 4.2084 5.6632 5.6632 5.9097 5.9097 7.3666 7.3666 8.5685 8.5685 8.6525 8.6525 8.8307 8.8307 9.0880 9.0880 k = 0.1607-0.0928 0.1312 ( 29943 PWs) bands (ev): -15.0219 -15.0219 -15.0137 -15.0137 -8.4079 -8.4079 -7.6121 -7.6121 -7.5717 -7.5717 -7.5647 -7.5647 -7.4563 -7.4563 -7.4249 -7.4249 -3.8707 -3.8707 -3.8205 -3.8205 -2.5205 -2.5205 -2.5126 -2.5126 -2.4127 -2.4127 -2.4056 -2.4056 -1.0149 -1.0149 -0.4837 -0.4837 -0.4267 -0.4267 0.1784 0.1784 0.1801 0.1801 0.6123 0.6123 0.9572 0.9572 1.0396 1.0396 1.2172 1.2172 2.6226 2.6226 2.6746 2.6746 2.8396 2.8396 2.9037 2.9037 2.9914 2.9914 3.1360 3.1360 3.4292 3.4292 3.5277 3.5277 3.8606 3.8606 4.0307 4.0307 4.0931 4.0931 4.1977 4.1977 5.6027 5.6027 5.9073 5.9073 7.4318 7.4318 8.6126 8.6126 8.7163 8.7163 8.9087 8.9087 9.1316 9.1316 k = 0.1786-0.1031 0.1458 ( 29935 PWs) bands (ev): -15.0217 -15.0217 -15.0138 -15.0138 -8.4031 -8.4031 -7.6139 -7.6139 -7.5744 -7.5744 -7.5662 -7.5662 -7.4627 -7.4627 -7.4245 -7.4245 -3.8660 -3.8660 -3.8187 -3.8187 -2.5130 -2.5130 -2.5033 -2.5033 -2.4104 -2.4104 -2.4018 -2.4018 -0.9908 -0.9908 -0.4952 -0.4952 -0.4273 -0.4273 0.1734 0.1734 0.1737 0.1737 0.6135 0.6135 0.9577 0.9577 1.0568 1.0568 1.2292 1.2292 2.5996 2.5996 2.6623 2.6623 2.8267 2.8267 2.8917 2.8917 2.9966 2.9966 3.1217 3.1217 3.4402 3.4402 3.4974 3.4974 3.8137 3.8137 3.9971 3.9971 4.0728 4.0728 4.1869 4.1869 5.5385 5.5385 5.9048 5.9048 7.5024 7.5024 8.6615 8.6615 8.7859 8.7859 8.9929 8.9929 9.1769 9.1769 k = 0.1964-0.1134 0.1604 ( 29907 PWs) bands (ev): -15.0215 -15.0215 -15.0140 -15.0140 -8.3979 -8.3979 -7.6159 -7.6159 -7.5772 -7.5772 -7.5677 -7.5677 -7.4697 -7.4697 -7.4240 -7.4240 -3.8611 -3.8611 -3.8168 -3.8168 -2.5051 -2.5051 -2.4935 -2.4935 -2.4080 -2.4080 -2.3979 -2.3979 -0.9652 -0.9652 -0.5069 -0.5069 -0.4280 -0.4280 0.1668 0.1668 0.1686 0.1686 0.6149 0.6149 0.9582 0.9582 1.0748 1.0748 1.2420 1.2420 2.5753 2.5753 2.6497 2.6497 2.8129 2.8129 2.8796 2.8796 3.0021 3.0021 3.1068 3.1068 3.4521 3.4521 3.4644 3.4644 3.7663 3.7663 3.9573 3.9573 4.0551 4.0551 4.1762 4.1762 5.4716 5.4716 5.9023 5.9023 7.5778 7.5778 8.7151 8.7151 8.8609 8.8609 9.0824 9.0824 9.2226 9.2226 k = 0.2143-0.1237 0.1750 ( 29903 PWs) bands (ev): -15.0213 -15.0213 -15.0141 -15.0141 -8.3925 -8.3925 -7.6179 -7.6179 -7.5801 -7.5801 -7.5692 -7.5692 -7.4770 -7.4770 -7.4236 -7.4236 -3.8560 -3.8560 -3.8149 -3.8149 -2.4969 -2.4969 -2.4832 -2.4832 -2.4055 -2.4055 -2.3938 -2.3938 -0.9386 -0.9386 -0.5184 -0.5184 -0.4288 -0.4288 0.1594 0.1594 0.1639 0.1639 0.6165 0.6165 0.9587 0.9587 1.0932 1.0932 1.2553 1.2553 2.5496 2.5496 2.6371 2.6371 2.7986 2.7986 2.8678 2.8678 3.0077 3.0077 3.0916 3.0916 3.4292 3.4292 3.4646 3.4646 3.7191 3.7191 3.9135 3.9135 4.0384 4.0384 4.1658 4.1658 5.4030 5.4030 5.8997 5.8997 7.6572 7.6572 8.7732 8.7732 8.9408 8.9408 9.1760 9.1760 9.2676 9.2676 k = 0.2321-0.1340 0.1895 ( 29903 PWs) bands (ev): -15.0211 -15.0211 -15.0142 -15.0142 -8.3868 -8.3868 -7.6199 -7.6199 -7.5829 -7.5829 -7.5709 -7.5709 -7.4848 -7.4848 -7.4231 -7.4231 -3.8508 -3.8508 -3.8129 -3.8129 -2.4884 -2.4884 -2.4725 -2.4725 -2.4029 -2.4029 -2.3897 -2.3897 -0.9115 -0.9115 -0.5293 -0.5293 -0.4297 -0.4297 0.1516 0.1516 0.1595 0.1595 0.6182 0.6182 0.9590 0.9590 1.1121 1.1121 1.2690 1.2690 2.5229 2.5229 2.6247 2.6247 2.7840 2.7840 2.8564 2.8564 3.0134 3.0134 3.0767 3.0767 3.3920 3.3920 3.4776 3.4776 3.6727 3.6727 3.8671 3.8671 4.0218 4.0218 4.1558 4.1558 5.3336 5.3336 5.8971 5.8971 7.7400 7.7400 8.8356 8.8356 9.0247 9.0247 9.2725 9.2725 9.3109 9.3109 k = 0.2500-0.1443 0.2041 ( 29847 PWs) bands (ev): -15.0208 -15.0208 -15.0144 -15.0144 -8.3810 -8.3810 -7.6219 -7.6219 -7.5857 -7.5857 -7.5725 -7.5725 -7.4927 -7.4927 -7.4226 -7.4226 -3.8454 -3.8454 -3.8108 -3.8108 -2.4798 -2.4798 -2.4616 -2.4616 -2.4002 -2.4002 -2.3855 -2.3855 -0.8844 -0.8844 -0.5390 -0.5390 -0.4305 -0.4305 0.1436 0.1436 0.1553 0.1553 0.6201 0.6201 0.9593 0.9593 1.1310 1.1310 1.2830 1.2830 2.4950 2.4950 2.6124 2.6124 2.7696 2.7696 2.8455 2.8455 3.0192 3.0192 3.0622 3.0622 3.3533 3.3533 3.4911 3.4911 3.6277 3.6277 3.8191 3.8191 4.0050 4.0050 4.1463 4.1463 5.2641 5.2641 5.8946 5.8946 7.8253 7.8253 8.9018 8.9018 9.1122 9.1122 9.3517 9.3517 9.3706 9.3706 k = 0.2679-0.1546 0.2187 ( 29899 PWs) bands (ev): -15.0206 -15.0206 -15.0145 -15.0145 -8.3751 -8.3751 -7.6238 -7.6238 -7.5884 -7.5884 -7.5741 -7.5741 -7.5010 -7.5010 -7.4221 -7.4221 -3.8401 -3.8401 -3.8088 -3.8088 -2.4711 -2.4711 -2.4506 -2.4506 -2.3975 -2.3975 -2.3814 -2.3814 -0.8581 -0.8581 -0.5471 -0.5471 -0.4315 -0.4315 0.1353 0.1353 0.1515 0.1515 0.6221 0.6221 0.9594 0.9594 1.1499 1.1499 1.2971 1.2971 2.4662 2.4662 2.6005 2.6005 2.7558 2.7558 2.8355 2.8355 3.0250 3.0250 3.0488 3.0488 3.3135 3.3135 3.5048 3.5048 3.5844 3.5844 3.7701 3.7701 3.9877 3.9877 4.1373 4.1373 5.1953 5.1953 5.8921 5.8921 7.9125 7.9125 8.9715 8.9715 9.2023 9.2023 9.3899 9.3899 9.4686 9.4686 k = 0.2857-0.1650 0.2333 ( 29894 PWs) bands (ev): -15.0204 -15.0204 -15.0147 -15.0147 -8.3692 -8.3692 -7.6256 -7.6256 -7.5911 -7.5911 -7.5757 -7.5757 -7.5093 -7.5093 -7.4216 -7.4216 -3.8348 -3.8348 -3.8069 -3.8069 -2.4625 -2.4625 -2.4396 -2.4396 -2.3948 -2.3948 -2.3773 -2.3773 -0.8335 -0.8335 -0.5529 -0.5529 -0.4324 -0.4324 0.1270 0.1270 0.1481 0.1481 0.6242 0.6242 0.9595 0.9595 1.1685 1.1685 1.3110 1.3110 2.4368 2.4368 2.5890 2.5890 2.7431 2.7431 2.8263 2.8263 3.0307 3.0307 3.0367 3.0367 3.2734 3.2734 3.5183 3.5183 3.5432 3.5432 3.7212 3.7212 3.9700 3.9700 4.1289 4.1289 5.1282 5.1282 5.8898 5.8898 8.0005 8.0005 9.0442 9.0442 9.2942 9.2942 9.4258 9.4258 9.5642 9.5642 k = 0.3036-0.1753 0.2479 ( 29902 PWs) bands (ev): -15.0202 -15.0202 -15.0148 -15.0148 -8.3634 -8.3634 -7.6273 -7.6273 -7.5936 -7.5936 -7.5773 -7.5773 -7.5176 -7.5176 -7.4212 -7.4212 -3.8297 -3.8297 -3.8049 -3.8049 -2.4541 -2.4541 -2.4289 -2.4289 -2.3921 -2.3921 -2.3734 -2.3734 -0.8114 -0.8114 -0.5555 -0.5555 -0.4334 -0.4334 0.1187 0.1187 0.1450 0.1450 0.6263 0.6263 0.9594 0.9594 1.1866 1.1866 1.3247 1.3247 2.4070 2.4070 2.5781 2.5781 2.7318 2.7318 2.8180 2.8180 3.0264 3.0264 3.0362 3.0362 3.2335 3.2335 3.5043 3.5043 3.5308 3.5308 3.6736 3.6736 3.9519 3.9519 4.1210 4.1210 5.0633 5.0633 5.8875 5.8875 8.0886 8.0886 9.1192 9.1192 9.3862 9.3862 9.4601 9.4601 9.6548 9.6548 k = 0.3214-0.1856 0.2624 ( 29882 PWs) bands (ev): -15.0200 -15.0200 -15.0149 -15.0149 -8.3577 -8.3577 -7.6287 -7.6287 -7.5961 -7.5961 -7.5788 -7.5788 -7.5259 -7.5259 -7.4207 -7.4207 -3.8247 -3.8247 -3.8031 -3.8031 -2.4459 -2.4459 -2.4185 -2.4185 -2.3895 -2.3895 -2.3696 -2.3696 -0.7929 -0.7929 -0.5545 -0.5545 -0.4344 -0.4344 0.1105 0.1105 0.1422 0.1422 0.6285 0.6285 0.9592 0.9592 1.2039 1.2039 1.3378 1.3378 2.3772 2.3772 2.5678 2.5678 2.7221 2.7221 2.8106 2.8106 3.0184 3.0184 3.0409 3.0409 3.1949 3.1949 3.4679 3.4679 3.5391 3.5391 3.6307 3.6307 3.9334 3.9334 4.1137 4.1137 5.0015 5.0015 5.8854 5.8854 8.1755 8.1755 9.1955 9.1955 9.4709 9.4709 9.4996 9.4996 9.7371 9.7371 k = 0.3393-0.1959 0.2770 ( 29882 PWs) bands (ev): -15.0198 -15.0198 -15.0151 -15.0151 -8.3522 -8.3522 -7.6298 -7.6298 -7.5984 -7.5984 -7.5802 -7.5802 -7.5340 -7.5340 -7.4203 -7.4203 -3.8200 -3.8200 -3.8014 -3.8014 -2.4382 -2.4382 -2.4088 -2.4088 -2.3868 -2.3868 -2.3661 -2.3661 -0.7787 -0.7787 -0.5493 -0.5493 -0.4354 -0.4354 0.1026 0.1026 0.1398 0.1398 0.6307 0.6307 0.9589 0.9589 1.2204 1.2204 1.3503 1.3503 2.3480 2.3480 2.5581 2.5581 2.7145 2.7145 2.8040 2.8040 3.0129 3.0129 3.0436 3.0436 3.1594 3.1594 3.4339 3.4339 3.5320 3.5320 3.6045 3.6045 3.9146 3.9146 4.1070 4.1070 4.9433 4.9433 5.8834 5.8834 8.2603 8.2603 9.2723 9.2723 9.5141 9.5141 9.5774 9.5774 9.8078 9.8078 k = 0.3571-0.2062 0.2916 ( 29866 PWs) bands (ev): -15.0196 -15.0196 -15.0152 -15.0152 -8.3470 -8.3470 -7.6305 -7.6305 -7.6007 -7.6007 -7.5815 -7.5815 -7.5418 -7.5418 -7.4199 -7.4199 -3.8156 -3.8156 -3.7998 -3.7998 -2.4309 -2.4309 -2.3999 -2.3999 -2.3841 -2.3841 -2.3629 -2.3629 -0.7688 -0.7688 -0.5403 -0.5403 -0.4364 -0.4364 0.0951 0.0951 0.1377 0.1377 0.6328 0.6328 0.9586 0.9586 1.2356 1.2356 1.3619 1.3619 2.3198 2.3198 2.5492 2.5492 2.7089 2.7089 2.7982 2.7982 3.0104 3.0104 3.0414 3.0414 3.1302 3.1302 3.4024 3.4024 3.5004 3.5004 3.6042 3.6042 3.8955 3.8955 4.1009 4.1009 4.8895 4.8895 5.8816 5.8816 8.3416 8.3416 9.3480 9.3480 9.5428 9.5428 9.6651 9.6651 9.8653 9.8653 k = 0.3750-0.2165 0.3062 ( 29870 PWs) bands (ev): -15.0194 -15.0194 -15.0153 -15.0153 -8.3422 -8.3422 -7.6310 -7.6310 -7.6028 -7.6028 -7.5827 -7.5827 -7.5492 -7.5492 -7.4195 -7.4195 -3.8116 -3.8116 -3.7983 -3.7983 -2.4242 -2.4242 -2.3924 -2.3924 -2.3808 -2.3808 -2.3599 -2.3599 -0.7627 -0.7627 -0.5283 -0.5283 -0.4373 -0.4373 0.0882 0.0882 0.1360 0.1360 0.6348 0.6348 0.9582 0.9582 1.2495 1.2495 1.3726 1.3726 2.2932 2.2932 2.5412 2.5412 2.7055 2.7055 2.7930 2.7930 3.0111 3.0111 3.0294 3.0294 3.1129 3.1129 3.3735 3.3735 3.4591 3.4591 3.6157 3.6157 3.8761 3.8761 4.0953 4.0953 4.8405 4.8405 5.8799 5.8799 8.4181 8.4181 9.4212 9.4212 9.5683 9.5683 9.7499 9.7499 9.9105 9.9105 k = 0.3929-0.2268 0.3208 ( 29882 PWs) bands (ev): -15.0193 -15.0193 -15.0154 -15.0154 -8.3378 -8.3378 -7.6310 -7.6310 -7.6049 -7.6049 -7.5838 -7.5838 -7.5560 -7.5560 -7.4192 -7.4192 -3.8080 -3.8080 -3.7970 -3.7970 -2.4182 -2.4182 -2.3869 -2.3869 -2.3766 -2.3766 -2.3573 -2.3573 -0.7597 -0.7597 -0.5145 -0.5145 -0.4382 -0.4382 0.0819 0.0819 0.1346 0.1346 0.6367 0.6367 0.9578 0.9578 1.2618 1.2618 1.3821 1.3821 2.2688 2.2688 2.5340 2.5340 2.7044 2.7044 2.7884 2.7884 3.0073 3.0073 3.0150 3.0150 3.1083 3.1083 3.3471 3.3471 3.4165 3.4165 3.6307 3.6307 3.8566 3.8566 4.0904 4.0904 4.7969 4.7969 5.8785 5.8785 8.4885 8.4885 9.4900 9.4900 9.5912 9.5912 9.8292 9.8292 9.9464 9.9464 k = 0.4107-0.2371 0.3353 ( 29870 PWs) bands (ev): -15.0192 -15.0192 -15.0155 -15.0155 -8.3340 -8.3340 -7.6306 -7.6306 -7.6069 -7.6069 -7.5848 -7.5848 -7.5622 -7.5622 -7.4189 -7.4189 -3.8049 -3.8049 -3.7959 -3.7959 -2.4130 -2.4130 -2.3835 -2.3835 -2.3716 -2.3716 -2.3551 -2.3551 -0.7587 -0.7587 -0.5005 -0.5005 -0.4390 -0.4390 0.0764 0.0764 0.1334 0.1334 0.6384 0.6384 0.9574 0.9574 1.2724 1.2724 1.3904 1.3904 2.2471 2.2471 2.5278 2.5278 2.7053 2.7053 2.7843 2.7843 2.9809 2.9809 3.0220 3.0220 3.1109 3.1109 3.3234 3.3234 3.3755 3.3755 3.6472 3.6472 3.8371 3.8371 4.0861 4.0861 4.7592 4.7592 5.8773 5.8773 8.5513 8.5513 9.5526 9.5526 9.6114 9.6114 9.9010 9.9010 9.9756 9.9756 k = 0.4286-0.2474 0.3499 ( 29874 PWs) bands (ev): -15.0190 -15.0190 -15.0155 -15.0155 -8.3308 -8.3308 -7.6299 -7.6299 -7.6090 -7.6090 -7.5855 -7.5855 -7.5674 -7.5674 -7.4187 -7.4187 -3.8023 -3.8023 -3.7950 -3.7950 -2.4086 -2.4086 -2.3814 -2.3814 -2.3666 -2.3666 -2.3532 -2.3532 -0.7589 -0.7589 -0.4873 -0.4873 -0.4396 -0.4396 0.0717 0.0717 0.1325 0.1325 0.6398 0.6398 0.9570 0.9570 1.2811 1.2811 1.3974 1.3974 2.2286 2.2286 2.5227 2.5227 2.7078 2.7078 2.7809 2.7809 2.9550 2.9550 3.0316 3.0316 3.1165 3.1165 3.3026 3.3026 3.3375 3.3375 3.6645 3.6645 3.8175 3.8175 4.0825 4.0825 4.7278 4.7278 5.8762 5.8762 8.6050 8.6050 9.6068 9.6068 9.6286 9.6286 9.9633 9.9633 10.0000 10.0000 k = 0.4464-0.2577 0.3645 ( 29890 PWs) bands (ev): -15.0190 -15.0190 -15.0156 -15.0156 -8.3282 -8.3282 -7.6288 -7.6288 -7.6109 -7.6109 -7.5862 -7.5862 -7.5717 -7.5717 -7.4185 -7.4185 -3.8002 -3.8002 -3.7942 -3.7942 -2.4051 -2.4051 -2.3800 -2.3800 -2.3624 -2.3624 -2.3518 -2.3518 -0.7596 -0.7596 -0.4761 -0.4761 -0.4402 -0.4402 0.0680 0.0680 0.1318 0.1318 0.6410 0.6410 0.9566 0.9566 1.2880 1.2880 1.4030 1.4030 2.2138 2.2138 2.5186 2.5186 2.7116 2.7116 2.7781 2.7781 2.9320 2.9320 3.0429 3.0429 3.1231 3.1231 3.2849 3.2849 3.3037 3.3037 3.6823 3.6823 3.7980 3.7980 4.0796 4.0796 4.7031 4.7031 5.8754 5.8754 8.6483 8.6483 9.6425 9.6425 9.6511 9.6511 10.0144 10.0144 10.0199 10.0199 k = 0.4643-0.2681 0.3791 ( 29910 PWs) bands (ev): -15.0189 -15.0189 -15.0156 -15.0156 -8.3263 -8.3263 -7.6276 -7.6276 -7.6127 -7.6127 -7.5866 -7.5866 -7.5748 -7.5748 -7.4184 -7.4184 -3.7987 -3.7987 -3.7937 -3.7937 -2.4025 -2.4025 -2.3790 -2.3790 -2.3592 -2.3592 -2.3507 -2.3507 -0.7604 -0.7604 -0.4675 -0.4675 -0.4406 -0.4406 0.0653 0.0653 0.1314 0.1314 0.6418 0.6418 0.9564 0.9564 1.2929 1.2929 1.4070 1.4070 2.2030 2.2030 2.5157 2.5157 2.7156 2.7156 2.7760 2.7760 2.9138 2.9138 3.0544 3.0544 3.1294 3.1294 3.2711 3.2711 3.2761 3.2761 3.7004 3.7004 3.7786 3.7786 4.0775 4.0775 4.6852 4.6852 5.8748 5.8748 8.6801 8.6801 9.6527 9.6527 9.6838 9.6838 10.0351 10.0351 10.0523 10.0523 k = 0.4821-0.2784 0.3937 ( 29902 PWs) bands (ev): -15.0189 -15.0189 -15.0157 -15.0157 -8.3252 -8.3252 -7.6266 -7.6266 -7.6141 -7.6141 -7.5869 -7.5869 -7.5768 -7.5768 -7.4183 -7.4183 -3.7978 -3.7978 -3.7934 -3.7934 -2.4010 -2.4010 -2.3785 -2.3785 -2.3573 -2.3573 -2.3501 -2.3501 -0.7610 -0.7610 -0.4622 -0.4622 -0.4408 -0.4408 0.0636 0.0636 0.1311 0.1311 0.6423 0.6423 0.9562 0.9562 1.2958 1.2958 1.4095 1.4095 2.1964 2.1964 2.5139 2.5139 2.7187 2.7187 2.7748 2.7748 2.9020 2.9020 3.0634 3.0634 3.1339 3.1339 3.2573 3.2573 3.2622 3.2622 3.7184 3.7184 3.7600 3.7600 4.0762 4.0762 4.6744 4.6744 5.8745 5.8745 8.6996 8.6996 9.6589 9.6589 9.7039 9.7039 10.0446 10.0446 10.0758 10.0758 k = 0.5000-0.2887 0.4082 ( 29962 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3248 -8.3248 -7.6262 -7.6262 -7.6147 -7.6147 -7.5870 -7.5870 -7.5774 -7.5774 -7.4182 -7.4182 -3.7975 -3.7975 -3.7933 -3.7933 -2.4005 -2.4005 -2.3783 -2.3783 -2.3567 -2.3567 -2.3499 -2.3499 -0.7612 -0.7612 -0.4604 -0.4604 -0.4409 -0.4409 0.0631 0.0631 0.1310 0.1310 0.6425 0.6425 0.9562 0.9562 1.2968 1.2968 1.4103 1.4103 2.1942 2.1942 2.5133 2.5133 2.7199 2.7199 2.7743 2.7743 2.8979 2.8979 3.0670 3.0670 3.1356 3.1356 3.2505 3.2505 3.2590 3.2590 3.7310 3.7310 3.7471 3.7471 4.0758 4.0758 4.6708 4.6708 5.8744 5.8744 8.7062 8.7062 9.6610 9.6610 9.7106 9.7106 10.0479 10.0479 10.0837 10.0837 k = 0.5000-0.2887 0.4082 ( 29962 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3248 -8.3248 -7.6262 -7.6262 -7.6147 -7.6147 -7.5870 -7.5870 -7.5774 -7.5774 -7.4182 -7.4182 -3.7975 -3.7975 -3.7933 -3.7933 -2.4005 -2.4005 -2.3783 -2.3783 -2.3567 -2.3567 -2.3499 -2.3499 -0.7612 -0.7612 -0.4604 -0.4604 -0.4409 -0.4409 0.0631 0.0631 0.1310 0.1310 0.6425 0.6425 0.9562 0.9562 1.2968 1.2968 1.4103 1.4103 2.1942 2.1942 2.5133 2.5133 2.7199 2.7199 2.7743 2.7743 2.8979 2.8979 3.0670 3.0670 3.1356 3.1356 3.2505 3.2505 3.2590 3.2590 3.7310 3.7310 3.7471 3.7471 4.0758 4.0758 4.6708 4.6708 5.8744 5.8744 8.7062 8.7062 9.6610 9.6610 9.7106 9.7106 10.0479 10.0479 10.0837 10.0837 k = 0.5000-0.2681 0.4228 ( 29886 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3248 -8.3248 -7.6296 -7.6296 -7.6135 -7.6135 -7.5850 -7.5850 -7.5770 -7.5770 -7.4185 -7.4185 -3.7975 -3.7975 -3.7933 -3.7933 -2.4004 -2.4004 -2.3783 -2.3783 -2.3567 -2.3567 -2.3500 -2.3500 -0.7604 -0.7604 -0.4609 -0.4609 -0.4414 -0.4414 0.0631 0.0631 0.1307 0.1307 0.6423 0.6423 0.9573 0.9573 1.2969 1.2969 1.4097 1.4097 2.1943 2.1943 2.5136 2.5136 2.7188 2.7188 2.7716 2.7716 2.9015 2.9015 3.0666 3.0666 3.1349 3.1349 3.2475 3.2475 3.2645 3.2645 3.7296 3.7296 3.7461 3.7461 4.0745 4.0745 4.6746 4.6746 5.8718 5.8718 8.7058 8.7058 9.6638 9.6638 9.7137 9.7137 10.0500 10.0500 10.0841 10.0841 k = 0.5000-0.2474 0.4374 ( 29896 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3246 -8.3246 -7.6368 -7.6368 -7.6120 -7.6120 -7.5814 -7.5814 -7.5743 -7.5743 -7.4192 -7.4192 -3.7975 -3.7975 -3.7933 -3.7933 -2.4000 -2.4000 -2.3782 -2.3782 -2.3568 -2.3568 -2.3505 -2.3505 -0.7578 -0.7578 -0.4624 -0.4624 -0.4428 -0.4428 0.0634 0.0634 0.1297 0.1297 0.6416 0.6416 0.9607 0.9607 1.2971 1.2971 1.4081 1.4081 2.1945 2.1945 2.5145 2.5145 2.7153 2.7153 2.7649 2.7649 2.9111 2.9111 3.0656 3.0656 3.1328 3.1328 3.2446 3.2446 3.2749 3.2749 3.7250 3.7250 3.7440 3.7440 4.0707 4.0707 4.6860 4.6860 5.8642 5.8642 8.7050 8.7050 9.6719 9.6719 9.7230 9.7230 10.0562 10.0562 10.0853 10.0853 k = 0.5000-0.2268 0.4520 ( 29880 PWs) bands (ev): -15.0188 -15.0188 -15.0158 -15.0158 -8.3242 -8.3242 -7.6451 -7.6451 -7.6111 -7.6111 -7.5799 -7.5799 -7.5674 -7.5674 -7.4205 -7.4205 -3.7975 -3.7975 -3.7934 -3.7934 -2.3994 -2.3994 -2.3781 -2.3781 -2.3571 -2.3571 -2.3511 -2.3511 -0.7535 -0.7535 -0.4655 -0.4655 -0.4445 -0.4445 0.0637 0.0637 0.1282 0.1282 0.6406 0.6406 0.9663 0.9663 1.2971 1.2971 1.4056 1.4056 2.1949 2.1949 2.5160 2.5160 2.7090 2.7090 2.7568 2.7568 2.9242 2.9242 3.0640 3.0640 3.1294 3.1294 3.2440 3.2440 3.2877 3.2877 3.7162 3.7162 3.7421 3.7421 4.0640 4.0640 4.7046 4.7046 5.8517 5.8517 8.7035 8.7035 9.6854 9.6854 9.7383 9.7383 10.0665 10.0665 10.0872 10.0872 k = 0.5000-0.2062 0.4666 ( 29882 PWs) bands (ev): -15.0187 -15.0187 -15.0158 -15.0158 -8.3238 -8.3238 -7.6536 -7.6536 -7.6106 -7.6106 -7.5796 -7.5796 -7.5583 -7.5583 -7.4222 -7.4222 -3.7974 -3.7974 -3.7935 -3.7935 -2.3986 -2.3986 -2.3780 -2.3780 -2.3574 -2.3574 -2.3521 -2.3521 -0.7475 -0.7475 -0.4706 -0.4706 -0.4462 -0.4462 0.0643 0.0643 0.1260 0.1260 0.6393 0.6393 0.9738 0.9738 1.2965 1.2965 1.4028 1.4028 2.1955 2.1955 2.5179 2.5179 2.7001 2.7001 2.7494 2.7494 2.9385 2.9385 3.0621 3.0621 3.1247 3.1247 3.2461 3.2461 3.3024 3.3024 3.7040 3.7040 3.7411 3.7411 4.0544 4.0544 4.7295 4.7295 5.8346 5.8346 8.7016 8.7016 9.7040 9.7040 9.7598 9.7598 10.0806 10.0806 10.0890 10.0891 k = 0.5000-0.1856 0.4811 ( 29880 PWs) bands (ev): -15.0186 -15.0186 -15.0159 -15.0159 -8.3233 -8.3233 -7.6620 -7.6620 -7.6102 -7.6102 -7.5795 -7.5795 -7.5485 -7.5485 -7.4244 -7.4244 -3.7974 -3.7974 -3.7936 -3.7936 -2.3976 -2.3976 -2.3779 -2.3779 -2.3578 -2.3578 -2.3532 -2.3532 -0.7399 -0.7399 -0.4779 -0.4779 -0.4474 -0.4474 0.0652 0.0652 0.1234 0.1234 0.6377 0.6377 0.9831 0.9831 1.2947 1.2947 1.4003 1.4003 2.1962 2.1962 2.5201 2.5201 2.6891 2.6891 2.7435 2.7435 2.9522 2.9522 3.0601 3.0601 3.1190 3.1190 3.2509 3.2509 3.3186 3.3186 3.6897 3.6897 3.7406 3.7406 4.0417 4.0417 4.7599 4.7599 5.8132 5.8132 8.6994 8.6994 9.7274 9.7274 9.7872 9.7872 10.0884 10.0884 10.0946 10.0946 k = 0.5000-0.1650 0.4957 ( 29860 PWs) bands (ev): -15.0185 -15.0185 -15.0160 -15.0160 -8.3228 -8.3228 -7.6699 -7.6699 -7.6100 -7.6100 -7.5796 -7.5796 -7.5386 -7.5386 -7.4272 -7.4272 -3.7973 -3.7973 -3.7937 -3.7937 -2.3964 -2.3964 -2.3778 -2.3778 -2.3583 -2.3583 -2.3545 -2.3545 -0.7308 -0.7308 -0.4872 -0.4872 -0.4482 -0.4482 0.0663 0.0663 0.1204 0.1204 0.6360 0.6360 0.9939 0.9939 1.2911 1.2911 1.3986 1.3986 2.1970 2.1970 2.5225 2.5225 2.6771 2.6771 2.7390 2.7390 2.9643 2.9643 3.0584 3.0584 3.1126 3.1126 3.2581 3.2581 3.3356 3.3356 3.6746 3.6746 3.7407 3.7407 4.0259 4.0259 4.7947 4.7947 5.7882 5.7882 8.6969 8.6969 9.7553 9.7553 9.8205 9.8205 10.0865 10.0865 10.0979 10.0979 k = 0.5000-0.1443 0.5103 ( 29852 PWs) bands (ev): -15.0184 -15.0184 -15.0161 -15.0161 -8.3222 -8.3222 -7.6773 -7.6773 -7.6097 -7.6097 -7.5796 -7.5796 -7.5287 -7.5287 -7.4304 -7.4304 -3.7972 -3.7972 -3.7939 -3.7939 -2.3950 -2.3950 -2.3777 -2.3777 -2.3588 -2.3588 -2.3558 -2.3558 -0.7204 -0.7204 -0.4984 -0.4984 -0.4487 -0.4487 0.0679 0.0679 0.1170 0.1170 0.6341 0.6341 1.0059 1.0059 1.2854 1.2854 1.3981 1.3981 2.1980 2.1980 2.5249 2.5249 2.6651 2.6651 2.7357 2.7357 2.9740 2.9740 3.0572 3.0572 3.1060 3.1060 3.2675 3.2675 3.3525 3.3525 3.6602 3.6602 3.7415 3.7415 4.0072 4.0072 4.8327 4.8327 5.7601 5.7601 8.6943 8.6943 9.7871 9.7871 9.8593 9.8593 10.0855 10.0855 10.1014 10.1014 k = 0.5000-0.1237 0.5249 ( 29866 PWs) bands (ev): -15.0182 -15.0182 -15.0163 -15.0163 -8.3216 -8.3216 -7.6839 -7.6839 -7.6096 -7.6096 -7.5797 -7.5797 -7.5189 -7.5189 -7.4342 -7.4342 -3.7971 -3.7971 -3.7940 -3.7940 -2.3934 -2.3934 -2.3777 -2.3777 -2.3595 -2.3595 -2.3572 -2.3572 -0.7086 -0.7086 -0.5110 -0.5110 -0.4490 -0.4490 0.0698 0.0698 0.1134 0.1134 0.6323 0.6323 1.0186 1.0186 1.2776 1.2776 1.3988 1.3988 2.1990 2.1990 2.5270 2.5270 2.6539 2.6539 2.7332 2.7332 2.9809 2.9809 3.0567 3.0567 3.0994 3.0994 3.2786 3.2786 3.3679 3.3679 3.6478 3.6478 3.7432 3.7432 3.9861 3.9861 4.8723 4.8723 5.7300 5.7300 8.6917 8.6917 9.8222 9.8222 9.9035 9.9035 10.0861 10.0861 10.1048 10.1048 k = 0.5000-0.1031 0.5395 ( 29888 PWs) bands (ev): -15.0181 -15.0181 -15.0164 -15.0164 -8.3210 -8.3210 -7.6896 -7.6896 -7.6094 -7.6094 -7.5798 -7.5798 -7.5094 -7.5094 -7.4385 -7.4385 -3.7970 -3.7970 -3.7942 -3.7942 -2.3917 -2.3917 -2.3778 -2.3778 -2.3604 -2.3604 -2.3583 -2.3583 -0.6958 -0.6958 -0.5249 -0.5249 -0.4491 -0.4491 0.0721 0.0721 0.1096 0.1096 0.6306 0.6306 1.0317 1.0317 1.2682 1.2682 1.4006 1.4006 2.2001 2.2001 2.5290 2.5290 2.6438 2.6438 2.7315 2.7315 2.9850 2.9850 3.0570 3.0570 3.0934 3.0934 3.2912 3.2912 3.3803 3.3803 3.6384 3.6384 3.7461 3.7461 3.9632 3.9632 4.9120 4.9120 5.6990 5.6990 8.6893 8.6893 9.8595 9.8595 9.9521 9.9521 10.0885 10.0885 10.1079 10.1079 k = 0.5000-0.0825 0.5541 ( 29912 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3205 -8.3205 -7.6944 -7.6944 -7.6093 -7.6093 -7.5799 -7.5799 -7.5002 -7.5002 -7.4433 -7.4433 -3.7969 -3.7969 -3.7943 -3.7943 -2.3898 -2.3898 -2.3781 -2.3781 -2.3614 -2.3614 -2.3592 -2.3592 -0.6822 -0.6822 -0.5395 -0.5395 -0.4492 -0.4492 0.0748 0.0748 0.1056 0.1056 0.6290 0.6290 1.0446 1.0446 1.2578 1.2578 1.4029 1.4029 2.2011 2.2011 2.5305 2.5305 2.6352 2.6352 2.7304 2.7304 2.9870 2.9870 3.0579 3.0579 3.0881 3.0881 3.3047 3.3047 3.3884 3.3884 3.6329 3.6329 3.7506 3.7506 3.9392 3.9392 4.9499 4.9499 5.6686 5.6686 8.6871 8.6871 9.8975 9.8975 10.0036 10.0036 10.0935 10.0935 10.1105 10.1105 k = 0.5000-0.0619 0.5686 ( 29910 PWs) bands (ev): -15.0178 -15.0178 -15.0167 -15.0167 -8.3200 -8.3200 -7.6983 -7.6983 -7.6092 -7.6092 -7.5800 -7.5800 -7.4915 -7.4915 -7.4487 -7.4487 -3.7968 -3.7968 -3.7945 -3.7945 -2.3880 -2.3880 -2.3787 -2.3787 -2.3624 -2.3624 -2.3597 -2.3597 -0.6681 -0.6681 -0.5545 -0.5545 -0.4493 -0.4493 0.0778 0.0778 0.1015 0.1015 0.6278 0.6278 1.0565 1.0565 1.2476 1.2476 1.4053 1.4053 2.2020 2.2020 2.5316 2.5316 2.6283 2.6283 2.7298 2.7298 2.9874 2.9874 3.0590 3.0590 3.0838 3.0838 3.3185 3.3185 3.3913 3.3913 3.6310 3.6310 3.7570 3.7570 3.9153 3.9153 4.9838 4.9838 5.6408 5.6408 8.6853 8.6853 9.9340 9.9340 10.0515 10.0515 10.1043 10.1043 10.1145 10.1145 k = 0.5000-0.0412 0.5832 ( 29916 PWs) bands (ev): -15.0176 -15.0176 -15.0169 -15.0169 -8.3197 -8.3197 -7.7010 -7.7010 -7.6091 -7.6091 -7.5801 -7.5801 -7.4831 -7.4831 -7.4545 -7.4545 -3.7967 -3.7967 -3.7946 -3.7946 -2.3861 -2.3861 -2.3796 -2.3796 -2.3632 -2.3632 -2.3601 -2.3601 -0.6543 -0.6543 -0.5690 -0.5690 -0.4493 -0.4493 0.0812 0.0812 0.0975 0.0975 0.6268 0.6268 1.0663 1.0663 1.2387 1.2387 1.4074 1.4074 2.2027 2.2027 2.5324 2.5324 2.6234 2.6234 2.7295 2.7295 2.9870 2.9870 3.0602 3.0602 3.0806 3.0806 3.3317 3.3317 3.3896 3.3896 3.6315 3.6315 3.7650 3.7650 3.8935 3.8935 5.0110 5.0110 5.6180 5.6180 8.6840 8.6840 9.9656 9.9656 10.0772 10.0772 10.1108 10.1108 10.1464 10.1464 k = 0.5000-0.0206 0.5978 ( 29906 PWs) bands (ev): -15.0174 -15.0174 -15.0171 -15.0171 -8.3195 -8.3195 -7.7027 -7.7027 -7.6090 -7.6090 -7.5801 -7.5801 -7.4752 -7.4752 -7.4609 -7.4609 -3.7967 -3.7967 -3.7947 -3.7947 -2.3842 -2.3842 -2.3808 -2.3808 -2.3638 -2.3638 -2.3604 -2.3604 -0.6427 -0.6427 -0.5811 -0.5811 -0.4493 -0.4493 0.0846 0.0846 0.0936 0.0936 0.6262 0.6262 1.0731 1.0731 1.2325 1.2325 1.4087 1.4087 2.2031 2.2031 2.5328 2.5328 2.6204 2.6204 2.7294 2.7294 2.9865 2.9865 3.0609 3.0609 3.0786 3.0786 3.3426 3.3426 3.3853 3.3853 3.6329 3.6329 3.7727 3.7727 3.8769 3.8769 5.0289 5.0289 5.6028 5.6028 8.6832 8.6832 9.9878 9.9878 10.0849 10.0849 10.1115 10.1115 10.1979 10.1979 k = 0.5000-0.0000 0.6124 ( 29892 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3194 -8.3194 -7.7033 -7.7033 -7.6090 -7.6090 -7.5801 -7.5801 -7.4681 -7.4681 -7.4675 -7.4675 -3.7967 -3.7967 -3.7947 -3.7947 -2.3829 -2.3829 -2.3820 -2.3820 -2.3639 -2.3639 -2.3605 -2.3605 -0.6375 -0.6375 -0.5864 -0.5864 -0.4493 -0.4493 0.0869 0.0869 0.0911 0.0911 0.6260 0.6260 1.0755 1.0755 1.2303 1.2303 1.4092 1.4092 2.2033 2.2033 2.5329 2.5329 2.6194 2.6194 2.7294 2.7294 2.9863 2.9863 3.0612 3.0612 3.0780 3.0780 3.3474 3.3474 3.3826 3.3826 3.6335 3.6335 3.7762 3.7762 3.8703 3.8703 5.0352 5.0352 5.5975 5.5975 8.6829 8.6829 9.9960 9.9960 10.0868 10.0868 10.1116 10.1116 10.2277 10.2277 k = 0.5000-0.0000 0.6124 ( 29892 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3194 -8.3194 -7.7033 -7.7033 -7.6090 -7.6090 -7.5801 -7.5801 -7.4681 -7.4681 -7.4675 -7.4675 -3.7967 -3.7967 -3.7947 -3.7947 -2.3829 -2.3829 -2.3820 -2.3820 -2.3639 -2.3639 -2.3605 -2.3605 -0.6375 -0.6375 -0.5864 -0.5864 -0.4493 -0.4493 0.0869 0.0869 0.0911 0.0911 0.6260 0.6260 1.0755 1.0755 1.2303 1.2303 1.4092 1.4092 2.2033 2.2033 2.5329 2.5329 2.6194 2.6194 2.7294 2.7294 2.9863 2.9863 3.0612 3.0612 3.0780 3.0780 3.3474 3.3474 3.3826 3.3826 3.6335 3.6335 3.7762 3.7762 3.8703 3.8703 5.0352 5.0352 5.5975 5.5975 8.6829 8.6829 9.9960 9.9960 10.0868 10.0868 10.1116 10.1116 10.2277 10.2277 k = 0.4875 0.0217 0.6124 ( 29910 PWs) bands (ev): -15.0174 -15.0174 -15.0171 -15.0171 -8.3195 -8.3195 -7.7032 -7.7032 -7.6088 -7.6088 -7.5799 -7.5799 -7.4730 -7.4730 -7.4630 -7.4630 -3.7967 -3.7967 -3.7947 -3.7947 -2.3838 -2.3838 -2.3816 -2.3816 -2.3638 -2.3638 -2.3604 -2.3604 -0.6399 -0.6399 -0.5839 -0.5839 -0.4498 -0.4498 0.0856 0.0856 0.0928 0.0928 0.6261 0.6261 1.0731 1.0731 1.2312 1.2312 1.4100 1.4100 2.2033 2.2033 2.5332 2.5332 2.6200 2.6200 2.7289 2.7289 2.9853 2.9853 3.0629 3.0629 3.0786 3.0786 3.3448 3.3448 3.3850 3.3850 3.6337 3.6337 3.7744 3.7744 3.8734 3.8734 5.0333 5.0333 5.6000 5.6000 8.6815 8.6815 9.9873 9.9873 10.0804 10.0804 10.1090 10.1090 10.2125 10.2125 k = 0.4750 0.0433 0.6124 ( 29916 PWs) bands (ev): -15.0175 -15.0175 -15.0170 -15.0170 -8.3198 -8.3198 -7.7030 -7.7030 -7.6081 -7.6081 -7.5794 -7.5794 -7.4783 -7.4783 -7.4586 -7.4586 -3.7969 -3.7969 -3.7948 -3.7948 -2.3852 -2.3852 -2.3817 -2.3817 -2.3634 -2.3634 -2.3602 -2.3602 -0.6458 -0.6458 -0.5773 -0.5773 -0.4511 -0.4511 0.0835 0.0835 0.0955 0.0955 0.6264 0.6264 1.0666 1.0666 1.2343 1.2343 1.4121 1.4121 2.2035 2.2035 2.5341 2.5341 2.6217 2.6217 2.7272 2.7272 2.9835 2.9835 3.0658 3.0658 3.0816 3.0816 3.3382 3.3382 3.3906 3.3906 3.6344 3.6344 3.7702 3.7702 3.8813 3.8813 5.0279 5.0279 5.6072 5.6072 8.6777 8.6777 9.9601 9.9601 10.0578 10.0578 10.1093 10.1093 10.1889 10.1889 k = 0.4625 0.0650 0.6124 ( 29914 PWs) bands (ev): -15.0176 -15.0176 -15.0169 -15.0169 -8.3203 -8.3203 -7.7028 -7.7028 -7.6070 -7.6070 -7.5785 -7.5785 -7.4837 -7.4837 -7.4546 -7.4546 -3.7970 -3.7970 -3.7950 -3.7950 -2.3866 -2.3866 -2.3824 -2.3824 -2.3629 -2.3629 -2.3597 -2.3597 -0.6533 -0.6533 -0.5686 -0.5686 -0.4533 -0.4533 0.0818 0.0818 0.0983 0.0983 0.6269 0.6269 1.0567 1.0567 1.2392 1.2392 1.4149 1.4149 2.2035 2.2035 2.5354 2.5354 2.6245 2.6245 2.7242 2.7242 2.9822 2.9822 3.0671 3.0671 3.0881 3.0881 3.3303 3.3303 3.3965 3.3965 3.6356 3.6356 3.7653 3.7653 3.8918 3.8918 5.0195 5.0195 5.6181 5.6181 8.6720 8.6720 9.9189 9.9189 10.0261 10.0261 10.1128 10.1128 10.1724 10.1724 k = 0.4500 0.0866 0.6124 ( 29907 PWs) bands (ev): -15.0177 -15.0177 -15.0168 -15.0168 -8.3207 -8.3207 -7.7026 -7.7026 -7.6057 -7.6057 -7.5772 -7.5772 -7.4891 -7.4891 -7.4510 -7.4510 -3.7972 -3.7972 -3.7952 -3.7952 -2.3880 -2.3880 -2.3834 -2.3834 -2.3623 -2.3623 -2.3592 -2.3592 -0.6611 -0.6611 -0.5588 -0.5588 -0.4564 -0.4564 0.0804 0.0804 0.1010 0.1010 0.6276 0.6276 1.0450 1.0450 1.2453 1.2453 1.4180 1.4180 2.2035 2.2035 2.5371 2.5371 2.6280 2.6280 2.7197 2.7197 2.9823 2.9823 3.0666 3.0666 3.0965 3.0965 3.3227 3.3227 3.4012 3.4012 3.6372 3.6372 3.7614 3.7614 3.9029 3.9029 5.0090 5.0090 5.6315 5.6315 8.6651 8.6651 9.8719 9.8719 9.9922 9.9922 10.1174 10.1174 10.1626 10.1626 k = 0.4375 0.1083 0.6124 ( 29875 PWs) bands (ev): -15.0178 -15.0178 -15.0168 -15.0168 -8.3212 -8.3212 -7.7024 -7.7024 -7.6042 -7.6042 -7.5756 -7.5756 -7.4944 -7.4944 -7.4480 -7.4480 -3.7974 -3.7974 -3.7955 -3.7955 -2.3893 -2.3893 -2.3847 -2.3847 -2.3619 -2.3619 -2.3586 -2.3586 -0.6684 -0.6684 -0.5487 -0.5487 -0.4602 -0.4602 0.0794 0.0794 0.1033 0.1033 0.6282 0.6282 1.0329 1.0329 1.2517 1.2517 1.4211 1.4211 2.2033 2.2033 2.5391 2.5391 2.6322 2.6322 2.7140 2.7140 2.9841 2.9841 3.0650 3.0650 3.1052 3.1052 3.3162 3.3162 3.4039 3.4039 3.6392 3.6392 3.7589 3.7589 3.9135 3.9135 4.9975 4.9975 5.6460 5.6460 8.6577 8.6577 9.8262 9.8262 9.9600 9.9600 10.1221 10.1221 10.1562 10.1562 k = 0.4250 0.1299 0.6124 ( 29879 PWs) bands (ev): -15.0178 -15.0178 -15.0167 -15.0167 -8.3217 -8.3217 -7.7023 -7.7023 -7.6027 -7.6027 -7.5738 -7.5738 -7.4994 -7.4994 -7.4455 -7.4455 -3.7976 -3.7976 -3.7957 -3.7957 -2.3904 -2.3904 -2.3859 -2.3859 -2.3615 -2.3615 -2.3579 -2.3579 -0.6749 -0.6749 -0.5388 -0.5388 -0.4648 -0.4648 0.0788 0.0788 0.1053 0.1053 0.6289 0.6289 1.0215 1.0215 1.2578 1.2578 1.4238 1.4238 2.2031 2.2031 2.5412 2.5412 2.6367 2.6367 2.7075 2.7075 2.9873 2.9873 3.0628 3.0628 3.1129 3.1129 3.3115 3.3115 3.4044 3.4044 3.6414 3.6414 3.7579 3.7579 3.9228 3.9228 4.9862 4.9862 5.6601 5.6601 8.6505 8.6505 9.7855 9.7855 9.9319 9.9319 10.1266 10.1266 10.1512 10.1512 k = 0.4125 0.1516 0.6124 ( 29881 PWs) bands (ev): -15.0179 -15.0179 -15.0167 -15.0167 -8.3221 -8.3221 -7.7023 -7.7023 -7.6015 -7.6015 -7.5718 -7.5718 -7.5039 -7.5039 -7.4435 -7.4435 -3.7977 -3.7977 -3.7959 -3.7959 -2.3914 -2.3914 -2.3870 -2.3870 -2.3612 -2.3612 -2.3574 -2.3574 -0.6802 -0.6802 -0.5294 -0.5294 -0.4698 -0.4698 0.0784 0.0784 0.1068 0.1068 0.6295 0.6295 1.0117 1.0117 1.2631 1.2631 1.4261 1.4261 2.2028 2.2028 2.5431 2.5431 2.6413 2.6413 2.7008 2.7008 2.9915 2.9915 3.0600 3.0600 3.1191 3.1191 3.3087 3.3087 3.4032 3.4032 3.6434 3.6434 3.7581 3.7581 3.9304 3.9304 4.9762 4.9762 5.6725 5.6725 8.6440 8.6440 9.7523 9.7523 9.9091 9.9091 10.1304 10.1304 10.1468 10.1468 k = 0.4000 0.1732 0.6124 ( 29894 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3225 -8.3225 -7.7022 -7.7022 -7.6005 -7.6005 -7.5700 -7.5700 -7.5075 -7.5075 -7.4421 -7.4421 -3.7978 -3.7978 -3.7961 -3.7961 -2.3921 -2.3921 -2.3878 -2.3878 -2.3610 -2.3610 -2.3570 -2.3570 -0.6841 -0.6841 -0.5210 -0.5210 -0.4749 -0.4749 0.0782 0.0782 0.1079 0.1079 0.6300 0.6300 1.0043 1.0043 1.2671 1.2671 1.4278 1.4278 2.2026 2.2026 2.5446 2.5446 2.6457 2.6457 2.6946 2.6946 2.9958 2.9958 3.0572 3.0572 3.1235 3.1235 3.3074 3.3074 3.4012 3.4012 3.6452 3.6452 3.7589 3.7589 3.9360 3.9360 4.9682 4.9682 5.6822 5.6822 8.6389 8.6389 9.7278 9.7278 9.8923 9.8923 10.1330 10.1330 10.1432 10.1432 k = 0.3875 0.1949 0.6124 ( 29884 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5999 -7.5999 -7.5687 -7.5687 -7.5099 -7.5099 -7.4412 -7.4412 -3.7979 -3.7979 -3.7962 -3.7962 -2.3925 -2.3925 -2.3883 -2.3883 -2.3609 -2.3609 -2.3567 -2.3567 -0.6865 -0.6865 -0.5147 -0.5147 -0.4793 -0.4793 0.0781 0.0781 0.1086 0.1086 0.6303 0.6303 0.9996 0.9996 1.2697 1.2697 1.4289 1.4289 2.2024 2.2024 2.5457 2.5457 2.6491 2.6491 2.6899 2.6899 2.9991 2.9991 3.0549 3.0549 3.1261 3.1261 3.3070 3.3070 3.3995 3.3995 3.6463 3.6463 3.7597 3.7597 3.9394 3.9394 4.9632 4.9632 5.6884 5.6884 8.6357 8.6357 9.7129 9.7129 9.8822 9.8822 10.1341 10.1341 10.1412 10.1412 k = 0.3750 0.2165 0.6124 ( 29864 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5997 -7.5997 -7.5682 -7.5682 -7.5107 -7.5107 -7.4410 -7.4410 -3.7979 -3.7979 -3.7962 -3.7962 -2.3926 -2.3926 -2.3885 -2.3885 -2.3608 -2.3608 -2.3566 -2.3566 -0.6873 -0.6873 -0.5121 -0.5121 -0.4812 -0.4812 0.0781 0.0781 0.1088 0.1088 0.6304 0.6304 0.9981 0.9981 1.2705 1.2705 1.4292 1.4292 2.2024 2.2024 2.5460 2.5460 2.6505 2.6505 2.6881 2.6881 3.0003 3.0003 3.0540 3.0540 3.1269 3.1269 3.3070 3.3070 3.3988 3.3988 3.6467 3.6467 3.7600 3.7600 3.9405 3.9405 4.9615 4.9615 5.6905 5.6905 8.6346 8.6346 9.7078 9.7078 9.8788 9.8788 10.1341 10.1341 10.1407 10.1407 k = 0.3750 0.2165 0.6124 ( 29864 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5997 -7.5997 -7.5682 -7.5682 -7.5107 -7.5107 -7.4410 -7.4410 -3.7979 -3.7979 -3.7962 -3.7962 -2.3926 -2.3926 -2.3885 -2.3885 -2.3608 -2.3608 -2.3566 -2.3566 -0.6873 -0.6873 -0.5121 -0.5121 -0.4812 -0.4812 0.0781 0.0781 0.1088 0.1088 0.6304 0.6304 0.9981 0.9981 1.2705 1.2705 1.4292 1.4292 2.2024 2.2024 2.5460 2.5460 2.6505 2.6505 2.6881 2.6881 3.0003 3.0003 3.0540 3.0540 3.1269 3.1269 3.3070 3.3070 3.3988 3.3988 3.6467 3.6467 3.7600 3.7600 3.9405 3.9405 4.9615 4.9615 5.6905 5.6905 8.6346 8.6346 9.7078 9.7078 9.8788 9.8788 10.1341 10.1341 10.1407 10.1407 k = 0.3625 0.2093 0.5920 ( 29868 PWs) bands (ev): -15.0178 -15.0178 -15.0168 -15.0168 -8.3233 -8.3233 -7.7075 -7.7075 -7.5986 -7.5986 -7.5648 -7.5648 -7.5036 -7.5036 -7.4454 -7.4454 -3.7986 -3.7986 -3.7968 -3.7968 -2.3925 -2.3925 -2.3919 -2.3919 -2.3614 -2.3614 -2.3575 -2.3575 -0.6746 -0.6746 -0.5239 -0.5239 -0.4874 -0.4874 0.0815 0.0815 0.1069 0.1069 0.6294 0.6294 0.9958 0.9958 1.2594 1.2594 1.4433 1.4433 2.2049 2.2049 2.5528 2.5528 2.6447 2.6447 2.6820 2.6820 3.0026 3.0026 3.0425 3.0425 3.1485 3.1485 3.3152 3.3152 3.4175 3.4175 3.6490 3.6490 3.7646 3.7646 3.9171 3.9171 5.0080 5.0080 5.6648 5.6648 8.6118 8.6118 9.7092 9.7092 9.8366 9.8366 10.1512 10.1512 10.1778 10.1778 k = 0.3500 0.2021 0.5715 ( 29884 PWs) bands (ev): -15.0176 -15.0176 -15.0170 -15.0170 -8.3242 -8.3242 -7.7117 -7.7117 -7.5978 -7.5978 -7.5607 -7.5607 -7.4969 -7.4969 -7.4500 -7.4500 -3.7997 -3.7997 -3.7973 -3.7973 -2.3972 -2.3972 -2.3914 -2.3914 -2.3619 -2.3619 -2.3586 -2.3586 -0.6619 -0.6619 -0.5367 -0.5367 -0.4934 -0.4934 0.0846 0.0846 0.1061 0.1061 0.6287 0.6287 0.9914 0.9914 1.2473 1.2473 1.4584 1.4584 2.2084 2.2084 2.5600 2.5600 2.6409 2.6409 2.6773 2.6773 3.0052 3.0052 3.0320 3.0320 3.1703 3.1703 3.3228 3.3228 3.4357 3.4357 3.6560 3.6560 3.7685 3.7685 3.8956 3.8956 5.0554 5.0554 5.6404 5.6404 8.5847 8.5847 9.7089 9.7089 9.7915 9.7915 10.1665 10.1665 10.1873 10.1873 k = 0.3375 0.1949 0.5511 ( 29872 PWs) bands (ev): -15.0174 -15.0174 -15.0172 -15.0172 -8.3256 -8.3256 -7.7148 -7.7148 -7.5970 -7.5970 -7.5562 -7.5562 -7.4907 -7.4907 -7.4549 -7.4549 -3.8013 -3.8013 -3.7977 -3.7977 -2.4024 -2.4024 -2.3913 -2.3913 -2.3625 -2.3625 -2.3601 -2.3601 -0.6497 -0.6497 -0.5502 -0.5502 -0.4990 -0.4990 0.0869 0.0869 0.1069 0.1069 0.6283 0.6283 0.9852 0.9852 1.2346 1.2346 1.4735 1.4735 2.2130 2.2130 2.5671 2.5671 2.6395 2.6395 2.6742 2.6742 3.0079 3.0079 3.0239 3.0239 3.1914 3.1914 3.3301 3.3301 3.4532 3.4532 3.6672 3.6672 3.7702 3.7702 3.8787 3.8787 5.1032 5.1032 5.6179 5.6179 8.5530 8.5530 9.7058 9.7058 9.7433 9.7433 10.1744 10.1744 10.1824 10.1824 k = 0.3250 0.1876 0.5307 ( 29874 PWs) bands (ev): -15.0175 -15.0175 -15.0172 -15.0172 -8.3274 -8.3274 -7.7167 -7.7167 -7.5964 -7.5964 -7.5513 -7.5513 -7.4850 -7.4850 -7.4600 -7.4600 -3.8032 -3.8032 -3.7981 -3.7981 -2.4081 -2.4081 -2.3914 -2.3914 -2.3638 -2.3638 -2.3614 -2.3614 -0.6394 -0.6394 -0.5634 -0.5634 -0.5041 -0.5041 0.0884 0.0884 0.1093 0.1093 0.6281 0.6281 0.9775 0.9775 1.2215 1.2215 1.4875 1.4875 2.2190 2.2190 2.5740 2.5740 2.6408 2.6408 2.6729 2.6729 3.0065 3.0065 3.0228 3.0228 3.2110 3.2110 3.3376 3.3376 3.4700 3.4700 3.6820 3.6820 3.7679 3.7679 3.8692 3.8692 5.1510 5.1510 5.5977 5.5977 8.5164 8.5164 9.6874 9.6874 9.7038 9.7038 10.1244 10.1244 10.1631 10.1631 k = 0.3125 0.1804 0.5103 ( 29918 PWs) bands (ev): -15.0177 -15.0177 -15.0169 -15.0169 -8.3298 -8.3298 -7.7175 -7.7175 -7.5958 -7.5958 -7.5459 -7.5459 -7.4798 -7.4798 -7.4650 -7.4650 -3.8054 -3.8054 -3.7987 -3.7987 -2.4142 -2.4142 -2.3920 -2.3920 -2.3664 -2.3664 -2.3621 -2.3621 -0.6338 -0.6338 -0.5735 -0.5735 -0.5086 -0.5086 0.0896 0.0896 0.1129 0.1129 0.6281 0.6281 0.9688 0.9688 1.2084 1.2084 1.4994 1.4994 2.2268 2.2268 2.5801 2.5801 2.6450 2.6450 2.6736 2.6736 3.0005 3.0005 3.0301 3.0301 3.2281 3.2281 3.3458 3.3458 3.4861 3.4861 3.6989 3.6989 3.7618 3.7618 3.8686 3.8686 5.1985 5.1985 5.5801 5.5801 8.4748 8.4748 9.6322 9.6322 9.6931 9.6931 10.0214 10.0214 10.1230 10.1230 k = 0.3000 0.1732 0.4899 ( 29884 PWs) bands (ev): -15.0180 -15.0180 -15.0167 -15.0167 -8.3326 -8.3326 -7.7170 -7.7170 -7.5952 -7.5952 -7.5403 -7.5403 -7.4761 -7.4761 -7.4692 -7.4692 -3.8080 -3.8080 -3.7993 -3.7993 -2.4208 -2.4208 -2.3928 -2.3928 -2.3700 -2.3700 -2.3627 -2.3627 -0.6376 -0.6376 -0.5758 -0.5758 -0.5123 -0.5123 0.0909 0.0909 0.1171 0.1171 0.6282 0.6282 0.9596 0.9596 1.1953 1.1953 1.5085 1.5085 2.2366 2.2366 2.5855 2.5855 2.6521 2.6521 2.6766 2.6766 2.9941 2.9941 3.0418 3.0418 3.2421 3.2421 3.3552 3.3552 3.5017 3.5017 3.7147 3.7147 3.7572 3.7572 3.8755 3.8755 5.2455 5.2455 5.5656 5.5656 8.4282 8.4282 9.5713 9.5713 9.6798 9.6798 9.9129 9.9129 10.0802 10.0802 k = 0.2875 0.1660 0.4695 ( 29886 PWs) bands (ev): -15.0182 -15.0182 -15.0165 -15.0165 -8.3360 -8.3360 -7.7153 -7.7153 -7.5946 -7.5946 -7.5345 -7.5345 -7.4778 -7.4778 -7.4683 -7.4683 -3.8109 -3.8109 -3.8000 -3.8000 -2.4276 -2.4276 -2.3940 -2.3940 -2.3744 -2.3744 -2.3633 -2.3633 -0.6514 -0.6514 -0.5699 -0.5699 -0.5152 -0.5152 0.0927 0.0927 0.1216 0.1216 0.6284 0.6284 0.9502 0.9502 1.1825 1.1825 1.5140 1.5140 2.2487 2.2487 2.5900 2.5900 2.6615 2.6615 2.6820 2.6820 2.9883 2.9883 3.0571 3.0571 3.2526 3.2526 3.3661 3.3661 3.5165 3.5165 3.7221 3.7221 3.7641 3.7641 3.8876 3.8876 5.2916 5.2916 5.5545 5.5545 8.3767 8.3767 9.5067 9.5067 9.6617 9.6617 9.8056 9.8056 10.0320 10.0320 k = 0.2750 0.1588 0.4491 ( 29898 PWs) bands (ev): -15.0185 -15.0185 -15.0163 -15.0163 -8.3398 -8.3398 -7.7124 -7.7124 -7.5939 -7.5939 -7.5286 -7.5286 -7.4827 -7.4827 -7.4646 -7.4646 -3.8140 -3.8140 -3.8009 -3.8009 -2.4348 -2.4348 -2.3955 -2.3955 -2.3797 -2.3797 -2.3642 -2.3642 -0.6710 -0.6710 -0.5601 -0.5601 -0.5171 -0.5171 0.0953 0.0953 0.1261 0.1261 0.6285 0.6285 0.9412 0.9412 1.1698 1.1698 1.5156 1.5156 2.2632 2.2632 2.5941 2.5941 2.6729 2.6729 2.6899 2.6899 2.9833 2.9833 3.0756 3.0756 3.2596 3.2596 3.3785 3.3785 3.5302 3.5302 3.7228 3.7228 3.7831 3.7831 3.9030 3.9030 5.3364 5.3364 5.5471 5.5471 8.3204 8.3204 9.4397 9.4397 9.6368 9.6368 9.7023 9.7023 9.9767 9.9767 k = 0.2625 0.1516 0.4287 ( 29886 PWs) bands (ev): -15.0188 -15.0188 -15.0160 -15.0160 -8.3442 -8.3442 -7.7085 -7.7085 -7.5932 -7.5932 -7.5227 -7.5227 -7.4878 -7.4878 -7.4608 -7.4608 -3.8175 -3.8175 -3.8019 -3.8019 -2.4422 -2.4422 -2.3975 -2.3975 -2.3856 -2.3856 -2.3653 -2.3653 -0.6938 -0.6938 -0.5489 -0.5489 -0.5180 -0.5180 0.0987 0.0987 0.1306 0.1306 0.6284 0.6284 0.9328 0.9328 1.1575 1.1575 1.5129 1.5129 2.2803 2.2803 2.5979 2.5979 2.6854 2.6854 2.7004 2.7004 2.9791 2.9791 3.0970 3.0970 3.2637 3.2637 3.3920 3.3920 3.5424 3.5424 3.7261 3.7261 3.8065 3.8065 3.9208 3.9208 5.3794 5.3794 5.5440 5.5440 8.2597 8.2597 9.3715 9.3715 9.5832 9.5832 9.6255 9.6255 9.9128 9.9128 k = 0.2500 0.1443 0.4082 ( 29908 PWs) bands (ev): -15.0190 -15.0190 -15.0158 -15.0158 -8.3489 -8.3489 -7.7036 -7.7036 -7.5923 -7.5923 -7.5172 -7.5172 -7.4925 -7.4925 -7.4573 -7.4573 -3.8213 -3.8213 -3.8031 -3.8031 -2.4497 -2.4497 -2.4004 -2.4004 -2.3916 -2.3916 -2.3668 -2.3668 -0.7187 -0.7187 -0.5375 -0.5375 -0.5179 -0.5179 0.1029 0.1029 0.1349 0.1349 0.6281 0.6281 0.9254 0.9254 1.1455 1.1455 1.5059 1.5059 2.3000 2.3000 2.6019 2.6019 2.6986 2.6986 2.7132 2.7132 2.9756 2.9756 3.1204 3.1204 3.2662 3.2662 3.4058 3.4058 3.5534 3.5534 3.7357 3.7357 3.8312 3.8312 3.9403 3.9403 5.4198 5.4198 5.5459 5.5459 8.1949 8.1949 9.3033 9.3033 9.4886 9.4886 9.5879 9.5879 9.8403 9.8403 k = 0.2375 0.1371 0.3878 ( 29882 PWs) bands (ev): -15.0193 -15.0193 -15.0156 -15.0156 -8.3539 -8.3539 -7.6978 -7.6978 -7.5914 -7.5914 -7.5132 -7.5132 -7.4957 -7.4957 -7.4540 -7.4540 -3.8253 -3.8253 -3.8043 -3.8043 -2.4574 -2.4574 -2.4055 -2.4055 -2.3964 -2.3964 -2.3687 -2.3687 -0.7450 -0.7450 -0.5267 -0.5267 -0.5163 -0.5163 0.1079 0.1079 0.1391 0.1391 0.6275 0.6275 0.9192 0.9192 1.1339 1.1339 1.4946 1.4946 2.3221 2.3221 2.6062 2.6062 2.7123 2.7123 2.7281 2.7281 2.9727 2.9727 3.1442 3.1442 3.2690 3.2690 3.4188 3.4188 3.5644 3.5644 3.7522 3.7522 3.8562 3.8562 3.9610 3.9610 5.4561 5.4561 5.5541 5.5541 8.1267 8.1267 9.2359 9.2359 9.3920 9.3920 9.5515 9.5515 9.7607 9.7607 k = 0.2250 0.1299 0.3674 ( 29876 PWs) bands (ev): -15.0196 -15.0196 -15.0154 -15.0154 -8.3593 -8.3593 -7.6912 -7.6912 -7.5904 -7.5904 -7.5126 -7.5126 -7.4953 -7.4953 -7.4510 -7.4510 -3.8296 -3.8296 -3.8057 -3.8057 -2.4652 -2.4652 -2.4131 -2.4131 -2.3995 -2.3995 -2.3709 -2.3709 -0.7724 -0.7724 -0.5185 -0.5185 -0.5115 -0.5115 0.1137 0.1137 0.1433 0.1433 0.6266 0.6266 0.9144 0.9144 1.1227 1.1227 1.4793 1.4793 2.3465 2.3465 2.6112 2.6112 2.7263 2.7263 2.7445 2.7445 2.9704 2.9704 3.1657 3.1657 3.2749 3.2749 3.4300 3.4300 3.5773 3.5773 3.7749 3.7749 3.8809 3.8809 3.9826 3.9826 5.4869 5.4869 5.5703 5.5703 8.0557 8.0557 9.1699 9.1699 9.2980 9.2980 9.5124 9.5124 9.6759 9.6759 k = 0.2125 0.1227 0.3470 ( 29898 PWs) bands (ev): -15.0199 -15.0199 -15.0152 -15.0152 -8.3648 -8.3648 -7.6840 -7.6840 -7.5894 -7.5894 -7.5156 -7.5156 -7.4913 -7.4913 -7.4482 -7.4482 -3.8340 -3.8340 -3.8072 -3.8072 -2.4729 -2.4729 -2.4221 -2.4221 -2.4019 -2.4019 -2.3735 -2.3735 -0.8006 -0.8006 -0.5140 -0.5140 -0.5026 -0.5026 0.1201 0.1201 0.1474 0.1474 0.6254 0.6254 0.9111 0.9111 1.1119 1.1119 1.4603 1.4603 2.3728 2.3728 2.6170 2.6170 2.7407 2.7407 2.7620 2.7620 2.9686 2.9686 3.1812 3.1812 3.2872 3.2872 3.4384 3.4384 3.5942 3.5942 3.8025 3.8025 3.9050 3.9050 4.0048 4.0048 5.5118 5.5118 5.5943 5.5943 7.9825 7.9825 9.1056 9.1056 9.2074 9.2074 9.4707 9.4707 9.5876 9.5876 k = 0.2000 0.1155 0.3266 ( 29920 PWs) bands (ev): -15.0202 -15.0202 -15.0150 -15.0150 -8.3705 -8.3705 -7.6763 -7.6763 -7.5882 -7.5882 -7.5199 -7.5199 -7.4859 -7.4859 -7.4456 -7.4456 -3.8387 -3.8387 -3.8088 -3.8088 -2.4807 -2.4807 -2.4320 -2.4320 -2.4040 -2.4040 -2.3765 -2.3765 -0.8292 -0.8292 -0.5098 -0.5098 -0.4931 -0.4931 0.1270 0.1270 0.1515 0.1515 0.6240 0.6240 0.9094 0.9094 1.1014 1.1014 1.4381 1.4381 2.4008 2.4008 2.6236 2.6236 2.7555 2.7555 2.7802 2.7802 2.9673 2.9673 3.1891 3.1891 3.3075 3.3075 3.4440 3.4440 3.6160 3.6160 3.8338 3.8338 3.9282 3.9282 4.0273 4.0273 5.5333 5.5333 5.6237 5.6237 7.9080 7.9080 9.0431 9.0431 9.1207 9.1207 9.4270 9.4270 9.4972 9.4972 k = 0.1875 0.1083 0.3062 ( 29913 PWs) bands (ev): -15.0204 -15.0204 -15.0147 -15.0147 -8.3763 -8.3763 -7.6683 -7.6683 -7.5869 -7.5869 -7.5245 -7.5245 -7.4801 -7.4801 -7.4433 -7.4433 -3.8434 -3.8434 -3.8105 -3.8105 -2.4883 -2.4883 -2.4424 -2.4424 -2.4060 -2.4060 -2.3798 -2.3798 -0.8580 -0.8580 -0.5050 -0.5050 -0.4840 -0.4840 0.1343 0.1343 0.1557 0.1557 0.6224 0.6224 0.9092 0.9092 1.0913 1.0913 1.4134 1.4134 2.4299 2.4299 2.6311 2.6311 2.7703 2.7703 2.7987 2.7987 2.9662 2.9662 3.1909 3.1909 3.3334 3.3334 3.4474 3.4474 3.6430 3.6430 3.8679 3.8679 3.9504 3.9504 4.0498 4.0498 5.5545 5.5545 5.6553 5.6553 7.8329 7.8329 8.9824 8.9824 9.0382 9.0382 9.3820 9.3820 9.4060 9.4060 k = 0.1750 0.1010 0.2858 ( 29901 PWs) bands (ev): -15.0207 -15.0207 -15.0146 -15.0146 -8.3820 -8.3820 -7.6601 -7.6601 -7.5855 -7.5855 -7.5291 -7.5291 -7.4743 -7.4743 -7.4411 -7.4411 -3.8483 -3.8483 -3.8122 -3.8122 -2.4958 -2.4958 -2.4532 -2.4532 -2.4080 -2.4080 -2.3834 -2.3834 -0.8866 -0.8866 -0.4995 -0.4995 -0.4756 -0.4756 0.1418 0.1418 0.1599 0.1599 0.6206 0.6206 0.9103 0.9103 1.0815 1.0815 1.3867 1.3867 2.4597 2.4597 2.6394 2.6394 2.7851 2.7851 2.8174 2.8174 2.9656 2.9656 3.1894 3.1894 3.3610 3.3610 3.4504 3.4504 3.6745 3.6745 3.9039 3.9039 3.9714 3.9714 4.0722 4.0722 5.5769 5.5769 5.6870 5.6870 7.7579 7.7579 8.9232 8.9232 8.9600 8.9600 9.3145 9.3145 9.3364 9.3364 k = 0.1625 0.0938 0.2654 ( 29891 PWs) bands (ev): -15.0210 -15.0210 -15.0144 -15.0144 -8.3877 -8.3877 -7.6519 -7.6519 -7.5840 -7.5840 -7.5335 -7.5335 -7.4685 -7.4685 -7.4391 -7.4391 -3.8531 -3.8531 -3.8140 -3.8140 -2.5030 -2.5030 -2.4642 -2.4642 -2.4099 -2.4099 -2.3872 -2.3872 -0.9148 -0.9148 -0.4934 -0.4934 -0.4679 -0.4679 0.1493 0.1493 0.1643 0.1643 0.6189 0.6189 0.9126 0.9126 1.0718 1.0718 1.3589 1.3589 2.4899 2.4899 2.6483 2.6483 2.7996 2.7996 2.8360 2.8360 2.9652 2.9652 3.1866 3.1866 3.3859 3.3859 3.4557 3.4557 3.7098 3.7098 3.9409 3.9409 3.9912 3.9912 4.0941 4.0941 5.6015 5.6015 5.7179 5.7179 7.6838 7.6838 8.8652 8.8652 8.8868 8.8868 9.2242 9.2242 9.2904 9.2904 k = 0.1500 0.0866 0.2449 ( 29905 PWs) bands (ev): -15.0212 -15.0212 -15.0142 -15.0142 -8.3933 -8.3933 -7.6439 -7.6439 -7.5823 -7.5823 -7.5376 -7.5376 -7.4630 -7.4630 -7.4373 -7.4373 -3.8579 -3.8579 -3.8157 -3.8157 -2.5100 -2.5100 -2.4752 -2.4752 -2.4117 -2.4117 -2.3911 -2.3911 -0.9423 -0.9423 -0.4868 -0.4868 -0.4608 -0.4608 0.1568 0.1568 0.1687 0.1687 0.6172 0.6172 0.9159 0.9159 1.0622 1.0622 1.3306 1.3306 2.5198 2.5198 2.6578 2.6578 2.8136 2.8136 2.8542 2.8542 2.9650 2.9650 3.1835 3.1835 3.4027 3.4027 3.4679 3.4679 3.7481 3.7481 3.9783 3.9783 4.0099 4.0099 4.1154 4.1154 5.6283 5.6283 5.7472 5.7472 7.6113 7.6113 8.8072 8.8072 8.8198 8.8198 9.1357 9.1357 9.2448 9.2448 k = 0.1375 0.0794 0.2245 ( 29905 PWs) bands (ev): -15.0215 -15.0215 -15.0140 -15.0140 -8.3986 -8.3986 -7.6363 -7.6363 -7.5806 -7.5806 -7.5414 -7.5414 -7.4577 -7.4577 -7.4356 -7.4356 -3.8626 -3.8626 -3.8175 -3.8175 -2.5167 -2.5167 -2.4861 -2.4861 -2.4135 -2.4135 -2.3951 -2.3951 -0.9687 -0.9687 -0.4798 -0.4798 -0.4545 -0.4545 0.1641 0.1641 0.1732 0.1732 0.6155 0.6155 0.9199 0.9199 1.0526 1.0526 1.3027 1.3027 2.5492 2.5492 2.6677 2.6677 2.8267 2.8267 2.8718 2.8718 2.9650 2.9650 3.1808 3.1808 3.4095 3.4095 3.4883 3.4883 3.7887 3.7887 4.0145 4.0145 4.0282 4.0282 4.1359 4.1359 5.6574 5.6574 5.7746 5.7746 7.5412 7.5412 8.7476 8.7476 8.7609 8.7609 9.0498 9.0498 9.2001 9.2001 k = 0.1250 0.0722 0.2041 ( 29907 PWs) bands (ev): -15.0217 -15.0217 -15.0139 -15.0139 -8.4036 -8.4036 -7.6292 -7.6292 -7.5786 -7.5786 -7.5448 -7.5448 -7.4527 -7.4527 -7.4341 -7.4341 -3.8672 -3.8672 -3.8193 -3.8193 -2.5230 -2.5230 -2.4967 -2.4967 -2.4151 -2.4151 -2.3992 -2.3992 -0.9939 -0.9939 -0.4725 -0.4725 -0.4488 -0.4488 0.1710 0.1710 0.1778 0.1778 0.6140 0.6140 0.9245 0.9245 1.0427 1.0427 1.2760 1.2760 2.5776 2.5776 2.6777 2.6777 2.8388 2.8388 2.8884 2.8884 2.9652 2.9652 3.1791 3.1791 3.4102 3.4102 3.5129 3.5129 3.8305 3.8305 4.0402 4.0402 4.0548 4.0548 4.1554 4.1554 5.6882 5.6882 5.8000 5.8000 7.4740 7.4740 8.6896 8.6896 8.7071 8.7071 8.9674 8.9674 9.1565 9.1565 k = 0.1125 0.0650 0.1837 ( 29943 PWs) bands (ev): -15.0219 -15.0219 -15.0137 -15.0137 -8.4084 -8.4084 -7.6230 -7.6230 -7.5764 -7.5764 -7.5478 -7.5478 -7.4480 -7.4480 -7.4328 -7.4328 -3.8715 -3.8715 -3.8209 -3.8209 -2.5288 -2.5288 -2.5067 -2.5067 -2.4166 -2.4166 -2.4031 -2.4031 -1.0175 -1.0175 -0.4652 -0.4652 -0.4438 -0.4438 0.1775 0.1775 0.1824 0.1824 0.6127 0.6127 0.9292 0.9292 1.0324 1.0324 1.2514 1.2514 2.6047 2.6047 2.6876 2.6876 2.8497 2.8497 2.9039 2.9039 2.9656 2.9656 3.1785 3.1785 3.4080 3.4080 3.5380 3.5380 3.8729 3.8729 4.0555 4.0555 4.0888 4.0888 4.1736 4.1736 5.7202 5.7202 5.8231 5.8231 7.4104 7.4104 8.6359 8.6359 8.6564 8.6564 8.8894 8.8894 9.1147 9.1147 k = 0.1000 0.0577 0.1633 ( 29951 PWs) bands (ev): -15.0221 -15.0221 -15.0136 -15.0136 -8.4127 -8.4127 -7.6176 -7.6176 -7.5740 -7.5740 -7.5503 -7.5503 -7.4438 -7.4438 -7.4315 -7.4315 -3.8756 -3.8756 -3.8225 -3.8225 -2.5342 -2.5342 -2.5162 -2.5162 -2.4180 -2.4180 -2.4069 -2.4069 -1.0393 -1.0393 -0.4580 -0.4580 -0.4394 -0.4394 0.1835 0.1835 0.1869 0.1869 0.6115 0.6115 0.9339 0.9339 1.0215 1.0215 1.2294 1.2294 2.6302 2.6302 2.6973 2.6973 2.8592 2.8592 2.9178 2.9178 2.9660 2.9660 3.1791 3.1791 3.4046 3.4046 3.5619 3.5619 3.9149 3.9149 4.0686 4.0686 4.1217 4.1217 4.1905 4.1905 5.7528 5.7528 5.8438 5.8438 7.3511 7.3511 8.5872 8.5872 8.6086 8.6086 8.8166 8.8166 9.0751 9.0751 k = 0.0875 0.0505 0.1429 ( 29967 PWs) bands (ev): -15.0222 -15.0222 -15.0135 -15.0135 -8.4167 -8.4167 -7.6132 -7.6132 -7.5713 -7.5713 -7.5524 -7.5524 -7.4400 -7.4400 -7.4305 -7.4305 -3.8794 -3.8794 -3.8240 -3.8240 -2.5391 -2.5391 -2.5249 -2.5249 -2.4192 -2.4192 -2.4105 -2.4105 -1.0591 -1.0591 -0.4510 -0.4510 -0.4357 -0.4357 0.1889 0.1889 0.1913 0.1913 0.6106 0.6106 0.9384 0.9384 1.0101 1.0101 1.2106 1.2106 2.6537 2.6537 2.7064 2.7064 2.8671 2.8671 2.9301 2.9301 2.9664 2.9664 3.1810 3.1810 3.4007 3.4007 3.5838 3.5838 3.9555 3.9555 4.0800 4.0800 4.1520 4.1520 4.2059 4.2059 5.7851 5.7851 5.8620 5.8620 7.2968 7.2968 8.5438 8.5438 8.5640 8.5640 8.7499 8.7499 9.0382 9.0382 k = 0.0750 0.0433 0.1225 ( 29941 PWs) bands (ev): -15.0224 -15.0224 -15.0134 -15.0134 -8.4202 -8.4202 -7.6099 -7.6099 -7.5686 -7.5686 -7.5541 -7.5541 -7.4366 -7.4366 -7.4295 -7.4295 -3.8827 -3.8827 -3.8253 -3.8253 -2.5434 -2.5434 -2.5327 -2.5327 -2.4204 -2.4204 -2.4137 -2.4137 -1.0767 -1.0767 -0.4445 -0.4445 -0.4325 -0.4325 0.1937 0.1937 0.1955 0.1955 0.6098 0.6098 0.9424 0.9424 0.9984 0.9984 1.1953 1.1953 2.6751 2.6751 2.7148 2.7148 2.8734 2.8734 2.9406 2.9406 2.9669 2.9669 3.1840 3.1840 3.3966 3.3966 3.6033 3.6033 3.9938 3.9938 4.0900 4.0900 4.1792 4.1792 4.2195 4.2195 5.8162 5.8162 5.8777 5.8777 7.2480 7.2480 8.5059 8.5059 8.5234 8.5234 8.6900 8.6900 9.0045 9.0045 k = 0.0625 0.0361 0.1021 ( 29947 PWs) bands (ev): -15.0225 -15.0225 -15.0133 -15.0133 -8.4232 -8.4232 -7.6074 -7.6074 -7.5658 -7.5658 -7.5554 -7.5554 -7.4337 -7.4337 -7.4288 -7.4288 -3.8857 -3.8857 -3.8265 -3.8265 -2.5471 -2.5471 -2.5395 -2.5395 -2.4213 -2.4213 -2.4166 -2.4166 -1.0918 -1.0918 -0.4386 -0.4386 -0.4298 -0.4298 0.1979 0.1979 0.1992 0.1992 0.6092 0.6092 0.9458 0.9458 0.9869 0.9869 1.1833 1.1833 2.6939 2.6939 2.7224 2.7224 2.8782 2.8782 2.9494 2.9494 2.9674 2.9674 3.1878 3.1878 3.3926 3.3926 3.6201 3.6201 4.0286 4.0286 4.0983 4.0983 4.2030 4.2030 4.2313 4.2313 5.8450 5.8450 5.8909 5.8909 7.2055 7.2055 8.4737 8.4737 8.4875 8.4875 8.6379 8.6379 8.9746 8.9746 k = 0.0500 0.0289 0.0816 ( 29959 PWs) bands (ev): -15.0226 -15.0226 -15.0132 -15.0132 -8.4257 -8.4257 -7.6057 -7.6057 -7.5632 -7.5632 -7.5564 -7.5564 -7.4313 -7.4313 -7.4281 -7.4281 -3.8882 -3.8882 -3.8275 -3.8275 -2.5501 -2.5501 -2.5452 -2.5452 -2.4221 -2.4221 -2.4190 -2.4190 -1.1045 -1.1045 -0.4336 -0.4336 -0.4276 -0.4276 0.2015 0.2015 0.2024 0.2024 0.6087 0.6087 0.9487 0.9487 0.9761 0.9761 1.1745 1.1745 2.7101 2.7101 2.7288 2.7288 2.8815 2.8815 2.9564 2.9564 2.9678 2.9678 3.1919 3.1919 3.3889 3.3889 3.6340 3.6340 4.0589 4.0589 4.1052 4.1052 4.2228 4.2228 4.2412 4.2412 5.8704 5.8704 5.9016 5.9016 7.1697 7.1697 8.4472 8.4472 8.4569 8.4569 8.5941 8.5941 8.9490 8.9490 k = 0.0375 0.0217 0.0612 ( 29945 PWs) bands (ev): -15.0227 -15.0227 -15.0132 -15.0132 -8.4276 -8.4276 -7.6046 -7.6046 -7.5609 -7.5609 -7.5570 -7.5570 -7.4294 -7.4294 -7.4276 -7.4276 -3.8901 -3.8901 -3.8282 -3.8282 -2.5526 -2.5526 -2.5498 -2.5498 -2.4227 -2.4227 -2.4210 -2.4210 -1.1144 -1.1144 -0.4294 -0.4294 -0.4260 -0.4260 0.2044 0.2044 0.2050 0.2050 0.6084 0.6084 0.9509 0.9509 0.9668 0.9668 1.1682 1.1682 2.7231 2.7231 2.7339 2.7339 2.8835 2.8835 2.9618 2.9618 2.9681 2.9681 3.1957 3.1957 3.3858 3.3858 3.6449 3.6449 4.0837 4.0837 4.1105 4.1105 4.2385 4.2385 4.2489 4.2489 5.8914 5.8914 5.9099 5.9099 7.1413 7.1413 8.4265 8.4265 8.4324 8.4324 8.5594 8.5594 8.9285 8.9285 k = 0.0250 0.0144 0.0408 ( 29931 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4291 -8.4291 -7.6039 -7.6039 -7.5592 -7.5592 -7.5575 -7.5575 -7.4280 -7.4280 -7.4272 -7.4272 -3.8915 -3.8915 -3.8288 -3.8288 -2.5543 -2.5543 -2.5531 -2.5531 -2.4232 -2.4232 -2.4224 -2.4224 -1.1216 -1.1216 -0.4264 -0.4264 -0.4248 -0.4248 0.2065 0.2065 0.2068 0.2068 0.6082 0.6082 0.9524 0.9524 0.9597 0.9597 1.1641 1.1641 2.7328 2.7328 2.7377 2.7377 2.8847 2.8847 2.9656 2.9656 2.9683 2.9683 3.1990 3.1990 3.3834 3.3834 3.6527 3.6527 4.1022 4.1022 4.1144 4.1144 4.2498 4.2498 4.2545 4.2545 5.9072 5.9072 5.9157 5.9157 7.1206 7.1206 8.4117 8.4117 8.4144 8.4144 8.5342 8.5342 8.9134 8.9134 k = 0.0125 0.0072 0.0204 ( 29949 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4299 -8.4299 -7.6036 -7.6036 -7.5582 -7.5582 -7.5577 -7.5577 -7.4272 -7.4272 -7.4270 -7.4270 -3.8924 -3.8924 -3.8292 -3.8292 -2.5554 -2.5554 -2.5550 -2.5550 -2.4234 -2.4234 -2.4232 -2.4232 -1.1259 -1.1259 -0.4245 -0.4245 -0.4241 -0.4241 0.2079 0.2079 0.2079 0.2079 0.6080 0.6080 0.9533 0.9533 0.9551 0.9551 1.1619 1.1619 2.7388 2.7388 2.7400 2.7400 2.8852 2.8852 2.9678 2.9678 2.9685 2.9685 3.2011 3.2011 3.3818 3.3818 3.6575 3.6575 4.1136 4.1136 4.1167 4.1167 4.2567 4.2567 4.2578 4.2578 5.9170 5.9170 5.9191 5.9191 7.1080 7.1080 8.4028 8.4028 8.4035 8.4035 8.5189 8.5189 8.9041 8.9041 k = 0.0000 0.0000 0.0000 ( 29939 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4302 -8.4302 -7.6034 -7.6034 -7.5578 -7.5578 -7.5578 -7.5578 -7.4269 -7.4269 -7.4269 -7.4269 -3.8927 -3.8927 -3.8293 -3.8293 -2.5557 -2.5557 -2.5557 -2.5557 -2.4235 -2.4235 -2.4235 -2.4235 -1.1274 -1.1274 -0.4239 -0.4239 -0.4239 -0.4239 0.2083 0.2083 0.2083 0.2083 0.6080 0.6080 0.9536 0.9536 0.9536 0.9536 1.1611 1.1611 2.7408 2.7408 2.7408 2.7408 2.8853 2.8853 2.9685 2.9685 2.9685 2.9685 3.2018 3.2018 3.3813 3.3813 3.6590 3.6590 4.1174 4.1174 4.1174 4.1174 4.2590 4.2590 4.2590 4.2590 5.9203 5.9203 5.9203 5.9203 7.1038 7.1038 8.3998 8.3998 8.3998 8.3998 8.5138 8.5138 8.9010 8.9010 k = 0.0000 0.0000 0.0000 ( 29939 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4302 -8.4302 -7.6034 -7.6034 -7.5578 -7.5578 -7.5578 -7.5578 -7.4269 -7.4269 -7.4269 -7.4269 -3.8927 -3.8927 -3.8293 -3.8293 -2.5557 -2.5557 -2.5557 -2.5557 -2.4235 -2.4235 -2.4235 -2.4235 -1.1274 -1.1274 -0.4239 -0.4239 -0.4239 -0.4239 0.2083 0.2083 0.2083 0.2083 0.6080 0.6080 0.9536 0.9536 0.9536 0.9536 1.1611 1.1611 2.7408 2.7408 2.7408 2.7408 2.8853 2.8853 2.9685 2.9685 2.9685 2.9685 3.2018 3.2018 3.3813 3.3813 3.6590 3.6590 4.1174 4.1174 4.1174 4.1174 4.2590 4.2590 4.2590 4.2590 5.9203 5.9203 5.9203 5.9203 7.1038 7.1038 8.3998 8.3998 8.3998 8.3998 8.5138 8.5138 8.9010 8.9010 k = 0.0208 0.0120 0.0085 ( 29951 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4299 -8.4299 -7.6036 -7.6036 -7.5582 -7.5582 -7.5577 -7.5577 -7.4271 -7.4271 -7.4271 -7.4271 -3.8924 -3.8924 -3.8292 -3.8292 -2.5554 -2.5554 -2.5550 -2.5550 -2.4235 -2.4235 -2.4232 -2.4232 -1.1259 -1.1259 -0.4244 -0.4244 -0.4243 -0.4243 0.2079 0.2079 0.2079 0.2079 0.6080 0.6080 0.9532 0.9532 0.9553 0.9553 1.1619 1.1619 2.7386 2.7386 2.7400 2.7400 2.8852 2.8852 2.9679 2.9679 2.9684 2.9684 3.2011 3.2011 3.3819 3.3819 3.6574 3.6574 4.1134 4.1134 4.1166 4.1166 4.2567 4.2567 4.2577 4.2577 5.9175 5.9175 5.9184 5.9184 7.1082 7.1082 8.4032 8.4032 8.4033 8.4033 8.5191 8.5191 8.9043 8.9043 k = 0.0417 0.0241 0.0170 ( 29939 PWs) bands (ev): -15.0228 -15.0228 -15.0131 -15.0131 -8.4290 -8.4290 -7.6040 -7.6040 -7.5594 -7.5594 -7.5573 -7.5573 -7.4277 -7.4277 -7.4276 -7.4276 -3.8915 -3.8915 -3.8288 -3.8288 -2.5543 -2.5543 -2.5529 -2.5529 -2.4232 -2.4232 -2.4223 -2.4223 -1.1214 -1.1214 -0.4258 -0.4258 -0.4256 -0.4256 0.2065 0.2065 0.2067 0.2067 0.6082 0.6082 0.9518 0.9518 0.9604 0.9604 1.1643 1.1643 2.7322 2.7322 2.7378 2.7378 2.8847 2.8847 2.9658 2.9658 2.9679 2.9679 3.1989 3.1989 3.3834 3.3834 3.6525 3.6525 4.1015 4.1015 4.1143 4.1143 4.2499 4.2499 4.2538 4.2538 5.9093 5.9093 5.9128 5.9128 7.1213 7.1213 8.4133 8.4133 8.4139 8.4139 8.5350 8.5350 8.9138 8.9138 k = 0.0625 0.0361 0.0255 ( 29933 PWs) bands (ev): -15.0227 -15.0227 -15.0132 -15.0132 -8.4275 -8.4275 -7.6047 -7.6047 -7.5612 -7.5612 -7.5568 -7.5568 -7.4287 -7.4287 -7.4284 -7.4284 -3.8900 -3.8900 -3.8282 -3.8282 -2.5526 -2.5526 -2.5493 -2.5493 -2.4228 -2.4228 -2.4207 -2.4207 -1.1139 -1.1139 -0.4281 -0.4281 -0.4276 -0.4276 0.2043 0.2043 0.2048 0.2048 0.6084 0.6084 0.9491 0.9491 0.9688 0.9688 1.1687 1.1687 2.7219 2.7219 2.7341 2.7341 2.8836 2.8836 2.9622 2.9622 2.9672 2.9672 3.1958 3.1958 3.3858 3.3858 3.6443 3.6443 4.0823 4.0823 4.1103 4.1103 4.2388 4.2388 4.2474 4.2474 5.8961 5.8961 5.9038 5.9038 7.1427 7.1427 8.4299 8.4299 8.4312 8.4312 8.5612 8.5612 8.9294 8.9294 k = 0.0833 0.0481 0.0340 ( 29939 PWs) bands (ev): -15.0226 -15.0226 -15.0132 -15.0132 -8.4255 -8.4255 -7.6061 -7.6061 -7.5635 -7.5635 -7.5560 -7.5560 -7.4300 -7.4300 -7.4296 -7.4296 -3.8880 -3.8880 -3.8274 -3.8274 -2.5503 -2.5503 -2.5444 -2.5444 -2.4223 -2.4223 -2.4186 -2.4186 -1.1035 -1.1035 -0.4313 -0.4313 -0.4304 -0.4304 0.2012 0.2012 0.2022 0.2022 0.6088 0.6088 0.9447 0.9447 0.9802 0.9802 1.1755 1.1755 2.7079 2.7079 2.7291 2.7291 2.8816 2.8816 2.9568 2.9568 2.9662 2.9662 3.1924 3.1924 3.3888 3.3888 3.6331 3.6331 4.0566 4.0566 4.1048 4.1048 4.2234 4.2234 4.2383 4.2383 5.8781 5.8781 5.8917 5.8917 7.1720 7.1720 8.4528 8.4528 8.4551 8.4551 8.5971 8.5971 8.9505 8.9505 k = 0.1042 0.0601 0.0425 ( 29948 PWs) bands (ev): -15.0225 -15.0225 -15.0133 -15.0133 -8.4229 -8.4229 -7.6082 -7.6082 -7.5658 -7.5658 -7.5549 -7.5549 -7.4317 -7.4317 -7.4310 -7.4310 -3.8854 -3.8854 -3.8264 -3.8264 -2.5473 -2.5473 -2.5383 -2.5383 -2.4216 -2.4216 -2.4159 -2.4159 -1.0904 -1.0904 -0.4352 -0.4352 -0.4339 -0.4339 0.1974 0.1974 0.1990 0.1990 0.6093 0.6093 0.9382 0.9382 0.9945 0.9945 1.1852 1.1852 2.6905 2.6905 2.7228 2.7228 2.8786 2.8786 2.9494 2.9494 2.9650 2.9650 3.1893 3.1893 3.3922 3.3922 3.6187 3.6187 4.0252 4.0252 4.0977 4.0977 4.2041 4.2041 4.2266 4.2266 5.8562 5.8562 5.8770 5.8770 7.2088 7.2088 8.4816 8.4816 8.4851 8.4851 8.6421 8.6421 8.9761 8.9761 k = 0.1250 0.0722 0.0510 ( 29939 PWs) bands (ev): -15.0224 -15.0224 -15.0134 -15.0134 -8.4198 -8.4198 -7.6116 -7.6116 -7.5678 -7.5678 -7.5537 -7.5537 -7.4338 -7.4338 -7.4328 -7.4328 -3.8824 -3.8824 -3.8252 -3.8252 -2.5438 -2.5438 -2.5310 -2.5310 -2.4209 -2.4209 -2.4128 -2.4128 -1.0747 -1.0747 -0.4398 -0.4398 -0.4381 -0.4381 0.1929 0.1929 0.1954 0.1954 0.6099 0.6099 0.9292 0.9292 1.0115 1.0115 1.1980 1.1980 2.6701 2.6701 2.7155 2.7155 2.8743 2.8743 2.9398 2.9398 2.9636 2.9636 3.1873 3.1873 3.3957 3.3957 3.6015 3.6015 3.9893 3.9893 4.0888 4.0888 4.1815 4.1815 4.2125 4.2125 5.8311 5.8311 5.8602 5.8602 7.2522 7.2522 8.5157 8.5157 8.5207 8.5207 8.6954 8.6954 9.0052 9.0052 k = 0.1458 0.0842 0.0595 ( 29951 PWs) bands (ev): -15.0222 -15.0222 -15.0135 -15.0135 -8.4161 -8.4161 -7.6162 -7.6162 -7.5692 -7.5692 -7.5522 -7.5522 -7.4362 -7.4362 -7.4349 -7.4349 -3.8789 -3.8789 -3.8238 -3.8238 -2.5396 -2.5396 -2.5226 -2.5226 -2.4201 -2.4201 -2.4091 -2.4091 -1.0566 -1.0566 -0.4451 -0.4451 -0.4428 -0.4428 0.1878 0.1878 0.1915 0.1915 0.6108 0.6108 0.9176 0.9176 1.0307 1.0307 1.2141 1.2141 2.6469 2.6469 2.7072 2.7072 2.8685 2.8685 2.9278 2.9278 2.9621 2.9621 3.1867 3.1867 3.3993 3.3993 3.5815 3.5815 3.9500 3.9500 4.0777 4.0777 4.1564 4.1564 4.1960 4.1960 5.8034 5.8034 5.8419 5.8419 7.3015 7.3015 8.5547 8.5547 8.5614 8.5614 8.7559 8.7559 9.0368 9.0368 k = 0.1667 0.0962 0.0680 ( 29957 PWs) bands (ev): -15.0220 -15.0220 -15.0136 -15.0136 -8.4121 -8.4121 -7.6223 -7.6223 -7.5698 -7.5698 -7.5505 -7.5505 -7.4390 -7.4390 -7.4372 -7.4372 -3.8751 -3.8751 -3.8223 -3.8223 -2.5350 -2.5350 -2.5132 -2.5132 -2.4192 -2.4192 -2.4051 -2.4051 -1.0362 -1.0362 -0.4507 -0.4507 -0.4479 -0.4479 0.1822 0.1822 0.1873 0.1873 0.6118 0.6118 0.9036 0.9036 1.0518 1.0518 1.2333 1.2333 2.6212 2.6212 2.6984 2.6984 2.8612 2.8612 2.9136 2.9136 2.9606 2.9606 3.1881 3.1881 3.4028 3.4028 3.5591 3.5591 3.9085 3.9085 4.0634 4.0634 4.1302 4.1302 4.1774 4.1774 5.7739 5.7739 5.8225 5.8225 7.3561 7.3561 8.5978 8.5978 8.6065 8.6065 8.8225 8.8225 9.0695 9.0695 k = 0.1875 0.1083 0.0765 ( 29966 PWs) bands (ev): -15.0218 -15.0218 -15.0138 -15.0138 -8.4076 -8.4076 -7.6297 -7.6297 -7.5695 -7.5695 -7.5485 -7.5485 -7.4420 -7.4420 -7.4398 -7.4398 -3.8709 -3.8709 -3.8207 -3.8207 -2.5300 -2.5300 -2.5031 -2.5031 -2.4184 -2.4184 -2.4008 -2.4008 -1.0139 -1.0139 -0.4568 -0.4568 -0.4535 -0.4535 0.1763 0.1763 0.1831 0.1831 0.6131 0.6131 0.8874 0.8874 1.0745 1.0745 1.2554 1.2554 2.5933 2.5933 2.6891 2.6891 2.8525 2.8525 2.8972 2.8972 2.9590 2.9590 3.1915 3.1915 3.4063 3.4063 3.5344 3.5344 3.8658 3.8658 4.0442 4.0442 4.1054 4.1054 4.1569 4.1569 5.7435 5.7435 5.8026 5.8026 7.4151 7.4151 8.6446 8.6446 8.6553 8.6553 8.8938 8.8938 9.1023 9.1023 k = 0.2083 0.1203 0.0851 ( 29948 PWs) bands (ev): -15.0216 -15.0216 -15.0139 -15.0139 -8.4027 -8.4027 -7.6382 -7.6382 -7.5686 -7.5686 -7.5464 -7.5464 -7.4454 -7.4454 -7.4427 -7.4427 -3.8666 -3.8666 -3.8191 -3.8191 -2.5245 -2.5245 -2.4923 -2.4923 -2.4176 -2.4176 -2.3962 -2.3962 -0.9900 -0.9900 -0.4631 -0.4631 -0.4592 -0.4592 0.1701 0.1701 0.1788 0.1788 0.6146 0.6146 0.8694 0.8694 1.0984 1.0984 1.2799 1.2799 2.5633 2.5633 2.6797 2.6797 2.8424 2.8424 2.8791 2.8791 2.9574 2.9574 3.1969 3.1969 3.4097 3.4097 3.5078 3.5078 3.8229 3.8229 4.0180 4.0180 4.0845 4.0845 4.1347 4.1347 5.7127 5.7127 5.7828 5.7828 7.4778 7.4778 8.6943 8.6943 8.7072 8.7072 8.9684 8.9684 9.1346 9.1346 k = 0.2292 0.1323 0.0936 ( 29927 PWs) bands (ev): -15.0214 -15.0214 -15.0141 -15.0141 -8.3976 -8.3976 -7.6476 -7.6476 -7.5671 -7.5671 -7.5440 -7.5440 -7.4489 -7.4489 -7.4458 -7.4458 -3.8620 -3.8620 -3.8174 -3.8174 -2.5188 -2.5188 -2.4810 -2.4810 -2.4169 -2.4169 -2.3915 -2.3915 -0.9648 -0.9648 -0.4695 -0.4695 -0.4652 -0.4652 0.1639 0.1639 0.1746 0.1746 0.6163 0.6163 0.8500 0.8500 1.1231 1.1231 1.3065 1.3065 2.5317 2.5317 2.6705 2.6705 2.8310 2.8310 2.8597 2.8597 2.9557 2.9557 3.2042 3.2042 3.4131 3.4131 3.4796 3.4796 3.7808 3.7808 3.9855 3.9855 4.0677 4.0677 4.1111 4.1111 5.6822 5.6822 5.7632 5.7632 7.5435 7.5435 8.7464 8.7464 8.7616 8.7616 9.0446 9.0446 9.1660 9.1660 k = 0.2500 0.1443 0.1021 ( 29912 PWs) bands (ev): -15.0211 -15.0211 -15.0143 -15.0143 -8.3922 -8.3922 -7.6575 -7.6575 -7.5650 -7.5650 -7.5415 -7.5415 -7.4528 -7.4528 -7.4491 -7.4491 -3.8573 -3.8573 -3.8157 -3.8157 -2.5127 -2.5127 -2.4694 -2.4694 -2.4163 -2.4163 -2.3867 -2.3867 -0.9387 -0.9387 -0.4759 -0.4759 -0.4712 -0.4712 0.1577 0.1577 0.1705 0.1705 0.6182 0.6182 0.8296 0.8296 1.1482 1.1482 1.3346 1.3346 2.4988 2.4988 2.6617 2.6617 2.8183 2.8183 2.8396 2.8396 2.9539 2.9539 3.2131 3.2131 3.4165 3.4165 3.4504 3.4504 3.7400 3.7400 3.9488 3.9488 4.0535 4.0535 4.0864 4.0864 5.6525 5.6525 5.7444 5.7444 7.6114 7.6114 8.8005 8.8005 8.8180 8.8180 9.1201 9.1201 9.1969 9.1969 k = 0.2708 0.1564 0.1106 ( 29900 PWs) bands (ev): -15.0209 -15.0209 -15.0145 -15.0145 -8.3867 -8.3867 -7.6677 -7.6677 -7.5626 -7.5626 -7.5388 -7.5388 -7.4568 -7.4568 -7.4526 -7.4526 -3.8526 -3.8526 -3.8141 -3.8141 -2.5065 -2.5065 -2.4577 -2.4577 -2.4159 -2.4159 -2.3820 -2.3820 -0.9122 -0.9122 -0.4822 -0.4822 -0.4771 -0.4771 0.1518 0.1518 0.1666 0.1666 0.6203 0.6203 0.8086 0.8086 1.1733 1.1733 1.3638 1.3638 2.4649 2.4649 2.6537 2.6537 2.8043 2.8043 2.8198 2.8198 2.9521 2.9521 3.2234 3.2234 3.4189 3.4189 3.4216 3.4216 3.7013 3.7013 3.9099 3.9099 4.0410 4.0410 4.0609 4.0609 5.6240 5.6240 5.7266 5.7266 7.6807 7.6807 8.8560 8.8560 8.8757 8.8757 9.1894 9.1894 9.2309 9.2309 k = 0.2917 0.1684 0.1191 ( 29879 PWs) bands (ev): -15.0206 -15.0206 -15.0147 -15.0147 -8.3811 -8.3811 -7.6780 -7.6780 -7.5598 -7.5598 -7.5358 -7.5358 -7.4610 -7.4610 -7.4563 -7.4563 -3.8480 -3.8480 -3.8126 -3.8126 -2.5002 -2.5002 -2.4460 -2.4460 -2.4156 -2.4156 -2.3774 -2.3774 -0.8856 -0.8856 -0.4882 -0.4882 -0.4829 -0.4829 0.1464 0.1464 0.1630 0.1630 0.6224 0.6224 0.7874 0.7874 1.1979 1.1979 1.3935 1.3935 2.4305 2.4305 2.6465 2.6465 2.7882 2.7882 2.8015 2.8015 2.9501 2.9501 3.2347 3.2347 3.3904 3.3904 3.4239 3.4239 3.6651 3.6651 3.8701 3.8701 4.0295 4.0295 4.0350 4.0350 5.5972 5.5972 5.7099 5.7099 7.7507 7.7507 8.9126 8.9126 8.9345 8.9345 9.2358 9.2358 9.2834 9.2834 k = 0.3125 0.1804 0.1276 ( 29882 PWs) bands (ev): -15.0203 -15.0203 -15.0149 -15.0149 -8.3756 -8.3756 -7.6882 -7.6882 -7.5568 -7.5568 -7.5327 -7.5327 -7.4654 -7.4654 -7.4601 -7.4601 -3.8434 -3.8434 -3.8112 -3.8112 -2.4939 -2.4939 -2.4345 -2.4345 -2.4156 -2.4156 -2.3730 -2.3730 -0.8595 -0.8595 -0.4940 -0.4940 -0.4885 -0.4885 0.1415 0.1415 0.1596 0.1596 0.6247 0.6247 0.7665 0.7665 1.2217 1.2217 1.4232 1.4232 2.3963 2.3963 2.6406 2.6406 2.7703 2.7703 2.7856 2.7856 2.9481 2.9481 3.2464 3.2464 3.3614 3.3614 3.4277 3.4277 3.6315 3.6315 3.8304 3.8304 4.0091 4.0091 4.0188 4.0188 5.5724 5.5724 5.6946 5.6946 7.8206 7.8206 8.9700 8.9700 8.9939 8.9939 9.2638 9.2638 9.3481 9.3481 k = 0.3333 0.1925 0.1361 ( 29915 PWs) bands (ev): -15.0200 -15.0200 -15.0151 -15.0151 -8.3702 -8.3702 -7.6980 -7.6980 -7.5535 -7.5535 -7.5294 -7.5294 -7.4698 -7.4698 -7.4641 -7.4641 -3.8390 -3.8390 -3.8099 -3.8099 -2.4877 -2.4877 -2.4234 -2.4234 -2.4159 -2.4159 -2.3690 -2.3690 -0.8344 -0.8344 -0.4994 -0.4994 -0.4937 -0.4937 0.1373 0.1373 0.1565 0.1565 0.6271 0.6271 0.7461 0.7461 1.2443 1.2443 1.4523 1.4523 2.3628 2.3628 2.6358 2.6358 2.7518 2.7518 2.7713 2.7713 2.9458 2.9458 3.2571 3.2571 3.3349 3.3349 3.4316 3.4316 3.6009 3.6009 3.7919 3.7919 3.9836 3.9836 4.0090 4.0090 5.5498 5.5498 5.6807 5.6807 7.8894 7.8894 9.0280 9.0280 9.0538 9.0538 9.2860 9.2860 9.4105 9.4105 k = 0.3542 0.2045 0.1446 ( 29876 PWs) bands (ev): -15.0197 -15.0197 -15.0154 -15.0154 -8.3650 -8.3650 -7.7073 -7.7073 -7.5500 -7.5500 -7.5260 -7.5260 -7.4743 -7.4743 -7.4681 -7.4681 -3.8348 -3.8348 -3.8089 -3.8089 -2.4816 -2.4816 -2.4164 -2.4164 -2.4129 -2.4129 -2.3654 -2.3654 -0.8108 -0.8108 -0.5043 -0.5043 -0.4986 -0.4986 0.1339 0.1339 0.1538 0.1538 0.6294 0.6294 0.7268 0.7268 1.2653 1.2653 1.4801 1.4801 2.3308 2.3308 2.6323 2.6323 2.7342 2.7342 2.7580 2.7580 2.9435 2.9435 3.2630 3.2630 3.3152 3.3152 3.4355 3.4355 3.5734 3.5734 3.7554 3.7554 3.9589 3.9589 4.0000 4.0000 5.5295 5.5295 5.6683 5.6683 7.9562 7.9562 9.0863 9.0863 9.1138 9.1138 9.3041 9.3041 9.4670 9.4670 k = 0.3750 0.2165 0.1531 ( 29874 PWs) bands (ev): -15.0194 -15.0194 -15.0157 -15.0157 -8.3603 -8.3603 -7.7159 -7.7159 -7.5464 -7.5464 -7.5224 -7.5224 -7.4787 -7.4787 -7.4723 -7.4723 -3.8310 -3.8310 -3.8080 -3.8080 -2.4757 -2.4757 -2.4171 -2.4171 -2.4031 -2.4031 -2.3624 -2.3624 -0.7891 -0.7891 -0.5087 -0.5087 -0.5029 -0.5029 0.1313 0.1313 0.1513 0.1513 0.6316 0.6316 0.7090 0.7090 1.2842 1.2842 1.5060 1.5060 2.3011 2.3011 2.6301 2.6301 2.7182 2.7182 2.7457 2.7457 2.9410 2.9410 3.2559 3.2559 3.3109 3.3109 3.4388 3.4388 3.5492 3.5492 3.7217 3.7217 3.9356 3.9356 3.9920 3.9920 5.5117 5.5117 5.6576 5.6576 8.0198 8.0198 9.1448 9.1448 9.1738 9.1738 9.3175 9.3175 9.5155 9.5155 k = 0.3958 0.2285 0.1616 ( 29859 PWs) bands (ev): -15.0190 -15.0190 -15.0159 -15.0159 -8.3560 -8.3560 -7.7235 -7.7235 -7.5428 -7.5428 -7.5187 -7.5187 -7.4831 -7.4831 -7.4765 -7.4765 -3.8274 -3.8274 -3.8074 -3.8074 -2.4702 -2.4702 -2.4182 -2.4182 -2.3942 -2.3942 -2.3600 -2.3600 -0.7700 -0.7700 -0.5125 -0.5125 -0.5067 -0.5067 0.1295 0.1295 0.1493 0.1493 0.6338 0.6338 0.6928 0.6928 1.3009 1.3009 1.5294 1.5294 2.2743 2.2743 2.6289 2.6289 2.7042 2.7042 2.7345 2.7345 2.9386 2.9386 3.2391 3.2391 3.3192 3.3192 3.4407 3.4407 3.5288 3.5288 3.6916 3.6916 3.9142 3.9142 3.9851 3.9851 5.4966 5.4966 5.6485 5.6485 8.0788 8.0788 9.2030 9.2030 9.2333 9.2333 9.3252 9.3252 9.5478 9.5478 k = 0.4167 0.2406 0.1701 ( 29853 PWs) bands (ev): -15.0187 -15.0187 -15.0162 -15.0162 -8.3523 -8.3523 -7.7300 -7.7300 -7.5393 -7.5393 -7.5148 -7.5148 -7.4873 -7.4873 -7.4808 -7.4808 -3.8243 -3.8243 -3.8071 -3.8071 -2.4652 -2.4652 -2.4194 -2.4194 -2.3863 -2.3863 -2.3584 -2.3584 -0.7538 -0.7538 -0.5156 -0.5156 -0.5099 -0.5099 0.1283 0.1283 0.1475 0.1475 0.6358 0.6358 0.6788 0.6788 1.3149 1.3149 1.5496 1.5496 2.2513 2.2513 2.6286 2.6286 2.6925 2.6925 2.7247 2.7247 2.9362 2.9362 3.2213 3.2213 3.3316 3.3316 3.4401 3.4401 3.5132 3.5132 3.6658 3.6658 3.8953 3.8953 3.9792 3.9792 5.4841 5.4841 5.6410 5.6410 8.1314 8.1314 9.2605 9.2605 9.2906 9.2906 9.3275 9.3275 9.5424 9.5424 k = 0.4375 0.2526 0.1786 ( 29859 PWs) bands (ev): -15.0184 -15.0184 -15.0165 -15.0165 -8.3493 -8.3493 -7.7352 -7.7352 -7.5360 -7.5360 -7.5109 -7.5109 -7.4911 -7.4911 -7.4851 -7.4851 -3.8217 -3.8217 -3.8069 -3.8069 -2.4609 -2.4609 -2.4207 -2.4207 -2.3796 -2.3796 -2.3575 -2.3575 -0.7408 -0.7408 -0.5181 -0.5181 -0.5124 -0.5124 0.1276 0.1276 0.1462 0.1462 0.6376 0.6376 0.6673 0.6673 1.3261 1.3261 1.5661 1.5661 2.2326 2.2326 2.6288 2.6288 2.6834 2.6834 2.7166 2.7166 2.9341 2.9341 3.2061 3.2061 3.3450 3.3450 3.4355 3.4355 3.5031 3.5031 3.6450 3.6450 3.8796 3.8796 3.9746 3.9746 5.4744 5.4744 5.6352 5.6352 8.1757 8.1757 9.3154 9.3154 9.3163 9.3163 9.3542 9.3542 9.5273 9.5273 k = 0.4583 0.2646 0.1871 ( 29877 PWs) bands (ev): -15.0181 -15.0181 -15.0168 -15.0168 -8.3471 -8.3471 -7.7390 -7.7390 -7.5332 -7.5332 -7.5069 -7.5069 -7.4942 -7.4942 -7.4893 -7.4893 -3.8197 -3.8197 -3.8070 -3.8070 -2.4575 -2.4575 -2.4220 -2.4220 -2.3742 -2.3742 -2.3573 -2.3573 -0.7313 -0.7313 -0.5198 -0.5198 -0.5142 -0.5142 0.1273 0.1273 0.1453 0.1453 0.6394 0.6394 0.6583 0.6583 1.3342 1.3342 1.5782 1.5782 2.2189 2.2189 2.6293 2.6293 2.6768 2.6768 2.7105 2.7105 2.9324 2.9324 3.1946 3.1946 3.3582 3.3582 3.4274 3.4274 3.4981 3.4981 3.6297 3.6297 3.8678 3.8678 3.9713 3.9713 5.4674 5.4674 5.6310 5.6310 8.2096 8.2096 9.3079 9.3079 9.3681 9.3681 9.4063 9.4063 9.5173 9.5173 k = 0.4792 0.2766 0.1956 ( 29889 PWs) bands (ev): -15.0178 -15.0178 -15.0171 -15.0171 -8.3458 -8.3458 -7.7413 -7.7413 -7.5313 -7.5313 -7.5029 -7.5029 -7.4964 -7.4964 -7.4934 -7.4934 -3.8184 -3.8184 -3.8071 -3.8071 -2.4553 -2.4553 -2.4229 -2.4229 -2.3705 -2.3705 -2.3576 -2.3576 -0.7255 -0.7255 -0.5209 -0.5209 -0.5153 -0.5153 0.1272 0.1272 0.1447 0.1447 0.6411 0.6411 0.6523 0.6523 1.3391 1.3391 1.5857 1.5857 2.2105 2.2105 2.6297 2.6297 2.6729 2.6729 2.7067 2.7067 2.9314 2.9314 3.1874 3.1874 3.3693 3.3693 3.4184 3.4184 3.4963 3.4963 3.6204 3.6204 3.8604 3.8604 3.9693 3.9693 5.4633 5.4633 5.6285 5.6285 8.2310 8.2310 9.3001 9.3001 9.4100 9.4100 9.4505 9.4505 9.5124 9.5124 k = 0.5000 0.2887 0.2041 ( 29904 PWs) bands (ev): -15.0175 -15.0175 -15.0174 -15.0174 -8.3453 -8.3453 -7.7421 -7.7421 -7.5306 -7.5306 -7.5003 -7.5003 -7.4972 -7.4972 -7.4961 -7.4961 -3.8179 -3.8179 -3.8071 -3.8071 -2.4545 -2.4545 -2.4232 -2.4232 -2.3691 -2.3691 -2.3579 -2.3579 -0.7236 -0.7236 -0.5212 -0.5212 -0.5157 -0.5157 0.1272 0.1272 0.1445 0.1445 0.6420 0.6420 0.6498 0.6498 1.3408 1.3408 1.5882 1.5882 2.2076 2.2076 2.6299 2.6299 2.6716 2.6716 2.7054 2.7054 2.9310 2.9310 3.1850 3.1850 3.3744 3.3744 3.4139 3.4139 3.4959 3.4959 3.6173 3.6173 3.8579 3.8579 3.9686 3.9686 5.4619 5.4619 5.6277 5.6277 8.2383 8.2383 9.2969 9.2969 9.4279 9.4279 9.4703 9.4703 9.5108 9.5108 k = 0.5000 0.2887 0.2041 ( 29904 PWs) bands (ev): -15.0175 -15.0175 -15.0174 -15.0174 -8.3453 -8.3453 -7.7421 -7.7421 -7.5306 -7.5306 -7.5003 -7.5003 -7.4972 -7.4972 -7.4961 -7.4961 -3.8179 -3.8179 -3.8071 -3.8071 -2.4545 -2.4545 -2.4232 -2.4232 -2.3691 -2.3691 -2.3579 -2.3579 -0.7236 -0.7236 -0.5212 -0.5212 -0.5157 -0.5157 0.1272 0.1272 0.1445 0.1445 0.6420 0.6420 0.6498 0.6498 1.3408 1.3408 1.5882 1.5882 2.2076 2.2076 2.6299 2.6299 2.6716 2.6716 2.7054 2.7054 2.9310 2.9310 3.1850 3.1850 3.3744 3.3744 3.4139 3.4139 3.4959 3.4959 3.6173 3.6173 3.8579 3.8579 3.9686 3.9686 5.4619 5.4619 5.6277 5.6277 8.2383 8.2383 9.2969 9.2969 9.4279 9.4279 9.4703 9.4703 9.5108 9.5108 k = 0.5074 0.2674 0.2161 ( 29897 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3452 -8.3452 -7.7419 -7.7419 -7.5314 -7.5314 -7.5035 -7.5035 -7.4955 -7.4955 -7.4943 -7.4943 -3.8178 -3.8178 -3.8070 -3.8070 -2.4541 -2.4541 -2.4230 -2.4230 -2.3690 -2.3690 -2.3579 -2.3579 -0.7225 -0.7225 -0.5216 -0.5216 -0.5160 -0.5160 0.1268 0.1268 0.1441 0.1441 0.6418 0.6418 0.6528 0.6528 1.3401 1.3401 1.5873 1.5873 2.2078 2.2078 2.6295 2.6295 2.6715 2.6715 2.7049 2.7049 2.9312 2.9312 3.1843 3.1843 3.3710 3.3710 3.4139 3.4139 3.4959 3.4959 3.6195 3.6195 3.8562 3.8562 3.9675 3.9675 5.4605 5.4605 5.6256 5.6256 8.2409 8.2409 9.3011 9.3011 9.4313 9.4313 9.4737 9.4737 9.5171 9.5171 k = 0.5147 0.2462 0.2281 ( 29871 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3447 -8.3447 -7.7414 -7.7414 -7.5338 -7.5338 -7.5080 -7.5080 -7.4941 -7.4941 -7.4905 -7.4905 -3.8173 -3.8173 -3.8068 -3.8068 -2.4528 -2.4528 -2.4223 -2.4223 -2.3688 -2.3688 -2.3579 -2.3579 -0.7193 -0.7193 -0.5234 -0.5234 -0.5165 -0.5165 0.1254 0.1254 0.1429 0.1429 0.6412 0.6412 0.6613 0.6613 1.3380 1.3380 1.5847 1.5847 2.2084 2.2084 2.6283 2.6283 2.6710 2.6710 2.7034 2.7034 2.9319 2.9319 3.1820 3.1820 3.3616 3.3616 3.4134 3.4134 3.4956 3.4956 3.6259 3.6259 3.8511 3.8511 3.9644 3.9644 5.4562 5.4562 5.6196 5.6196 8.2485 8.2485 9.3135 9.3135 9.4412 9.4412 9.4843 9.4843 9.5357 9.5357 k = 0.5221 0.2250 0.2401 ( 29871 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3439 -8.3439 -7.7405 -7.7405 -7.5374 -7.5374 -7.5128 -7.5128 -7.4922 -7.4922 -7.4868 -7.4868 -3.8166 -3.8166 -3.8065 -3.8065 -2.4507 -2.4507 -2.4212 -2.4212 -2.3685 -2.3685 -2.3579 -2.3579 -0.7142 -0.7142 -0.5270 -0.5270 -0.5163 -0.5163 0.1232 0.1232 0.1411 0.1411 0.6405 0.6405 0.6751 0.6751 1.3345 1.3345 1.5804 1.5804 2.2092 2.2092 2.6262 2.6262 2.6702 2.6702 2.7009 2.7009 2.9331 2.9331 3.1781 3.1781 3.3481 3.3481 3.4115 3.4115 3.4950 3.4950 3.6355 3.6355 3.8430 3.8430 3.9593 3.9593 5.4480 5.4480 5.6111 5.6111 8.2611 8.2611 9.3334 9.3334 9.4563 9.4563 9.5030 9.5030 9.5660 9.5660 k = 0.5294 0.2038 0.2522 ( 29863 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3429 -8.3429 -7.7392 -7.7392 -7.5418 -7.5418 -7.5178 -7.5178 -7.4902 -7.4902 -7.4833 -7.4833 -3.8157 -3.8157 -3.8060 -3.8060 -2.4479 -2.4479 -2.4197 -2.4197 -2.3681 -2.3681 -2.3580 -2.3580 -0.7071 -0.7071 -0.5323 -0.5323 -0.5156 -0.5156 0.1203 0.1203 0.1387 0.1387 0.6395 0.6395 0.6936 0.6936 1.3297 1.3297 1.5745 1.5745 2.2103 2.2103 2.6234 2.6234 2.6690 2.6690 2.6978 2.6978 2.9348 2.9348 3.1723 3.1723 3.3324 3.3324 3.4082 3.4082 3.4940 3.4940 3.6473 3.6473 3.8321 3.8321 3.9526 3.9526 5.4346 5.4346 5.6020 5.6020 8.2782 8.2782 9.3600 9.3600 9.4755 9.4755 9.5307 9.5307 9.6064 9.6064 k = 0.5368 0.1825 0.2642 ( 29870 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3416 -8.3416 -7.7375 -7.7375 -7.5469 -7.5469 -7.5228 -7.5228 -7.4885 -7.4885 -7.4797 -7.4797 -3.8145 -3.8145 -3.8054 -3.8054 -2.4443 -2.4443 -2.4177 -2.4177 -2.3675 -2.3675 -2.3581 -2.3581 -0.6985 -0.6985 -0.5389 -0.5389 -0.5144 -0.5144 0.1170 0.1170 0.1359 0.1359 0.6384 0.6384 0.7164 0.7164 1.3236 1.3236 1.5671 1.5671 2.2116 2.2116 2.6199 2.6199 2.6672 2.6672 2.6943 2.6943 2.9370 2.9370 3.1645 3.1645 3.3155 3.3155 3.4034 3.4034 3.4924 3.4924 3.6602 3.6602 3.8191 3.8191 3.9445 3.9445 5.4147 5.4147 5.5945 5.5945 8.2995 8.2995 9.3920 9.3920 9.4980 9.4980 9.5676 9.5676 9.6534 9.6534 k = 0.5441 0.1613 0.2762 ( 29879 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3400 -8.3400 -7.7356 -7.7356 -7.5524 -7.5524 -7.5277 -7.5277 -7.4874 -7.4874 -7.4762 -7.4762 -3.8131 -3.8131 -3.8047 -3.8047 -2.4402 -2.4402 -2.4155 -2.4155 -2.3669 -2.3669 -2.3582 -2.3582 -0.6886 -0.6886 -0.5463 -0.5463 -0.5129 -0.5129 0.1133 0.1133 0.1326 0.1326 0.6371 0.6371 0.7426 0.7426 1.3163 1.3163 1.5585 1.5585 2.2129 2.2129 2.6158 2.6158 2.6642 2.6642 2.6911 2.6911 2.9398 2.9398 3.1546 3.1546 3.2985 3.2985 3.3974 3.3974 3.4902 3.4902 3.6729 3.6729 3.8049 3.8049 3.9353 3.9353 5.3879 5.3879 5.5901 5.5901 8.3246 8.3246 9.4280 9.4280 9.5235 9.5235 9.6131 9.6131 9.7005 9.7005 k = 0.5515 0.1401 0.2882 ( 29886 PWs) bands (ev): -15.0174 -15.0174 -15.0173 -15.0173 -8.3383 -8.3383 -7.7334 -7.7334 -7.5582 -7.5582 -7.5325 -7.5325 -7.4868 -7.4868 -7.4726 -7.4726 -3.8116 -3.8116 -3.8039 -3.8039 -2.4355 -2.4355 -2.4129 -2.4129 -2.3663 -2.3663 -2.3583 -2.3583 -0.6780 -0.6780 -0.5539 -0.5539 -0.5111 -0.5111 0.1095 0.1095 0.1291 0.1291 0.6358 0.6358 0.7716 0.7716 1.3079 1.3079 1.5486 1.5486 2.2141 2.2141 2.6111 2.6111 2.6599 2.6599 2.6887 2.6887 2.9432 2.9432 3.1428 3.1428 3.2819 3.2819 3.3903 3.3903 3.4873 3.4873 3.6840 3.6840 3.7908 3.7908 3.9257 3.9257 5.3547 5.3547 5.5891 5.5891 8.3527 8.3527 9.4664 9.4664 9.5520 9.5520 9.6661 9.6661 9.7461 9.7461 k = 0.5588 0.1189 0.3002 ( 29896 PWs) bands (ev): -15.0174 -15.0174 -15.0173 -15.0173 -8.3364 -8.3364 -7.7309 -7.7309 -7.5641 -7.5641 -7.5372 -7.5372 -7.4869 -7.4869 -7.4690 -7.4690 -3.8100 -3.8100 -3.8030 -3.8030 -2.4304 -2.4304 -2.4101 -2.4101 -2.3656 -2.3656 -2.3584 -2.3584 -0.6675 -0.6675 -0.5609 -0.5609 -0.5090 -0.5090 0.1057 0.1057 0.1254 0.1254 0.6345 0.6345 0.8026 0.8026 1.2988 1.2988 1.5378 1.5378 2.2151 2.2151 2.6060 2.6060 2.6545 2.6545 2.6873 2.6873 2.9474 2.9474 3.1293 3.1293 3.2658 3.2658 3.3825 3.3825 3.4835 3.4835 3.6917 3.6917 3.7790 3.7790 3.9160 3.9160 5.3166 5.3166 5.5912 5.5912 8.3832 8.3832 9.5056 9.5056 9.5831 9.5831 9.7254 9.7254 9.7944 9.7944 k = 0.5662 0.0976 0.3122 ( 29902 PWs) bands (ev): -15.0175 -15.0175 -15.0172 -15.0172 -8.3344 -8.3344 -7.7281 -7.7281 -7.5699 -7.5699 -7.5417 -7.5417 -7.4875 -7.4875 -7.4655 -7.4655 -3.8083 -3.8083 -3.8021 -3.8021 -2.4250 -2.4250 -2.4072 -2.4072 -2.3649 -2.3649 -2.3585 -2.3585 -0.6582 -0.6582 -0.5662 -0.5662 -0.5066 -0.5066 0.1021 0.1021 0.1216 0.1216 0.6332 0.6332 0.8347 0.8347 1.2892 1.2892 1.5261 1.5261 2.2156 2.2156 2.6003 2.6003 2.6486 2.6486 2.6867 2.6867 2.9523 2.9523 3.1149 3.1149 3.2502 3.2502 3.3740 3.3740 3.4789 3.4789 3.6934 3.6934 3.7720 3.7720 3.9072 3.9072 5.2750 5.2750 5.5961 5.5961 8.4154 8.4154 9.5441 9.5441 9.6162 9.6162 9.7894 9.7894 9.8474 9.8474 k = 0.5735 0.0764 0.3242 ( 29893 PWs) bands (ev): -15.0175 -15.0175 -15.0172 -15.0172 -8.3324 -8.3324 -7.7252 -7.7252 -7.5757 -7.5757 -7.5460 -7.5460 -7.4888 -7.4888 -7.4620 -7.4620 -3.8065 -3.8065 -3.8012 -3.8012 -2.4195 -2.4195 -2.4041 -2.4041 -2.3642 -2.3642 -2.3585 -2.3585 -0.6519 -0.6519 -0.5682 -0.5682 -0.5040 -0.5040 0.0986 0.0986 0.1179 0.1179 0.6320 0.6320 0.8668 0.8668 1.2797 1.2797 1.5138 1.5138 2.2156 2.2156 2.5939 2.5939 2.6432 2.6432 2.6864 2.6864 2.9581 2.9581 3.1002 3.1002 3.2349 3.2349 3.3650 3.3650 3.4731 3.4731 3.6885 3.6885 3.7706 3.7706 3.8999 3.8999 5.2314 5.2314 5.6031 5.6031 8.4485 8.4485 9.5804 9.5804 9.6509 9.6509 9.8562 9.8562 9.9042 9.9042 k = 0.5809 0.0552 0.3362 ( 29902 PWs) bands (ev): -15.0175 -15.0175 -15.0171 -15.0171 -8.3304 -8.3304 -7.7221 -7.7221 -7.5811 -7.5811 -7.5500 -7.5500 -7.4906 -7.4906 -7.4586 -7.4586 -3.8048 -3.8048 -3.8003 -3.8003 -2.4140 -2.4140 -2.4011 -2.4011 -2.3636 -2.3636 -2.3586 -2.3586 -0.6498 -0.6498 -0.5658 -0.5658 -0.5012 -0.5012 0.0953 0.0953 0.1145 0.1145 0.6310 0.6310 0.8980 0.8980 1.2710 1.2710 1.5010 1.5010 2.2150 2.2150 2.5867 2.5867 2.6392 2.6392 2.6861 2.6861 2.9647 2.9647 3.0860 3.0860 3.2194 3.2194 3.3557 3.3557 3.4660 3.4660 3.6793 3.6793 3.7725 3.7725 3.8953 3.8953 5.1872 5.1872 5.6120 5.6120 8.4817 8.4817 9.6136 9.6136 9.6865 9.6865 9.9232 9.9232 9.9623 9.9623 k = 0.5882 0.0340 0.3482 ( 29902 PWs) bands (ev): -15.0176 -15.0176 -15.0171 -15.0171 -8.3285 -8.3285 -7.7189 -7.7189 -7.5860 -7.5860 -7.5538 -7.5538 -7.4930 -7.4930 -7.4553 -7.4553 -3.8032 -3.8032 -3.7994 -3.7994 -2.4087 -2.4087 -2.3983 -2.3983 -2.3631 -2.3631 -2.3585 -2.3585 -0.6520 -0.6520 -0.5591 -0.5591 -0.4982 -0.4982 0.0921 0.0921 0.1116 0.1116 0.6302 0.6302 0.9269 0.9269 1.2637 1.2637 1.4878 1.4878 2.2137 2.2137 2.5789 2.5789 2.6371 2.6371 2.6857 2.6857 2.9722 2.9722 3.0731 3.0731 3.2037 3.2037 3.3463 3.3463 3.4573 3.4573 3.6692 3.6692 3.7743 3.7743 3.8943 3.8943 5.1434 5.1434 5.6225 5.6225 8.5142 8.5142 9.6427 9.6427 9.7225 9.7225 9.9871 9.9871 10.0180 10.0180 k = 0.5956 0.0127 0.3602 ( 29899 PWs) bands (ev): -15.0176 -15.0176 -15.0170 -15.0170 -8.3268 -8.3268 -7.7156 -7.7156 -7.5903 -7.5903 -7.5574 -7.5574 -7.4958 -7.4958 -7.4522 -7.4522 -3.8017 -3.8017 -3.7986 -3.7986 -2.4038 -2.4038 -2.3957 -2.3957 -2.3626 -2.3626 -2.3583 -2.3583 -0.6573 -0.6573 -0.5497 -0.5497 -0.4951 -0.4951 0.0889 0.0889 0.1094 0.1094 0.6297 0.6297 0.9522 0.9522 1.2589 1.2589 1.4746 1.4746 2.2118 2.2118 2.5709 2.5709 2.6371 2.6371 2.6852 2.6852 2.9804 2.9804 3.0620 3.0620 3.1877 3.1877 3.3371 3.3371 3.4472 3.4472 3.6602 3.6602 3.7741 3.7741 3.8975 3.8975 5.1011 5.1011 5.6342 5.6342 8.5452 8.5452 9.6669 9.6669 9.7580 9.7580 10.0441 10.0441 10.0679 10.0679 k = 0.6029-0.0085 0.3722 ( 29896 PWs) bands (ev): -15.0177 -15.0177 -15.0169 -15.0169 -8.3253 -8.3253 -7.7123 -7.7123 -7.5939 -7.5939 -7.5606 -7.5606 -7.4990 -7.4990 -7.4492 -7.4492 -3.8003 -3.8003 -3.7978 -3.7978 -2.3993 -2.3993 -2.3936 -2.3936 -2.3622 -2.3622 -2.3580 -2.3580 -0.6643 -0.6643 -0.5392 -0.5392 -0.4918 -0.4918 0.0859 0.0859 0.1080 0.1080 0.6295 0.6295 0.9724 0.9724 1.2574 1.2574 1.4616 1.4616 2.2093 2.2093 2.5633 2.5633 2.6389 2.6389 2.6847 2.6847 2.9886 2.9886 3.0535 3.0535 3.1716 3.1716 3.3282 3.3282 3.4356 3.4356 3.6535 3.6535 3.7717 3.7717 3.9046 3.9046 5.0611 5.0611 5.6470 5.6470 8.5736 8.5736 9.6857 9.6857 9.7921 9.7921 10.0900 10.0900 10.1091 10.1091 k = 0.6103-0.0297 0.3842 ( 29876 PWs) bands (ev): -15.0177 -15.0177 -15.0168 -15.0168 -8.3241 -8.3241 -7.7089 -7.7089 -7.5967 -7.5967 -7.5636 -7.5636 -7.5026 -7.5026 -7.4463 -7.4463 -3.7992 -3.7992 -3.7972 -3.7972 -2.3954 -2.3954 -2.3921 -2.3921 -2.3617 -2.3617 -2.3576 -2.3576 -0.6719 -0.6719 -0.5289 -0.5289 -0.4884 -0.4884 0.0830 0.0830 0.1075 0.1075 0.6295 0.6295 0.9868 0.9868 1.2594 1.2594 1.4493 1.4493 2.2067 2.2067 2.5564 2.5564 2.6421 2.6421 2.6846 2.6846 2.9958 2.9958 3.0487 3.0487 3.1557 3.1557 3.3200 3.3200 3.4232 3.4232 3.6492 3.6492 3.7678 3.7678 3.9147 3.9147 5.0241 5.0241 5.6608 5.6608 8.5987 8.5987 9.6989 9.6989 9.8239 9.8239 10.1216 10.1216 10.1390 10.1390 k = 0.6176-0.0509 0.3962 ( 29878 PWs) bands (ev): -15.0178 -15.0178 -15.0167 -15.0167 -8.3232 -8.3232 -7.7056 -7.7056 -7.5986 -7.5986 -7.5661 -7.5661 -7.5065 -7.5065 -7.4435 -7.4435 -3.7984 -3.7984 -3.7967 -3.7967 -2.3929 -2.3929 -2.3906 -2.3906 -2.3612 -2.3612 -2.3571 -2.3571 -0.6797 -0.6797 -0.5197 -0.5197 -0.4848 -0.4848 0.0803 0.0803 0.1078 0.1078 0.6299 0.6299 0.9951 0.9951 1.2643 1.2643 1.4382 1.4382 2.2042 2.2042 2.5506 2.5506 2.6463 2.6463 2.6854 2.6854 3.0000 3.0000 3.0488 3.0488 3.1405 3.1405 3.3128 3.3128 3.4106 3.4106 3.6472 3.6472 3.7635 3.7635 3.9270 3.9270 4.9907 4.9907 5.6753 5.6753 8.6193 8.6193 9.7063 9.7063 9.8530 9.8530 10.1373 10.1373 10.1526 10.1526 k = 0.6250-0.0722 0.4082 ( 29864 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5997 -7.5997 -7.5682 -7.5682 -7.5107 -7.5107 -7.4410 -7.4410 -3.7979 -3.7979 -3.7962 -3.7962 -2.3926 -2.3926 -2.3885 -2.3885 -2.3608 -2.3608 -2.3566 -2.3566 -0.6873 -0.6873 -0.5121 -0.5121 -0.4812 -0.4812 0.0781 0.0781 0.1088 0.1088 0.6304 0.6304 0.9981 0.9981 1.2705 1.2705 1.4292 1.4292 2.2024 2.2024 2.5460 2.5460 2.6505 2.6505 2.6881 2.6881 3.0003 3.0003 3.0540 3.0540 3.1269 3.1269 3.3070 3.3070 3.3988 3.3988 3.6467 3.6467 3.7600 3.7600 3.9405 3.9405 4.9615 4.9615 5.6905 5.6905 8.6346 8.6346 9.7078 9.7078 9.8788 9.8788 10.1341 10.1341 10.1407 10.1407 k = 0.6250-0.0722 0.4082 ( 29864 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5997 -7.5997 -7.5682 -7.5682 -7.5107 -7.5107 -7.4410 -7.4410 -3.7979 -3.7979 -3.7962 -3.7962 -2.3926 -2.3926 -2.3885 -2.3885 -2.3608 -2.3608 -2.3566 -2.3566 -0.6873 -0.6873 -0.5121 -0.5121 -0.4812 -0.4812 0.0781 0.0781 0.1088 0.1088 0.6304 0.6304 0.9981 0.9981 1.2705 1.2705 1.4292 1.4292 2.2024 2.2024 2.5460 2.5460 2.6505 2.6505 2.6881 2.6881 3.0003 3.0003 3.0540 3.0540 3.1269 3.1269 3.3070 3.3070 3.3988 3.3988 3.6467 3.6467 3.7600 3.7600 3.9405 3.9405 4.9615 4.9615 5.6905 5.6905 8.6346 8.6346 9.7078 9.7078 9.8788 9.8788 10.1341 10.1341 10.1407 10.1407 k = 0.6125-0.0650 0.4287 ( 29884 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5999 -7.5999 -7.5687 -7.5687 -7.5099 -7.5099 -7.4412 -7.4412 -3.7979 -3.7979 -3.7962 -3.7962 -2.3925 -2.3925 -2.3883 -2.3883 -2.3609 -2.3609 -2.3567 -2.3567 -0.6865 -0.6865 -0.5147 -0.5147 -0.4793 -0.4793 0.0781 0.0781 0.1086 0.1086 0.6303 0.6303 0.9996 0.9996 1.2697 1.2697 1.4289 1.4289 2.2024 2.2024 2.5457 2.5457 2.6491 2.6491 2.6899 2.6899 2.9991 2.9991 3.0549 3.0549 3.1261 3.1261 3.3070 3.3070 3.3995 3.3995 3.6463 3.6463 3.7597 3.7597 3.9394 3.9394 4.9632 4.9632 5.6884 5.6884 8.6357 8.6357 9.7129 9.7129 9.8822 9.8822 10.1341 10.1341 10.1412 10.1412 k = 0.6000-0.0577 0.4491 ( 29894 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3225 -8.3225 -7.7022 -7.7022 -7.6005 -7.6005 -7.5700 -7.5700 -7.5075 -7.5075 -7.4421 -7.4421 -3.7978 -3.7978 -3.7961 -3.7961 -2.3921 -2.3921 -2.3878 -2.3878 -2.3610 -2.3610 -2.3570 -2.3570 -0.6841 -0.6841 -0.5210 -0.5210 -0.4749 -0.4749 0.0782 0.0782 0.1079 0.1079 0.6300 0.6300 1.0043 1.0043 1.2671 1.2671 1.4278 1.4278 2.2026 2.2026 2.5446 2.5446 2.6457 2.6457 2.6946 2.6946 2.9958 2.9958 3.0572 3.0572 3.1235 3.1235 3.3074 3.3074 3.4012 3.4012 3.6452 3.6452 3.7589 3.7589 3.9360 3.9360 4.9682 4.9682 5.6822 5.6822 8.6389 8.6389 9.7278 9.7278 9.8923 9.8923 10.1330 10.1330 10.1432 10.1432 k = 0.5875-0.0505 0.4695 ( 29881 PWs) bands (ev): -15.0179 -15.0179 -15.0167 -15.0167 -8.3221 -8.3221 -7.7023 -7.7023 -7.6015 -7.6015 -7.5718 -7.5718 -7.5039 -7.5039 -7.4435 -7.4435 -3.7977 -3.7977 -3.7959 -3.7959 -2.3914 -2.3914 -2.3870 -2.3870 -2.3612 -2.3612 -2.3574 -2.3574 -0.6802 -0.6802 -0.5294 -0.5294 -0.4698 -0.4698 0.0784 0.0784 0.1068 0.1068 0.6295 0.6295 1.0117 1.0117 1.2631 1.2631 1.4261 1.4261 2.2028 2.2028 2.5431 2.5431 2.6413 2.6413 2.7008 2.7008 2.9915 2.9915 3.0600 3.0600 3.1191 3.1191 3.3087 3.3087 3.4032 3.4032 3.6434 3.6434 3.7581 3.7581 3.9304 3.9304 4.9762 4.9762 5.6725 5.6725 8.6440 8.6440 9.7523 9.7523 9.9090 9.9090 10.1304 10.1304 10.1468 10.1468 k = 0.5750-0.0433 0.4899 ( 29879 PWs) bands (ev): -15.0178 -15.0178 -15.0167 -15.0167 -8.3217 -8.3217 -7.7023 -7.7023 -7.6027 -7.6027 -7.5738 -7.5738 -7.4994 -7.4994 -7.4455 -7.4455 -3.7976 -3.7976 -3.7957 -3.7957 -2.3904 -2.3904 -2.3859 -2.3859 -2.3615 -2.3615 -2.3579 -2.3579 -0.6749 -0.6749 -0.5388 -0.5388 -0.4648 -0.4648 0.0788 0.0788 0.1053 0.1053 0.6289 0.6289 1.0215 1.0215 1.2578 1.2578 1.4238 1.4238 2.2031 2.2031 2.5412 2.5412 2.6367 2.6367 2.7075 2.7075 2.9873 2.9873 3.0628 3.0628 3.1129 3.1129 3.3115 3.3115 3.4044 3.4044 3.6414 3.6414 3.7579 3.7579 3.9228 3.9228 4.9862 4.9862 5.6601 5.6601 8.6505 8.6505 9.7855 9.7855 9.9319 9.9319 10.1266 10.1266 10.1512 10.1512 k = 0.5625-0.0361 0.5103 ( 29875 PWs) bands (ev): -15.0178 -15.0178 -15.0168 -15.0168 -8.3212 -8.3212 -7.7024 -7.7024 -7.6042 -7.6042 -7.5756 -7.5756 -7.4944 -7.4944 -7.4480 -7.4480 -3.7974 -3.7974 -3.7955 -3.7955 -2.3893 -2.3893 -2.3847 -2.3847 -2.3619 -2.3619 -2.3586 -2.3586 -0.6684 -0.6684 -0.5487 -0.5487 -0.4602 -0.4602 0.0794 0.0794 0.1033 0.1033 0.6282 0.6282 1.0329 1.0329 1.2517 1.2517 1.4211 1.4211 2.2033 2.2033 2.5391 2.5391 2.6322 2.6322 2.7140 2.7140 2.9841 2.9841 3.0650 3.0650 3.1052 3.1052 3.3162 3.3162 3.4039 3.4039 3.6392 3.6392 3.7589 3.7589 3.9135 3.9135 4.9975 4.9975 5.6460 5.6460 8.6577 8.6577 9.8262 9.8262 9.9600 9.9600 10.1221 10.1221 10.1562 10.1562 k = 0.5500-0.0289 0.5307 ( 29907 PWs) bands (ev): -15.0177 -15.0177 -15.0168 -15.0168 -8.3207 -8.3207 -7.7026 -7.7026 -7.6057 -7.6057 -7.5772 -7.5772 -7.4891 -7.4891 -7.4510 -7.4510 -3.7972 -3.7972 -3.7952 -3.7952 -2.3880 -2.3880 -2.3834 -2.3834 -2.3623 -2.3623 -2.3592 -2.3592 -0.6611 -0.6611 -0.5588 -0.5588 -0.4564 -0.4564 0.0804 0.0804 0.1010 0.1010 0.6276 0.6276 1.0450 1.0450 1.2453 1.2453 1.4180 1.4180 2.2035 2.2035 2.5371 2.5371 2.6280 2.6280 2.7197 2.7197 2.9823 2.9823 3.0666 3.0666 3.0965 3.0965 3.3227 3.3227 3.4012 3.4012 3.6372 3.6372 3.7614 3.7614 3.9029 3.9029 5.0090 5.0090 5.6315 5.6315 8.6651 8.6651 9.8719 9.8719 9.9922 9.9922 10.1174 10.1174 10.1626 10.1626 k = 0.5375-0.0217 0.5511 ( 29914 PWs) bands (ev): -15.0176 -15.0176 -15.0169 -15.0169 -8.3203 -8.3203 -7.7028 -7.7028 -7.6070 -7.6070 -7.5785 -7.5785 -7.4837 -7.4837 -7.4546 -7.4546 -3.7970 -3.7970 -3.7950 -3.7950 -2.3866 -2.3866 -2.3824 -2.3824 -2.3629 -2.3629 -2.3597 -2.3597 -0.6533 -0.6533 -0.5686 -0.5686 -0.4533 -0.4533 0.0818 0.0818 0.0983 0.0983 0.6269 0.6269 1.0567 1.0567 1.2392 1.2392 1.4149 1.4149 2.2035 2.2035 2.5354 2.5354 2.6245 2.6245 2.7242 2.7242 2.9822 2.9822 3.0671 3.0671 3.0881 3.0881 3.3303 3.3303 3.3965 3.3965 3.6356 3.6356 3.7653 3.7653 3.8918 3.8918 5.0195 5.0195 5.6181 5.6181 8.6720 8.6720 9.9189 9.9189 10.0261 10.0261 10.1128 10.1128 10.1724 10.1724 k = 0.5250-0.0144 0.5715 ( 29916 PWs) bands (ev): -15.0175 -15.0175 -15.0170 -15.0170 -8.3198 -8.3198 -7.7030 -7.7030 -7.6081 -7.6081 -7.5794 -7.5794 -7.4783 -7.4783 -7.4586 -7.4586 -3.7969 -3.7969 -3.7948 -3.7948 -2.3852 -2.3852 -2.3817 -2.3817 -2.3634 -2.3634 -2.3602 -2.3602 -0.6458 -0.6458 -0.5773 -0.5773 -0.4511 -0.4511 0.0835 0.0835 0.0955 0.0955 0.6264 0.6264 1.0666 1.0666 1.2343 1.2343 1.4121 1.4121 2.2035 2.2035 2.5341 2.5341 2.6217 2.6217 2.7272 2.7272 2.9835 2.9835 3.0658 3.0658 3.0816 3.0816 3.3382 3.3382 3.3906 3.3906 3.6344 3.6344 3.7702 3.7702 3.8813 3.8813 5.0279 5.0279 5.6072 5.6072 8.6777 8.6777 9.9601 9.9601 10.0578 10.0578 10.1093 10.1093 10.1889 10.1889 k = 0.5125-0.0072 0.5920 ( 29910 PWs) bands (ev): -15.0174 -15.0174 -15.0171 -15.0171 -8.3195 -8.3195 -7.7032 -7.7032 -7.6088 -7.6088 -7.5799 -7.5799 -7.4730 -7.4730 -7.4630 -7.4630 -3.7967 -3.7967 -3.7947 -3.7947 -2.3838 -2.3838 -2.3816 -2.3816 -2.3638 -2.3638 -2.3604 -2.3604 -0.6399 -0.6399 -0.5839 -0.5839 -0.4498 -0.4498 0.0856 0.0856 0.0928 0.0928 0.6261 0.6261 1.0731 1.0731 1.2312 1.2312 1.4100 1.4100 2.2033 2.2033 2.5332 2.5332 2.6200 2.6200 2.7289 2.7289 2.9853 2.9853 3.0629 3.0629 3.0786 3.0786 3.3448 3.3448 3.3850 3.3850 3.6337 3.6337 3.7744 3.7744 3.8734 3.8734 5.0333 5.0333 5.6000 5.6000 8.6815 8.6815 9.9873 9.9873 10.0804 10.0804 10.1090 10.1090 10.2125 10.2125 k = 0.5000-0.0000 0.6124 ( 29892 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3194 -8.3194 -7.7033 -7.7033 -7.6090 -7.6090 -7.5801 -7.5801 -7.4681 -7.4681 -7.4675 -7.4675 -3.7967 -3.7967 -3.7947 -3.7947 -2.3829 -2.3829 -2.3820 -2.3820 -2.3639 -2.3639 -2.3605 -2.3605 -0.6375 -0.6375 -0.5864 -0.5864 -0.4493 -0.4493 0.0869 0.0869 0.0911 0.0911 0.6260 0.6260 1.0755 1.0755 1.2303 1.2303 1.4092 1.4092 2.2033 2.2033 2.5329 2.5329 2.6194 2.6194 2.7294 2.7294 2.9863 2.9863 3.0612 3.0612 3.0780 3.0780 3.3474 3.3474 3.3826 3.3826 3.6335 3.6335 3.7762 3.7762 3.8703 3.8703 5.0352 5.0352 5.5975 5.5975 8.6829 8.6829 9.9960 9.9960 10.0868 10.0868 10.1116 10.1116 10.2277 10.2277 k = 0.5000-0.0000 0.6124 ( 29892 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3194 -8.3194 -7.7033 -7.7033 -7.6090 -7.6090 -7.5801 -7.5801 -7.4681 -7.4681 -7.4675 -7.4675 -3.7967 -3.7967 -3.7947 -3.7947 -2.3829 -2.3829 -2.3820 -2.3820 -2.3639 -2.3639 -2.3605 -2.3605 -0.6375 -0.6375 -0.5864 -0.5864 -0.4493 -0.4493 0.0869 0.0869 0.0911 0.0911 0.6260 0.6260 1.0755 1.0755 1.2303 1.2303 1.4092 1.4092 2.2033 2.2033 2.5329 2.5329 2.6194 2.6194 2.7294 2.7294 2.9863 2.9863 3.0612 3.0612 3.0780 3.0780 3.3474 3.3474 3.3826 3.3826 3.6335 3.6335 3.7762 3.7762 3.8703 3.8703 5.0352 5.0352 5.5975 5.5975 8.6829 8.6829 9.9960 9.9960 10.0868 10.0868 10.1116 10.1116 10.2277 10.2277 k = 0.5000 0.0144 0.5920 ( 29906 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3196 -8.3196 -7.7036 -7.7036 -7.6085 -7.6085 -7.5797 -7.5797 -7.4683 -7.4683 -7.4675 -7.4675 -3.7968 -3.7968 -3.7948 -3.7948 -2.3834 -2.3834 -2.3824 -2.3824 -2.3639 -2.3639 -2.3604 -2.3604 -0.6369 -0.6369 -0.5869 -0.5869 -0.4502 -0.4502 0.0866 0.0866 0.0919 0.0919 0.6260 0.6260 1.0732 1.0732 1.2298 1.2298 1.4114 1.4114 2.2036 2.2036 2.5337 2.5337 2.6196 2.6196 2.7285 2.7285 2.9840 2.9840 3.0652 3.0652 3.0785 3.0785 3.3472 3.3472 3.3845 3.3845 3.6346 3.6346 3.7761 3.7761 3.8702 3.8702 5.0377 5.0377 5.5973 5.5973 8.6796 8.6796 9.9884 9.9884 10.0780 10.0780 10.1033 10.1033 10.2232 10.2232 k = 0.5000 0.0289 0.5715 ( 29912 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3201 -8.3201 -7.7047 -7.7047 -7.6072 -7.6072 -7.5786 -7.5786 -7.4687 -7.4687 -7.4673 -7.4673 -3.7971 -3.7971 -3.7951 -3.7951 -2.3848 -2.3848 -2.3835 -2.3835 -2.3636 -2.3636 -2.3603 -2.3603 -0.6350 -0.6350 -0.5884 -0.5884 -0.4528 -0.4528 0.0862 0.0862 0.0936 0.0936 0.6262 0.6262 1.0664 1.0664 1.2287 1.2287 1.4176 1.4176 2.2047 2.2047 2.5359 2.5359 2.6204 2.6204 2.7261 2.7261 2.9787 2.9787 3.0713 3.0713 3.0841 3.0841 3.3470 3.3470 3.3895 3.3895 3.6378 3.6378 3.7756 3.7756 3.8699 3.8699 5.0452 5.0452 5.5968 5.5968 8.6700 8.6700 9.9674 9.9674 10.0463 10.0463 10.0915 10.0915 10.2134 10.2134 k = 0.5000 0.0433 0.5511 ( 29898 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3209 -8.3209 -7.7063 -7.7063 -7.6050 -7.6050 -7.5768 -7.5768 -7.4692 -7.4692 -7.4673 -7.4673 -3.7976 -3.7976 -3.7956 -3.7956 -2.3872 -2.3872 -2.3851 -2.3851 -2.3633 -2.3633 -2.3601 -2.3601 -0.6319 -0.6319 -0.5909 -0.5909 -0.4569 -0.4569 0.0860 0.0860 0.0958 0.0958 0.6264 0.6264 1.0545 1.0545 1.2284 1.2284 1.4269 1.4269 2.2063 2.2063 2.5395 2.5395 2.6218 2.6218 2.7223 2.7223 2.9731 2.9731 3.0720 3.0720 3.0993 3.0993 3.3474 3.3474 3.3968 3.3968 3.6431 3.6431 3.7747 3.7747 3.8696 3.8696 5.0577 5.0577 5.5960 5.5960 8.6544 8.6544 9.9361 9.9361 10.0002 10.0002 10.0779 10.0779 10.1960 10.1960 k = 0.5000 0.0577 0.5307 ( 29898 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3220 -8.3220 -7.7084 -7.7084 -7.6021 -7.6021 -7.5743 -7.5743 -7.4699 -7.4699 -7.4674 -7.4674 -3.7984 -3.7984 -3.7962 -3.7962 -2.3905 -2.3905 -2.3872 -2.3872 -2.3631 -2.3631 -2.3600 -2.3600 -0.6277 -0.6277 -0.5945 -0.5945 -0.4623 -0.4623 0.0863 0.0863 0.0984 0.0984 0.6267 0.6267 1.0375 1.0375 1.2300 1.2300 1.4382 1.4382 2.2082 2.2082 2.5445 2.5445 2.6237 2.6237 2.7175 2.7175 2.9685 2.9685 3.0717 3.0717 3.1183 3.1183 3.3489 3.3489 3.4056 3.4056 3.6503 3.6503 3.7733 3.7733 3.8697 3.8697 5.0749 5.0749 5.5949 5.5949 8.6335 8.6335 9.8977 9.8977 9.9489 9.9489 10.0585 10.0585 10.1681 10.1681 k = 0.5000 0.0722 0.5103 ( 29874 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3234 -8.3234 -7.7109 -7.7109 -7.5985 -7.5985 -7.5711 -7.5711 -7.4707 -7.4707 -7.4676 -7.4676 -3.7993 -3.7993 -3.7969 -3.7969 -2.3944 -2.3944 -2.3896 -2.3896 -2.3629 -2.3629 -2.3598 -2.3598 -0.6223 -0.6223 -0.5993 -0.5993 -0.4685 -0.4685 0.0872 0.0872 0.1013 0.1013 0.6272 0.6272 1.0157 1.0157 1.2341 1.2341 1.4508 1.4508 2.2103 2.2103 2.5507 2.5507 2.6263 2.6263 2.7120 2.7120 2.9652 2.9652 3.0721 3.0721 3.1385 3.1385 3.3516 3.3516 3.4153 3.4153 3.6591 3.6591 3.7710 3.7710 3.8706 3.8706 5.0967 5.0967 5.5935 5.5935 8.6082 8.6082 9.8543 9.8543 9.8961 9.8961 10.0322 10.0322 10.1313 10.1313 k = 0.5000 0.0866 0.4899 ( 29884 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3250 -8.3250 -7.7137 -7.7137 -7.5943 -7.5943 -7.5675 -7.5675 -7.4716 -7.4716 -7.4680 -7.4680 -3.8005 -3.8005 -3.7977 -3.7977 -2.3990 -2.3990 -2.3923 -2.3923 -2.3629 -2.3629 -2.3596 -2.3596 -0.6162 -0.6162 -0.6053 -0.6053 -0.4752 -0.4752 0.0885 0.0885 0.1045 0.1045 0.6278 0.6278 0.9898 0.9898 1.2404 1.2404 1.4640 1.4640 2.2123 2.2123 2.5578 2.5578 2.6294 2.6294 2.7064 2.7064 2.9627 2.9627 3.0742 3.0742 3.1586 3.1586 3.3554 3.3554 3.4256 3.4256 3.6694 3.6694 3.7678 3.7678 3.8727 3.8727 5.1226 5.1226 5.5918 5.5918 8.5792 8.5792 9.8074 9.8074 9.8440 9.8440 9.9989 9.9989 10.0883 10.0883 k = 0.5000 0.1010 0.4695 ( 29870 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3268 -8.3268 -7.7167 -7.7167 -7.5897 -7.5897 -7.5634 -7.5634 -7.4726 -7.4726 -7.4685 -7.4685 -3.8019 -3.8019 -3.7986 -3.7986 -2.4040 -2.4040 -2.3952 -2.3952 -2.3630 -2.3630 -2.3594 -2.3594 -0.6142 -0.6142 -0.6077 -0.6077 -0.4819 -0.4819 0.0905 0.0905 0.1078 0.1078 0.6286 0.6286 0.9608 0.9608 1.2487 1.2487 1.4774 1.4774 2.2140 2.2140 2.5657 2.5657 2.6332 2.6332 2.7009 2.7009 2.9605 2.9605 3.0788 3.0788 3.1782 3.1782 3.3601 3.3601 3.4360 3.4360 3.6807 3.6807 3.7637 3.7637 3.8763 3.8763 5.1522 5.1522 5.5899 5.5899 8.5476 8.5476 9.7581 9.7581 9.7936 9.7936 9.9595 9.9595 10.0405 10.0405 k = 0.5000 0.1155 0.4491 ( 29880 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3287 -8.3287 -7.7198 -7.7198 -7.5847 -7.5847 -7.5589 -7.5589 -7.4738 -7.4738 -7.4692 -7.4692 -3.8035 -3.8035 -3.7995 -3.7995 -2.4093 -2.4093 -2.3982 -2.3982 -2.3634 -2.3634 -2.3592 -2.3592 -0.6225 -0.6225 -0.6002 -0.6002 -0.4883 -0.4883 0.0928 0.0928 0.1113 0.1113 0.6295 0.6295 0.9296 0.9296 1.2582 1.2582 1.4907 1.4907 2.2152 2.2152 2.5740 2.5740 2.6377 2.6377 2.6961 2.6961 2.9580 2.9580 3.0860 3.0860 3.1970 3.1970 3.3654 3.3654 3.4463 3.4463 3.6921 3.6921 3.7589 3.7589 3.8816 3.8816 5.1850 5.1850 5.5880 5.5880 8.5142 8.5142 9.7074 9.7074 9.7457 9.7457 9.9151 9.9151 9.9893 9.9893 k = 0.5000 0.1299 0.4287 ( 29884 PWs) bands (ev): -15.0173 -15.0173 -15.0173 -15.0173 -8.3307 -8.3307 -7.7228 -7.7228 -7.5795 -7.5795 -7.5541 -7.5541 -7.4752 -7.4752 -7.4701 -7.4701 -3.8051 -3.8051 -3.8004 -3.8004 -2.4148 -2.4148 -2.4014 -2.4014 -2.3638 -2.3638 -2.3589 -2.3589 -0.6326 -0.6326 -0.5916 -0.5916 -0.4941 -0.4941 0.0957 0.0957 0.1150 0.1150 0.6306 0.6306 0.8970 0.8970 1.2686 1.2686 1.5037 1.5037 2.2160 2.2160 2.5823 2.5823 2.6427 2.6427 2.6920 2.6920 2.9552 2.9552 3.0956 3.0956 3.2149 3.2149 3.3711 3.3711 3.4561 3.4561 3.7022 3.7022 3.7552 3.7552 3.8886 3.8886 5.2201 5.2201 5.5861 5.5861 8.4799 8.4799 9.6565 9.6565 9.7005 9.7005 9.8670 9.8670 9.9363 9.9363 k = 0.5000 0.1443 0.4082 ( 29906 PWs) bands (ev): -15.0174 -15.0174 -15.0173 -15.0173 -8.3327 -8.3327 -7.7258 -7.7258 -7.5740 -7.5740 -7.5491 -7.5491 -7.4768 -7.4768 -7.4713 -7.4713 -3.8068 -3.8068 -3.8013 -3.8013 -2.4203 -2.4203 -2.4045 -2.4045 -2.3644 -2.3644 -2.3587 -2.3587 -0.6437 -0.6437 -0.5825 -0.5825 -0.4992 -0.4992 0.0988 0.0988 0.1187 0.1187 0.6319 0.6319 0.8638 0.8638 1.2792 1.2792 1.5162 1.5162 2.2161 2.2161 2.5903 2.5903 2.6482 2.6482 2.6890 2.6890 2.9520 2.9520 3.1072 3.1072 3.2320 3.2320 3.3770 3.3770 3.4651 3.4651 3.7075 3.7075 3.7556 3.7556 3.8970 3.8970 5.2567 5.2567 5.5845 5.5845 8.4456 8.4456 9.6063 9.6063 9.6583 9.6583 9.8156 9.8156 9.8840 9.8840 k = 0.5000 0.1588 0.3878 ( 29906 PWs) bands (ev): -15.0174 -15.0174 -15.0173 -15.0173 -8.3347 -8.3347 -7.7286 -7.7286 -7.5683 -7.5683 -7.5439 -7.5439 -7.4785 -7.4785 -7.4727 -7.4727 -3.8085 -3.8085 -3.8022 -3.8022 -2.4258 -2.4258 -2.4076 -2.4076 -2.3650 -2.3650 -2.3586 -2.3586 -0.6554 -0.6554 -0.5732 -0.5732 -0.5035 -0.5035 0.1023 0.1023 0.1224 0.1224 0.6332 0.6332 0.8308 0.8308 1.2896 1.2896 1.5282 1.5282 2.2158 2.2158 2.5977 2.5977 2.6538 2.6538 2.6872 2.6872 2.9486 2.9486 3.1199 3.1199 3.2488 3.2488 3.3829 3.3829 3.4730 3.4730 3.7050 3.7050 3.7632 3.7632 3.9064 3.9064 5.2938 5.2938 5.5834 5.5834 8.4119 8.4119 9.5575 9.5575 9.6191 9.6191 9.7618 9.7618 9.8349 9.8349 k = 0.5000 0.1732 0.3674 ( 29902 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3367 -8.3367 -7.7312 -7.7312 -7.5627 -7.5627 -7.5386 -7.5386 -7.4805 -7.4805 -7.4743 -7.4743 -3.8102 -3.8102 -3.8031 -3.8031 -2.4311 -2.4311 -2.4105 -2.4105 -2.3657 -2.3657 -2.3584 -2.3584 -0.6672 -0.6672 -0.5639 -0.5639 -0.5071 -0.5071 0.1060 0.1060 0.1261 0.1261 0.6345 0.6345 0.7987 0.7987 1.2996 1.2996 1.5395 1.5395 2.2151 2.2151 2.6044 2.6044 2.6589 2.6589 2.6869 2.6869 2.9453 2.9453 3.1329 3.1329 3.2655 3.2655 3.3887 3.3887 3.4796 3.4796 3.6966 3.6966 3.7759 3.7759 3.9164 3.9164 5.3298 5.3298 5.5833 5.5833 8.3797 8.3797 9.5108 9.5108 9.5832 9.5832 9.7072 9.7072 9.7905 9.7905 k = 0.5000 0.1876 0.3470 ( 29902 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3385 -8.3385 -7.7337 -7.7337 -7.5570 -7.5570 -7.5333 -7.5333 -7.4826 -7.4826 -7.4763 -7.4763 -3.8118 -3.8118 -3.8040 -3.8040 -2.4361 -2.4361 -2.4132 -2.4132 -2.3664 -2.3664 -2.3583 -2.3583 -0.6787 -0.6787 -0.5549 -0.5549 -0.5101 -0.5101 0.1098 0.1098 0.1297 0.1297 0.6359 0.6359 0.7681 0.7681 1.3088 1.3088 1.5500 1.5500 2.2140 2.2140 2.6104 2.6104 2.6630 2.6630 2.6882 2.6882 2.9421 2.9421 3.1452 3.1452 3.2823 3.2823 3.3944 3.3944 3.4850 3.4850 3.6853 3.6853 3.7907 3.7907 3.9264 3.9264 5.3635 5.3635 5.5848 5.5848 8.3494 8.3494 9.4669 9.4669 9.5508 9.5508 9.6543 9.6543 9.7507 9.7507 k = 0.5000 0.2021 0.3266 ( 29900 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3402 -8.3402 -7.7358 -7.7358 -7.5515 -7.5515 -7.5280 -7.5280 -7.4849 -7.4849 -7.4786 -7.4786 -3.8133 -3.8133 -3.8047 -3.8047 -2.4406 -2.4406 -2.4157 -2.4157 -2.3670 -2.3670 -2.3582 -2.3582 -0.6895 -0.6895 -0.5464 -0.5464 -0.5124 -0.5124 0.1136 0.1136 0.1331 0.1331 0.6372 0.6372 0.7397 0.7397 1.3170 1.3170 1.5595 1.5595 2.2128 2.2128 2.6156 2.6156 2.6659 2.6659 2.6909 2.6909 2.9392 2.9392 3.1562 3.1562 3.2995 3.2995 3.3998 3.3998 3.4891 3.4891 3.6725 3.6725 3.8058 3.8058 3.9362 3.9362 5.3933 5.3933 5.5883 5.5883 8.3219 8.3219 9.4262 9.4262 9.5218 9.5218 9.6056 9.6056 9.7062 9.7062 k = 0.5000 0.2165 0.3062 ( 29888 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3417 -8.3417 -7.7377 -7.7377 -7.5463 -7.5463 -7.5227 -7.5227 -7.4873 -7.4873 -7.4811 -7.4811 -3.8146 -3.8146 -3.8054 -3.8054 -2.4447 -2.4447 -2.4179 -2.4179 -2.3676 -2.3676 -2.3581 -2.3581 -0.6993 -0.6993 -0.5387 -0.5387 -0.5142 -0.5142 0.1173 0.1173 0.1362 0.1362 0.6385 0.6385 0.7142 0.7142 1.3242 1.3242 1.5679 1.5679 2.2115 2.2115 2.6200 2.6200 2.6679 2.6679 2.6944 2.6944 2.9367 2.9367 3.1655 3.1655 3.3166 3.3166 3.4047 3.4047 3.4920 3.4920 3.6593 3.6593 3.8202 3.8202 3.9452 3.9452 5.4177 5.4177 5.5943 5.5943 8.2975 8.2975 9.3897 9.3897 9.4963 9.4963 9.5630 9.5630 9.6519 9.6519 k = 0.5000 0.2309 0.2858 ( 29894 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3430 -8.3430 -7.7393 -7.7393 -7.5414 -7.5414 -7.5176 -7.5176 -7.4897 -7.4897 -7.4840 -7.4840 -3.8158 -3.8158 -3.8060 -3.8060 -2.4481 -2.4481 -2.4198 -2.4198 -2.3681 -2.3681 -2.3580 -2.3580 -0.7077 -0.7077 -0.5320 -0.5320 -0.5155 -0.5155 0.1205 0.1205 0.1389 0.1389 0.6396 0.6396 0.6921 0.6921 1.3301 1.3301 1.5750 1.5750 2.2102 2.2102 2.6236 2.6236 2.6693 2.6693 2.6980 2.6980 2.9346 2.9346 3.1728 3.1728 3.3334 3.3334 3.4088 3.4088 3.4939 3.4939 3.6465 3.6465 3.8329 3.8329 3.9531 3.9531 5.4361 5.4361 5.6024 5.6024 8.2768 8.2768 9.3580 9.3580 9.4742 9.4742 9.5281 9.5281 9.6037 9.6037 k = 0.5000 0.2454 0.2654 ( 29878 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3440 -8.3440 -7.7405 -7.7405 -7.5371 -7.5371 -7.5126 -7.5126 -7.4921 -7.4921 -7.4872 -7.4872 -3.8167 -3.8167 -3.8065 -3.8065 -2.4509 -2.4509 -2.4213 -2.4213 -2.3685 -2.3685 -2.3579 -2.3579 -0.7145 -0.7145 -0.5268 -0.5268 -0.5163 -0.5163 0.1233 0.1233 0.1412 0.1412 0.6405 0.6405 0.6742 0.6742 1.3348 1.3348 1.5807 1.5807 2.2092 2.2092 2.6263 2.6263 2.6703 2.6703 2.7011 2.7011 2.9330 2.9330 3.1784 3.1784 3.3489 3.3489 3.4117 3.4117 3.4950 3.4950 3.6349 3.6349 3.8435 3.8435 3.9597 3.9597 5.4486 5.4486 5.6115 5.6115 8.2603 8.2603 9.3321 9.3321 9.4554 9.4554 9.5017 9.5017 9.5641 9.5641 k = 0.5000 0.2598 0.2449 ( 29892 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3447 -8.3447 -7.7414 -7.7414 -7.5337 -7.5337 -7.5079 -7.5079 -7.4941 -7.4941 -7.4907 -7.4907 -3.8173 -3.8173 -3.8068 -3.8068 -2.4529 -2.4529 -2.4223 -2.4223 -2.3689 -2.3689 -2.3579 -2.3579 -0.7195 -0.7195 -0.5233 -0.5233 -0.5165 -0.5165 0.1254 0.1254 0.1430 0.1430 0.6412 0.6412 0.6609 0.6609 1.3381 1.3381 1.5848 1.5848 2.2083 2.2083 2.6283 2.6283 2.6710 2.6710 2.7035 2.7035 2.9319 2.9319 3.1821 3.1821 3.3620 3.3620 3.4134 3.4134 3.4956 3.4956 3.6256 3.6256 3.8514 3.8514 3.9645 3.9645 5.4564 5.4564 5.6198 5.6198 8.2482 8.2482 9.3129 9.3129 9.4407 9.4407 9.4838 9.4838 9.5348 9.5348 k = 0.5000 0.2742 0.2245 ( 29888 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3452 -8.3452 -7.7419 -7.7419 -7.5314 -7.5314 -7.5034 -7.5034 -7.4956 -7.4956 -7.4943 -7.4943 -3.8178 -3.8178 -3.8070 -3.8070 -2.4541 -2.4541 -2.4230 -2.4230 -2.3690 -2.3690 -2.3579 -2.3579 -0.7225 -0.7225 -0.5216 -0.5216 -0.5160 -0.5160 0.1268 0.1268 0.1441 0.1441 0.6418 0.6418 0.6527 0.6527 1.3401 1.3401 1.5874 1.5874 2.2078 2.2078 2.6295 2.6295 2.6715 2.6715 2.7049 2.7049 2.9312 2.9312 3.1843 3.1843 3.3711 3.3711 3.4139 3.4139 3.4959 3.4959 3.6194 3.6194 3.8563 3.8563 3.9676 3.9676 5.4606 5.4606 5.6256 5.6256 8.2408 8.2408 9.3010 9.3010 9.4312 9.4312 9.4736 9.4736 9.5169 9.5169 k = 0.5000 0.2887 0.2041 ( 29904 PWs) bands (ev): -15.0175 -15.0175 -15.0174 -15.0174 -8.3453 -8.3453 -7.7421 -7.7421 -7.5306 -7.5306 -7.5003 -7.5003 -7.4972 -7.4972 -7.4961 -7.4961 -3.8179 -3.8179 -3.8071 -3.8071 -2.4545 -2.4545 -2.4232 -2.4232 -2.3691 -2.3691 -2.3579 -2.3579 -0.7236 -0.7236 -0.5212 -0.5212 -0.5157 -0.5157 0.1272 0.1272 0.1445 0.1445 0.6420 0.6420 0.6498 0.6498 1.3408 1.3408 1.5882 1.5882 2.2076 2.2076 2.6299 2.6299 2.6716 2.6716 2.7054 2.7054 2.9310 2.9310 3.1850 3.1850 3.3744 3.3744 3.4139 3.4139 3.4959 3.4959 3.6173 3.6173 3.8579 3.8579 3.9686 3.9686 5.4619 5.4619 5.6277 5.6277 8.2383 8.2383 9.2969 9.2969 9.4279 9.4279 9.4703 9.4703 9.5108 9.5108 k = 0.5000 0.2887 0.2041 ( 29904 PWs) bands (ev): -15.0175 -15.0175 -15.0174 -15.0174 -8.3453 -8.3453 -7.7421 -7.7421 -7.5306 -7.5306 -7.5003 -7.5003 -7.4972 -7.4972 -7.4961 -7.4961 -3.8179 -3.8179 -3.8071 -3.8071 -2.4545 -2.4545 -2.4232 -2.4232 -2.3691 -2.3691 -2.3579 -2.3579 -0.7236 -0.7236 -0.5212 -0.5212 -0.5157 -0.5157 0.1272 0.1272 0.1445 0.1445 0.6420 0.6420 0.6498 0.6498 1.3408 1.3408 1.5882 1.5882 2.2076 2.2076 2.6299 2.6299 2.6716 2.6716 2.7054 2.7054 2.9310 2.9310 3.1850 3.1850 3.3744 3.3744 3.4139 3.4139 3.4959 3.4959 3.6173 3.6173 3.8579 3.8579 3.9686 3.9686 5.4619 5.4619 5.6277 5.6277 8.2383 8.2383 9.2969 9.2969 9.4279 9.4279 9.4703 9.4703 9.5108 9.5108 k = 0.4926 0.2844 0.2281 ( 29897 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3452 -8.3452 -7.7419 -7.7419 -7.5314 -7.5314 -7.5035 -7.5035 -7.4955 -7.4955 -7.4943 -7.4943 -3.8178 -3.8178 -3.8070 -3.8070 -2.4541 -2.4541 -2.4230 -2.4230 -2.3690 -2.3690 -2.3579 -2.3579 -0.7225 -0.7225 -0.5216 -0.5216 -0.5160 -0.5160 0.1268 0.1268 0.1441 0.1441 0.6418 0.6418 0.6528 0.6528 1.3401 1.3401 1.5873 1.5873 2.2078 2.2078 2.6295 2.6295 2.6715 2.6715 2.7049 2.7049 2.9312 2.9312 3.1843 3.1843 3.3710 3.3710 3.4139 3.4139 3.4959 3.4959 3.6195 3.6195 3.8562 3.8562 3.9675 3.9675 5.4605 5.4605 5.6256 5.6256 8.2409 8.2409 9.3011 9.3011 9.4313 9.4313 9.4737 9.4737 9.5171 9.5171 k = 0.4853 0.2802 0.2522 ( 29871 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3447 -8.3447 -7.7414 -7.7414 -7.5338 -7.5338 -7.5080 -7.5080 -7.4941 -7.4941 -7.4905 -7.4905 -3.8173 -3.8173 -3.8068 -3.8068 -2.4528 -2.4528 -2.4223 -2.4223 -2.3688 -2.3688 -2.3579 -2.3579 -0.7193 -0.7193 -0.5234 -0.5234 -0.5165 -0.5165 0.1254 0.1254 0.1429 0.1429 0.6412 0.6412 0.6613 0.6613 1.3380 1.3380 1.5847 1.5847 2.2084 2.2084 2.6283 2.6283 2.6710 2.6710 2.7034 2.7034 2.9319 2.9319 3.1820 3.1820 3.3616 3.3616 3.4134 3.4134 3.4956 3.4956 3.6259 3.6259 3.8511 3.8511 3.9644 3.9644 5.4562 5.4562 5.6196 5.6196 8.2485 8.2485 9.3135 9.3135 9.4412 9.4412 9.4843 9.4843 9.5357 9.5357 k = 0.4779 0.2759 0.2762 ( 29871 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3439 -8.3439 -7.7405 -7.7405 -7.5374 -7.5374 -7.5128 -7.5128 -7.4922 -7.4922 -7.4868 -7.4868 -3.8166 -3.8166 -3.8065 -3.8065 -2.4507 -2.4507 -2.4212 -2.4212 -2.3685 -2.3685 -2.3579 -2.3579 -0.7142 -0.7142 -0.5270 -0.5270 -0.5163 -0.5163 0.1232 0.1232 0.1411 0.1411 0.6405 0.6405 0.6751 0.6751 1.3345 1.3345 1.5804 1.5804 2.2092 2.2092 2.6262 2.6262 2.6702 2.6702 2.7009 2.7009 2.9331 2.9331 3.1781 3.1781 3.3481 3.3481 3.4115 3.4115 3.4950 3.4950 3.6355 3.6355 3.8430 3.8430 3.9593 3.9593 5.4480 5.4480 5.6111 5.6111 8.2611 8.2611 9.3334 9.3334 9.4563 9.4563 9.5030 9.5030 9.5660 9.5660 k = 0.4706 0.2717 0.3002 ( 29863 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3429 -8.3429 -7.7392 -7.7392 -7.5418 -7.5418 -7.5178 -7.5178 -7.4902 -7.4902 -7.4833 -7.4833 -3.8157 -3.8157 -3.8060 -3.8060 -2.4479 -2.4479 -2.4197 -2.4197 -2.3681 -2.3681 -2.3580 -2.3580 -0.7071 -0.7071 -0.5323 -0.5323 -0.5156 -0.5156 0.1203 0.1203 0.1387 0.1387 0.6395 0.6395 0.6936 0.6936 1.3297 1.3297 1.5745 1.5745 2.2103 2.2103 2.6234 2.6234 2.6690 2.6690 2.6978 2.6978 2.9348 2.9348 3.1723 3.1723 3.3324 3.3324 3.4082 3.4082 3.4940 3.4940 3.6473 3.6473 3.8321 3.8321 3.9526 3.9526 5.4346 5.4346 5.6020 5.6020 8.2782 8.2782 9.3600 9.3600 9.4755 9.4755 9.5307 9.5307 9.6064 9.6064 k = 0.4632 0.2674 0.3242 ( 29870 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3416 -8.3416 -7.7375 -7.7375 -7.5469 -7.5469 -7.5227 -7.5227 -7.4885 -7.4885 -7.4797 -7.4797 -3.8145 -3.8145 -3.8054 -3.8054 -2.4443 -2.4443 -2.4177 -2.4177 -2.3675 -2.3675 -2.3581 -2.3581 -0.6985 -0.6985 -0.5389 -0.5389 -0.5144 -0.5144 0.1170 0.1170 0.1359 0.1359 0.6384 0.6384 0.7164 0.7164 1.3236 1.3236 1.5671 1.5671 2.2116 2.2116 2.6199 2.6199 2.6672 2.6672 2.6943 2.6943 2.9370 2.9370 3.1645 3.1645 3.3155 3.3155 3.4034 3.4034 3.4924 3.4924 3.6602 3.6602 3.8191 3.8191 3.9445 3.9445 5.4147 5.4147 5.5945 5.5945 8.2996 8.2996 9.3920 9.3920 9.4980 9.4980 9.5676 9.5676 9.6534 9.6534 k = 0.4559 0.2632 0.3482 ( 29879 PWs) bands (ev): -15.0174 -15.0174 -15.0174 -15.0174 -8.3400 -8.3400 -7.7356 -7.7356 -7.5524 -7.5524 -7.5277 -7.5277 -7.4874 -7.4874 -7.4762 -7.4762 -3.8131 -3.8131 -3.8047 -3.8047 -2.4402 -2.4402 -2.4155 -2.4155 -2.3669 -2.3669 -2.3582 -2.3582 -0.6886 -0.6886 -0.5463 -0.5463 -0.5129 -0.5129 0.1133 0.1133 0.1326 0.1326 0.6371 0.6371 0.7426 0.7426 1.3163 1.3163 1.5585 1.5585 2.2129 2.2129 2.6157 2.6157 2.6642 2.6642 2.6911 2.6911 2.9398 2.9398 3.1546 3.1546 3.2985 3.2985 3.3974 3.3974 3.4902 3.4902 3.6729 3.6729 3.8049 3.8049 3.9353 3.9353 5.3879 5.3879 5.5901 5.5901 8.3246 8.3246 9.4280 9.4280 9.5236 9.5236 9.6131 9.6131 9.7005 9.7005 k = 0.4485 0.2590 0.3722 ( 29886 PWs) bands (ev): -15.0174 -15.0174 -15.0173 -15.0173 -8.3383 -8.3383 -7.7334 -7.7334 -7.5582 -7.5582 -7.5325 -7.5325 -7.4868 -7.4868 -7.4726 -7.4726 -3.8116 -3.8116 -3.8039 -3.8039 -2.4355 -2.4355 -2.4129 -2.4129 -2.3663 -2.3663 -2.3583 -2.3583 -0.6780 -0.6780 -0.5539 -0.5539 -0.5111 -0.5111 0.1095 0.1095 0.1291 0.1291 0.6358 0.6358 0.7716 0.7716 1.3079 1.3079 1.5486 1.5486 2.2141 2.2141 2.6111 2.6111 2.6599 2.6599 2.6887 2.6887 2.9432 2.9432 3.1428 3.1428 3.2819 3.2819 3.3903 3.3903 3.4873 3.4873 3.6840 3.6840 3.7908 3.7908 3.9257 3.9257 5.3547 5.3547 5.5890 5.5890 8.3527 8.3527 9.4664 9.4664 9.5520 9.5520 9.6661 9.6661 9.7461 9.7461 k = 0.4412 0.2547 0.3962 ( 29896 PWs) bands (ev): -15.0174 -15.0174 -15.0173 -15.0173 -8.3364 -8.3364 -7.7309 -7.7309 -7.5641 -7.5641 -7.5372 -7.5372 -7.4869 -7.4869 -7.4690 -7.4690 -3.8100 -3.8100 -3.8030 -3.8030 -2.4304 -2.4304 -2.4101 -2.4101 -2.3656 -2.3656 -2.3584 -2.3584 -0.6675 -0.6675 -0.5609 -0.5609 -0.5090 -0.5090 0.1057 0.1057 0.1254 0.1254 0.6345 0.6345 0.8026 0.8026 1.2988 1.2988 1.5378 1.5378 2.2151 2.2151 2.6060 2.6060 2.6545 2.6545 2.6873 2.6873 2.9474 2.9474 3.1293 3.1293 3.2658 3.2658 3.3825 3.3825 3.4835 3.4835 3.6917 3.6917 3.7790 3.7790 3.9160 3.9160 5.3166 5.3166 5.5912 5.5912 8.3832 8.3832 9.5056 9.5056 9.5831 9.5831 9.7254 9.7254 9.7944 9.7944 k = 0.4338 0.2505 0.4203 ( 29902 PWs) bands (ev): -15.0175 -15.0175 -15.0172 -15.0172 -8.3344 -8.3344 -7.7281 -7.7281 -7.5699 -7.5699 -7.5417 -7.5417 -7.4875 -7.4875 -7.4655 -7.4655 -3.8083 -3.8083 -3.8021 -3.8021 -2.4250 -2.4250 -2.4072 -2.4072 -2.3649 -2.3649 -2.3585 -2.3585 -0.6582 -0.6582 -0.5662 -0.5662 -0.5066 -0.5066 0.1021 0.1021 0.1216 0.1216 0.6332 0.6332 0.8347 0.8347 1.2892 1.2892 1.5261 1.5261 2.2156 2.2156 2.6003 2.6003 2.6486 2.6486 2.6867 2.6867 2.9523 2.9523 3.1149 3.1149 3.2502 3.2502 3.3740 3.3740 3.4789 3.4789 3.6934 3.6934 3.7720 3.7720 3.9072 3.9072 5.2750 5.2750 5.5961 5.5961 8.4154 8.4154 9.5441 9.5441 9.6162 9.6162 9.7894 9.7894 9.8474 9.8474 k = 0.4265 0.2462 0.4443 ( 29893 PWs) bands (ev): -15.0175 -15.0175 -15.0172 -15.0172 -8.3324 -8.3324 -7.7252 -7.7252 -7.5757 -7.5757 -7.5460 -7.5460 -7.4888 -7.4888 -7.4620 -7.4620 -3.8065 -3.8065 -3.8012 -3.8012 -2.4195 -2.4195 -2.4041 -2.4041 -2.3642 -2.3642 -2.3585 -2.3585 -0.6519 -0.6519 -0.5682 -0.5682 -0.5040 -0.5040 0.0986 0.0986 0.1179 0.1179 0.6320 0.6320 0.8668 0.8668 1.2797 1.2797 1.5138 1.5138 2.2156 2.2156 2.5939 2.5939 2.6432 2.6432 2.6863 2.6863 2.9581 2.9581 3.1002 3.1002 3.2349 3.2349 3.3650 3.3650 3.4731 3.4731 3.6885 3.6885 3.7706 3.7706 3.8999 3.8999 5.2314 5.2314 5.6031 5.6031 8.4485 8.4485 9.5805 9.5805 9.6509 9.6509 9.8562 9.8562 9.9042 9.9042 k = 0.4191 0.2420 0.4683 ( 29902 PWs) bands (ev): -15.0175 -15.0175 -15.0171 -15.0171 -8.3304 -8.3304 -7.7221 -7.7221 -7.5811 -7.5811 -7.5500 -7.5500 -7.4906 -7.4906 -7.4586 -7.4586 -3.8048 -3.8048 -3.8003 -3.8003 -2.4140 -2.4140 -2.4011 -2.4011 -2.3636 -2.3636 -2.3586 -2.3586 -0.6498 -0.6498 -0.5658 -0.5658 -0.5012 -0.5012 0.0952 0.0952 0.1145 0.1145 0.6310 0.6310 0.8980 0.8980 1.2710 1.2710 1.5010 1.5010 2.2150 2.2150 2.5867 2.5867 2.6392 2.6392 2.6861 2.6861 2.9647 2.9647 3.0860 3.0860 3.2194 3.2194 3.3557 3.3557 3.4660 3.4660 3.6793 3.6793 3.7725 3.7725 3.8953 3.8953 5.1872 5.1872 5.6120 5.6120 8.4817 8.4817 9.6136 9.6136 9.6865 9.6865 9.9232 9.9232 9.9623 9.9623 k = 0.4118 0.2377 0.4923 ( 29902 PWs) bands (ev): -15.0176 -15.0176 -15.0171 -15.0171 -8.3285 -8.3285 -7.7189 -7.7189 -7.5860 -7.5860 -7.5538 -7.5538 -7.4930 -7.4930 -7.4553 -7.4553 -3.8032 -3.8032 -3.7994 -3.7994 -2.4087 -2.4087 -2.3983 -2.3983 -2.3631 -2.3631 -2.3585 -2.3585 -0.6520 -0.6520 -0.5591 -0.5591 -0.4982 -0.4982 0.0920 0.0920 0.1116 0.1116 0.6302 0.6302 0.9269 0.9269 1.2637 1.2637 1.4878 1.4878 2.2137 2.2137 2.5789 2.5789 2.6371 2.6371 2.6857 2.6857 2.9722 2.9722 3.0731 3.0731 3.2037 3.2037 3.3463 3.3463 3.4574 3.4574 3.6692 3.6692 3.7743 3.7743 3.8943 3.8943 5.1434 5.1434 5.6225 5.6225 8.5142 8.5142 9.6427 9.6427 9.7225 9.7225 9.9871 9.9871 10.0180 10.0180 k = 0.4044 0.2335 0.5163 ( 29899 PWs) bands (ev): -15.0176 -15.0176 -15.0170 -15.0170 -8.3268 -8.3268 -7.7156 -7.7156 -7.5903 -7.5903 -7.5574 -7.5574 -7.4958 -7.4958 -7.4522 -7.4522 -3.8017 -3.8017 -3.7986 -3.7986 -2.4037 -2.4037 -2.3957 -2.3957 -2.3626 -2.3626 -2.3583 -2.3583 -0.6573 -0.6573 -0.5497 -0.5497 -0.4951 -0.4951 0.0889 0.0889 0.1094 0.1094 0.6297 0.6297 0.9522 0.9522 1.2589 1.2589 1.4746 1.4746 2.2118 2.2118 2.5709 2.5709 2.6371 2.6371 2.6852 2.6852 2.9804 2.9804 3.0620 3.0620 3.1877 3.1877 3.3371 3.3371 3.4472 3.4472 3.6602 3.6602 3.7741 3.7741 3.8975 3.8975 5.1012 5.1012 5.6342 5.6342 8.5452 8.5452 9.6669 9.6669 9.7580 9.7580 10.0441 10.0441 10.0679 10.0679 k = 0.3971 0.2292 0.5403 ( 29896 PWs) bands (ev): -15.0177 -15.0177 -15.0169 -15.0169 -8.3253 -8.3253 -7.7123 -7.7123 -7.5939 -7.5939 -7.5606 -7.5606 -7.4990 -7.4990 -7.4491 -7.4491 -3.8003 -3.8003 -3.7978 -3.7978 -2.3993 -2.3993 -2.3936 -2.3936 -2.3622 -2.3622 -2.3580 -2.3580 -0.6643 -0.6643 -0.5392 -0.5392 -0.4918 -0.4918 0.0859 0.0859 0.1080 0.1080 0.6295 0.6295 0.9724 0.9724 1.2574 1.2574 1.4616 1.4616 2.2093 2.2093 2.5633 2.5633 2.6389 2.6389 2.6847 2.6847 2.9886 2.9886 3.0535 3.0535 3.1716 3.1716 3.3282 3.3282 3.4356 3.4356 3.6535 3.6535 3.7717 3.7717 3.9046 3.9046 5.0611 5.0611 5.6470 5.6470 8.5736 8.5736 9.6857 9.6857 9.7921 9.7921 10.0900 10.0900 10.1091 10.1091 k = 0.3897 0.2250 0.5643 ( 29876 PWs) bands (ev): -15.0177 -15.0177 -15.0168 -15.0168 -8.3241 -8.3241 -7.7089 -7.7089 -7.5967 -7.5967 -7.5636 -7.5636 -7.5026 -7.5026 -7.4463 -7.4463 -3.7992 -3.7992 -3.7972 -3.7972 -2.3954 -2.3954 -2.3921 -2.3921 -2.3617 -2.3617 -2.3576 -2.3576 -0.6719 -0.6719 -0.5289 -0.5289 -0.4884 -0.4884 0.0830 0.0830 0.1075 0.1075 0.6295 0.6295 0.9868 0.9868 1.2594 1.2594 1.4493 1.4493 2.2067 2.2067 2.5564 2.5564 2.6421 2.6421 2.6846 2.6846 2.9958 2.9958 3.0487 3.0487 3.1557 3.1557 3.3200 3.3200 3.4232 3.4232 3.6492 3.6492 3.7678 3.7678 3.9147 3.9147 5.0241 5.0241 5.6608 5.6608 8.5987 8.5987 9.6989 9.6989 9.8239 9.8239 10.1216 10.1216 10.1390 10.1390 k = 0.3824 0.2208 0.5884 ( 29878 PWs) bands (ev): -15.0178 -15.0178 -15.0167 -15.0167 -8.3232 -8.3232 -7.7056 -7.7056 -7.5986 -7.5986 -7.5661 -7.5661 -7.5065 -7.5065 -7.4435 -7.4435 -3.7984 -3.7984 -3.7967 -3.7967 -2.3929 -2.3929 -2.3906 -2.3906 -2.3612 -2.3612 -2.3571 -2.3571 -0.6797 -0.6797 -0.5197 -0.5197 -0.4848 -0.4848 0.0803 0.0803 0.1078 0.1078 0.6299 0.6299 0.9951 0.9951 1.2643 1.2643 1.4382 1.4382 2.2042 2.2042 2.5506 2.5506 2.6463 2.6463 2.6854 2.6854 3.0000 3.0000 3.0488 3.0488 3.1405 3.1405 3.3128 3.3128 3.4106 3.4106 3.6472 3.6472 3.7635 3.7635 3.9270 3.9270 4.9908 4.9908 5.6753 5.6753 8.6193 8.6193 9.7063 9.7063 9.8530 9.8530 10.1373 10.1373 10.1526 10.1526 k = 0.3750 0.2165 0.6124 ( 29864 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5997 -7.5997 -7.5682 -7.5682 -7.5107 -7.5107 -7.4410 -7.4410 -3.7979 -3.7979 -3.7962 -3.7962 -2.3926 -2.3926 -2.3885 -2.3885 -2.3608 -2.3608 -2.3566 -2.3566 -0.6873 -0.6873 -0.5121 -0.5121 -0.4812 -0.4812 0.0781 0.0781 0.1088 0.1088 0.6304 0.6304 0.9981 0.9981 1.2705 1.2705 1.4292 1.4292 2.2024 2.2024 2.5460 2.5460 2.6505 2.6505 2.6881 2.6881 3.0003 3.0003 3.0540 3.0540 3.1269 3.1269 3.3070 3.3070 3.3988 3.3988 3.6467 3.6467 3.7600 3.7600 3.9405 3.9405 4.9615 4.9615 5.6905 5.6905 8.6346 8.6346 9.7078 9.7078 9.8788 9.8788 10.1341 10.1341 10.1407 10.1407 k = 0.6250-0.0722 0.4082 ( 29864 PWs) bands (ev): -15.0179 -15.0179 -15.0166 -15.0166 -8.3227 -8.3227 -7.7022 -7.7022 -7.5997 -7.5997 -7.5682 -7.5682 -7.5107 -7.5107 -7.4410 -7.4410 -3.7979 -3.7979 -3.7962 -3.7962 -2.3926 -2.3926 -2.3885 -2.3885 -2.3608 -2.3608 -2.3566 -2.3566 -0.6873 -0.6873 -0.5121 -0.5121 -0.4812 -0.4812 0.0781 0.0781 0.1088 0.1088 0.6304 0.6304 0.9981 0.9981 1.2705 1.2705 1.4292 1.4292 2.2024 2.2024 2.5460 2.5460 2.6505 2.6505 2.6881 2.6881 3.0003 3.0003 3.0540 3.0540 3.1269 3.1269 3.3070 3.3070 3.3988 3.3988 3.6467 3.6467 3.7600 3.7600 3.9405 3.9405 4.9615 4.9615 5.6905 5.6905 8.6346 8.6346 9.7078 9.7078 9.8788 9.8788 10.1341 10.1341 10.1407 10.1407 k = 0.6125-0.0938 0.4082 ( 29862 PWs) bands (ev): -15.0181 -15.0181 -15.0164 -15.0164 -8.3225 -8.3225 -7.6960 -7.6960 -7.6009 -7.6009 -7.5711 -7.5711 -7.5183 -7.5183 -7.4369 -7.4369 -3.7976 -3.7976 -3.7956 -3.7956 -2.3935 -2.3935 -2.3852 -2.3852 -2.3602 -2.3602 -2.3559 -2.3559 -0.6997 -0.6997 -0.5017 -0.5017 -0.4750 -0.4750 0.0747 0.0747 0.1115 0.1115 0.6317 0.6317 0.9980 0.9980 1.2801 1.2801 1.4172 1.4172 2.2004 2.2004 2.5397 2.5397 2.6579 2.6579 2.6954 2.6954 2.9976 2.9976 3.0661 3.0661 3.1068 3.1068 3.2980 3.2980 3.3800 3.3800 3.6488 3.6488 3.7556 3.7556 3.9642 3.9642 4.9161 4.9161 5.7169 5.7169 8.6533 8.6533 9.7052 9.7052 9.9179 9.9179 10.0738 10.0738 10.1262 10.1262 k = 0.6000-0.1155 0.4082 ( 29864 PWs) bands (ev): -15.0182 -15.0182 -15.0163 -15.0163 -8.3225 -8.3225 -7.6889 -7.6889 -7.6024 -7.6024 -7.5734 -7.5734 -7.5262 -7.5262 -7.4331 -7.4331 -3.7974 -3.7974 -3.7949 -3.7949 -2.3946 -2.3946 -2.3825 -2.3825 -2.3596 -2.3596 -2.3552 -2.3552 -0.7114 -0.7114 -0.4924 -0.4924 -0.4689 -0.4689 0.0717 0.0717 0.1145 0.1145 0.6331 0.6331 0.9957 0.9957 1.2878 1.2878 1.4082 1.4082 2.1989 2.1989 2.5341 2.5341 2.6665 2.6665 2.7037 2.7037 2.9930 2.9930 3.0780 3.0780 3.0899 3.0899 3.2882 3.2882 3.3616 3.3616 3.6549 3.6549 3.7517 3.7517 3.9869 3.9869 4.8724 4.8724 5.7435 5.7435 8.6683 8.6683 9.7016 9.7016 9.9510 9.9510 10.0090 10.0090 10.1160 10.1160 k = 0.5875-0.1371 0.4082 ( 29886 PWs) bands (ev): -15.0184 -15.0184 -15.0161 -15.0161 -8.3227 -8.3227 -7.6811 -7.6811 -7.6039 -7.6039 -7.5752 -7.5752 -7.5345 -7.5345 -7.4297 -7.4297 -3.7974 -3.7974 -3.7944 -3.7944 -2.3957 -2.3957 -2.3807 -2.3807 -2.3589 -2.3589 -2.3545 -2.3545 -0.7222 -0.7222 -0.4845 -0.4845 -0.4631 -0.4631 0.0691 0.0691 0.1176 0.1176 0.6347 0.6347 0.9914 0.9914 1.2931 1.2931 1.4027 1.4027 2.1977 2.1977 2.5291 2.5291 2.6759 2.6759 2.7128 2.7128 2.9850 2.9850 3.0756 3.0756 3.0914 3.0914 3.2780 3.2780 3.3440 3.3440 3.6645 3.6645 3.7485 3.7485 4.0078 4.0078 4.8311 4.8311 5.7695 5.7695 8.6801 8.6801 9.6976 9.6976 9.9306 9.9306 9.9966 9.9966 10.1075 10.1075 k = 0.5750-0.1588 0.4082 ( 29882 PWs) bands (ev): -15.0185 -15.0185 -15.0160 -15.0160 -8.3231 -8.3231 -7.6726 -7.6726 -7.6055 -7.6055 -7.5765 -7.5765 -7.5430 -7.5430 -7.4268 -7.4268 -3.7974 -3.7974 -3.7940 -3.7940 -2.3968 -2.3968 -2.3794 -2.3794 -2.3583 -2.3583 -2.3537 -2.3537 -0.7320 -0.7320 -0.4778 -0.4778 -0.4577 -0.4577 0.0671 0.0671 0.1207 0.1207 0.6363 0.6363 0.9855 0.9855 1.2962 1.2962 1.4006 1.4006 2.1968 2.1968 2.5248 2.5248 2.6855 2.6855 2.7227 2.7227 2.9731 2.9731 3.0680 3.0680 3.1026 3.1026 3.2677 3.2677 3.3276 3.3276 3.6767 3.6767 3.7461 3.7461 4.0264 4.0264 4.7927 4.7927 5.7941 5.7941 8.6890 8.6890 9.6931 9.6931 9.8730 9.8730 10.0229 10.0229 10.1006 10.1006 k = 0.5625-0.1804 0.4082 ( 29872 PWs) bands (ev): -15.0186 -15.0186 -15.0159 -15.0159 -8.3235 -8.3235 -7.6637 -7.6637 -7.6071 -7.6071 -7.5776 -7.5776 -7.5518 -7.5518 -7.4242 -7.4242 -3.7974 -3.7974 -3.7937 -3.7937 -2.3978 -2.3978 -2.3787 -2.3787 -2.3578 -2.3578 -2.3528 -2.3528 -0.7406 -0.7406 -0.4723 -0.4723 -0.4529 -0.4529 0.0656 0.0656 0.1236 0.1236 0.6379 0.6379 0.9788 0.9788 1.2975 1.2975 1.4011 1.4011 2.1960 2.1960 2.5212 2.5212 2.6948 2.6948 2.7331 2.7331 2.9579 2.9579 3.0646 3.0646 3.1129 3.1129 3.2583 3.2583 3.3124 3.3124 3.6902 3.6902 3.7444 3.7444 4.0421 4.0421 4.7582 4.7582 5.8166 5.8166 8.6955 8.6955 9.6884 9.6884 9.8209 9.8209 10.0457 10.0457 10.0950 10.0950 k = 0.5500-0.2021 0.4082 ( 29894 PWs) bands (ev): -15.0187 -15.0187 -15.0158 -15.0158 -8.3239 -8.3239 -7.6546 -7.6546 -7.6087 -7.6087 -7.5784 -7.5784 -7.5604 -7.5604 -7.4221 -7.4221 -3.7974 -3.7974 -3.7935 -3.7935 -2.3987 -2.3987 -2.3783 -2.3783 -2.3574 -2.3574 -2.3519 -2.3519 -0.7479 -0.7479 -0.4679 -0.4679 -0.4487 -0.4487 0.0645 0.0645 0.1261 0.1261 0.6394 0.6394 0.9719 0.9719 1.2978 1.2978 1.4031 1.4031 2.1954 2.1954 2.5183 2.5183 2.7033 2.7033 2.7440 2.7440 2.9414 2.9414 3.0639 3.0639 3.1216 3.1216 3.2508 3.2508 3.2984 3.2984 3.7038 3.7038 3.7434 3.7434 4.0547 4.0547 4.7283 4.7283 5.8363 5.8363 8.7000 8.7000 9.6831 9.6831 9.7778 9.7778 10.0600 10.0600 10.0906 10.0906 k = 0.5375-0.2237 0.4082 ( 29894 PWs) bands (ev): -15.0188 -15.0188 -15.0158 -15.0158 -8.3243 -8.3243 -7.6455 -7.6455 -7.6101 -7.6101 -7.5793 -7.5793 -7.5686 -7.5686 -7.4204 -7.4204 -3.7975 -3.7975 -3.7934 -3.7934 -2.3995 -2.3995 -2.3782 -2.3782 -2.3571 -2.3571 -2.3511 -2.3511 -0.7537 -0.7537 -0.4645 -0.4645 -0.4454 -0.4454 0.0638 0.0638 0.1282 0.1282 0.6407 0.6407 0.9656 0.9656 1.2975 1.2975 1.4057 1.4057 2.1949 2.1949 2.5161 2.5161 2.7103 2.7103 2.7548 2.7548 2.9252 2.9252 3.0646 3.0646 3.1282 3.1282 3.2463 3.2463 3.2856 3.2856 3.7160 3.7160 3.7433 3.7433 4.0642 4.0642 4.7038 4.7038 5.8525 5.8525 8.7030 8.7030 9.6770 9.6770 9.7454 9.7454 10.0616 10.0616 10.0875 10.0875 k = 0.5250-0.2454 0.4082 ( 29898 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3246 -8.3246 -7.6368 -7.6368 -7.6117 -7.6117 -7.5812 -7.5812 -7.5747 -7.5747 -7.4192 -7.4192 -3.7975 -3.7975 -3.7933 -3.7933 -2.4000 -2.4000 -2.3782 -2.3782 -2.3568 -2.3568 -2.3504 -2.3504 -0.7578 -0.7578 -0.4622 -0.4622 -0.4429 -0.4429 0.0634 0.0634 0.1298 0.1298 0.6417 0.6417 0.9605 0.9605 1.2972 1.2972 1.4081 1.4081 2.1945 2.1945 2.5145 2.5145 2.7156 2.7156 2.7645 2.7645 2.9113 2.9113 3.0657 3.0657 3.1325 3.1325 3.2453 3.2453 3.2741 3.2741 3.7249 3.7249 3.7443 3.7443 4.0707 4.0707 4.6857 4.6857 5.8645 5.8645 8.7049 8.7049 9.6699 9.6699 9.7245 9.7245 10.0554 10.0554 10.0854 10.0854 k = 0.5125-0.2670 0.4082 ( 29896 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3248 -8.3248 -7.6296 -7.6296 -7.6135 -7.6135 -7.5850 -7.5850 -7.5770 -7.5770 -7.4185 -7.4185 -3.7975 -3.7975 -3.7933 -3.7933 -2.4004 -2.4004 -2.3783 -2.3783 -2.3567 -2.3567 -2.3500 -2.3500 -0.7604 -0.7604 -0.4608 -0.4608 -0.4414 -0.4414 0.0631 0.0631 0.1307 0.1307 0.6423 0.6423 0.9573 0.9573 1.2969 1.2969 1.4097 1.4097 2.1943 2.1943 2.5136 2.5136 2.7188 2.7188 2.7716 2.7716 2.9015 2.9015 3.0666 3.0666 3.1349 3.1349 3.2476 3.2476 3.2644 3.2644 3.7296 3.7296 3.7462 3.7462 4.0745 4.0745 4.6745 4.6745 5.8719 5.8719 8.7058 8.7058 9.6636 9.6636 9.7138 9.7138 10.0499 10.0499 10.0841 10.0841 k = 0.5000-0.2887 0.4082 ( 29962 PWs) bands (ev): -15.0188 -15.0188 -15.0157 -15.0157 -8.3248 -8.3248 -7.6262 -7.6262 -7.6147 -7.6147 -7.5870 -7.5870 -7.5774 -7.5774 -7.4182 -7.4182 -3.7975 -3.7975 -3.7933 -3.7933 -2.4005 -2.4005 -2.3783 -2.3783 -2.3567 -2.3567 -2.3499 -2.3499 -0.7612 -0.7612 -0.4604 -0.4604 -0.4409 -0.4409 0.0631 0.0631 0.1310 0.1310 0.6425 0.6425 0.9562 0.9562 1.2968 1.2968 1.4103 1.4103 2.1942 2.1942 2.5133 2.5133 2.7199 2.7199 2.7743 2.7743 2.8979 2.8979 3.0670 3.0670 3.1356 3.1356 3.2505 3.2505 3.2590 3.2590 3.7310 3.7310 3.7471 3.7471 4.0758 4.0758 4.6708 4.6708 5.8744 5.8744 8.7062 8.7062 9.6610 9.6610 9.7106 9.7106 10.0479 10.0479 10.0837 10.0837 Writing output data file Cs2PtI6.save init_run : 1.13s CPU 1.35s WALL ( 1 calls) electrons : 1085.40s CPU 1097.39s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.09s CPU 0.14s WALL ( 1 calls) Called by electrons: c_bands : 1085.40s CPU 1097.38s 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 0.02s WALL ( 1 calls) newd : 0.32s CPU 0.43s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.28s CPU 0.33s WALL ( 190 calls) cegterg : 1027.81s CPU 1038.87s WALL ( 567 calls) Called by sum_band: Called by *egterg: h_psi : 711.62s CPU 717.57s WALL ( 9802 calls) s_psi : 34.16s CPU 33.94s WALL ( 9802 calls) g_psi : 1.21s CPU 1.19s WALL ( 9045 calls) cdiaghg : 205.22s CPU 205.83s WALL ( 9235 calls) cegterg:over : 44.10s CPU 44.20s WALL ( 9045 calls) cegterg:upda : 42.38s CPU 42.32s WALL ( 9045 calls) cegterg:last : 19.86s CPU 19.86s WALL ( 1137 calls) cdiaghg:chol : 8.12s CPU 8.20s WALL ( 9235 calls) cdiaghg:inve : 6.08s CPU 6.00s WALL ( 9235 calls) cdiaghg:para : 11.68s CPU 12.11s WALL ( 18470 calls) Called by h_psi: h_psi:vloc : 620.66s CPU 625.86s WALL ( 9802 calls) h_psi:vnl : 89.51s CPU 90.28s WALL ( 9802 calls) add_vuspsi : 46.85s CPU 47.47s WALL ( 9802 calls) General routines calbec : 42.55s CPU 42.77s WALL ( 9802 calls) fft : 0.02s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 591.31s CPU 596.44s WALL ( 1134840 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.18s CPU 0.37s WALL ( 380 calls) Parallel routines fft_scatter : 264.70s CPU 266.99s WALL ( 1134863 calls) PWSCF : 19m26.68s CPU 20m 0.46s WALL This run was terminated on: 14:33: 3 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=