Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 14:39:37 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./LiInAg2.save/ file In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 61 61 16 1874 1874 271 Max 62 62 17 1878 1878 277 Sum 2197 2197 595 67529 67529 9841 bravais-lattice index = 14 lattice parameter (alat) = 8.7785 a.u. unit-cell volume = 478.3583 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 38.00 number of Kohn-Sham states= 46 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 412.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.778550 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 In read from file: /users/gautes/Pseudo/In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 52ff8a85f9af3f41268f91f861ab85bf Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1241 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 Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ag read from file: /users/gautes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential In 13.00 114.81800 In( 1.00) Li 3.00 6.94100 Li( 1.00) Ag 11.00 107.86820 Ag( 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= 320 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0104167 -0.0060141 0.0085052), wk = 0.0031250 k( 3) = ( 0.0208333 -0.0120281 0.0170103), wk = 0.0031250 k( 4) = ( 0.0312500 -0.0180422 0.0255155), wk = 0.0031250 k( 5) = ( 0.0416667 -0.0240563 0.0340207), wk = 0.0031250 k( 6) = ( 0.0520833 -0.0300703 0.0425259), wk = 0.0031250 k( 7) = ( 0.0625000 -0.0360844 0.0510310), wk = 0.0031250 k( 8) = ( 0.0729167 -0.0420985 0.0595362), wk = 0.0031250 k( 9) = ( 0.0833333 -0.0481125 0.0680414), wk = 0.0031250 k( 10) = ( 0.0937500 -0.0541266 0.0765466), wk = 0.0031250 k( 11) = ( 0.1041667 -0.0601407 0.0850517), wk = 0.0031250 k( 12) = ( 0.1145833 -0.0661547 0.0935569), wk = 0.0031250 k( 13) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0031250 k( 14) = ( 0.1354167 -0.0781829 0.1105672), wk = 0.0031250 k( 15) = ( 0.1458333 -0.0841969 0.1190724), wk = 0.0031250 k( 16) = ( 0.1562500 -0.0902110 0.1275776), wk = 0.0031250 k( 17) = ( 0.1666667 -0.0962250 0.1360828), wk = 0.0031250 k( 18) = ( 0.1770833 -0.1022391 0.1445879), wk = 0.0031250 k( 19) = ( 0.1875000 -0.1082532 0.1530931), wk = 0.0031250 k( 20) = ( 0.1979167 -0.1142672 0.1615983), wk = 0.0031250 k( 21) = ( 0.2083333 -0.1202813 0.1701035), wk = 0.0031250 k( 22) = ( 0.2187500 -0.1262954 0.1786086), wk = 0.0031250 k( 23) = ( 0.2291667 -0.1323094 0.1871138), wk = 0.0031250 k( 24) = ( 0.2395833 -0.1383235 0.1956190), wk = 0.0031250 k( 25) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0031250 k( 26) = ( 0.2604167 -0.1503516 0.2126293), wk = 0.0031250 k( 27) = ( 0.2708333 -0.1563657 0.2211345), wk = 0.0031250 k( 28) = ( 0.2812500 -0.1623798 0.2296397), wk = 0.0031250 k( 29) = ( 0.2916667 -0.1683938 0.2381448), wk = 0.0031250 k( 30) = ( 0.3020833 -0.1744079 0.2466500), wk = 0.0031250 k( 31) = ( 0.3125000 -0.1804220 0.2551552), wk = 0.0031250 k( 32) = ( 0.3229167 -0.1864360 0.2636604), wk = 0.0031250 k( 33) = ( 0.3333333 -0.1924501 0.2721655), wk = 0.0031250 k( 34) = ( 0.3437500 -0.1984642 0.2806707), wk = 0.0031250 k( 35) = ( 0.3541667 -0.2044782 0.2891759), wk = 0.0031250 k( 36) = ( 0.3645833 -0.2104923 0.2976810), wk = 0.0031250 k( 37) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0031250 k( 38) = ( 0.3854167 -0.2225204 0.3146914), wk = 0.0031250 k( 39) = ( 0.3958333 -0.2285345 0.3231966), wk = 0.0031250 k( 40) = ( 0.4062500 -0.2345485 0.3317017), wk = 0.0031250 k( 41) = ( 0.4166667 -0.2405626 0.3402069), wk = 0.0031250 k( 42) = ( 0.4270833 -0.2465767 0.3487121), wk = 0.0031250 k( 43) = ( 0.4375000 -0.2525907 0.3572173), wk = 0.0031250 k( 44) = ( 0.4479167 -0.2586048 0.3657224), wk = 0.0031250 k( 45) = ( 0.4583333 -0.2646189 0.3742276), wk = 0.0031250 k( 46) = ( 0.4687500 -0.2706329 0.3827328), wk = 0.0031250 k( 47) = ( 0.4791667 -0.2766470 0.3912379), wk = 0.0031250 k( 48) = ( 0.4895833 -0.2826611 0.3997431), wk = 0.0031250 k( 49) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0031250 k( 50) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0031250 k( 51) = ( 0.5000000 -0.2766470 0.4167535), wk = 0.0031250 k( 52) = ( 0.5000000 -0.2646189 0.4252586), wk = 0.0031250 k( 53) = ( 0.5000000 -0.2525907 0.4337638), wk = 0.0031250 k( 54) = ( 0.5000000 -0.2405626 0.4422690), wk = 0.0031250 k( 55) = ( 0.5000000 -0.2285345 0.4507742), wk = 0.0031250 k( 56) = ( 0.5000000 -0.2165064 0.4592793), wk = 0.0031250 k( 57) = ( 0.5000000 -0.2044782 0.4677845), wk = 0.0031250 k( 58) = ( 0.5000000 -0.1924501 0.4762897), wk = 0.0031250 k( 59) = ( 0.5000000 -0.1804220 0.4847948), wk = 0.0031250 k( 60) = ( 0.5000000 -0.1683938 0.4933000), wk = 0.0031250 k( 61) = ( 0.5000000 -0.1563657 0.5018052), wk = 0.0031250 k( 62) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0031250 k( 63) = ( 0.5000000 -0.1323094 0.5188155), wk = 0.0031250 k( 64) = ( 0.5000000 -0.1202813 0.5273207), wk = 0.0031250 k( 65) = ( 0.5000000 -0.1082532 0.5358259), wk = 0.0031250 k( 66) = ( 0.5000000 -0.0962250 0.5443311), wk = 0.0031250 k( 67) = ( 0.5000000 -0.0841969 0.5528362), wk = 0.0031250 k( 68) = ( 0.5000000 -0.0721688 0.5613414), wk = 0.0031250 k( 69) = ( 0.5000000 -0.0601406 0.5698466), wk = 0.0031250 k( 70) = ( 0.5000000 -0.0481125 0.5783517), wk = 0.0031250 k( 71) = ( 0.5000000 -0.0360844 0.5868569), wk = 0.0031250 k( 72) = ( 0.5000000 -0.0240563 0.5953621), wk = 0.0031250 k( 73) = ( 0.5000000 -0.0120281 0.6038673), wk = 0.0031250 k( 74) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031250 k( 75) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031250 k( 76) = ( 0.4926471 0.0127357 0.6123724), wk = 0.0031250 k( 77) = ( 0.4852941 0.0254713 0.6123724), wk = 0.0031250 k( 78) = ( 0.4779412 0.0382070 0.6123724), wk = 0.0031250 k( 79) = ( 0.4705882 0.0509427 0.6123724), wk = 0.0031250 k( 80) = ( 0.4632353 0.0636783 0.6123724), wk = 0.0031250 k( 81) = ( 0.4558823 0.0764140 0.6123724), wk = 0.0031250 k( 82) = ( 0.4485294 0.0891497 0.6123724), wk = 0.0031250 k( 83) = ( 0.4411765 0.1018853 0.6123724), wk = 0.0031250 k( 84) = ( 0.4338235 0.1146210 0.6123724), wk = 0.0031250 k( 85) = ( 0.4264706 0.1273567 0.6123724), wk = 0.0031250 k( 86) = ( 0.4191177 0.1400923 0.6123724), wk = 0.0031250 k( 87) = ( 0.4117647 0.1528280 0.6123724), wk = 0.0031250 k( 88) = ( 0.4044118 0.1655637 0.6123724), wk = 0.0031250 k( 89) = ( 0.3970588 0.1782994 0.6123724), wk = 0.0031250 k( 90) = ( 0.3897059 0.1910350 0.6123724), wk = 0.0031250 k( 91) = ( 0.3823529 0.2037707 0.6123724), wk = 0.0031250 k( 92) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0031250 k( 93) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0031250 k( 94) = ( 0.3676471 0.2122611 0.6003651), wk = 0.0031250 k( 95) = ( 0.3602941 0.2080159 0.5883578), wk = 0.0031250 k( 96) = ( 0.3529412 0.2037707 0.5763505), wk = 0.0031250 k( 97) = ( 0.3455882 0.1995255 0.5643432), wk = 0.0031250 k( 98) = ( 0.3382353 0.1952802 0.5523359), wk = 0.0031250 k( 99) = ( 0.3308823 0.1910350 0.5403286), wk = 0.0031250 k( 100) = ( 0.3235294 0.1867898 0.5283213), wk = 0.0031250 k( 101) = ( 0.3161765 0.1825446 0.5163140), wk = 0.0031250 k( 102) = ( 0.3088235 0.1782993 0.5043067), wk = 0.0031250 k( 103) = ( 0.3014706 0.1740541 0.4922994), wk = 0.0031250 k( 104) = ( 0.2941177 0.1698089 0.4802921), wk = 0.0031250 k( 105) = ( 0.2867647 0.1655637 0.4682848), wk = 0.0031250 k( 106) = ( 0.2794118 0.1613185 0.4562775), wk = 0.0031250 k( 107) = ( 0.2720588 0.1570732 0.4442702), wk = 0.0031250 k( 108) = ( 0.2647059 0.1528280 0.4322629), wk = 0.0031250 k( 109) = ( 0.2573529 0.1485828 0.4202556), wk = 0.0031250 k( 110) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0031250 k( 111) = ( 0.2426471 0.1400923 0.3962410), wk = 0.0031250 k( 112) = ( 0.2352941 0.1358471 0.3842337), wk = 0.0031250 k( 113) = ( 0.2279412 0.1316019 0.3722264), wk = 0.0031250 k( 114) = ( 0.2205882 0.1273567 0.3602191), wk = 0.0031250 k( 115) = ( 0.2132353 0.1231115 0.3482118), wk = 0.0031250 k( 116) = ( 0.2058823 0.1188662 0.3362045), wk = 0.0031250 k( 117) = ( 0.1985294 0.1146210 0.3241972), wk = 0.0031250 k( 118) = ( 0.1911765 0.1103758 0.3121899), wk = 0.0031250 k( 119) = ( 0.1838235 0.1061306 0.3001826), wk = 0.0031250 k( 120) = ( 0.1764706 0.1018853 0.2881753), wk = 0.0031250 k( 121) = ( 0.1691177 0.0976401 0.2761680), wk = 0.0031250 k( 122) = ( 0.1617647 0.0933949 0.2641607), wk = 0.0031250 k( 123) = ( 0.1544118 0.0891497 0.2521534), wk = 0.0031250 k( 124) = ( 0.1470588 0.0849044 0.2401461), wk = 0.0031250 k( 125) = ( 0.1397059 0.0806592 0.2281387), wk = 0.0031250 k( 126) = ( 0.1323529 0.0764140 0.2161314), wk = 0.0031250 k( 127) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0031250 k( 128) = ( 0.1176471 0.0679236 0.1921168), wk = 0.0031250 k( 129) = ( 0.1102941 0.0636783 0.1801095), wk = 0.0031250 k( 130) = ( 0.1029412 0.0594331 0.1681022), wk = 0.0031250 k( 131) = ( 0.0955882 0.0551879 0.1560949), wk = 0.0031250 k( 132) = ( 0.0882353 0.0509427 0.1440876), wk = 0.0031250 k( 133) = ( 0.0808824 0.0466974 0.1320803), wk = 0.0031250 k( 134) = ( 0.0735294 0.0424522 0.1200730), wk = 0.0031250 k( 135) = ( 0.0661765 0.0382070 0.1080657), wk = 0.0031250 k( 136) = ( 0.0588235 0.0339618 0.0960584), wk = 0.0031250 k( 137) = ( 0.0514706 0.0297166 0.0840511), wk = 0.0031250 k( 138) = ( 0.0441177 0.0254713 0.0720438), wk = 0.0031250 k( 139) = ( 0.0367647 0.0212261 0.0600365), wk = 0.0031250 k( 140) = ( 0.0294118 0.0169809 0.0480292), wk = 0.0031250 k( 141) = ( 0.0220588 0.0127357 0.0360219), wk = 0.0031250 k( 142) = ( 0.0147059 0.0084904 0.0240146), wk = 0.0031250 k( 143) = ( 0.0073529 0.0042452 0.0120073), wk = 0.0031250 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 145) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 146) = ( 0.0119048 0.0068732 0.0048601), wk = 0.0031250 k( 147) = ( 0.0238095 0.0137464 0.0097202), wk = 0.0031250 k( 148) = ( 0.0357143 0.0206197 0.0145803), wk = 0.0031250 k( 149) = ( 0.0476191 0.0274929 0.0194404), wk = 0.0031250 k( 150) = ( 0.0595238 0.0343661 0.0243005), wk = 0.0031250 k( 151) = ( 0.0714286 0.0412393 0.0291606), wk = 0.0031250 k( 152) = ( 0.0833333 0.0481125 0.0340207), wk = 0.0031250 k( 153) = ( 0.0952381 0.0549857 0.0388808), wk = 0.0031250 k( 154) = ( 0.1071429 0.0618590 0.0437409), wk = 0.0031250 k( 155) = ( 0.1190476 0.0687322 0.0486010), wk = 0.0031250 k( 156) = ( 0.1309524 0.0756054 0.0534611), wk = 0.0031250 k( 157) = ( 0.1428571 0.0824786 0.0583212), wk = 0.0031250 k( 158) = ( 0.1547619 0.0893518 0.0631813), wk = 0.0031250 k( 159) = ( 0.1666667 0.0962250 0.0680414), wk = 0.0031250 k( 160) = ( 0.1785714 0.1030983 0.0729015), wk = 0.0031250 k( 161) = ( 0.1904762 0.1099715 0.0777616), wk = 0.0031250 k( 162) = ( 0.2023810 0.1168447 0.0826217), wk = 0.0031250 k( 163) = ( 0.2142857 0.1237179 0.0874818), wk = 0.0031250 k( 164) = ( 0.2261905 0.1305911 0.0923419), wk = 0.0031250 k( 165) = ( 0.2380952 0.1374644 0.0972020), wk = 0.0031250 k( 166) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0031250 k( 167) = ( 0.2619048 0.1512108 0.1069222), wk = 0.0031250 k( 168) = ( 0.2738095 0.1580840 0.1117823), wk = 0.0031250 k( 169) = ( 0.2857143 0.1649572 0.1166424), wk = 0.0031250 k( 170) = ( 0.2976190 0.1718304 0.1215025), wk = 0.0031250 k( 171) = ( 0.3095238 0.1787037 0.1263626), wk = 0.0031250 k( 172) = ( 0.3214286 0.1855769 0.1312227), wk = 0.0031250 k( 173) = ( 0.3333333 0.1924501 0.1360828), wk = 0.0031250 k( 174) = ( 0.3452381 0.1993233 0.1409429), wk = 0.0031250 k( 175) = ( 0.3571429 0.2061965 0.1458030), wk = 0.0031250 k( 176) = ( 0.3690476 0.2130697 0.1506631), wk = 0.0031250 k( 177) = ( 0.3809524 0.2199430 0.1555232), wk = 0.0031250 k( 178) = ( 0.3928571 0.2268162 0.1603833), wk = 0.0031250 k( 179) = ( 0.4047619 0.2336894 0.1652434), wk = 0.0031250 k( 180) = ( 0.4166667 0.2405626 0.1701035), wk = 0.0031250 k( 181) = ( 0.4285714 0.2474358 0.1749636), wk = 0.0031250 k( 182) = ( 0.4404762 0.2543090 0.1798237), wk = 0.0031250 k( 183) = ( 0.4523810 0.2611823 0.1846837), wk = 0.0031250 k( 184) = ( 0.4642857 0.2680555 0.1895438), wk = 0.0031250 k( 185) = ( 0.4761905 0.2749287 0.1944039), wk = 0.0031250 k( 186) = ( 0.4880952 0.2818019 0.1992640), wk = 0.0031250 k( 187) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031250 k( 188) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031250 k( 189) = ( 0.5041667 0.2766470 0.2109283), wk = 0.0031250 k( 190) = ( 0.5083333 0.2646189 0.2177324), wk = 0.0031250 k( 191) = ( 0.5125000 0.2525907 0.2245366), wk = 0.0031250 k( 192) = ( 0.5166667 0.2405626 0.2313407), wk = 0.0031250 k( 193) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0031250 k( 194) = ( 0.5250000 0.2165064 0.2449490), wk = 0.0031250 k( 195) = ( 0.5291667 0.2044782 0.2517531), wk = 0.0031250 k( 196) = ( 0.5333333 0.1924501 0.2585572), wk = 0.0031250 k( 197) = ( 0.5375000 0.1804220 0.2653614), wk = 0.0031250 k( 198) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0031250 k( 199) = ( 0.5458333 0.1563657 0.2789697), wk = 0.0031250 k( 200) = ( 0.5500000 0.1443376 0.2857738), wk = 0.0031250 k( 201) = ( 0.5541667 0.1323094 0.2925779), wk = 0.0031250 k( 202) = ( 0.5583333 0.1202813 0.2993821), wk = 0.0031250 k( 203) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0031250 k( 204) = ( 0.5666667 0.0962250 0.3129904), wk = 0.0031250 k( 205) = ( 0.5708333 0.0841969 0.3197945), wk = 0.0031250 k( 206) = ( 0.5750000 0.0721688 0.3265986), wk = 0.0031250 k( 207) = ( 0.5791667 0.0601407 0.3334028), wk = 0.0031250 k( 208) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0031250 k( 209) = ( 0.5875000 0.0360844 0.3470110), wk = 0.0031250 k( 210) = ( 0.5916667 0.0240563 0.3538152), wk = 0.0031250 k( 211) = ( 0.5958333 0.0120281 0.3606193), wk = 0.0031250 k( 212) = ( 0.6000000 -0.0000000 0.3674235), wk = 0.0031250 k( 213) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0031250 k( 214) = ( 0.6083333 -0.0240563 0.3810317), wk = 0.0031250 k( 215) = ( 0.6125000 -0.0360844 0.3878359), wk = 0.0031250 k( 216) = ( 0.6166667 -0.0481125 0.3946400), wk = 0.0031250 k( 217) = ( 0.6208333 -0.0601407 0.4014442), wk = 0.0031250 k( 218) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0031250 k( 219) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0031250 k( 220) = ( 0.6176471 -0.0679236 0.4202556), wk = 0.0031250 k( 221) = ( 0.6102941 -0.0636783 0.4322629), wk = 0.0031250 k( 222) = ( 0.6029412 -0.0594331 0.4442702), wk = 0.0031250 k( 223) = ( 0.5955882 -0.0551879 0.4562775), wk = 0.0031250 k( 224) = ( 0.5882353 -0.0509427 0.4682848), wk = 0.0031250 k( 225) = ( 0.5808823 -0.0466974 0.4802921), wk = 0.0031250 k( 226) = ( 0.5735294 -0.0424522 0.4922994), wk = 0.0031250 k( 227) = ( 0.5661765 -0.0382070 0.5043067), wk = 0.0031250 k( 228) = ( 0.5588235 -0.0339618 0.5163140), wk = 0.0031250 k( 229) = ( 0.5514706 -0.0297166 0.5283213), wk = 0.0031250 k( 230) = ( 0.5441177 -0.0254713 0.5403286), wk = 0.0031250 k( 231) = ( 0.5367647 -0.0212261 0.5523359), wk = 0.0031250 k( 232) = ( 0.5294118 -0.0169809 0.5643432), wk = 0.0031250 k( 233) = ( 0.5220588 -0.0127357 0.5763505), wk = 0.0031250 k( 234) = ( 0.5147059 -0.0084904 0.5883578), wk = 0.0031250 k( 235) = ( 0.5073529 -0.0042452 0.6003651), wk = 0.0031250 k( 236) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031250 k( 237) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0031250 k( 238) = ( 0.5000000 0.0084904 0.6003651), wk = 0.0031250 k( 239) = ( 0.5000000 0.0169809 0.5883578), wk = 0.0031250 k( 240) = ( 0.5000000 0.0254713 0.5763505), wk = 0.0031250 k( 241) = ( 0.5000000 0.0339618 0.5643432), wk = 0.0031250 k( 242) = ( 0.5000000 0.0424522 0.5523359), wk = 0.0031250 k( 243) = ( 0.5000000 0.0509427 0.5403286), wk = 0.0031250 k( 244) = ( 0.5000000 0.0594331 0.5283213), wk = 0.0031250 k( 245) = ( 0.5000000 0.0679236 0.5163140), wk = 0.0031250 k( 246) = ( 0.5000000 0.0764140 0.5043067), wk = 0.0031250 k( 247) = ( 0.5000000 0.0849044 0.4922994), wk = 0.0031250 k( 248) = ( 0.5000000 0.0933949 0.4802921), wk = 0.0031250 k( 249) = ( 0.5000000 0.1018853 0.4682848), wk = 0.0031250 k( 250) = ( 0.5000000 0.1103758 0.4562775), wk = 0.0031250 k( 251) = ( 0.5000000 0.1188662 0.4442702), wk = 0.0031250 k( 252) = ( 0.5000000 0.1273567 0.4322629), wk = 0.0031250 k( 253) = ( 0.5000000 0.1358471 0.4202556), wk = 0.0031250 k( 254) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0031250 k( 255) = ( 0.5000000 0.1528280 0.3962410), wk = 0.0031250 k( 256) = ( 0.5000000 0.1613185 0.3842337), wk = 0.0031250 k( 257) = ( 0.5000000 0.1698089 0.3722264), wk = 0.0031250 k( 258) = ( 0.5000000 0.1782993 0.3602191), wk = 0.0031250 k( 259) = ( 0.5000000 0.1867898 0.3482118), wk = 0.0031250 k( 260) = ( 0.5000000 0.1952802 0.3362045), wk = 0.0031250 k( 261) = ( 0.5000000 0.2037707 0.3241972), wk = 0.0031250 k( 262) = ( 0.5000000 0.2122611 0.3121899), wk = 0.0031250 k( 263) = ( 0.5000000 0.2207516 0.3001826), wk = 0.0031250 k( 264) = ( 0.5000000 0.2292420 0.2881753), wk = 0.0031250 k( 265) = ( 0.5000000 0.2377325 0.2761680), wk = 0.0031250 k( 266) = ( 0.5000000 0.2462229 0.2641607), wk = 0.0031250 k( 267) = ( 0.5000000 0.2547134 0.2521533), wk = 0.0031250 k( 268) = ( 0.5000000 0.2632038 0.2401460), wk = 0.0031250 k( 269) = ( 0.5000000 0.2716942 0.2281387), wk = 0.0031250 k( 270) = ( 0.5000000 0.2801847 0.2161314), wk = 0.0031250 k( 271) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031250 k( 272) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0031250 k( 273) = ( 0.4958333 0.2862695 0.2177324), wk = 0.0031250 k( 274) = ( 0.4916667 0.2838639 0.2313407), wk = 0.0031250 k( 275) = ( 0.4875000 0.2814583 0.2449490), wk = 0.0031250 k( 276) = ( 0.4833333 0.2790526 0.2585572), wk = 0.0031250 k( 277) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0031250 k( 278) = ( 0.4750000 0.2742414 0.2857738), wk = 0.0031250 k( 279) = ( 0.4708333 0.2718357 0.2993821), wk = 0.0031250 k( 280) = ( 0.4666667 0.2694301 0.3129904), wk = 0.0031250 k( 281) = ( 0.4625000 0.2670245 0.3265986), wk = 0.0031250 k( 282) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0031250 k( 283) = ( 0.4541667 0.2622132 0.3538152), wk = 0.0031250 k( 284) = ( 0.4500000 0.2598076 0.3674235), wk = 0.0031250 k( 285) = ( 0.4458333 0.2574020 0.3810317), wk = 0.0031250 k( 286) = ( 0.4416667 0.2549964 0.3946400), wk = 0.0031250 k( 287) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0031250 k( 288) = ( 0.4333333 0.2501851 0.4218566), wk = 0.0031250 k( 289) = ( 0.4291667 0.2477795 0.4354648), wk = 0.0031250 k( 290) = ( 0.4250000 0.2453739 0.4490731), wk = 0.0031250 k( 291) = ( 0.4208333 0.2429682 0.4626814), wk = 0.0031250 k( 292) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0031250 k( 293) = ( 0.4125000 0.2381570 0.4898979), wk = 0.0031250 k( 294) = ( 0.4083333 0.2357514 0.5035062), wk = 0.0031250 k( 295) = ( 0.4041667 0.2333457 0.5171145), wk = 0.0031250 k( 296) = ( 0.4000000 0.2309401 0.5307228), wk = 0.0031250 k( 297) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0031250 k( 298) = ( 0.3916667 0.2261289 0.5579393), wk = 0.0031250 k( 299) = ( 0.3875000 0.2237232 0.5715476), wk = 0.0031250 k( 300) = ( 0.3833333 0.2213176 0.5851559), wk = 0.0031250 k( 301) = ( 0.3791667 0.2189120 0.5987642), wk = 0.0031250 k( 302) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0031250 k( 303) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0031250 k( 304) = ( 0.6176471 -0.0849044 0.4082483), wk = 0.0031250 k( 305) = ( 0.6102941 -0.0976401 0.4082483), wk = 0.0031250 k( 306) = ( 0.6029412 -0.1103758 0.4082483), wk = 0.0031250 k( 307) = ( 0.5955882 -0.1231115 0.4082483), wk = 0.0031250 k( 308) = ( 0.5882353 -0.1358471 0.4082483), wk = 0.0031250 k( 309) = ( 0.5808823 -0.1485828 0.4082483), wk = 0.0031250 k( 310) = ( 0.5735294 -0.1613185 0.4082483), wk = 0.0031250 k( 311) = ( 0.5661765 -0.1740541 0.4082483), wk = 0.0031250 k( 312) = ( 0.5588235 -0.1867898 0.4082483), wk = 0.0031250 k( 313) = ( 0.5514706 -0.1995255 0.4082483), wk = 0.0031250 k( 314) = ( 0.5441177 -0.2122611 0.4082483), wk = 0.0031250 k( 315) = ( 0.5367647 -0.2249968 0.4082483), wk = 0.0031250 k( 316) = ( 0.5294118 -0.2377325 0.4082483), wk = 0.0031250 k( 317) = ( 0.5220588 -0.2504681 0.4082483), wk = 0.0031250 k( 318) = ( 0.5147059 -0.2632038 0.4082483), wk = 0.0031250 k( 319) = ( 0.5073529 -0.2759395 0.4082483), wk = 0.0031250 k( 320) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0031250 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0104167 -0.0000000 0.0104167), wk = 0.0031250 k( 3) = ( 0.0208333 0.0000000 0.0208333), wk = 0.0031250 k( 4) = ( 0.0312500 0.0000000 0.0312500), wk = 0.0031250 k( 5) = ( 0.0416667 -0.0000000 0.0416667), wk = 0.0031250 k( 6) = ( 0.0520833 -0.0000000 0.0520833), wk = 0.0031250 k( 7) = ( 0.0625000 0.0000000 0.0625000), wk = 0.0031250 k( 8) = ( 0.0729167 0.0000000 0.0729167), wk = 0.0031250 k( 9) = ( 0.0833333 -0.0000000 0.0833333), wk = 0.0031250 k( 10) = ( 0.0937500 -0.0000000 0.0937500), wk = 0.0031250 k( 11) = ( 0.1041667 -0.0000000 0.1041667), wk = 0.0031250 k( 12) = ( 0.1145833 -0.0000000 0.1145833), wk = 0.0031250 k( 13) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0031250 k( 14) = ( 0.1354167 0.0000000 0.1354167), wk = 0.0031250 k( 15) = ( 0.1458333 0.0000000 0.1458333), wk = 0.0031250 k( 16) = ( 0.1562500 -0.0000000 0.1562500), wk = 0.0031250 k( 17) = ( 0.1666667 -0.0000000 0.1666667), wk = 0.0031250 k( 18) = ( 0.1770833 -0.0000000 0.1770833), wk = 0.0031250 k( 19) = ( 0.1875000 -0.0000000 0.1875000), wk = 0.0031250 k( 20) = ( 0.1979167 -0.0000000 0.1979167), wk = 0.0031250 k( 21) = ( 0.2083333 -0.0000000 0.2083333), wk = 0.0031250 k( 22) = ( 0.2187500 -0.0000000 0.2187500), wk = 0.0031250 k( 23) = ( 0.2291667 0.0000000 0.2291667), wk = 0.0031250 k( 24) = ( 0.2395833 -0.0000000 0.2395833), wk = 0.0031250 k( 25) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0031250 k( 26) = ( 0.2604167 0.0000000 0.2604167), wk = 0.0031250 k( 27) = ( 0.2708333 0.0000000 0.2708333), wk = 0.0031250 k( 28) = ( 0.2812500 -0.0000000 0.2812500), wk = 0.0031250 k( 29) = ( 0.2916667 -0.0000000 0.2916667), wk = 0.0031250 k( 30) = ( 0.3020833 -0.0000000 0.3020833), wk = 0.0031250 k( 31) = ( 0.3125000 -0.0000000 0.3125000), wk = 0.0031250 k( 32) = ( 0.3229167 0.0000000 0.3229167), wk = 0.0031250 k( 33) = ( 0.3333333 0.0000000 0.3333333), wk = 0.0031250 k( 34) = ( 0.3437500 0.0000000 0.3437500), wk = 0.0031250 k( 35) = ( 0.3541667 -0.0000000 0.3541667), wk = 0.0031250 k( 36) = ( 0.3645833 -0.0000000 0.3645833), wk = 0.0031250 k( 37) = ( 0.3750000 -0.0000000 0.3750000), wk = 0.0031250 k( 38) = ( 0.3854167 -0.0000000 0.3854167), wk = 0.0031250 k( 39) = ( 0.3958333 -0.0000000 0.3958333), wk = 0.0031250 k( 40) = ( 0.4062500 -0.0000000 0.4062500), wk = 0.0031250 k( 41) = ( 0.4166667 -0.0000000 0.4166667), wk = 0.0031250 k( 42) = ( 0.4270833 -0.0000000 0.4270833), wk = 0.0031250 k( 43) = ( 0.4375000 -0.0000000 0.4375000), wk = 0.0031250 k( 44) = ( 0.4479167 -0.0000000 0.4479167), wk = 0.0031250 k( 45) = ( 0.4583333 -0.0000000 0.4583333), wk = 0.0031250 k( 46) = ( 0.4687500 -0.0000000 0.4687500), wk = 0.0031250 k( 47) = ( 0.4791667 -0.0000000 0.4791667), wk = 0.0031250 k( 48) = ( 0.4895833 -0.0000000 0.4895833), wk = 0.0031250 k( 49) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031250 k( 50) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031250 k( 51) = ( 0.5000000 0.0104167 0.5104167), wk = 0.0031250 k( 52) = ( 0.5000000 0.0208333 0.5208333), wk = 0.0031250 k( 53) = ( 0.5000000 0.0312500 0.5312500), wk = 0.0031250 k( 54) = ( 0.5000000 0.0416667 0.5416667), wk = 0.0031250 k( 55) = ( 0.5000000 0.0520833 0.5520833), wk = 0.0031250 k( 56) = ( 0.5000000 0.0625000 0.5625000), wk = 0.0031250 k( 57) = ( 0.5000000 0.0729167 0.5729167), wk = 0.0031250 k( 58) = ( 0.5000000 0.0833333 0.5833333), wk = 0.0031250 k( 59) = ( 0.5000000 0.0937500 0.5937500), wk = 0.0031250 k( 60) = ( 0.5000000 0.1041667 0.6041667), wk = 0.0031250 k( 61) = ( 0.5000000 0.1145833 0.6145833), wk = 0.0031250 k( 62) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0031250 k( 63) = ( 0.5000000 0.1354167 0.6354167), wk = 0.0031250 k( 64) = ( 0.5000000 0.1458333 0.6458333), wk = 0.0031250 k( 65) = ( 0.5000000 0.1562500 0.6562500), wk = 0.0031250 k( 66) = ( 0.5000000 0.1666667 0.6666667), wk = 0.0031250 k( 67) = ( 0.5000000 0.1770833 0.6770833), wk = 0.0031250 k( 68) = ( 0.5000000 0.1875000 0.6875000), wk = 0.0031250 k( 69) = ( 0.5000000 0.1979167 0.6979167), wk = 0.0031250 k( 70) = ( 0.5000000 0.2083333 0.7083333), wk = 0.0031250 k( 71) = ( 0.5000000 0.2187500 0.7187500), wk = 0.0031250 k( 72) = ( 0.5000000 0.2291667 0.7291667), wk = 0.0031250 k( 73) = ( 0.5000000 0.2395833 0.7395833), wk = 0.0031250 k( 74) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031250 k( 75) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031250 k( 76) = ( 0.4926471 0.2573529 0.7500000), wk = 0.0031250 k( 77) = ( 0.4852941 0.2647059 0.7500000), wk = 0.0031250 k( 78) = ( 0.4779412 0.2720588 0.7500000), wk = 0.0031250 k( 79) = ( 0.4705882 0.2794118 0.7500000), wk = 0.0031250 k( 80) = ( 0.4632353 0.2867647 0.7500000), wk = 0.0031250 k( 81) = ( 0.4558823 0.2941177 0.7500000), wk = 0.0031250 k( 82) = ( 0.4485294 0.3014706 0.7500000), wk = 0.0031250 k( 83) = ( 0.4411765 0.3088235 0.7500000), wk = 0.0031250 k( 84) = ( 0.4338235 0.3161765 0.7500000), wk = 0.0031250 k( 85) = ( 0.4264706 0.3235294 0.7500000), wk = 0.0031250 k( 86) = ( 0.4191177 0.3308824 0.7500000), wk = 0.0031250 k( 87) = ( 0.4117647 0.3382353 0.7500000), wk = 0.0031250 k( 88) = ( 0.4044118 0.3455882 0.7500000), wk = 0.0031250 k( 89) = ( 0.3970588 0.3529412 0.7500000), wk = 0.0031250 k( 90) = ( 0.3897059 0.3602941 0.7500000), wk = 0.0031250 k( 91) = ( 0.3823529 0.3676471 0.7500000), wk = 0.0031250 k( 92) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0031250 k( 93) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0031250 k( 94) = ( 0.3676471 0.3676471 0.7352941), wk = 0.0031250 k( 95) = ( 0.3602941 0.3602941 0.7205882), wk = 0.0031250 k( 96) = ( 0.3529412 0.3529412 0.7058824), wk = 0.0031250 k( 97) = ( 0.3455882 0.3455882 0.6911765), wk = 0.0031250 k( 98) = ( 0.3382353 0.3382353 0.6764706), wk = 0.0031250 k( 99) = ( 0.3308823 0.3308824 0.6617647), wk = 0.0031250 k( 100) = ( 0.3235294 0.3235294 0.6470588), wk = 0.0031250 k( 101) = ( 0.3161765 0.3161765 0.6323529), wk = 0.0031250 k( 102) = ( 0.3088235 0.3088235 0.6176471), wk = 0.0031250 k( 103) = ( 0.3014706 0.3014706 0.6029412), wk = 0.0031250 k( 104) = ( 0.2941177 0.2941177 0.5882353), wk = 0.0031250 k( 105) = ( 0.2867647 0.2867647 0.5735294), wk = 0.0031250 k( 106) = ( 0.2794118 0.2794118 0.5588235), wk = 0.0031250 k( 107) = ( 0.2720588 0.2720588 0.5441177), wk = 0.0031250 k( 108) = ( 0.2647059 0.2647059 0.5294118), wk = 0.0031250 k( 109) = ( 0.2573529 0.2573529 0.5147059), wk = 0.0031250 k( 110) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0031250 k( 111) = ( 0.2426471 0.2426471 0.4852941), wk = 0.0031250 k( 112) = ( 0.2352941 0.2352941 0.4705882), wk = 0.0031250 k( 113) = ( 0.2279412 0.2279412 0.4558824), wk = 0.0031250 k( 114) = ( 0.2205882 0.2205882 0.4411765), wk = 0.0031250 k( 115) = ( 0.2132353 0.2132353 0.4264706), wk = 0.0031250 k( 116) = ( 0.2058823 0.2058823 0.4117647), wk = 0.0031250 k( 117) = ( 0.1985294 0.1985294 0.3970588), wk = 0.0031250 k( 118) = ( 0.1911765 0.1911765 0.3823529), wk = 0.0031250 k( 119) = ( 0.1838235 0.1838235 0.3676471), wk = 0.0031250 k( 120) = ( 0.1764706 0.1764706 0.3529412), wk = 0.0031250 k( 121) = ( 0.1691177 0.1691177 0.3382353), wk = 0.0031250 k( 122) = ( 0.1617647 0.1617647 0.3235294), wk = 0.0031250 k( 123) = ( 0.1544118 0.1544118 0.3088235), wk = 0.0031250 k( 124) = ( 0.1470588 0.1470588 0.2941177), wk = 0.0031250 k( 125) = ( 0.1397059 0.1397059 0.2794118), wk = 0.0031250 k( 126) = ( 0.1323529 0.1323529 0.2647059), wk = 0.0031250 k( 127) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0031250 k( 128) = ( 0.1176471 0.1176471 0.2352941), wk = 0.0031250 k( 129) = ( 0.1102941 0.1102941 0.2205882), wk = 0.0031250 k( 130) = ( 0.1029412 0.1029412 0.2058824), wk = 0.0031250 k( 131) = ( 0.0955882 0.0955882 0.1911765), wk = 0.0031250 k( 132) = ( 0.0882353 0.0882353 0.1764706), wk = 0.0031250 k( 133) = ( 0.0808824 0.0808824 0.1617647), wk = 0.0031250 k( 134) = ( 0.0735294 0.0735294 0.1470588), wk = 0.0031250 k( 135) = ( 0.0661765 0.0661765 0.1323529), wk = 0.0031250 k( 136) = ( 0.0588235 0.0588235 0.1176471), wk = 0.0031250 k( 137) = ( 0.0514706 0.0514706 0.1029412), wk = 0.0031250 k( 138) = ( 0.0441177 0.0441177 0.0882353), wk = 0.0031250 k( 139) = ( 0.0367647 0.0367647 0.0735294), wk = 0.0031250 k( 140) = ( 0.0294118 0.0294118 0.0588235), wk = 0.0031250 k( 141) = ( 0.0220588 0.0220588 0.0441177), wk = 0.0031250 k( 142) = ( 0.0147059 0.0147059 0.0294118), wk = 0.0031250 k( 143) = ( 0.0073529 0.0073529 0.0147059), wk = 0.0031250 k( 144) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 145) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 146) = ( 0.0119048 0.0119048 0.0119048), wk = 0.0031250 k( 147) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0031250 k( 148) = ( 0.0357143 0.0357143 0.0357143), wk = 0.0031250 k( 149) = ( 0.0476191 0.0476191 0.0476191), wk = 0.0031250 k( 150) = ( 0.0595238 0.0595238 0.0595238), wk = 0.0031250 k( 151) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0031250 k( 152) = ( 0.0833333 0.0833333 0.0833333), wk = 0.0031250 k( 153) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0031250 k( 154) = ( 0.1071429 0.1071429 0.1071429), wk = 0.0031250 k( 155) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0031250 k( 156) = ( 0.1309524 0.1309524 0.1309524), wk = 0.0031250 k( 157) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0031250 k( 158) = ( 0.1547619 0.1547619 0.1547619), wk = 0.0031250 k( 159) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0031250 k( 160) = ( 0.1785714 0.1785714 0.1785714), wk = 0.0031250 k( 161) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0031250 k( 162) = ( 0.2023810 0.2023810 0.2023810), wk = 0.0031250 k( 163) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0031250 k( 164) = ( 0.2261905 0.2261905 0.2261905), wk = 0.0031250 k( 165) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0031250 k( 166) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0031250 k( 167) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0031250 k( 168) = ( 0.2738095 0.2738095 0.2738095), wk = 0.0031250 k( 169) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0031250 k( 170) = ( 0.2976190 0.2976190 0.2976191), wk = 0.0031250 k( 171) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0031250 k( 172) = ( 0.3214286 0.3214286 0.3214286), wk = 0.0031250 k( 173) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0031250 k( 174) = ( 0.3452381 0.3452381 0.3452381), wk = 0.0031250 k( 175) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0031250 k( 176) = ( 0.3690476 0.3690476 0.3690476), wk = 0.0031250 k( 177) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0031250 k( 178) = ( 0.3928571 0.3928571 0.3928571), wk = 0.0031250 k( 179) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0031250 k( 180) = ( 0.4166667 0.4166667 0.4166667), wk = 0.0031250 k( 181) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0031250 k( 182) = ( 0.4404762 0.4404762 0.4404762), wk = 0.0031250 k( 183) = ( 0.4523810 0.4523810 0.4523810), wk = 0.0031250 k( 184) = ( 0.4642857 0.4642857 0.4642857), wk = 0.0031250 k( 185) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0031250 k( 186) = ( 0.4880952 0.4880952 0.4880952), wk = 0.0031250 k( 187) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 188) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 189) = ( 0.5041667 0.4916667 0.5041667), wk = 0.0031250 k( 190) = ( 0.5083333 0.4833333 0.5083333), wk = 0.0031250 k( 191) = ( 0.5125000 0.4750000 0.5125000), wk = 0.0031250 k( 192) = ( 0.5166667 0.4666667 0.5166667), wk = 0.0031250 k( 193) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0031250 k( 194) = ( 0.5250000 0.4500000 0.5250000), wk = 0.0031250 k( 195) = ( 0.5291667 0.4416667 0.5291667), wk = 0.0031250 k( 196) = ( 0.5333333 0.4333333 0.5333333), wk = 0.0031250 k( 197) = ( 0.5375000 0.4250000 0.5375000), wk = 0.0031250 k( 198) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0031250 k( 199) = ( 0.5458333 0.4083333 0.5458333), wk = 0.0031250 k( 200) = ( 0.5500000 0.4000000 0.5500000), wk = 0.0031250 k( 201) = ( 0.5541667 0.3916667 0.5541667), wk = 0.0031250 k( 202) = ( 0.5583333 0.3833333 0.5583333), wk = 0.0031250 k( 203) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0031250 k( 204) = ( 0.5666667 0.3666667 0.5666667), wk = 0.0031250 k( 205) = ( 0.5708333 0.3583333 0.5708333), wk = 0.0031250 k( 206) = ( 0.5750000 0.3500000 0.5750000), wk = 0.0031250 k( 207) = ( 0.5791667 0.3416667 0.5791667), wk = 0.0031250 k( 208) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0031250 k( 209) = ( 0.5875000 0.3250000 0.5875000), wk = 0.0031250 k( 210) = ( 0.5916667 0.3166667 0.5916667), wk = 0.0031250 k( 211) = ( 0.5958333 0.3083333 0.5958333), wk = 0.0031250 k( 212) = ( 0.6000000 0.3000000 0.6000000), wk = 0.0031250 k( 213) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0031250 k( 214) = ( 0.6083333 0.2833333 0.6083333), wk = 0.0031250 k( 215) = ( 0.6125000 0.2750000 0.6125000), wk = 0.0031250 k( 216) = ( 0.6166667 0.2666667 0.6166667), wk = 0.0031250 k( 217) = ( 0.6208333 0.2583333 0.6208333), wk = 0.0031250 k( 218) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0031250 k( 219) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0031250 k( 220) = ( 0.6176471 0.2500000 0.6323529), wk = 0.0031250 k( 221) = ( 0.6102941 0.2500000 0.6397059), wk = 0.0031250 k( 222) = ( 0.6029412 0.2500000 0.6470588), wk = 0.0031250 k( 223) = ( 0.5955882 0.2500000 0.6544118), wk = 0.0031250 k( 224) = ( 0.5882353 0.2500000 0.6617647), wk = 0.0031250 k( 225) = ( 0.5808823 0.2500000 0.6691177), wk = 0.0031250 k( 226) = ( 0.5735294 0.2500000 0.6764706), wk = 0.0031250 k( 227) = ( 0.5661765 0.2500000 0.6838235), wk = 0.0031250 k( 228) = ( 0.5588235 0.2500000 0.6911765), wk = 0.0031250 k( 229) = ( 0.5514706 0.2500000 0.6985294), wk = 0.0031250 k( 230) = ( 0.5441177 0.2500000 0.7058824), wk = 0.0031250 k( 231) = ( 0.5367647 0.2500000 0.7132353), wk = 0.0031250 k( 232) = ( 0.5294118 0.2500000 0.7205882), wk = 0.0031250 k( 233) = ( 0.5220588 0.2500000 0.7279412), wk = 0.0031250 k( 234) = ( 0.5147059 0.2500000 0.7352941), wk = 0.0031250 k( 235) = ( 0.5073529 0.2500000 0.7426471), wk = 0.0031250 k( 236) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031250 k( 237) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0031250 k( 238) = ( 0.5000000 0.2573529 0.7426471), wk = 0.0031250 k( 239) = ( 0.5000000 0.2647059 0.7352941), wk = 0.0031250 k( 240) = ( 0.5000000 0.2720588 0.7279412), wk = 0.0031250 k( 241) = ( 0.5000000 0.2794118 0.7205882), wk = 0.0031250 k( 242) = ( 0.5000000 0.2867647 0.7132353), wk = 0.0031250 k( 243) = ( 0.5000000 0.2941177 0.7058824), wk = 0.0031250 k( 244) = ( 0.5000000 0.3014706 0.6985294), wk = 0.0031250 k( 245) = ( 0.5000000 0.3088235 0.6911765), wk = 0.0031250 k( 246) = ( 0.5000000 0.3161765 0.6838235), wk = 0.0031250 k( 247) = ( 0.5000000 0.3235294 0.6764706), wk = 0.0031250 k( 248) = ( 0.5000000 0.3308823 0.6691177), wk = 0.0031250 k( 249) = ( 0.5000000 0.3382353 0.6617647), wk = 0.0031250 k( 250) = ( 0.5000000 0.3455882 0.6544118), wk = 0.0031250 k( 251) = ( 0.5000000 0.3529412 0.6470588), wk = 0.0031250 k( 252) = ( 0.5000000 0.3602941 0.6397059), wk = 0.0031250 k( 253) = ( 0.5000000 0.3676471 0.6323529), wk = 0.0031250 k( 254) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0031250 k( 255) = ( 0.5000000 0.3823529 0.6176471), wk = 0.0031250 k( 256) = ( 0.5000000 0.3897059 0.6102941), wk = 0.0031250 k( 257) = ( 0.5000000 0.3970588 0.6029412), wk = 0.0031250 k( 258) = ( 0.5000000 0.4044118 0.5955882), wk = 0.0031250 k( 259) = ( 0.5000000 0.4117647 0.5882353), wk = 0.0031250 k( 260) = ( 0.5000000 0.4191177 0.5808823), wk = 0.0031250 k( 261) = ( 0.5000000 0.4264706 0.5735294), wk = 0.0031250 k( 262) = ( 0.5000000 0.4338235 0.5661765), wk = 0.0031250 k( 263) = ( 0.5000000 0.4411765 0.5588235), wk = 0.0031250 k( 264) = ( 0.5000000 0.4485294 0.5514706), wk = 0.0031250 k( 265) = ( 0.5000000 0.4558824 0.5441177), wk = 0.0031250 k( 266) = ( 0.5000000 0.4632353 0.5367647), wk = 0.0031250 k( 267) = ( 0.5000000 0.4705882 0.5294118), wk = 0.0031250 k( 268) = ( 0.5000000 0.4779412 0.5220588), wk = 0.0031250 k( 269) = ( 0.5000000 0.4852941 0.5147059), wk = 0.0031250 k( 270) = ( 0.5000000 0.4926471 0.5073529), wk = 0.0031250 k( 271) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 272) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 273) = ( 0.4958333 0.4958333 0.5083333), wk = 0.0031250 k( 274) = ( 0.4916667 0.4916667 0.5166667), wk = 0.0031250 k( 275) = ( 0.4875000 0.4875000 0.5250000), wk = 0.0031250 k( 276) = ( 0.4833333 0.4833333 0.5333333), wk = 0.0031250 k( 277) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0031250 k( 278) = ( 0.4750000 0.4750000 0.5500000), wk = 0.0031250 k( 279) = ( 0.4708333 0.4708333 0.5583333), wk = 0.0031250 k( 280) = ( 0.4666667 0.4666667 0.5666667), wk = 0.0031250 k( 281) = ( 0.4625000 0.4625000 0.5750000), wk = 0.0031250 k( 282) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0031250 k( 283) = ( 0.4541667 0.4541667 0.5916667), wk = 0.0031250 k( 284) = ( 0.4500000 0.4500000 0.6000000), wk = 0.0031250 k( 285) = ( 0.4458333 0.4458333 0.6083333), wk = 0.0031250 k( 286) = ( 0.4416667 0.4416667 0.6166667), wk = 0.0031250 k( 287) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0031250 k( 288) = ( 0.4333333 0.4333333 0.6333333), wk = 0.0031250 k( 289) = ( 0.4291667 0.4291667 0.6416667), wk = 0.0031250 k( 290) = ( 0.4250000 0.4250000 0.6500000), wk = 0.0031250 k( 291) = ( 0.4208333 0.4208333 0.6583333), wk = 0.0031250 k( 292) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0031250 k( 293) = ( 0.4125000 0.4125000 0.6750000), wk = 0.0031250 k( 294) = ( 0.4083333 0.4083333 0.6833333), wk = 0.0031250 k( 295) = ( 0.4041667 0.4041667 0.6916667), wk = 0.0031250 k( 296) = ( 0.4000000 0.4000000 0.7000000), wk = 0.0031250 k( 297) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0031250 k( 298) = ( 0.3916667 0.3916667 0.7166667), wk = 0.0031250 k( 299) = ( 0.3875000 0.3875000 0.7250000), wk = 0.0031250 k( 300) = ( 0.3833333 0.3833333 0.7333333), wk = 0.0031250 k( 301) = ( 0.3791667 0.3791667 0.7416667), wk = 0.0031250 k( 302) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0031250 k( 303) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0031250 k( 304) = ( 0.6176471 0.2352941 0.6176471), wk = 0.0031250 k( 305) = ( 0.6102941 0.2205882 0.6102941), wk = 0.0031250 k( 306) = ( 0.6029412 0.2058823 0.6029412), wk = 0.0031250 k( 307) = ( 0.5955882 0.1911765 0.5955882), wk = 0.0031250 k( 308) = ( 0.5882353 0.1764706 0.5882353), wk = 0.0031250 k( 309) = ( 0.5808823 0.1617647 0.5808824), wk = 0.0031250 k( 310) = ( 0.5735294 0.1470588 0.5735294), wk = 0.0031250 k( 311) = ( 0.5661765 0.1323529 0.5661765), wk = 0.0031250 k( 312) = ( 0.5588235 0.1176471 0.5588235), wk = 0.0031250 k( 313) = ( 0.5514706 0.1029412 0.5514706), wk = 0.0031250 k( 314) = ( 0.5441177 0.0882353 0.5441177), wk = 0.0031250 k( 315) = ( 0.5367647 0.0735294 0.5367647), wk = 0.0031250 k( 316) = ( 0.5294118 0.0588235 0.5294118), wk = 0.0031250 k( 317) = ( 0.5220588 0.0441176 0.5220588), wk = 0.0031250 k( 318) = ( 0.5147059 0.0294118 0.5147059), wk = 0.0031250 k( 319) = ( 0.5073529 0.0147059 0.5073529), wk = 0.0031250 k( 320) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0031250 Dense grid: 67529 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 476, 46) NL pseudopotentials 0.42 Mb ( 238, 116) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1875) G-vector shells 0.00 Mb ( 472) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.34 Mb ( 476, 184) Each subspace H/S matrix 0.03 Mb ( 46, 46) Each matrix 0.16 Mb ( 116, 2, 46) The potential is recalculated from file : ./LiInAg2.save/charge-density.dat Starting wfc are 64 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.0 secs Computing kpt #: 2 total cpu time spent up to now is 3.6 secs Computing kpt #: 3 total cpu time spent up to now is 4.2 secs Computing kpt #: 4 total cpu time spent up to now is 4.9 secs Computing kpt #: 5 total cpu time spent up to now is 5.5 secs Computing kpt #: 6 total cpu time spent up to now is 6.1 secs Computing kpt #: 7 total cpu time spent up to now is 6.7 secs Computing kpt #: 8 total cpu time spent up to now is 7.3 secs Computing kpt #: 9 total cpu time spent up to now is 7.9 secs Computing kpt #: 10 total cpu time spent up to now is 8.6 secs Computing kpt #: 11 total cpu time spent up to now is 9.2 secs Computing kpt #: 12 total cpu time spent up to now is 9.8 secs Computing kpt #: 13 total cpu time spent up to now is 10.4 secs Computing kpt #: 14 total cpu time spent up to now is 11.0 secs Computing kpt #: 15 total cpu time spent up to now is 11.6 secs Computing kpt #: 16 total cpu time spent up to now is 12.3 secs Computing kpt #: 17 total cpu time spent up to now is 12.9 secs Computing kpt #: 18 total cpu time spent up to now is 13.5 secs Computing kpt #: 19 total cpu time spent up to now is 14.2 secs Computing kpt #: 20 total cpu time spent up to now is 14.9 secs Computing kpt #: 21 total cpu time spent up to now is 15.6 secs Computing kpt #: 22 total cpu time spent up to now is 16.2 secs Computing kpt #: 23 total cpu time spent up to now is 16.9 secs Computing kpt #: 24 total cpu time spent up to now is 17.6 secs Computing kpt #: 25 total cpu time spent up to now is 18.3 secs Computing kpt #: 26 total cpu time spent up to now is 18.9 secs Computing kpt #: 27 total cpu time spent up to now is 19.6 secs Computing kpt #: 28 total cpu time spent up to now is 20.4 secs Computing kpt #: 29 total cpu time spent up to now is 21.0 secs Computing kpt #: 30 total cpu time spent up to now is 21.7 secs Computing kpt #: 31 total cpu time spent up to now is 22.4 secs Computing kpt #: 32 total cpu time spent up to now is 23.1 secs Computing kpt #: 33 total cpu time spent up to now is 23.8 secs Computing kpt #: 34 total cpu time spent up to now is 24.4 secs Computing kpt #: 35 total cpu time spent up to now is 25.1 secs Computing kpt #: 36 total cpu time spent up to now is 25.8 secs Computing kpt #: 37 total cpu time spent up to now is 26.5 secs Computing kpt #: 38 total cpu time spent up to now is 27.2 secs Computing kpt #: 39 total cpu time spent up to now is 27.9 secs Computing kpt #: 40 total cpu time spent up to now is 28.6 secs Computing kpt #: 41 total cpu time spent up to now is 29.3 secs Computing kpt #: 42 total cpu time spent up to now is 30.0 secs Computing kpt #: 43 total cpu time spent up to now is 30.8 secs Computing kpt #: 44 total cpu time spent up to now is 31.5 secs Computing kpt #: 45 total cpu time spent up to now is 32.2 secs Computing kpt #: 46 total cpu time spent up to now is 32.9 secs Computing kpt #: 47 total cpu time spent up to now is 33.6 secs Computing kpt #: 48 total cpu time spent up to now is 34.3 secs Computing kpt #: 49 total cpu time spent up to now is 35.0 secs Computing kpt #: 50 total cpu time spent up to now is 35.7 secs Computing kpt #: 51 total cpu time spent up to now is 36.4 secs Computing kpt #: 52 total cpu time spent up to now is 37.2 secs Computing kpt #: 53 total cpu time spent up to now is 37.9 secs Computing kpt #: 54 total cpu time spent up to now is 38.6 secs Computing kpt #: 55 total cpu time spent up to now is 39.3 secs Computing kpt #: 56 total cpu time spent up to now is 40.0 secs Computing kpt #: 57 total cpu time spent up to now is 40.6 secs Computing kpt #: 58 total cpu time spent up to now is 41.2 secs Computing kpt #: 59 total cpu time spent up to now is 41.9 secs Computing kpt #: 60 total cpu time spent up to now is 42.5 secs Computing kpt #: 61 total cpu time spent up to now is 43.1 secs Computing kpt #: 62 total cpu time spent up to now is 43.7 secs Computing kpt #: 63 total cpu time spent up to now is 44.4 secs Computing kpt #: 64 total cpu time spent up to now is 45.0 secs Computing kpt #: 65 total cpu time spent up to now is 45.7 secs Computing kpt #: 66 total cpu time spent up to now is 46.3 secs Computing kpt #: 67 total cpu time spent up to now is 47.0 secs Computing kpt #: 68 total cpu time spent up to now is 47.6 secs Computing kpt #: 69 total cpu time spent up to now is 48.3 secs Computing kpt #: 70 total cpu time spent up to now is 48.9 secs Computing kpt #: 71 total cpu time spent up to now is 49.6 secs Computing kpt #: 72 total cpu time spent up to now is 50.2 secs Computing kpt #: 73 total cpu time spent up to now is 50.8 secs Computing kpt #: 74 total cpu time spent up to now is 51.4 secs Computing kpt #: 75 total cpu time spent up to now is 52.0 secs Computing kpt #: 76 total cpu time spent up to now is 52.6 secs Computing kpt #: 77 total cpu time spent up to now is 53.2 secs Computing kpt #: 78 total cpu time spent up to now is 53.8 secs Computing kpt #: 79 total cpu time spent up to now is 54.4 secs Computing kpt #: 80 total cpu time spent up to now is 55.1 secs Computing kpt #: 81 total cpu time spent up to now is 55.8 secs Computing kpt #: 82 total cpu time spent up to now is 56.4 secs Computing kpt #: 83 total cpu time spent up to now is 57.1 secs Computing kpt #: 84 total cpu time spent up to now is 57.8 secs Computing kpt #: 85 total cpu time spent up to now is 58.4 secs Computing kpt #: 86 total cpu time spent up to now is 59.1 secs Computing kpt #: 87 total cpu time spent up to now is 59.7 secs Computing kpt #: 88 total cpu time spent up to now is 60.4 secs Computing kpt #: 89 total cpu time spent up to now is 61.0 secs Computing kpt #: 90 total cpu time spent up to now is 61.7 secs Computing kpt #: 91 total cpu time spent up to now is 62.3 secs Computing kpt #: 92 total cpu time spent up to now is 63.0 secs Computing kpt #: 93 total cpu time spent up to now is 63.6 secs Computing kpt #: 94 total cpu time spent up to now is 64.3 secs Computing kpt #: 95 total cpu time spent up to now is 65.0 secs Computing kpt #: 96 total cpu time spent up to now is 65.6 secs Computing kpt #: 97 total cpu time spent up to now is 66.3 secs Computing kpt #: 98 total cpu time spent up to now is 67.0 secs Computing kpt #: 99 total cpu time spent up to now is 67.5 secs Computing kpt #: 100 total cpu time spent up to now is 68.1 secs Computing kpt #: 101 total cpu time spent up to now is 68.8 secs Computing kpt #: 102 total cpu time spent up to now is 69.5 secs Computing kpt #: 103 total cpu time spent up to now is 70.2 secs Computing kpt #: 104 total cpu time spent up to now is 70.9 secs Computing kpt #: 105 total cpu time spent up to now is 71.5 secs Computing kpt #: 106 total cpu time spent up to now is 72.2 secs Computing kpt #: 107 total cpu time spent up to now is 72.9 secs Computing kpt #: 108 total cpu time spent up to now is 73.5 secs Computing kpt #: 109 total cpu time spent up to now is 74.1 secs Computing kpt #: 110 total cpu time spent up to now is 74.8 secs Computing kpt #: 111 total cpu time spent up to now is 75.4 secs Computing kpt #: 112 total cpu time spent up to now is 76.0 secs Computing kpt #: 113 total cpu time spent up to now is 76.6 secs Computing kpt #: 114 total cpu time spent up to now is 77.2 secs Computing kpt #: 115 total cpu time spent up to now is 77.8 secs Computing kpt #: 116 total cpu time spent up to now is 78.4 secs Computing kpt #: 117 total cpu time spent up to now is 79.0 secs Computing kpt #: 118 total cpu time spent up to now is 79.6 secs Computing kpt #: 119 total cpu time spent up to now is 80.2 secs Computing kpt #: 120 total cpu time spent up to now is 80.9 secs Computing kpt #: 121 total cpu time spent up to now is 81.5 secs Computing kpt #: 122 total cpu time spent up to now is 82.1 secs Computing kpt #: 123 total cpu time spent up to now is 82.7 secs Computing kpt #: 124 total cpu time spent up to now is 83.3 secs Computing kpt #: 125 total cpu time spent up to now is 83.9 secs Computing kpt #: 126 total cpu time spent up to now is 84.5 secs Computing kpt #: 127 total cpu time spent up to now is 85.1 secs Computing kpt #: 128 total cpu time spent up to now is 85.7 secs Computing kpt #: 129 total cpu time spent up to now is 86.2 secs Computing kpt #: 130 total cpu time spent up to now is 86.8 secs Computing kpt #: 131 total cpu time spent up to now is 87.4 secs Computing kpt #: 132 total cpu time spent up to now is 88.0 secs Computing kpt #: 133 total cpu time spent up to now is 88.6 secs Computing kpt #: 134 total cpu time spent up to now is 89.1 secs Computing kpt #: 135 total cpu time spent up to now is 89.7 secs Computing kpt #: 136 total cpu time spent up to now is 90.3 secs Computing kpt #: 137 total cpu time spent up to now is 90.9 secs Computing kpt #: 138 total cpu time spent up to now is 91.4 secs Computing kpt #: 139 total cpu time spent up to now is 92.0 secs Computing kpt #: 140 total cpu time spent up to now is 92.6 secs Computing kpt #: 141 total cpu time spent up to now is 93.3 secs Computing kpt #: 142 total cpu time spent up to now is 93.9 secs Computing kpt #: 143 total cpu time spent up to now is 94.5 secs Computing kpt #: 144 total cpu time spent up to now is 95.1 secs Computing kpt #: 145 total cpu time spent up to now is 95.8 secs Computing kpt #: 146 total cpu time spent up to now is 96.4 secs Computing kpt #: 147 total cpu time spent up to now is 97.1 secs Computing kpt #: 148 total cpu time spent up to now is 97.7 secs Computing kpt #: 149 total cpu time spent up to now is 98.3 secs Computing kpt #: 150 total cpu time spent up to now is 98.9 secs Computing kpt #: 151 total cpu time spent up to now is 99.5 secs Computing kpt #: 152 total cpu time spent up to now is 100.1 secs Computing kpt #: 153 total cpu time spent up to now is 100.7 secs Computing kpt #: 154 total cpu time spent up to now is 101.3 secs Computing kpt #: 155 total cpu time spent up to now is 101.9 secs Computing kpt #: 156 total cpu time spent up to now is 102.5 secs Computing kpt #: 157 total cpu time spent up to now is 103.1 secs Computing kpt #: 158 total cpu time spent up to now is 103.7 secs Computing kpt #: 159 total cpu time spent up to now is 104.3 secs Computing kpt #: 160 total cpu time spent up to now is 104.8 secs Computing kpt #: 161 total cpu time spent up to now is 105.4 secs Computing kpt #: 162 total cpu time spent up to now is 106.0 secs Computing kpt #: 163 total cpu time spent up to now is 106.6 secs Computing kpt #: 164 total cpu time spent up to now is 107.1 secs Computing kpt #: 165 total cpu time spent up to now is 107.7 secs Computing kpt #: 166 total cpu time spent up to now is 108.3 secs Computing kpt #: 167 total cpu time spent up to now is 108.8 secs Computing kpt #: 168 total cpu time spent up to now is 109.4 secs Computing kpt #: 169 total cpu time spent up to now is 109.9 secs Computing kpt #: 170 total cpu time spent up to now is 110.5 secs Computing kpt #: 171 total cpu time spent up to now is 111.0 secs Computing kpt #: 172 total cpu time spent up to now is 111.6 secs Computing kpt #: 173 total cpu time spent up to now is 112.1 secs Computing kpt #: 174 total cpu time spent up to now is 112.6 secs Computing kpt #: 175 total cpu time spent up to now is 113.2 secs Computing kpt #: 176 total cpu time spent up to now is 113.7 secs Computing kpt #: 177 total cpu time spent up to now is 114.2 secs Computing kpt #: 178 total cpu time spent up to now is 114.7 secs Computing kpt #: 179 total cpu time spent up to now is 115.3 secs Computing kpt #: 180 total cpu time spent up to now is 115.8 secs Computing kpt #: 181 total cpu time spent up to now is 116.3 secs Computing kpt #: 182 total cpu time spent up to now is 116.8 secs Computing kpt #: 183 total cpu time spent up to now is 117.3 secs Computing kpt #: 184 total cpu time spent up to now is 117.8 secs Computing kpt #: 185 total cpu time spent up to now is 118.4 secs Computing kpt #: 186 total cpu time spent up to now is 118.9 secs Computing kpt #: 187 total cpu time spent up to now is 119.4 secs Computing kpt #: 188 total cpu time spent up to now is 119.9 secs Computing kpt #: 189 total cpu time spent up to now is 120.4 secs Computing kpt #: 190 total cpu time spent up to now is 120.9 secs Computing kpt #: 191 total cpu time spent up to now is 121.4 secs Computing kpt #: 192 total cpu time spent up to now is 122.0 secs Computing kpt #: 193 total cpu time spent up to now is 122.5 secs Computing kpt #: 194 total cpu time spent up to now is 123.0 secs Computing kpt #: 195 total cpu time spent up to now is 123.6 secs Computing kpt #: 196 total cpu time spent up to now is 124.1 secs Computing kpt #: 197 total cpu time spent up to now is 124.6 secs Computing kpt #: 198 total cpu time spent up to now is 125.1 secs Computing kpt #: 199 total cpu time spent up to now is 125.6 secs Computing kpt #: 200 total cpu time spent up to now is 126.2 secs Computing kpt #: 201 total cpu time spent up to now is 126.7 secs Computing kpt #: 202 total cpu time spent up to now is 127.3 secs Computing kpt #: 203 total cpu time spent up to now is 127.8 secs Computing kpt #: 204 total cpu time spent up to now is 128.4 secs Computing kpt #: 205 total cpu time spent up to now is 128.9 secs Computing kpt #: 206 total cpu time spent up to now is 129.5 secs Computing kpt #: 207 total cpu time spent up to now is 130.1 secs Computing kpt #: 208 total cpu time spent up to now is 130.6 secs Computing kpt #: 209 total cpu time spent up to now is 131.2 secs Computing kpt #: 210 total cpu time spent up to now is 131.8 secs Computing kpt #: 211 total cpu time spent up to now is 132.4 secs Computing kpt #: 212 total cpu time spent up to now is 133.0 secs Computing kpt #: 213 total cpu time spent up to now is 133.7 secs Computing kpt #: 214 total cpu time spent up to now is 134.3 secs Computing kpt #: 215 total cpu time spent up to now is 135.0 secs Computing kpt #: 216 total cpu time spent up to now is 135.7 secs Computing kpt #: 217 total cpu time spent up to now is 136.3 secs Computing kpt #: 218 total cpu time spent up to now is 137.0 secs Computing kpt #: 219 total cpu time spent up to now is 137.6 secs Computing kpt #: 220 total cpu time spent up to now is 138.3 secs Computing kpt #: 221 total cpu time spent up to now is 138.9 secs Computing kpt #: 222 total cpu time spent up to now is 139.6 secs Computing kpt #: 223 total cpu time spent up to now is 140.2 secs Computing kpt #: 224 total cpu time spent up to now is 140.9 secs Computing kpt #: 225 total cpu time spent up to now is 141.5 secs Computing kpt #: 226 total cpu time spent up to now is 142.2 secs Computing kpt #: 227 total cpu time spent up to now is 145.5 secs Computing kpt #: 228 total cpu time spent up to now is 146.2 secs Computing kpt #: 229 total cpu time spent up to now is 146.8 secs Computing kpt #: 230 total cpu time spent up to now is 147.5 secs Computing kpt #: 231 total cpu time spent up to now is 148.2 secs Computing kpt #: 232 total cpu time spent up to now is 148.9 secs Computing kpt #: 233 total cpu time spent up to now is 149.4 secs Computing kpt #: 234 total cpu time spent up to now is 150.0 secs Computing kpt #: 235 total cpu time spent up to now is 150.6 secs Computing kpt #: 236 total cpu time spent up to now is 151.2 secs Computing kpt #: 237 total cpu time spent up to now is 151.8 secs Computing kpt #: 238 total cpu time spent up to now is 152.4 secs Computing kpt #: 239 total cpu time spent up to now is 153.0 secs Computing kpt #: 240 total cpu time spent up to now is 153.6 secs Computing kpt #: 241 total cpu time spent up to now is 154.2 secs Computing kpt #: 242 total cpu time spent up to now is 154.7 secs Computing kpt #: 243 total cpu time spent up to now is 155.3 secs Computing kpt #: 244 total cpu time spent up to now is 155.9 secs Computing kpt #: 245 total cpu time spent up to now is 156.6 secs Computing kpt #: 246 total cpu time spent up to now is 157.5 secs Computing kpt #: 247 total cpu time spent up to now is 158.2 secs Computing kpt #: 248 total cpu time spent up to now is 158.8 secs Computing kpt #: 249 total cpu time spent up to now is 159.3 secs Computing kpt #: 250 total cpu time spent up to now is 159.9 secs Computing kpt #: 251 total cpu time spent up to now is 160.5 secs Computing kpt #: 252 total cpu time spent up to now is 161.2 secs Computing kpt #: 253 total cpu time spent up to now is 161.7 secs Computing kpt #: 254 total cpu time spent up to now is 162.3 secs Computing kpt #: 255 total cpu time spent up to now is 162.9 secs Computing kpt #: 256 total cpu time spent up to now is 163.4 secs Computing kpt #: 257 total cpu time spent up to now is 164.0 secs Computing kpt #: 258 total cpu time spent up to now is 164.5 secs Computing kpt #: 259 total cpu time spent up to now is 165.0 secs Computing kpt #: 260 total cpu time spent up to now is 165.6 secs Computing kpt #: 261 total cpu time spent up to now is 166.1 secs Computing kpt #: 262 total cpu time spent up to now is 166.6 secs Computing kpt #: 263 total cpu time spent up to now is 167.2 secs Computing kpt #: 264 total cpu time spent up to now is 167.7 secs Computing kpt #: 265 total cpu time spent up to now is 168.2 secs Computing kpt #: 266 total cpu time spent up to now is 168.7 secs Computing kpt #: 267 total cpu time spent up to now is 169.2 secs Computing kpt #: 268 total cpu time spent up to now is 169.8 secs Computing kpt #: 269 total cpu time spent up to now is 170.3 secs Computing kpt #: 270 total cpu time spent up to now is 170.8 secs Computing kpt #: 271 total cpu time spent up to now is 171.3 secs Computing kpt #: 272 total cpu time spent up to now is 171.8 secs Computing kpt #: 273 total cpu time spent up to now is 172.3 secs Computing kpt #: 274 total cpu time spent up to now is 172.8 secs Computing kpt #: 275 total cpu time spent up to now is 173.4 secs Computing kpt #: 276 total cpu time spent up to now is 173.9 secs Computing kpt #: 277 total cpu time spent up to now is 174.4 secs Computing kpt #: 278 total cpu time spent up to now is 174.9 secs Computing kpt #: 279 total cpu time spent up to now is 175.5 secs Computing kpt #: 280 total cpu time spent up to now is 176.0 secs Computing kpt #: 281 total cpu time spent up to now is 176.5 secs Computing kpt #: 282 total cpu time spent up to now is 177.0 secs Computing kpt #: 283 total cpu time spent up to now is 177.6 secs Computing kpt #: 284 total cpu time spent up to now is 178.1 secs Computing kpt #: 285 total cpu time spent up to now is 178.6 secs Computing kpt #: 286 total cpu time spent up to now is 179.2 secs Computing kpt #: 287 total cpu time spent up to now is 179.7 secs Computing kpt #: 288 total cpu time spent up to now is 180.3 secs Computing kpt #: 289 total cpu time spent up to now is 180.8 secs Computing kpt #: 290 total cpu time spent up to now is 181.4 secs Computing kpt #: 291 total cpu time spent up to now is 182.0 secs Computing kpt #: 292 total cpu time spent up to now is 182.5 secs Computing kpt #: 293 total cpu time spent up to now is 183.1 secs Computing kpt #: 294 total cpu time spent up to now is 183.7 secs Computing kpt #: 295 total cpu time spent up to now is 184.3 secs Computing kpt #: 296 total cpu time spent up to now is 184.9 secs Computing kpt #: 297 total cpu time spent up to now is 185.6 secs Computing kpt #: 298 total cpu time spent up to now is 186.2 secs Computing kpt #: 299 total cpu time spent up to now is 186.9 secs Computing kpt #: 300 total cpu time spent up to now is 187.6 secs Computing kpt #: 301 total cpu time spent up to now is 188.2 secs Computing kpt #: 302 total cpu time spent up to now is 188.9 secs Computing kpt #: 303 total cpu time spent up to now is 189.5 secs Computing kpt #: 304 total cpu time spent up to now is 190.2 secs Computing kpt #: 305 total cpu time spent up to now is 190.9 secs Computing kpt #: 306 total cpu time spent up to now is 191.5 secs Computing kpt #: 307 total cpu time spent up to now is 192.2 secs Computing kpt #: 308 total cpu time spent up to now is 192.8 secs Computing kpt #: 309 total cpu time spent up to now is 193.5 secs Computing kpt #: 310 total cpu time spent up to now is 194.2 secs Computing kpt #: 311 total cpu time spent up to now is 194.9 secs Computing kpt #: 312 total cpu time spent up to now is 195.6 secs Computing kpt #: 313 total cpu time spent up to now is 196.3 secs Computing kpt #: 314 total cpu time spent up to now is 197.0 secs Computing kpt #: 315 total cpu time spent up to now is 197.6 secs Computing kpt #: 316 total cpu time spent up to now is 198.3 secs Computing kpt #: 317 total cpu time spent up to now is 199.1 secs Computing kpt #: 318 total cpu time spent up to now is 199.8 secs Computing kpt #: 319 total cpu time spent up to now is 200.5 secs Computing kpt #: 320 total cpu time spent up to now is 201.3 secs ethr = 2.63E-08, avg # of iterations = 20.4 total cpu time spent up to now is 201.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8393 PWs) bands (ev): -35.4326 -35.4326 -4.3806 -4.3806 -4.3806 -4.3806 -3.5614 -3.5614 -3.5213 -3.5213 -3.5213 -3.5213 2.1343 2.1343 4.7854 4.7854 4.7854 4.7854 5.0388 5.0388 5.1275 5.1275 5.1275 5.1275 6.2468 6.2468 6.2468 6.2468 6.5419 6.5419 6.7580 6.7580 6.7580 6.7580 13.9075 13.9075 14.2870 14.2870 14.3121 14.3121 14.3121 14.3121 14.3627 14.3627 14.7226 14.7226 k = 0.0104-0.0060 0.0085 ( 8393 PWs) bands (ev): -35.4326 -35.4326 -4.3806 -4.3806 -4.3806 -4.3806 -3.5614 -3.5614 -3.5213 -3.5213 -3.5212 -3.5212 2.1357 2.1357 4.7855 4.7855 4.7862 4.7862 5.0392 5.0392 5.1275 5.1275 5.1281 5.1281 6.2462 6.2462 6.2466 6.2466 6.5415 6.5415 6.7566 6.7566 6.7580 6.7580 13.8840 13.8840 14.1625 14.1625 14.2836 14.2836 14.3083 14.3083 14.4464 14.4464 14.7628 14.7628 k = 0.0208-0.0120 0.0170 ( 8409 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5614 -3.5614 -3.5213 -3.5213 -3.5212 -3.5212 2.1398 2.1398 4.7859 4.7859 4.7885 4.7885 5.0406 5.0406 5.1277 5.1277 5.1299 5.1299 6.2446 6.2446 6.2460 6.2460 6.5401 6.5401 6.7523 6.7523 6.7579 6.7579 13.8182 13.8182 14.0194 14.0194 14.2179 14.2179 14.2185 14.2185 14.5768 14.5768 14.8597 14.8597 k = 0.0312-0.0180 0.0255 ( 8428 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5614 -3.5614 -3.5213 -3.5213 -3.5211 -3.5211 2.1466 2.1466 4.7866 4.7866 4.7923 4.7923 5.0429 5.0429 5.1279 5.1279 5.1328 5.1328 6.2418 6.2418 6.2450 6.2450 6.5380 6.5380 6.7452 6.7452 6.7578 6.7578 13.7206 13.7206 13.8733 13.8733 14.1078 14.1078 14.1399 14.1399 14.7040 14.7040 14.9803 14.9803 k = 0.0417-0.0241 0.0340 ( 8448 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3805 -4.3805 -3.5613 -3.5613 -3.5213 -3.5213 -3.5210 -3.5210 2.1562 2.1562 4.7874 4.7874 4.7976 4.7976 5.0462 5.0462 5.1283 5.1283 5.1370 5.1370 6.2380 6.2380 6.2436 6.2436 6.5349 6.5349 6.7354 6.7354 6.7576 6.7576 13.6027 13.6027 13.7256 13.7256 13.9899 13.9899 14.0552 14.0552 14.8270 14.8270 15.1061 15.1061 k = 0.0521-0.0301 0.0425 ( 8444 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3804 -4.3804 -3.5613 -3.5613 -3.5213 -3.5213 -3.5209 -3.5209 2.1684 2.1684 4.7884 4.7884 4.8045 4.8045 5.0505 5.0505 5.1287 5.1287 5.1423 5.1423 6.2331 6.2331 6.2418 6.2418 6.5311 6.5311 6.7228 6.7228 6.7574 6.7574 13.4727 13.4727 13.5770 13.5770 13.8676 13.8676 13.9667 13.9667 14.9456 14.9456 15.2342 15.2342 k = 0.0625-0.0361 0.0510 ( 8460 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3803 -4.3803 -3.5612 -3.5612 -3.5213 -3.5213 -3.5207 -3.5207 2.1833 2.1833 4.7894 4.7894 4.8128 4.8128 5.0560 5.0560 5.1293 5.1293 5.1487 5.1487 6.2273 6.2273 6.2395 6.2395 6.5266 6.5266 6.7075 6.7075 6.7571 6.7571 13.3360 13.3360 13.4281 13.4281 13.7421 13.7421 13.8757 13.8757 15.0592 15.0592 15.3613 15.3613 k = 0.0729-0.0421 0.0595 ( 8460 PWs) bands (ev): -35.4327 -35.4327 -4.3804 -4.3804 -4.3803 -4.3803 -3.5612 -3.5612 -3.5213 -3.5213 -3.5205 -3.5205 2.2009 2.2009 4.7903 4.7903 4.8226 4.8226 5.0628 5.0628 5.1299 5.1299 5.1563 5.1563 6.2205 6.2205 6.2367 6.2367 6.5214 6.5214 6.6898 6.6898 6.7568 6.7568 13.1955 13.1955 13.2794 13.2794 13.6136 13.6136 13.7837 13.7837 15.1659 15.1659 15.4856 15.4856 k = 0.0833-0.0481 0.0680 ( 8472 PWs) bands (ev): -35.4327 -35.4327 -4.3804 -4.3804 -4.3802 -4.3802 -3.5611 -3.5611 -3.5213 -3.5213 -3.5203 -3.5203 2.2211 2.2211 4.7911 4.7911 4.8339 4.8339 5.0709 5.0709 5.1307 5.1307 5.1649 5.1649 6.2127 6.2127 6.2334 6.2334 6.5156 6.5156 6.6696 6.6696 6.7564 6.7564 13.0532 13.0532 13.1313 13.1313 13.4820 13.4820 13.6917 13.6917 15.2609 15.2609 15.6062 15.6062 k = 0.0938-0.0541 0.0765 ( 8460 PWs) bands (ev): -35.4326 -35.4326 -4.3804 -4.3804 -4.3801 -4.3801 -3.5610 -3.5610 -3.5213 -3.5213 -3.5200 -3.5200 2.2440 2.2440 4.7917 4.7917 4.8466 4.8466 5.0804 5.0804 5.1315 5.1315 5.1747 5.1747 6.2041 6.2041 6.2296 6.2296 6.5092 6.5092 6.6470 6.6470 6.7560 6.7560 12.9101 12.9101 12.9839 12.9839 13.3472 13.3472 13.6007 13.6007 15.3304 15.3304 15.6932 15.6932 k = 0.1042-0.0601 0.0851 ( 8452 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3800 -4.3800 -3.5610 -3.5610 -3.5213 -3.5213 -3.5197 -3.5197 2.2693 2.2693 4.7920 4.7920 4.8607 4.8607 5.0915 5.0915 5.1324 5.1324 5.1854 5.1854 6.1948 6.1948 6.2253 6.2253 6.5025 6.5025 6.6223 6.6223 6.7556 6.7556 12.7671 12.7671 12.8376 12.8376 13.2091 13.2091 13.5113 13.5113 15.3489 15.3489 15.6890 15.6890 k = 0.1146-0.0662 0.0936 ( 8448 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3799 -4.3799 -3.5609 -3.5609 -3.5213 -3.5213 -3.5194 -3.5194 2.2972 2.2972 4.7919 4.7919 4.8762 4.8762 5.1041 5.1041 5.1334 5.1334 5.1973 5.1973 6.1847 6.1847 6.2203 6.2203 6.4953 6.4953 6.5956 6.5956 6.7551 6.7551 12.6246 12.6246 12.6926 12.6926 13.0675 13.0675 13.4241 13.4241 15.3100 15.3100 15.7377 15.7377 k = 0.1250-0.0722 0.1021 ( 8452 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3797 -4.3797 -3.5608 -3.5608 -3.5213 -3.5213 -3.5191 -3.5191 2.3275 2.3275 4.7915 4.7915 4.8930 4.8930 5.1183 5.1183 5.1345 5.1345 5.2101 5.2101 6.1740 6.1740 6.2147 6.2147 6.4880 6.4880 6.5670 6.5670 6.7546 6.7546 12.4830 12.4830 12.5488 12.5488 12.9225 12.9225 13.3396 13.3396 15.2404 15.2404 15.8146 15.8146 k = 0.1354-0.0782 0.1106 ( 8460 PWs) bands (ev): -35.4326 -35.4326 -4.3802 -4.3802 -4.3796 -4.3796 -3.5607 -3.5607 -3.5214 -3.5214 -3.5187 -3.5187 2.3602 2.3602 4.7905 4.7905 4.9111 4.9111 5.1341 5.1341 5.1357 5.1357 5.2239 5.2239 6.1628 6.1628 6.2085 6.2085 6.4804 6.4804 6.5367 6.5367 6.7541 6.7541 12.3427 12.3427 12.4065 12.4065 12.7742 12.7742 13.2578 13.2578 15.1597 15.1597 15.9014 15.9014 k = 0.1458-0.0842 0.1191 ( 8444 PWs) bands (ev): -35.4326 -35.4326 -4.3802 -4.3802 -4.3794 -4.3794 -3.5606 -3.5606 -3.5214 -3.5214 -3.5183 -3.5183 2.3953 2.3953 4.7892 4.7892 4.9304 4.9304 5.1369 5.1369 5.1516 5.1516 5.2386 5.2386 6.1511 6.1511 6.2015 6.2015 6.4729 6.4729 6.5049 6.5049 6.7536 6.7536 12.2037 12.2037 12.2658 12.2658 12.6226 12.6226 13.1792 13.1792 15.0759 15.0759 15.9917 15.9917 k = 0.1562-0.0902 0.1276 ( 8436 PWs) bands (ev): -35.4326 -35.4326 -4.3801 -4.3801 -4.3793 -4.3793 -3.5605 -3.5605 -3.5214 -3.5214 -3.5179 -3.5179 2.4326 2.4326 4.7874 4.7874 4.9510 4.9510 5.1382 5.1382 5.1706 5.1706 5.2543 5.2543 6.1391 6.1391 6.1937 6.1937 6.4654 6.4654 6.4719 6.4719 6.7530 6.7530 12.0664 12.0664 12.1267 12.1267 12.4679 12.4679 13.1036 13.1036 14.9923 14.9923 16.0836 16.0836 k = 0.1667-0.0962 0.1361 ( 8420 PWs) bands (ev): -35.4326 -35.4326 -4.3801 -4.3801 -4.3791 -4.3791 -3.5604 -3.5604 -3.5214 -3.5214 -3.5174 -3.5174 2.4721 2.4721 4.7851 4.7851 4.9726 4.9726 5.1396 5.1396 5.1912 5.1912 5.2710 5.2710 6.1269 6.1269 6.1853 6.1853 6.4377 6.4377 6.4580 6.4580 6.7525 6.7525 11.9308 11.9308 11.9893 11.9893 12.3105 12.3105 13.0313 13.0313 14.9107 14.9107 16.1765 16.1765 k = 0.1771-0.1022 0.1446 ( 8428 PWs) bands (ev): -35.4326 -35.4326 -4.3800 -4.3800 -4.3789 -4.3789 -3.5603 -3.5603 -3.5214 -3.5214 -3.5169 -3.5169 2.5137 2.5137 4.7825 4.7825 4.9952 4.9952 5.1411 5.1411 5.2132 5.2132 5.2885 5.2885 6.1146 6.1146 6.1760 6.1760 6.4027 6.4027 6.4508 6.4508 6.7519 6.7519 11.7970 11.7970 11.8535 11.8535 12.1507 12.1507 12.9622 12.9622 14.8318 14.8318 16.2709 16.2709 k = 0.1875-0.1083 0.1531 ( 8424 PWs) bands (ev): -35.4326 -35.4326 -4.3800 -4.3800 -4.3788 -4.3788 -3.5603 -3.5603 -3.5214 -3.5214 -3.5165 -3.5165 2.5573 2.5573 4.7794 4.7794 5.0188 5.0188 5.1426 5.1426 5.2368 5.2368 5.3068 5.3068 6.1023 6.1023 6.1659 6.1659 6.3672 6.3672 6.4439 6.4439 6.7513 6.7513 11.6653 11.6653 11.7195 11.7195 11.9890 11.9890 12.8963 12.8963 14.7563 14.7563 16.3668 16.3668 k = 0.1979-0.1143 0.1616 ( 8404 PWs) bands (ev): -35.4326 -35.4326 -4.3799 -4.3799 -4.3786 -4.3786 -3.5602 -3.5602 -3.5214 -3.5214 -3.5159 -3.5159 2.6028 2.6028 4.7760 4.7760 5.0431 5.0431 5.1444 5.1444 5.2616 5.2616 5.3260 5.3260 6.0901 6.0901 6.1549 6.1549 6.3313 6.3313 6.4373 6.4373 6.7508 6.7508 11.5356 11.5356 11.5871 11.5871 11.8259 11.8259 12.8337 12.8337 14.6842 14.6842 16.4648 16.4648 k = 0.2083-0.1203 0.1701 ( 8420 PWs) bands (ev): -35.4326 -35.4326 -4.3799 -4.3799 -4.3784 -4.3784 -3.5601 -3.5601 -3.5214 -3.5214 -3.5154 -3.5154 2.6501 2.6501 4.7722 4.7722 5.0680 5.0680 5.1464 5.1464 5.2878 5.2878 5.3459 5.3459 6.0783 6.0783 6.1431 6.1431 6.2954 6.2954 6.4310 6.4310 6.7503 6.7503 11.4081 11.4081 11.4560 11.4560 11.6620 11.6620 12.7741 12.7741 14.6157 14.6157 16.5650 16.5650 k = 0.2188-0.1263 0.1786 ( 8420 PWs) bands (ev): -35.4326 -35.4326 -4.3798 -4.3798 -4.3782 -4.3782 -3.5600 -3.5600 -3.5214 -3.5214 -3.5149 -3.5149 2.6991 2.6991 4.7682 4.7682 5.0929 5.0929 5.1491 5.1491 5.3151 5.3151 5.3664 5.3664 6.0670 6.0670 6.1302 6.1302 6.2600 6.2600 6.4252 6.4252 6.7498 6.7498 11.2829 11.2829 11.3258 11.3258 11.4984 11.4984 12.7177 12.7177 14.5508 14.5508 16.6678 16.6678 k = 0.2292-0.1323 0.1871 ( 8440 PWs) bands (ev): -35.4326 -35.4326 -4.3798 -4.3798 -4.3780 -4.3780 -3.5599 -3.5599 -3.5214 -3.5214 -3.5143 -3.5143 2.7495 2.7495 4.7639 4.7639 5.1166 5.1166 5.1537 5.1537 5.3435 5.3435 5.3876 5.3876 6.0563 6.0563 6.1162 6.1162 6.2255 6.2255 6.4197 6.4197 6.7494 6.7494 11.1601 11.1601 11.1952 11.1952 11.3367 11.3367 12.6642 12.6642 14.4894 14.4894 16.7731 16.7732 k = 0.2396-0.1383 0.1956 ( 8440 PWs) bands (ev): -35.4326 -35.4326 -4.3798 -4.3798 -4.3778 -4.3778 -3.5599 -3.5599 -3.5214 -3.5214 -3.5138 -3.5138 2.8013 2.8013 4.7594 4.7594 5.1345 5.1345 5.1643 5.1643 5.3729 5.3729 5.4094 5.4094 6.0465 6.0465 6.1007 6.1007 6.1925 6.1925 6.4146 6.4146 6.7490 6.7490 11.0398 11.0398 11.0618 11.0618 11.1799 11.1799 12.6137 12.6137 14.4316 14.4316 16.8813 16.8813 k = 0.2500-0.1443 0.2041 ( 8412 PWs) bands (ev): -35.4326 -35.4326 -4.3797 -4.3797 -4.3776 -4.3776 -3.5598 -3.5598 -3.5213 -3.5213 -3.5132 -3.5132 2.8543 2.8543 4.7547 4.7547 5.1428 5.1428 5.1848 5.1848 5.4031 5.4031 5.4315 5.4315 6.0379 6.0379 6.0832 6.0832 6.1619 6.1619 6.4099 6.4099 6.7487 6.7487 10.9213 10.9213 10.9221 10.9221 11.0327 11.0327 12.5661 12.5661 14.3770 14.3770 16.9923 16.9923 k = 0.2604-0.1504 0.2126 ( 8428 PWs) bands (ev): -35.4326 -35.4326 -4.3797 -4.3797 -4.3774 -4.3774 -3.5598 -3.5598 -3.5213 -3.5213 -3.5126 -3.5126 2.9083 2.9083 4.7499 4.7499 5.1466 5.1466 5.2098 5.2098 5.4339 5.4339 5.4541 5.4541 6.0307 6.0307 6.0632 6.0632 6.1347 6.1347 6.4056 6.4056 6.7485 6.7485 10.7711 10.7711 10.8071 10.8071 10.8981 10.8981 12.5212 12.5212 14.3257 14.3257 17.1063 17.1063 k = 0.2708-0.1564 0.2211 ( 8428 PWs) bands (ev): -35.4326 -35.4326 -4.3796 -4.3796 -4.3772 -4.3772 -3.5597 -3.5597 -3.5213 -3.5213 -3.5120 -3.5120 2.9631 2.9631 4.7449 4.7449 5.1490 5.1490 5.2359 5.2359 5.4646 5.4646 5.4774 5.4774 6.0252 6.0252 6.0404 6.0404 6.1114 6.1114 6.4016 6.4016 6.7483 6.7483 10.6135 10.6135 10.6949 10.6949 10.7742 10.7742 12.4789 12.4789 14.2774 14.2774 17.2231 17.2231 k = 0.2812-0.1624 0.2296 ( 8436 PWs) bands (ev): -35.4326 -35.4326 -4.3796 -4.3796 -4.3770 -4.3770 -3.5597 -3.5597 -3.5213 -3.5213 -3.5115 -3.5115 3.0185 3.0185 4.7398 4.7398 5.1509 5.1509 5.2620 5.2620 5.4925 5.4925 5.5038 5.5038 6.0158 6.0158 6.0218 6.0218 6.0916 6.0916 6.3980 6.3980 6.7483 6.7483 10.4526 10.4526 10.5857 10.5857 10.6576 10.6576 12.4392 12.4392 14.2321 14.2321 17.3429 17.3429 k = 0.2917-0.1684 0.2381 ( 8436 PWs) bands (ev): -35.4326 -35.4326 -4.3796 -4.3796 -4.3768 -4.3768 -3.5596 -3.5596 -3.5213 -3.5213 -3.5109 -3.5109 3.0743 3.0743 4.7347 4.7347 5.1525 5.1525 5.2875 5.2875 5.5156 5.5156 5.5349 5.5349 5.9905 5.9905 6.0209 6.0209 6.0745 6.0745 6.3946 6.3946 6.7483 6.7483 10.2905 10.2905 10.4795 10.4795 10.5462 10.5462 12.4020 12.4020 14.1896 14.1896 17.4656 17.4656 k = 0.3021-0.1744 0.2467 ( 8440 PWs) bands (ev): -35.4326 -35.4326 -4.3796 -4.3796 -4.3766 -4.3766 -3.5596 -3.5596 -3.5213 -3.5213 -3.5103 -3.5103 3.1303 3.1303 4.7295 4.7295 5.1540 5.1540 5.3119 5.3119 5.5362 5.5362 5.5680 5.5680 5.9659 5.9659 6.0228 6.0228 6.0593 6.0593 6.3916 6.3916 6.7485 6.7485 10.1289 10.1289 10.3765 10.3765 10.4392 10.4392 12.3672 12.3672 14.1498 14.1498 17.5911 17.5911 k = 0.3125-0.1804 0.2552 ( 8444 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3764 -4.3764 -3.5596 -3.5596 -3.5212 -3.5212 -3.5097 -3.5097 3.1861 3.1861 4.7243 4.7243 5.1553 5.1553 5.3346 5.3346 5.5551 5.5551 5.6017 5.6017 5.9430 5.9430 6.0281 6.0281 6.0455 6.0455 6.3888 6.3888 6.7489 6.7489 9.9684 9.9684 10.2769 10.2769 10.3362 10.3362 12.3347 12.3347 14.1127 14.1127 17.7195 17.7195 k = 0.3229-0.1864 0.2637 ( 8444 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3762 -4.3762 -3.5596 -3.5596 -3.5212 -3.5212 -3.5092 -3.5092 3.2415 3.2415 4.7191 4.7191 5.1565 5.1565 5.3553 5.3553 5.5720 5.5720 5.6360 5.6360 5.9226 5.9226 6.0328 6.0328 6.0372 6.0372 6.3863 6.3863 6.7494 6.7494 9.8097 9.8097 10.1808 10.1808 10.2371 10.2371 12.3045 12.3045 14.0780 14.0780 17.8507 17.8507 k = 0.3333-0.1925 0.2722 ( 8468 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3761 -4.3761 -3.5595 -3.5595 -3.5212 -3.5212 -3.5087 -3.5087 3.2962 3.2962 4.7139 4.7139 5.1577 5.1577 5.3733 5.3733 5.5868 5.5868 5.6704 5.6704 5.9052 5.9052 6.0212 6.0212 6.0502 6.0502 6.3840 6.3840 6.7502 6.7502 9.6533 9.6533 10.0883 10.0883 10.1419 10.1419 12.2764 12.2764 14.0457 14.0457 17.9846 17.9846 k = 0.3438-0.1985 0.2807 ( 8440 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3759 -4.3759 -3.5595 -3.5595 -3.5211 -3.5211 -3.5081 -3.5081 3.3498 3.3498 4.7088 4.7088 5.1588 5.1588 5.3883 5.3883 5.5992 5.5992 5.7050 5.7050 5.8913 5.8913 6.0107 6.0107 6.0674 6.0674 6.3819 6.3819 6.7511 6.7511 9.4995 9.4995 9.9998 9.9998 10.0506 10.0506 12.2504 12.2504 14.0158 14.0158 18.1211 18.1211 k = 0.3542-0.2045 0.2892 ( 8440 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3757 -4.3757 -3.5595 -3.5595 -3.5211 -3.5211 -3.5076 -3.5076 3.4022 3.4022 4.7038 4.7038 5.1598 5.1598 5.3999 5.3999 5.6094 5.6094 5.7394 5.7394 5.8812 5.8812 6.0014 6.0014 6.0889 6.0889 6.3800 6.3800 6.7524 6.7524 9.3487 9.3487 9.9153 9.9153 9.9635 9.9635 12.2263 12.2263 13.9880 13.9880 18.2602 18.2602 k = 0.3646-0.2105 0.2977 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3795 -4.3795 -4.3755 -4.3755 -3.5595 -3.5595 -3.5211 -3.5211 -3.5072 -3.5072 3.4528 3.4528 4.6989 4.6989 5.1607 5.1607 5.4080 5.4080 5.6174 5.6174 5.7736 5.7736 5.8746 5.8746 5.9935 5.9935 6.1145 6.1145 6.3782 6.3782 6.7539 6.7539 9.2015 9.2015 9.8350 9.8350 9.8808 9.8808 12.2043 12.2043 13.9625 13.9625 18.4017 18.4017 k = 0.3750-0.2165 0.3062 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3795 -4.3795 -4.3754 -4.3754 -3.5595 -3.5595 -3.5211 -3.5211 -3.5067 -3.5067 3.5015 3.5015 4.6941 4.6941 5.1615 5.1615 5.4126 5.4126 5.6234 5.6234 5.8071 5.8071 5.8713 5.8713 5.9871 5.9871 6.1439 6.1439 6.3767 6.3767 6.7557 6.7557 9.0583 9.0583 9.7593 9.7593 9.8026 9.8026 12.1841 12.1841 13.9390 13.9390 18.5456 18.5456 k = 0.3854-0.2225 0.3147 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3795 -4.3795 -4.3752 -4.3752 -3.5595 -3.5595 -3.5210 -3.5210 -3.5063 -3.5063 3.5479 3.5479 4.6895 4.6895 5.1623 5.1623 5.4141 5.4141 5.6277 5.6277 5.8398 5.8398 5.8704 5.8704 5.9827 5.9827 6.1767 6.1767 6.3752 6.3752 6.7580 6.7580 8.9195 8.9195 9.6882 9.6882 9.7291 9.7291 12.1657 12.1657 13.9176 13.9176 18.6917 18.6917 k = 0.3958-0.2285 0.3232 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3751 -4.3751 -3.5595 -3.5595 -3.5210 -3.5210 -3.5059 -3.5059 3.5916 3.5916 4.6851 4.6851 5.1630 5.1630 5.4130 5.4130 5.6306 5.6306 5.8711 5.8711 5.8712 5.8712 5.9804 5.9804 6.2126 6.2126 6.3740 6.3740 6.7606 6.7606 8.7857 8.7857 9.6222 9.6222 9.6607 9.6607 12.1491 12.1491 13.8982 13.8982 18.8398 18.8398 k = 0.4062-0.2345 0.3317 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3750 -4.3750 -3.5595 -3.5595 -3.5210 -3.5210 -3.5055 -3.5055 3.6323 3.6323 4.6809 4.6809 5.1636 5.1636 5.4099 5.4099 5.6324 5.6324 5.8724 5.8724 5.9009 5.9009 5.9806 5.9806 6.2507 6.2507 6.3728 6.3728 6.7638 6.7638 8.6577 8.6577 9.5614 9.5614 9.5976 9.5976 12.1342 12.1342 13.8808 13.8808 18.9896 18.9896 k = 0.4167-0.2406 0.3402 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3749 -4.3749 -3.5595 -3.5595 -3.5209 -3.5209 -3.5052 -3.5052 3.6696 3.6696 4.6770 4.6770 5.1642 5.1642 5.4055 5.4055 5.6334 5.6334 5.8735 5.8735 5.9287 5.9287 5.9831 5.9831 6.2905 6.2905 6.3718 6.3718 6.7676 6.7676 8.5362 8.5362 9.5061 9.5061 9.5401 9.5401 12.1210 12.1210 13.8653 13.8653 19.1408 19.1408 k = 0.4271-0.2466 0.3487 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3748 -4.3748 -3.5595 -3.5595 -3.5209 -3.5209 -3.5049 -3.5049 3.7034 3.7034 4.6734 4.6734 5.1646 5.1646 5.4003 5.4003 5.6339 5.6339 5.8740 5.8740 5.9541 5.9541 5.9876 5.9876 6.3309 6.3309 6.3709 6.3709 6.7720 6.7720 8.4224 8.4224 9.4565 9.4565 9.4885 9.4885 12.1095 12.1095 13.8517 13.8517 19.2930 19.2930 k = 0.4375-0.2526 0.3572 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3747 -4.3747 -3.5595 -3.5595 -3.5209 -3.5209 -3.5046 -3.5046 3.7333 3.7333 4.6702 4.6702 5.1651 5.1651 5.3949 5.3949 5.6339 5.6339 5.8739 5.8739 5.9769 5.9769 5.9936 5.9936 6.3701 6.3701 6.3707 6.3707 6.7772 6.7772 8.3174 8.3174 9.4129 9.4129 9.4430 9.4430 12.0995 12.0995 13.8399 13.8399 19.4452 19.4452 k = 0.4479-0.2586 0.3657 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3746 -4.3746 -3.5595 -3.5595 -3.5209 -3.5209 -3.5044 -3.5044 3.7590 3.7590 4.6673 4.6673 5.1654 5.1654 5.3897 5.3897 5.6338 5.6338 5.8733 5.8733 5.9966 5.9966 6.0001 6.0001 6.3695 6.3695 6.4084 6.4084 6.7832 6.7832 8.2228 8.2228 9.3756 9.3756 9.4039 9.4039 12.0912 12.0912 13.8300 13.8300 19.5964 19.5964 k = 0.4583-0.2646 0.3742 ( 8424 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5595 -3.5595 -3.5209 -3.5209 -3.5042 -3.5042 3.7804 3.7804 4.6649 4.6649 5.1657 5.1657 5.3850 5.3850 5.6335 5.6335 5.8724 5.8724 6.0065 6.0065 6.0131 6.0131 6.3689 6.3689 6.4424 6.4424 6.7897 6.7897 8.1405 8.1405 9.3447 9.3447 9.3716 9.3716 12.0843 12.0843 13.8219 13.8219 19.7443 19.7443 k = 0.4688-0.2706 0.3827 ( 8424 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5595 -3.5595 -3.5209 -3.5209 -3.5041 -3.5041 3.7972 3.7972 4.6630 4.6630 5.1659 5.1659 5.3811 5.3811 5.6332 5.6332 5.8715 5.8715 6.0121 6.0121 6.0261 6.0261 6.3685 6.3685 6.4709 6.4709 6.7965 6.7965 8.0727 8.0727 9.3204 9.3204 9.3462 9.3462 12.0791 12.0791 13.8156 13.8156 19.8850 19.8850 k = 0.4792-0.2766 0.3912 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5595 -3.5595 -3.5209 -3.5209 -3.5040 -3.5040 3.8094 3.8094 4.6616 4.6616 5.1661 5.1661 5.3782 5.3782 5.6329 5.6329 5.8707 5.8707 6.0165 6.0165 6.0356 6.0356 6.3682 6.3682 6.4925 6.4925 6.8025 6.8025 8.0219 8.0219 9.3030 9.3030 9.3279 9.3279 12.0753 12.0753 13.8112 13.8112 20.0102 20.0102 k = 0.4896-0.2827 0.3997 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5039 -3.5039 3.8167 3.8167 4.6607 4.6607 5.1662 5.1662 5.3764 5.3764 5.6327 5.6327 5.8702 5.8702 6.0192 6.0192 6.0413 6.0413 6.3680 6.3680 6.5058 6.5058 6.8069 6.8069 7.9902 7.9902 9.2925 9.2925 9.3169 9.3169 12.0731 12.0731 13.8085 13.8085 20.1038 20.1038 k = 0.5000-0.2887 0.4082 ( 8480 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5039 -3.5039 3.8192 3.8192 4.6605 4.6605 5.1662 5.1662 5.3758 5.3758 5.6327 5.6327 5.8700 5.8700 6.0202 6.0202 6.0432 6.0432 6.3680 6.3680 6.5104 6.5104 6.8085 6.8085 7.9794 7.9794 9.2890 9.2890 9.3132 9.3132 12.0723 12.0723 13.8076 13.8076 20.1402 20.1402 k = 0.5000-0.2887 0.4082 ( 8480 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5039 -3.5039 3.8192 3.8192 4.6605 4.6605 5.1662 5.1662 5.3758 5.3758 5.6327 5.6327 5.8700 5.8700 6.0202 6.0202 6.0432 6.0432 6.3680 6.3680 6.5104 6.5104 6.8085 6.8085 7.9794 7.9794 9.2890 9.2890 9.3132 9.3132 12.0723 12.0723 13.8076 13.8076 20.1402 20.1402 k = 0.5000-0.2766 0.4168 ( 8452 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5039 -3.5039 3.8193 3.8193 4.6619 4.6619 5.1667 5.1667 5.3754 5.3754 5.6318 5.6318 5.8685 5.8685 6.0201 6.0201 6.0439 6.0439 6.3674 6.3674 6.5128 6.5128 6.8073 6.8073 7.9798 7.9798 9.2848 9.2848 9.3090 9.3090 12.0833 12.0833 13.8119 13.8119 20.1211 20.1211 k = 0.5000-0.2646 0.4253 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5040 -3.5040 3.8198 3.8198 4.6660 4.6660 5.1681 5.1681 5.3742 5.3742 5.6292 5.6292 5.8641 5.8641 6.0199 6.0199 6.0457 6.0457 6.3659 6.3659 6.5199 6.5199 6.8039 6.8039 7.9810 7.9810 9.2709 9.2709 9.2983 9.2983 12.1161 12.1161 13.8248 13.8248 20.0578 20.0578 k = 0.5000-0.2526 0.4338 ( 8426 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5594 -3.5594 -3.5208 -3.5208 -3.5041 -3.5041 3.8207 3.8207 4.6730 4.6730 5.1705 5.1705 5.3723 5.3723 5.6247 5.6247 5.8576 5.8576 6.0195 6.0195 6.0483 6.0483 6.3635 6.3635 6.5308 6.5308 6.7986 6.7986 7.9831 7.9831 9.2450 9.2450 9.2845 9.2845 12.1696 12.1696 13.8462 13.8462 19.9465 19.9465 k = 0.5000-0.2406 0.4423 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5594 -3.5594 -3.5207 -3.5207 -3.5042 -3.5042 3.8219 3.8219 4.6827 4.6827 5.1739 5.1739 5.3697 5.3697 5.6183 5.6183 5.8499 5.8499 6.0190 6.0190 6.0514 6.0514 6.3605 6.3605 6.5441 6.5441 6.7923 6.7923 7.9859 7.9859 9.2080 9.2080 9.2682 9.2682 12.2424 12.2424 13.8760 13.8760 19.7993 19.7993 k = 0.5000-0.2285 0.4508 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3793 -4.3793 -4.3745 -4.3745 -3.5594 -3.5594 -3.5206 -3.5206 -3.5044 -3.5044 3.8234 3.8234 4.6950 4.6950 5.1782 5.1782 5.3663 5.3663 5.6100 5.6100 5.8419 5.8419 6.0182 6.0182 6.0545 6.0545 6.3571 6.3571 6.5579 6.5579 6.7861 6.7861 7.9895 7.9895 9.1624 9.1624 9.2489 9.2489 12.3328 12.3328 13.9138 13.9138 19.6317 19.6317 k = 0.5000-0.2165 0.4593 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3793 -4.3793 -4.3746 -4.3746 -3.5593 -3.5593 -3.5205 -3.5205 -3.5046 -3.5046 3.8251 3.8251 4.7099 4.7099 5.1834 5.1834 5.3622 5.3622 5.5998 5.5998 5.8343 5.8343 6.0171 6.0171 6.0574 6.0574 6.3534 6.3534 6.5695 6.5695 6.7824 6.7824 7.9940 7.9940 9.1105 9.1105 9.2264 9.2264 12.4389 12.4389 13.9595 13.9595 19.4533 19.4533 k = 0.5000-0.2045 0.4678 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3793 -4.3793 -4.3746 -4.3746 -3.5593 -3.5593 -3.5204 -3.5204 -3.5049 -3.5049 3.8272 3.8272 4.7272 4.7272 5.1896 5.1896 5.3574 5.3574 5.5878 5.5878 5.8277 5.8277 6.0157 6.0157 6.0600 6.0600 6.3494 6.3494 6.5754 6.5754 6.7838 6.7838 7.9993 7.9993 9.0541 9.0541 9.2010 9.2010 12.5589 12.5589 14.0126 14.0126 19.2696 19.2696 k = 0.5000-0.1925 0.4763 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3792 -4.3792 -4.3747 -4.3747 -3.5592 -3.5592 -3.5202 -3.5202 -3.5052 -3.5052 3.8294 3.8294 4.7468 4.7468 5.1968 5.1968 5.3519 5.3519 5.5745 5.5745 5.8224 5.8224 6.0141 6.0141 6.0621 6.0621 6.3451 6.3451 6.5728 6.5728 6.7928 6.7928 8.0054 8.0054 8.9950 8.9950 9.1728 9.1728 12.6914 12.6914 14.0729 14.0729 19.0834 19.0834 k = 0.5000-0.1804 0.4848 ( 8426 PWs) bands (ev): -35.4325 -35.4325 -4.3791 -4.3791 -4.3747 -4.3747 -3.5591 -3.5591 -3.5200 -3.5200 -3.5055 -3.5055 3.8319 3.8319 4.7685 4.7685 5.2048 5.2048 5.3457 5.3457 5.5602 5.5602 5.8184 5.8184 6.0121 6.0121 6.0637 6.0637 6.3407 6.3407 6.5608 6.5608 6.8101 6.8101 8.0125 8.0125 8.9344 8.9344 9.1423 9.1423 12.8348 12.8348 14.1399 14.1399 18.8966 18.8966 k = 0.5000-0.1684 0.4933 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3791 -4.3791 -4.3748 -4.3748 -3.5591 -3.5591 -3.5198 -3.5198 -3.5059 -3.5059 3.8345 3.8345 4.7922 4.7922 5.2137 5.2137 5.3389 5.3389 5.5457 5.5457 5.8157 5.8157 6.0097 6.0097 6.0648 6.0648 6.3360 6.3360 6.5405 6.5405 6.8343 6.8343 8.0204 8.0204 8.8735 8.8735 9.1100 9.1100 12.9879 12.9879 14.2132 14.2132 18.7105 18.7105 k = 0.5000-0.1564 0.5018 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3790 -4.3790 -4.3749 -4.3749 -3.5590 -3.5590 -3.5196 -3.5196 -3.5062 -3.5062 3.8372 3.8372 4.8175 4.8175 5.2233 5.2233 5.3315 5.3315 5.5314 5.5314 5.8140 5.8140 6.0070 6.0070 6.0652 6.0652 6.3312 6.3312 6.5140 6.5140 6.8632 6.8632 8.0292 8.0292 8.8134 8.8134 9.0762 9.0762 13.1496 13.1496 14.2923 14.2923 18.5260 18.5260 k = 0.5000-0.1443 0.5103 ( 8454 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3749 -4.3749 -3.5589 -3.5589 -3.5194 -3.5194 -3.5066 -3.5066 3.8400 3.8400 4.8441 4.8441 5.2335 5.2335 5.3235 5.3235 5.5181 5.5181 5.8132 5.8132 6.0040 6.0040 6.0647 6.0647 6.3263 6.3263 6.4829 6.4829 6.8951 6.8951 8.0390 8.0390 8.7547 8.7547 9.0414 9.0414 13.3191 13.3191 14.3767 14.3767 18.3439 18.3439 k = 0.5000-0.1323 0.5188 ( 8452 PWs) bands (ev): -35.4325 -35.4325 -4.3788 -4.3788 -4.3750 -4.3750 -3.5588 -3.5588 -3.5191 -3.5191 -3.5071 -3.5071 3.8429 3.8429 4.8718 4.8718 5.2439 5.2439 5.3149 5.3149 5.5066 5.5066 5.8130 5.8130 6.0006 6.0006 6.0630 6.0630 6.3212 6.3212 6.4490 6.4490 6.9286 6.9286 8.0498 8.0498 8.6979 8.6979 9.0062 9.0062 13.4955 13.4955 14.4656 14.4656 18.1649 18.1649 k = 0.5000-0.1203 0.5273 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3788 -4.3788 -4.3751 -4.3751 -3.5588 -3.5588 -3.5189 -3.5189 -3.5075 -3.5075 3.8457 3.8457 4.9002 4.9002 5.2541 5.2541 5.3060 5.3060 5.4980 5.4980 5.8130 5.8130 5.9970 5.9970 6.0598 6.0598 6.3160 6.3160 6.4137 6.4137 6.9626 6.9626 8.0616 8.0616 8.6435 8.6435 8.9712 8.9712 13.6782 13.6782 14.5585 14.5585 17.9896 17.9896 k = 0.5000-0.1083 0.5358 ( 8458 PWs) bands (ev): -35.4325 -35.4325 -4.3787 -4.3787 -4.3751 -4.3751 -3.5587 -3.5587 -3.5186 -3.5186 -3.5080 -3.5080 3.8484 3.8484 4.9288 4.9288 5.2630 5.2630 5.2971 5.2971 5.4931 5.4931 5.8130 5.8130 5.9931 5.9931 6.0545 6.0545 6.3107 6.3107 6.3786 6.3786 6.9963 6.9963 8.0744 8.0744 8.5917 8.5917 8.9368 8.9368 13.8666 13.8666 14.6546 14.6546 17.8181 17.8181 k = 0.5000-0.0962 0.5443 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3752 -4.3752 -3.5586 -3.5586 -3.5183 -3.5183 -3.5084 -3.5084 3.8511 3.8511 4.9572 4.9572 5.2687 5.2687 5.2895 5.2895 5.4932 5.4932 5.8125 5.8125 5.9890 5.9890 6.0466 6.0466 6.3051 6.3051 6.3454 6.3454 7.0289 7.0289 8.0884 8.0884 8.5427 8.5427 8.9036 8.9036 14.0604 14.0604 14.7527 14.7527 17.6411 17.6411 k = 0.5000-0.0842 0.5528 ( 8458 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3753 -4.3753 -3.5586 -3.5586 -3.5180 -3.5180 -3.5089 -3.5089 3.8535 3.8535 4.9850 4.9850 5.2668 5.2668 5.2869 5.2869 5.4993 5.4993 5.8109 5.8109 5.9846 5.9846 6.0356 6.0356 6.2977 6.2977 6.3173 6.3173 7.0597 7.0597 8.1035 8.1035 8.4966 8.4966 8.8723 8.8723 14.2589 14.2589 14.8517 14.8517 17.4123 17.4123 k = 0.5000-0.0722 0.5613 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3754 -4.3754 -3.5585 -3.5585 -3.5177 -3.5177 -3.5093 -3.5093 3.8557 3.8557 5.0117 5.0117 5.2581 5.2581 5.2883 5.2883 5.5118 5.5118 5.8075 5.8075 5.9798 5.9798 6.0216 6.0216 6.2825 6.2825 6.3019 6.3019 7.0881 7.0881 8.1198 8.1198 8.4534 8.4534 8.8435 8.8435 14.4620 14.4620 14.9498 14.9498 17.1717 17.1717 k = 0.5000-0.0601 0.5698 ( 8464 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3754 -4.3754 -3.5585 -3.5585 -3.5174 -3.5174 -3.5097 -3.5097 3.8577 3.8577 5.0369 5.0369 5.2471 5.2471 5.2894 5.2894 5.5307 5.5307 5.8009 5.8009 5.9739 5.9739 6.0062 6.0062 6.2639 6.2639 6.2957 6.2957 7.1135 7.1135 8.1375 8.1375 8.4131 8.4131 8.8178 8.8178 14.6690 14.6690 15.0450 15.0450 16.9319 16.9319 k = 0.5000-0.0481 0.5784 ( 8458 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3755 -4.3755 -3.5584 -3.5584 -3.5171 -3.5171 -3.5101 -3.5101 3.8594 3.8594 5.0602 5.0602 5.2354 5.2354 5.2894 5.2894 5.5553 5.5553 5.7899 5.7899 5.9658 5.9658 5.9927 5.9927 6.2490 6.2490 6.2916 6.2916 7.1353 7.1353 8.1565 8.1565 8.3755 8.3755 8.7957 8.7957 14.8795 14.8795 15.1343 15.1343 16.6939 16.6939 k = 0.5000-0.0361 0.5869 ( 8452 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3755 -4.3755 -3.5584 -3.5584 -3.5169 -3.5169 -3.5104 -3.5104 3.8607 3.8607 5.0811 5.0811 5.2235 5.2235 5.2887 5.2887 5.5844 5.5844 5.7730 5.7730 5.9551 5.9551 5.9841 5.9841 6.2386 6.2386 6.2884 6.2884 7.1528 7.1528 8.1769 8.1769 8.3407 8.3407 8.7779 8.7779 15.0910 15.0910 15.2157 15.2157 16.4582 16.4582 k = 0.5000-0.0241 0.5954 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5167 -3.5167 -3.5106 -3.5106 3.8617 3.8617 5.0985 5.0985 5.2125 5.2125 5.2878 5.2878 5.6168 5.6168 5.7497 5.7497 5.9451 5.9451 5.9794 5.9794 6.2319 6.2319 6.2861 6.2861 7.1658 7.1658 8.1988 8.1988 8.3085 8.3085 8.7648 8.7648 15.2571 15.2571 15.3302 15.3302 16.2251 16.2251 k = 0.5000-0.0120 0.6039 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5584 -3.5584 -3.5166 -3.5166 -3.5108 -3.5108 3.8623 3.8623 5.1109 5.1109 5.2039 5.2039 5.2871 5.2871 5.6506 5.6506 5.7213 5.7213 5.9386 5.9386 5.9771 5.9771 6.2282 6.2282 6.2847 6.2847 7.1737 7.1737 8.2219 8.2219 8.2793 8.2793 8.7567 8.7567 15.3076 15.3076 15.5415 15.5415 15.9951 15.9951 k = 0.5000-0.0000 0.6124 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5165 -3.5165 -3.5109 -3.5109 3.8625 3.8625 5.1156 5.1156 5.2005 5.2005 5.2868 5.2868 5.6767 5.6767 5.6968 5.6968 5.9364 5.9364 5.9764 5.9764 6.2270 6.2270 6.2842 6.2842 7.1763 7.1763 8.2396 8.2396 8.2596 8.2596 8.7540 8.7540 15.3228 15.3228 15.7425 15.7425 15.7901 15.7901 k = 0.5000-0.0000 0.6124 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5165 -3.5165 -3.5109 -3.5109 3.8625 3.8625 5.1156 5.1156 5.2005 5.2005 5.2868 5.2868 5.6767 5.6767 5.6968 5.6968 5.9364 5.9364 5.9764 5.9764 6.2270 6.2270 6.2842 6.2842 7.1763 7.1763 8.2396 8.2396 8.2596 8.2596 8.7540 8.7540 15.3228 15.3228 15.7425 15.7425 15.7901 15.7901 k = 0.4926 0.0127 0.6124 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5584 -3.5584 -3.5165 -3.5165 -3.5108 -3.5108 3.8620 3.8620 5.1135 5.1135 5.2024 5.2024 5.2871 5.2871 5.6601 5.6601 5.7124 5.7124 5.9374 5.9374 5.9765 5.9765 6.2275 6.2275 6.2843 6.2843 7.1732 7.1732 8.2274 8.2274 8.2649 8.2649 8.7687 8.7687 15.2955 15.2955 15.6243 15.6243 15.9292 15.9292 k = 0.4853 0.0255 0.6124 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5584 -3.5584 -3.5166 -3.5166 -3.5107 -3.5107 3.8605 3.8605 5.1080 5.1080 5.2071 5.2071 5.2879 5.2879 5.6363 5.6363 5.7327 5.7327 5.9407 5.9407 5.9769 5.9769 6.2290 6.2290 6.2845 6.2845 7.1649 7.1649 8.2102 8.2102 8.2594 8.2594 8.8135 8.8135 15.1885 15.1885 15.5528 15.5528 16.0927 16.0927 k = 0.4779 0.0382 0.6124 ( 8438 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5167 -3.5167 -3.5106 -3.5106 3.8583 3.8583 5.1003 5.1003 5.2136 5.2136 5.2892 5.2892 5.6126 5.6126 5.7501 5.7501 5.9462 5.9462 5.9779 5.9779 6.2315 6.2315 6.2848 6.2848 7.1530 7.1530 8.1920 8.1920 8.2410 8.2410 8.8844 8.8844 15.0194 15.0194 15.5354 15.5354 16.2597 16.2597 k = 0.4706 0.0509 0.6124 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5169 -3.5169 -3.5105 -3.5105 3.8555 3.8555 5.0915 5.0915 5.2207 5.2207 5.2910 5.2910 5.5900 5.5900 5.7634 5.7634 5.9538 5.9538 5.9798 5.9798 6.2355 6.2355 6.2850 6.2850 7.1386 7.1386 8.1704 8.1704 8.2173 8.2173 8.9744 8.9744 14.8278 14.8278 15.5364 15.5364 16.4299 16.4299 k = 0.4632 0.0637 0.6124 ( 8457 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5171 -3.5171 -3.5103 -3.5103 3.8522 3.8522 5.0821 5.0821 5.2277 5.2277 5.2934 5.2934 5.5692 5.5692 5.7717 5.7717 5.9625 5.9625 5.9836 5.9836 6.2409 6.2409 6.2853 6.2853 7.1229 7.1229 8.1413 8.1413 8.1968 8.1968 9.0773 9.0773 14.6303 14.6303 15.5417 15.5417 16.6029 16.6029 k = 0.4559 0.0764 0.6124 ( 8447 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3755 -4.3755 -3.5584 -3.5584 -3.5173 -3.5173 -3.5101 -3.5101 3.8486 3.8486 5.0727 5.0727 5.2342 5.2342 5.2961 5.2961 5.5507 5.5507 5.7754 5.7754 5.9697 5.9697 5.9909 5.9909 6.2479 6.2479 6.2858 6.2858 7.1064 7.1064 8.1055 8.1055 8.1820 8.1820 9.1887 9.1887 14.4333 14.4333 15.5472 15.5472 16.7785 16.7785 k = 0.4485 0.0891 0.6124 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3755 -4.3755 -3.5584 -3.5584 -3.5175 -3.5175 -3.5099 -3.5099 3.8448 3.8448 5.0634 5.0634 5.2400 5.2400 5.2991 5.2991 5.5348 5.5348 5.7749 5.7749 5.9745 5.9745 6.0017 6.0017 6.2564 6.2564 6.2867 6.2867 7.0896 7.0896 8.0668 8.0668 8.1710 8.1710 9.3051 9.3051 14.2400 14.2400 15.5517 15.5517 16.9565 16.9565 k = 0.4412 0.1019 0.6124 ( 8453 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3755 -4.3755 -3.5584 -3.5584 -3.5177 -3.5177 -3.5097 -3.5097 3.8411 3.8411 5.0544 5.0544 5.2448 5.2448 5.3022 5.3022 5.5218 5.5218 5.7712 5.7712 5.9778 5.9778 6.0138 6.0138 6.2654 6.2654 6.2892 6.2892 7.0730 7.0730 8.0280 8.0280 8.1624 8.1624 9.4239 9.4239 14.0527 14.0527 15.5550 15.5550 17.1365 17.1365 k = 0.4338 0.1146 0.6124 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3755 -4.3755 -3.5584 -3.5584 -3.5179 -3.5179 -3.5095 -3.5095 3.8373 3.8373 5.0460 5.0460 5.2486 5.2486 5.3052 5.3052 5.5119 5.5119 5.7649 5.7649 5.9807 5.9807 6.0254 6.0254 6.2723 6.2723 6.2956 6.2956 7.0568 7.0568 7.9906 7.9906 8.1553 8.1553 9.5427 9.5427 13.8735 13.8735 15.5572 15.5572 17.3172 17.3172 k = 0.4265 0.1274 0.6124 ( 8454 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5181 -3.5181 -3.5093 -3.5093 3.8338 3.8338 5.0383 5.0383 5.2513 5.2513 5.3078 5.3078 5.5050 5.5050 5.7570 5.7570 5.9833 5.9833 6.0356 6.0356 6.2756 6.2756 6.3071 6.3071 7.0414 7.0414 7.9558 7.9558 8.1495 8.1495 9.6590 9.6590 13.7044 13.7044 15.5585 15.5585 17.4905 17.4905 k = 0.4191 0.1401 0.6124 ( 8457 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5183 -3.5183 -3.5091 -3.5091 3.8306 3.8306 5.0313 5.0313 5.2532 5.2532 5.3100 5.3100 5.5011 5.5011 5.7481 5.7481 5.9856 5.9856 6.0441 6.0441 6.2766 6.2766 6.3216 6.3216 7.0269 7.0269 7.9242 7.9242 8.1447 8.1447 9.7703 9.7703 13.5477 13.5477 15.5592 15.5592 17.6189 17.6189 k = 0.4118 0.1528 0.6124 ( 8461 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5184 -3.5184 -3.5090 -3.5090 3.8277 3.8277 5.0251 5.0251 5.2543 5.2543 5.3117 5.3117 5.4996 5.4996 5.7389 5.7389 5.9878 5.9878 6.0508 6.0508 6.2768 6.2768 6.3368 6.3368 7.0137 7.0137 7.8966 7.8966 8.1409 8.1409 9.8737 9.8737 13.4062 13.4062 15.5594 15.5594 17.7259 17.7259 k = 0.4044 0.1656 0.6124 ( 8461 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3754 -4.3754 -3.5584 -3.5584 -3.5186 -3.5186 -3.5088 -3.5088 3.8253 3.8253 5.0200 5.0200 5.2549 5.2549 5.3130 5.3130 5.4999 5.4999 5.7301 5.7301 5.9896 5.9896 6.0559 6.0559 6.2767 6.2767 6.3513 6.3513 7.0022 7.0022 7.8733 7.8733 8.1378 8.1378 9.9658 9.9658 13.2831 13.2831 15.5593 15.5593 17.8273 17.8273 k = 0.3971 0.1783 0.6124 ( 8463 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5187 -3.5187 -3.5087 -3.5087 3.8233 3.8233 5.0159 5.0159 5.2551 5.2551 5.3138 5.3138 5.5013 5.5013 5.7223 5.7223 5.9911 5.9911 6.0597 6.0597 6.2766 6.2766 6.3639 6.3639 6.9926 6.9926 7.8547 7.8547 8.1355 8.1355 10.0431 10.0431 13.1819 13.1819 15.5591 15.5591 17.9204 17.9204 k = 0.3897 0.1910 0.6124 ( 8460 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5187 -3.5187 -3.5087 -3.5087 3.8218 3.8218 5.0129 5.0129 5.2550 5.2550 5.3144 5.3144 5.5030 5.5030 5.7161 5.7161 5.9922 5.9922 6.0622 6.0622 6.2764 6.2764 6.3737 6.3737 6.9854 6.9854 7.8412 7.8412 8.1339 8.1339 10.1018 10.1018 13.1060 13.1060 15.5589 15.5589 17.9989 17.9989 k = 0.3824 0.2038 0.6124 ( 8458 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8210 3.8210 5.0111 5.0111 5.2550 5.2550 5.3147 5.3147 5.5044 5.5044 5.7121 5.7121 5.9929 5.9929 6.0636 6.0636 6.2762 6.2762 6.3799 6.3799 6.9809 6.9809 7.8330 7.8330 8.1329 8.1329 10.1386 10.1386 13.0590 13.0590 15.5587 15.5587 18.0533 18.0533 k = 0.3750 0.2165 0.6124 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8207 3.8207 5.0105 5.0105 5.2549 5.2549 5.3148 5.3148 5.5049 5.5049 5.7108 5.7108 5.9932 5.9932 6.0641 6.0641 6.2762 6.2762 6.3820 6.3820 6.9794 6.9794 7.8303 7.8303 8.1326 8.1326 10.1512 10.1512 13.0430 13.0430 15.5586 15.5586 18.0731 18.0731 k = 0.3750 0.2165 0.6124 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8207 3.8207 5.0105 5.0105 5.2549 5.2549 5.3148 5.3148 5.5049 5.5049 5.7108 5.7108 5.9932 5.9932 6.0641 6.0641 6.2762 6.2762 6.3820 6.3820 6.9794 6.9794 7.8303 7.8303 8.1326 8.1326 10.1512 10.1512 13.0430 13.0430 15.5586 15.5586 18.0731 18.0731 k = 0.3676 0.2123 0.6004 ( 8460 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5187 -3.5187 -3.5090 -3.5090 3.8144 3.8144 5.0437 5.0437 5.2500 5.2500 5.3237 5.3237 5.5016 5.5016 5.7010 5.7010 5.9888 5.9888 6.0612 6.0612 6.2671 6.2671 6.3567 6.3567 6.9483 6.9483 7.8101 7.8101 8.1553 8.1553 10.2398 10.2398 13.0723 13.0723 15.7661 15.7661 17.9491 17.9491 k = 0.3603 0.2080 0.5884 ( 8466 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3756 -4.3756 -3.5583 -3.5583 -3.5186 -3.5186 -3.5094 -3.5094 3.8063 3.8063 5.0760 5.0760 5.2433 5.2433 5.3346 5.3346 5.5004 5.5004 5.6916 5.6916 5.9837 5.9837 6.0574 6.0574 6.2579 6.2579 6.3333 6.3333 6.8990 6.8990 7.8144 7.8144 8.1805 8.1805 10.3313 10.3313 13.0994 13.0994 15.9778 15.9778 17.8280 17.8280 k = 0.3529 0.2038 0.5764 ( 8470 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3757 -4.3757 -3.5582 -3.5582 -3.5185 -3.5185 -3.5097 -3.5097 3.7963 3.7963 5.1067 5.1067 5.2357 5.2357 5.3462 5.3462 5.5019 5.5019 5.6824 5.6824 5.9778 5.9778 6.0526 6.0526 6.2483 6.2483 6.3124 6.3124 6.8357 6.8357 7.8396 7.8396 8.2084 8.2084 10.4254 10.4254 13.1248 13.1248 16.1919 16.1919 17.7098 17.7098 k = 0.3456 0.1995 0.5643 ( 8470 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3759 -4.3759 -3.5582 -3.5582 -3.5184 -3.5184 -3.5101 -3.5101 3.7840 3.7840 5.1350 5.1350 5.2276 5.2276 5.3577 5.3577 5.5067 5.5067 5.6737 5.6737 5.9706 5.9706 6.0469 6.0469 6.2384 6.2384 6.2949 6.2949 6.7632 6.7632 7.8812 7.8812 8.2392 8.2392 10.5221 10.5221 13.1491 13.1491 16.4061 16.4061 17.5946 17.5946 k = 0.3382 0.1953 0.5523 ( 8478 PWs) bands (ev): -35.4326 -35.4326 -4.3783 -4.3783 -4.3760 -4.3760 -3.5581 -3.5581 -3.5184 -3.5184 -3.5104 -3.5104 3.7694 3.7694 5.1602 5.1602 5.2195 5.2195 5.3683 5.3683 5.5152 5.5152 5.6654 5.6654 5.9619 5.9619 6.0403 6.0403 6.2282 6.2282 6.2811 6.2811 6.6861 6.6861 7.9352 7.9352 8.2730 8.2730 10.6211 10.6211 13.1725 13.1725 16.6176 16.6176 17.4824 17.4824 k = 0.3309 0.1910 0.5403 ( 8470 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3761 -4.3761 -3.5581 -3.5581 -3.5184 -3.5184 -3.5106 -3.5106 3.7522 3.7522 5.1813 5.1813 5.2115 5.2115 5.3774 5.3774 5.5278 5.5278 5.6577 5.6577 5.9514 5.9514 6.0333 6.0333 6.2181 6.2181 6.2710 6.2710 6.6080 6.6080 7.9986 7.9986 8.3101 8.3101 10.7224 10.7224 13.1953 13.1953 16.8217 16.8217 17.3732 17.3732 k = 0.3235 0.1868 0.5283 ( 8470 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3762 -4.3762 -3.5581 -3.5581 -3.5184 -3.5184 -3.5109 -3.5109 3.7323 3.7323 5.1951 5.1951 5.2067 5.2067 5.3849 5.3849 5.5440 5.5440 5.6506 5.6506 5.9390 5.9390 6.0261 6.0261 6.2088 6.2088 6.2643 6.2643 6.5316 6.5316 8.0694 8.0694 8.3507 8.3507 10.8258 10.8258 13.2180 13.2180 17.0108 17.0108 17.2671 17.2671 k = 0.3162 0.1825 0.5163 ( 8464 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3763 -4.3763 -3.5581 -3.5581 -3.5185 -3.5185 -3.5111 -3.5111 3.7097 3.7097 5.1913 5.1913 5.2151 5.2151 5.3908 5.3908 5.5627 5.5627 5.6443 5.6443 5.9247 5.9247 6.0189 6.0189 6.2009 6.2009 6.2604 6.2604 6.4590 6.4590 8.1461 8.1461 8.3951 8.3951 10.9312 10.9312 13.2406 13.2406 17.1588 17.1588 17.1787 17.1787 k = 0.3088 0.1783 0.5043 ( 8452 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3764 -4.3764 -3.5580 -3.5580 -3.5186 -3.5186 -3.5112 -3.5112 3.6841 3.6841 5.1828 5.1828 5.2238 5.2238 5.3952 5.3952 5.5811 5.5811 5.6399 5.6399 5.9093 5.9093 6.0117 6.0117 6.1950 6.1950 6.2588 6.2588 6.3921 6.3921 8.2277 8.2277 8.4435 8.4435 11.0386 11.0386 13.2633 13.2633 17.0632 17.0632 17.2934 17.2934 k = 0.3015 0.1741 0.4923 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3765 -4.3765 -3.5581 -3.5581 -3.5187 -3.5187 -3.5114 -3.5114 3.6557 3.6557 5.1736 5.1736 5.2290 5.2290 5.3985 5.3985 5.5942 5.5942 5.6401 5.6401 5.8937 5.8937 6.0043 6.0043 6.1912 6.1912 6.2590 6.2590 6.3326 6.3326 8.3135 8.3135 8.4962 8.4962 11.1477 11.1477 13.2863 13.2863 16.9661 16.9661 17.3052 17.3052 k = 0.2941 0.1698 0.4803 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3766 -4.3766 -3.5581 -3.5581 -3.5189 -3.5189 -3.5115 -3.5115 3.6242 3.6242 5.1639 5.1639 5.2308 5.2308 5.4007 5.4007 5.5967 5.5967 5.6472 5.6472 5.8801 5.8801 5.9966 5.9966 6.1891 6.1891 6.2605 6.2605 6.2828 6.2828 8.4027 8.4027 8.5536 8.5536 11.2586 11.2586 13.3097 13.3097 16.8721 16.8721 17.2010 17.2010 k = 0.2868 0.1656 0.4683 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3767 -4.3767 -3.5581 -3.5581 -3.5191 -3.5191 -3.5116 -3.5116 3.5899 3.5899 5.1537 5.1537 5.2294 5.2294 5.4019 5.4019 5.5908 5.5908 5.6555 5.6555 5.8713 5.8713 5.9884 5.9884 6.1862 6.1862 6.2436 6.2436 6.2656 6.2656 8.4947 8.4947 8.6164 8.6164 11.3710 11.3710 13.3337 13.3337 16.7810 16.7810 17.0962 17.0962 k = 0.2794 0.1613 0.4563 ( 8456 PWs) bands (ev): -35.4326 -35.4326 -4.3782 -4.3782 -4.3768 -4.3768 -3.5581 -3.5581 -3.5192 -3.5192 -3.5118 -3.5118 3.5527 3.5527 5.1430 5.1430 5.2254 5.2254 5.4018 5.4018 5.5803 5.5803 5.6577 5.6577 5.8703 5.8703 5.9799 5.9799 6.1759 6.1759 6.2253 6.2253 6.2703 6.2703 8.5887 8.5887 8.6852 8.6852 11.4850 11.4850 13.3583 13.3583 16.6930 16.6930 16.9944 16.9944 k = 0.2721 0.1571 0.4443 ( 8450 PWs) bands (ev): -35.4326 -35.4326 -4.3783 -4.3783 -4.3769 -4.3769 -3.5582 -3.5582 -3.5194 -3.5194 -3.5119 -3.5119 3.5128 3.5128 5.1317 5.1317 5.2190 5.2190 5.4004 5.4004 5.5668 5.5668 5.6511 5.6511 5.8785 5.8785 5.9713 5.9713 6.1585 6.1585 6.2249 6.2249 6.2771 6.2771 8.6831 8.6831 8.7615 8.7615 11.6003 11.6003 13.3835 13.3835 16.6081 16.6081 16.8959 16.8959 k = 0.2647 0.1528 0.4323 ( 8450 PWs) bands (ev): -35.4326 -35.4326 -4.3783 -4.3783 -4.3770 -4.3770 -3.5582 -3.5582 -3.5196 -3.5196 -3.5120 -3.5120 3.4703 3.4703 5.1199 5.1199 5.2107 5.2107 5.3974 5.3974 5.5508 5.5508 5.6368 5.6368 5.8945 5.8945 5.9635 5.9635 6.1427 6.1427 6.2323 6.2323 6.2858 6.2858 8.7764 8.7764 8.8470 8.8470 11.7170 11.7170 13.4095 13.4095 16.5262 16.5262 16.8006 16.8006 k = 0.2574 0.1486 0.4203 ( 8456 PWs) bands (ev): -35.4326 -35.4326 -4.3784 -4.3784 -4.3771 -4.3771 -3.5583 -3.5583 -3.5198 -3.5198 -3.5121 -3.5121 3.4254 3.4254 5.1074 5.1074 5.2008 5.2008 5.3925 5.3925 5.5327 5.5327 5.6178 5.6178 5.9149 5.9149 5.9580 5.9580 6.1312 6.1312 6.2427 6.2427 6.2968 6.2968 8.8679 8.8679 8.9424 8.9424 11.8348 11.8348 13.4363 13.4363 16.4474 16.4474 16.7086 16.7086 k = 0.2500 0.1443 0.4082 ( 8452 PWs) bands (ev): -35.4326 -35.4326 -4.3785 -4.3785 -4.3772 -4.3772 -3.5584 -3.5584 -3.5200 -3.5200 -3.5122 -3.5122 3.3784 3.3784 5.0944 5.0944 5.1896 5.1896 5.3854 5.3854 5.5130 5.5130 5.5965 5.5965 5.9334 5.9334 5.9595 5.9595 6.1240 6.1240 6.2541 6.2541 6.3105 6.3105 8.9595 8.9595 9.0458 9.0458 11.9536 11.9536 13.4639 13.4639 16.3716 16.3716 16.6195 16.6195 k = 0.2426 0.1401 0.3962 ( 8452 PWs) bands (ev): -35.4326 -35.4326 -4.3785 -4.3785 -4.3773 -4.3773 -3.5584 -3.5584 -3.5202 -3.5202 -3.5124 -3.5124 3.3294 3.3294 5.0808 5.0808 5.1774 5.1774 5.3760 5.3760 5.4926 5.4926 5.5742 5.5742 5.9395 5.9395 5.9775 5.9775 6.1204 6.1204 6.2654 6.2654 6.3270 6.3270 9.0533 9.0533 9.1550 9.1550 12.0734 12.0734 13.4923 13.4923 16.2990 16.2990 16.5332 16.5332 k = 0.2353 0.1358 0.3842 ( 8460 PWs) bands (ev): -35.4326 -35.4326 -4.3786 -4.3786 -4.3774 -4.3774 -3.5585 -3.5585 -3.5203 -3.5203 -3.5126 -3.5126 3.2789 3.2789 5.0668 5.0668 5.1643 5.1643 5.3645 5.3645 5.4721 5.4721 5.5516 5.5516 5.9409 5.9409 6.0036 6.0036 6.1199 6.1199 6.2764 6.2764 6.3459 6.3459 9.1508 9.1508 9.2688 9.2688 12.1939 12.1939 13.5216 13.5216 16.2294 16.2294 16.4485 16.4485 k = 0.2279 0.1316 0.3722 ( 8444 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3775 -4.3775 -3.5586 -3.5586 -3.5205 -3.5205 -3.5128 -3.5128 3.2270 3.2270 5.0524 5.0524 5.1505 5.1505 5.3511 5.3511 5.4520 5.4520 5.5289 5.5289 5.9433 5.9433 6.0310 6.0310 6.1223 6.1223 6.2868 6.2868 6.3668 6.3668 9.2527 9.2527 9.3862 9.3862 12.3151 12.3151 13.5516 13.5516 16.1630 16.1630 16.3617 16.3617 k = 0.2206 0.1274 0.3602 ( 8438 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3776 -4.3776 -3.5587 -3.5587 -3.5206 -3.5206 -3.5130 -3.5130 3.1740 3.1740 5.0377 5.0377 5.1362 5.1362 5.3363 5.3363 5.4325 5.4325 5.5063 5.5063 5.9477 5.9477 6.0577 6.0577 6.1282 6.1282 6.2970 6.2970 6.3889 6.3889 9.3593 9.3593 9.5070 9.5070 12.4368 12.4368 13.5825 13.5825 16.0996 16.0996 16.2602 16.2602 k = 0.2132 0.1231 0.3482 ( 8430 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3777 -4.3777 -3.5588 -3.5588 -3.5208 -3.5208 -3.5132 -3.5132 3.1203 3.1203 5.0229 5.0229 5.1214 5.1214 5.3207 5.3207 5.4133 5.4133 5.4838 5.4838 5.9542 5.9542 6.0811 6.0811 6.1391 6.1391 6.3071 6.3071 6.4116 6.4116 9.4708 9.4708 9.6310 9.6310 12.5587 12.5587 13.6140 13.6140 16.0392 16.0392 16.1454 16.1454 k = 0.2059 0.1189 0.3362 ( 8438 PWs) bands (ev): -35.4326 -35.4326 -4.3790 -4.3790 -4.3778 -4.3778 -3.5589 -3.5589 -3.5209 -3.5209 -3.5134 -3.5134 3.0662 3.0662 5.0081 5.0081 5.1063 5.1063 5.3049 5.3049 5.3944 5.3944 5.4614 5.4614 5.9625 5.9625 6.0988 6.0988 6.1572 6.1572 6.3172 6.3172 6.4346 6.4346 9.5873 9.5873 9.7580 9.7580 12.6807 12.6807 13.6463 13.6463 15.9804 15.9804 16.0302 16.0302 k = 0.1985 0.1146 0.3242 ( 8444 PWs) bands (ev): -35.4326 -35.4326 -4.3791 -4.3791 -4.3779 -4.3779 -3.5590 -3.5590 -3.5210 -3.5210 -3.5137 -3.5137 3.0119 3.0119 4.9933 4.9933 5.0910 5.0910 5.2893 5.2893 5.3756 5.3756 5.4394 5.4394 5.9725 5.9725 6.1110 6.1110 6.1817 6.1817 6.3274 6.3274 6.4575 6.4575 9.7088 9.7088 9.8879 9.8879 12.8026 12.8026 13.6791 13.6791 15.9036 15.9036 15.9378 15.9378 k = 0.1912 0.1104 0.3122 ( 8438 PWs) bands (ev): -35.4326 -35.4326 -4.3791 -4.3791 -4.3780 -4.3780 -3.5592 -3.5592 -3.5211 -3.5211 -3.5140 -3.5140 2.9578 2.9578 4.9788 4.9788 5.0754 5.0754 5.2743 5.2743 5.3567 5.3567 5.4178 5.4178 5.9839 5.9839 6.1203 6.1203 6.2100 6.2100 6.3376 6.3376 6.4800 6.4800 9.8352 9.8352 10.0207 10.0207 12.9240 12.9240 13.7125 13.7125 15.7943 15.7943 15.8835 15.8835 k = 0.1838 0.1061 0.3002 ( 8434 PWs) bands (ev): -35.4326 -35.4326 -4.3792 -4.3792 -4.3781 -4.3781 -3.5593 -3.5593 -3.5212 -3.5212 -3.5143 -3.5143 2.9040 2.9040 4.9645 4.9645 5.0596 5.0596 5.2600 5.2600 5.3376 5.3376 5.3967 5.3967 5.9964 5.9964 6.1283 6.1283 6.2400 6.2400 6.3480 6.3480 6.5019 6.5019 9.9665 9.9665 10.1564 10.1564 13.0446 13.0446 13.7463 13.7463 15.6841 15.6841 15.8363 15.8363 k = 0.1765 0.1019 0.2882 ( 8422 PWs) bands (ev): -35.4326 -35.4326 -4.3793 -4.3793 -4.3782 -4.3782 -3.5594 -3.5594 -3.5213 -3.5213 -3.5147 -3.5147 2.8508 2.8508 4.9507 4.9507 5.0437 5.0437 5.2465 5.2465 5.3183 5.3183 5.3764 5.3764 6.0098 6.0098 6.1359 6.1359 6.2708 6.2708 6.3585 6.3585 6.5230 6.5230 10.1026 10.1026 10.2949 10.2949 13.1641 13.1641 13.7804 13.7804 15.5762 15.5762 15.7932 15.7932 k = 0.1691 0.0976 0.2762 ( 8422 PWs) bands (ev): -35.4326 -35.4326 -4.3794 -4.3794 -4.3784 -4.3784 -3.5595 -3.5595 -3.5213 -3.5213 -3.5150 -3.5150 2.7985 2.7985 4.9373 4.9373 5.0278 5.0278 5.2338 5.2338 5.2990 5.2990 5.3567 5.3567 6.0238 6.0238 6.1433 6.1433 6.3019 6.3019 6.3692 6.3692 6.5433 6.5433 10.2433 10.2433 10.4362 10.4362 13.2821 13.2821 13.8146 13.8146 15.4713 15.4713 15.7535 15.7535 k = 0.1618 0.0934 0.2642 ( 8408 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3785 -4.3785 -3.5596 -3.5596 -3.5214 -3.5214 -3.5154 -3.5154 2.7472 2.7472 4.9244 4.9244 5.0119 5.0119 5.2219 5.2219 5.2798 5.2798 5.3379 5.3379 6.0382 6.0382 6.1506 6.1506 6.3331 6.3331 6.3800 6.3800 6.5627 6.5627 10.3886 10.3886 10.5803 10.5803 13.3981 13.3981 13.8490 13.8490 15.3695 15.3695 15.7169 15.7169 k = 0.1544 0.0891 0.2522 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3796 -4.3796 -4.3786 -4.3786 -3.5597 -3.5597 -3.5214 -3.5214 -3.5157 -3.5157 2.6972 2.6972 4.9121 4.9121 4.9961 4.9961 5.2106 5.2106 5.2610 5.2610 5.3199 5.3199 6.0529 6.0529 6.1578 6.1578 6.3641 6.3641 6.3908 6.3908 6.5811 6.5811 10.5383 10.5383 10.7272 10.7272 13.5114 13.5114 13.8833 13.8833 15.2711 15.2711 15.6820 15.6820 k = 0.1471 0.0849 0.2401 ( 8420 PWs) bands (ev): -35.4326 -35.4326 -4.3797 -4.3797 -4.3788 -4.3788 -3.5599 -3.5599 -3.5214 -3.5214 -3.5161 -3.5161 2.6486 2.6486 4.9003 4.9003 4.9804 4.9804 5.1998 5.1998 5.2428 5.2428 5.3027 5.3027 6.0677 6.0677 6.1650 6.1650 6.3947 6.3947 6.4017 6.4017 6.5985 6.5985 10.6923 10.6923 10.8768 10.8768 13.6215 13.6215 13.9174 13.9174 15.1761 15.1761 15.6460 15.6460 k = 0.1397 0.0807 0.2281 ( 8426 PWs) bands (ev): -35.4326 -35.4326 -4.3798 -4.3798 -4.3789 -4.3789 -3.5600 -3.5600 -3.5215 -3.5215 -3.5165 -3.5165 2.6016 2.6016 4.8892 4.8892 4.9649 4.9649 5.1893 5.1893 5.2256 5.2256 5.2863 5.2863 6.0825 6.0825 6.1721 6.1721 6.4125 6.4125 6.4249 6.4249 6.6150 6.6150 10.8505 10.8505 11.0290 11.0290 13.7273 13.7273 13.9513 13.9513 15.0849 15.0849 15.6061 15.6061 k = 0.1324 0.0764 0.2161 ( 8428 PWs) bands (ev): -35.4326 -35.4326 -4.3798 -4.3798 -4.3790 -4.3790 -3.5601 -3.5601 -3.5215 -3.5215 -3.5169 -3.5169 2.5563 2.5563 4.8785 4.8785 4.9496 4.9496 5.1785 5.1785 5.2099 5.2099 5.2706 5.2706 6.0970 6.0970 6.1790 6.1790 6.4233 6.4233 6.4545 6.4545 6.6305 6.6305 11.0127 11.0127 11.1840 11.1840 13.8278 13.8278 13.9853 13.9853 14.9975 14.9975 15.5632 15.5632 k = 0.1250 0.0722 0.2041 ( 8400 PWs) bands (ev): -35.4326 -35.4326 -4.3799 -4.3799 -4.3792 -4.3792 -3.5602 -3.5602 -3.5215 -3.5215 -3.5173 -3.5173 2.5128 2.5128 4.8685 4.8685 4.9346 4.9346 5.1671 5.1671 5.1962 5.1962 5.2557 5.2557 6.1113 6.1113 6.1857 6.1857 6.4339 6.4339 6.4833 6.4833 6.6450 6.6450 11.1787 11.1787 11.3416 11.3416 13.9206 13.9206 14.0204 14.0204 14.9141 14.9141 15.5194 15.5194 k = 0.1176 0.0679 0.1921 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3800 -4.3800 -4.3793 -4.3793 -3.5603 -3.5603 -3.5215 -3.5215 -3.5176 -3.5176 2.4713 2.4713 4.8591 4.8591 4.9199 4.9199 5.1549 5.1549 5.1849 5.1849 5.2416 5.2416 6.1252 6.1252 6.1922 6.1922 6.4444 6.4444 6.5113 6.5113 6.6585 6.6585 11.3484 11.3484 11.5019 11.5019 13.9996 13.9996 14.0619 14.0619 14.8348 14.8348 15.4759 15.4759 k = 0.1103 0.0637 0.1801 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3800 -4.3800 -4.3794 -4.3794 -3.5604 -3.5604 -3.5215 -3.5215 -3.5180 -3.5180 2.4319 2.4319 4.8502 4.8502 4.9057 4.9057 5.1421 5.1421 5.1757 5.1757 5.2282 5.2282 6.1386 6.1386 6.1984 6.1984 6.4547 6.4547 6.5383 6.5383 6.6710 6.6710 11.5216 11.5216 11.6648 11.6648 14.0524 14.0524 14.1210 14.1210 14.7599 14.7599 15.4333 15.4333 k = 0.1029 0.0594 0.1681 ( 8440 PWs) bands (ev): -35.4326 -35.4326 -4.3801 -4.3801 -4.3795 -4.3795 -3.5605 -3.5605 -3.5215 -3.5215 -3.5184 -3.5184 2.3947 2.3947 4.8419 4.8419 4.8919 4.8919 5.1293 5.1293 5.1681 5.1681 5.2156 5.2156 6.1515 6.1515 6.2043 6.2043 6.4646 6.4646 6.5642 6.5642 6.6827 6.6827 11.6981 11.6981 11.8302 11.8302 14.0868 14.0868 14.1890 14.1890 14.6896 14.6896 15.3919 15.3919 k = 0.0956 0.0552 0.1561 ( 8450 PWs) bands (ev): -35.4326 -35.4326 -4.3802 -4.3802 -4.3797 -4.3797 -3.5607 -3.5607 -3.5215 -3.5215 -3.5187 -3.5187 2.3597 2.3597 4.8342 4.8342 4.8787 4.8787 5.1169 5.1169 5.1616 5.1616 5.2038 5.2038 6.1637 6.1637 6.2100 6.2100 6.4742 6.4742 6.5889 6.5889 6.6934 6.6934 11.8776 11.8776 11.9981 11.9981 14.1146 14.1146 14.2533 14.2533 14.6241 14.6241 15.3515 15.3515 k = 0.0882 0.0509 0.1441 ( 8447 PWs) bands (ev): -35.4326 -35.4326 -4.3802 -4.3802 -4.3798 -4.3798 -3.5608 -3.5608 -3.5214 -3.5214 -3.5191 -3.5191 2.3270 2.3270 4.8270 4.8270 4.8660 4.8660 5.1053 5.1053 5.1559 5.1559 5.1928 5.1928 6.1754 6.1754 6.2152 6.2152 6.4834 6.4834 6.6124 6.6124 6.7032 6.7032 12.0598 12.0598 12.1686 12.1686 14.1387 14.1387 14.3102 14.3102 14.5638 14.5638 15.3122 15.3122 k = 0.0809 0.0467 0.1321 ( 8435 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3799 -4.3799 -3.5608 -3.5608 -3.5214 -3.5214 -3.5194 -3.5194 2.2968 2.2968 4.8204 4.8204 4.8541 4.8541 5.0945 5.0945 5.1510 5.1510 5.1826 5.1826 6.1862 6.1862 6.2201 6.2201 6.4921 6.4921 6.6344 6.6344 6.7122 6.7122 12.2443 12.2443 12.3415 12.3415 14.1596 14.1596 14.3591 14.3591 14.5090 14.5090 15.2738 15.2738 k = 0.0735 0.0425 0.1201 ( 8445 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3800 -4.3800 -3.5609 -3.5609 -3.5214 -3.5214 -3.5197 -3.5197 2.2689 2.2689 4.8144 4.8144 4.8429 4.8429 5.0846 5.0846 5.1467 5.1467 5.1732 5.1732 6.1963 6.1963 6.2247 6.2247 6.5003 6.5003 6.6549 6.6549 6.7203 6.7203 12.4307 12.4307 12.5170 12.5170 14.1771 14.1771 14.4000 14.4000 14.4604 14.4604 15.2358 15.2358 k = 0.0662 0.0382 0.1081 ( 8449 PWs) bands (ev): -35.4326 -35.4326 -4.3804 -4.3804 -4.3801 -4.3801 -3.5610 -3.5610 -3.5214 -3.5214 -3.5200 -3.5200 2.2436 2.2436 4.8089 4.8089 4.8325 4.8325 5.0757 5.0757 5.1428 5.1428 5.1646 5.1646 6.2056 6.2056 6.2288 6.2288 6.5078 6.5078 6.6738 6.6738 6.7276 6.7276 12.6182 12.6182 12.6950 12.6950 14.1907 14.1907 14.4182 14.4182 14.4338 14.4338 15.1977 15.1977 k = 0.0588 0.0340 0.0961 ( 8461 PWs) bands (ev): -35.4327 -35.4327 -4.3804 -4.3804 -4.3802 -4.3802 -3.5611 -3.5611 -3.5214 -3.5214 -3.5202 -3.5202 2.2209 2.2209 4.8040 4.8040 4.8230 4.8230 5.0678 5.0678 5.1395 5.1395 5.1569 5.1569 6.2141 6.2141 6.2325 6.2325 6.5147 6.5147 6.6909 6.6909 6.7341 6.7341 12.8059 12.8059 12.8756 12.8756 14.1996 14.1996 14.3848 14.3848 14.4600 14.4600 15.1587 15.1587 k = 0.0515 0.0297 0.0841 ( 8461 PWs) bands (ev): -35.4327 -35.4327 -4.3804 -4.3804 -4.3803 -4.3803 -3.5612 -3.5612 -3.5213 -3.5213 -3.5205 -3.5205 2.2007 2.2007 4.7997 4.7997 4.8144 4.8144 5.0609 5.0609 5.1366 5.1366 5.1501 5.1501 6.2216 6.2216 6.2359 6.2359 6.5209 6.5209 6.7063 6.7063 6.7397 6.7397 12.9926 12.9926 13.0589 13.0589 14.2032 14.2032 14.3603 14.3603 14.4802 14.4802 15.1174 15.1174 k = 0.0441 0.0255 0.0720 ( 8453 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3803 -4.3803 -3.5612 -3.5612 -3.5213 -3.5213 -3.5207 -3.5207 2.1832 2.1832 4.7959 4.7959 4.8069 4.8069 5.0549 5.0549 5.1341 5.1341 5.1441 5.1441 6.2282 6.2282 6.2387 6.2387 6.5264 6.5264 6.7198 6.7198 6.7446 6.7446 13.1768 13.1768 13.2445 13.2445 14.2021 14.2021 14.3450 14.3450 14.4949 14.4949 15.0720 15.0720 k = 0.0368 0.0212 0.0600 ( 8453 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3804 -4.3804 -3.5613 -3.5613 -3.5213 -3.5213 -3.5208 -3.5208 2.1683 2.1683 4.7927 4.7927 4.8004 4.8004 5.0500 5.0500 5.1321 5.1321 5.1391 5.1391 6.2338 6.2338 6.2412 6.2412 6.5310 6.5310 6.7313 6.7313 6.7487 6.7487 13.3562 13.3562 13.4316 13.4316 14.1990 14.1990 14.3375 14.3375 14.5040 14.5040 15.0199 15.0199 k = 0.0294 0.0170 0.0480 ( 8445 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3805 -4.3805 -3.5613 -3.5613 -3.5213 -3.5213 -3.5210 -3.5210 2.1561 2.1561 4.7901 4.7901 4.7951 4.7951 5.0459 5.0459 5.1304 5.1304 5.1349 5.1349 6.2385 6.2385 6.2432 6.2432 6.5349 6.5349 6.7409 6.7409 6.7521 6.7521 13.5273 13.5273 13.6185 13.6185 14.1992 14.1992 14.3349 14.3349 14.5070 14.5070 14.9584 14.9584 k = 0.0221 0.0127 0.0360 ( 8429 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5614 -3.5614 -3.5213 -3.5213 -3.5211 -3.5211 2.1466 2.1466 4.7880 4.7880 4.7909 4.7909 5.0428 5.0428 5.1291 5.1291 5.1317 5.1317 6.2421 6.2421 6.2448 6.2448 6.5379 6.5379 6.7483 6.7483 6.7547 6.7547 13.6824 13.6824 13.8032 13.8032 14.2099 14.2099 14.3351 14.3351 14.5008 14.5008 14.8863 14.8863 k = 0.0147 0.0085 0.0240 ( 8405 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5614 -3.5614 -3.5213 -3.5213 -3.5212 -3.5212 2.1398 2.1398 4.7866 4.7866 4.7878 4.7878 5.0406 5.0406 5.1282 5.1282 5.1293 5.1293 6.2447 6.2447 6.2459 6.2459 6.5401 6.5401 6.7537 6.7537 6.7565 6.7565 13.8068 13.8068 13.9829 13.9829 14.2402 14.2402 14.3367 14.3367 14.4775 14.4775 14.8092 14.8092 k = 0.0074 0.0042 0.0120 ( 8393 PWs) bands (ev): -35.4326 -35.4326 -4.3806 -4.3806 -4.3806 -4.3806 -3.5614 -3.5614 -3.5213 -3.5213 -3.5212 -3.5212 2.1357 2.1357 4.7857 4.7857 4.7860 4.7860 5.0392 5.0392 5.1277 5.1277 5.1279 5.1279 6.2463 6.2463 6.2466 6.2466 6.5415 6.5415 6.7569 6.7569 6.7577 6.7577 13.8832 13.8832 14.1524 14.1524 14.2882 14.2882 14.3406 14.3406 14.4200 14.4200 14.7464 14.7464 k = 0.0000 0.0000 0.0000 ( 8393 PWs) bands (ev): -35.4326 -35.4326 -4.3806 -4.3806 -4.3806 -4.3806 -3.5614 -3.5614 -3.5213 -3.5213 -3.5213 -3.5213 2.1343 2.1343 4.7854 4.7854 4.7854 4.7854 5.0388 5.0388 5.1275 5.1275 5.1275 5.1275 6.2468 6.2468 6.2468 6.2468 6.5419 6.5419 6.7580 6.7580 6.7580 6.7580 13.9075 13.9075 14.2870 14.2870 14.3121 14.3121 14.3121 14.3121 14.3627 14.3627 14.7226 14.7226 k = 0.0000 0.0000 0.0000 ( 8393 PWs) bands (ev): -35.4326 -35.4326 -4.3806 -4.3806 -4.3806 -4.3806 -3.5614 -3.5614 -3.5213 -3.5213 -3.5213 -3.5213 2.1343 2.1343 4.7854 4.7854 4.7854 4.7854 5.0388 5.0388 5.1275 5.1275 5.1275 5.1275 6.2468 6.2468 6.2468 6.2468 6.5419 6.5419 6.7580 6.7580 6.7580 6.7580 13.9075 13.9075 14.2870 14.2870 14.3121 14.3121 14.3121 14.3121 14.3627 14.3627 14.7226 14.7226 k = 0.0119 0.0069 0.0049 ( 8393 PWs) bands (ev): -35.4326 -35.4326 -4.3806 -4.3806 -4.3806 -4.3806 -3.5614 -3.5614 -3.5213 -3.5213 -3.5212 -3.5212 2.1357 2.1357 4.7858 4.7858 4.7859 4.7859 5.0392 5.0392 5.1278 5.1278 5.1278 5.1278 6.2463 6.2463 6.2466 6.2466 6.5415 6.5415 6.7572 6.7572 6.7574 6.7574 13.8831 13.8831 14.1522 14.1522 14.2937 14.2937 14.3426 14.3426 14.4146 14.4146 14.7423 14.7423 k = 0.0238 0.0137 0.0097 ( 8405 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5614 -3.5614 -3.5213 -3.5213 -3.5212 -3.5212 2.1397 2.1397 4.7870 4.7870 4.7873 4.7873 5.0405 5.0405 5.1286 5.1286 5.1289 5.1289 6.2448 6.2448 6.2459 6.2459 6.5402 6.5402 6.7549 6.7549 6.7555 6.7555 13.7949 13.7949 14.0056 14.0056 14.2465 14.2465 14.3235 14.3235 14.4854 14.4854 14.7932 14.7932 k = 0.0357 0.0206 0.0146 ( 8423 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5614 -3.5614 -3.5213 -3.5213 -3.5211 -3.5211 2.1464 2.1464 4.7891 4.7891 4.7897 4.7897 5.0427 5.0427 5.1299 5.1299 5.1307 5.1307 6.2423 6.2423 6.2447 6.2447 6.5380 6.5380 6.7510 6.7510 6.7523 6.7523 13.6268 13.6268 13.9058 13.9058 14.1839 14.1839 14.2946 14.2946 14.5517 14.5517 14.8616 14.8616 k = 0.0476 0.0275 0.0194 ( 8435 PWs) bands (ev): -35.4326 -35.4326 -4.3805 -4.3805 -4.3805 -4.3805 -3.5613 -3.5613 -3.5213 -3.5213 -3.5210 -3.5210 2.1557 2.1557 4.7919 4.7919 4.7930 4.7930 5.0457 5.0457 5.1319 5.1319 5.1333 5.1333 6.2388 6.2388 6.2431 6.2431 6.5350 6.5350 6.7455 6.7455 6.7479 6.7479 13.4166 13.4166 13.8311 13.8311 14.1142 14.1142 14.2589 14.2589 14.6192 14.6192 14.9383 14.9383 k = 0.0595 0.0344 0.0243 ( 8444 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3804 -4.3804 -3.5613 -3.5613 -3.5213 -3.5213 -3.5208 -3.5208 2.1677 2.1677 4.7956 4.7956 4.7973 4.7973 5.0496 5.0496 5.1343 5.1343 5.1366 5.1366 6.2343 6.2343 6.2410 6.2410 6.5312 6.5312 6.7385 6.7385 6.7422 6.7422 13.1923 13.1923 13.7619 13.7619 14.0420 14.0420 14.2180 14.2180 14.6873 14.6873 15.0179 15.0179 k = 0.0714 0.0412 0.0292 ( 8450 PWs) bands (ev): -35.4327 -35.4327 -4.3805 -4.3805 -4.3804 -4.3804 -3.5612 -3.5612 -3.5213 -3.5213 -3.5207 -3.5207 2.1824 2.1824 4.8000 4.8000 4.8025 4.8025 5.0543 5.0543 5.1374 5.1374 5.1406 5.1406 6.2289 6.2289 6.2385 6.2385 6.5265 6.5265 6.7299 6.7299 6.7353 6.7353 12.9628 12.9628 13.6943 13.6943 13.9692 13.9692 14.1734 14.1734 14.7539 14.7539 15.0963 15.0963 k = 0.0833 0.0481 0.0340 ( 8450 PWs) bands (ev): -35.4326 -35.4326 -4.3804 -4.3804 -4.3803 -4.3803 -3.5612 -3.5612 -3.5214 -3.5214 -3.5205 -3.5205 2.1996 2.1996 4.8053 4.8053 4.8086 4.8086 5.0599 5.0599 5.1409 5.1409 5.1454 5.1454 6.2226 6.2226 6.2355 6.2355 6.5210 6.5210 6.7199 6.7199 6.7271 6.7271 12.7314 12.7314 13.6278 13.6278 13.8972 13.8972 14.1264 14.1264 14.8166 14.8166 15.1700 15.1700 k = 0.0952 0.0550 0.0389 ( 8456 PWs) bands (ev): -35.4327 -35.4327 -4.3804 -4.3804 -4.3802 -4.3802 -3.5611 -3.5611 -3.5214 -3.5214 -3.5202 -3.5202 2.2194 2.2194 4.8113 4.8113 4.8155 4.8155 5.0663 5.0663 5.1450 5.1450 5.1509 5.1509 6.2154 6.2154 6.2321 6.2321 6.5148 6.5148 6.7084 6.7084 6.7178 6.7178 12.4998 12.4998 13.5625 13.5625 13.8266 13.8266 14.0780 14.0780 14.8727 14.8727 15.2349 15.2349 k = 0.1071 0.0619 0.0437 ( 8456 PWs) bands (ev): -35.4326 -35.4326 -4.3804 -4.3804 -4.3801 -4.3801 -3.5610 -3.5610 -3.5214 -3.5214 -3.5200 -3.5200 2.2418 2.2418 4.8181 4.8181 4.8234 4.8234 5.0735 5.0735 5.1497 5.1497 5.1573 5.1573 6.2074 6.2074 6.2282 6.2282 6.5078 6.5078 6.6954 6.6954 6.7073 6.7073 12.2689 12.2689 13.4987 13.4987 13.7578 13.7578 14.0291 14.0291 14.9197 14.9197 15.2865 15.2865 k = 0.1190 0.0687 0.0486 ( 8441 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3800 -4.3800 -3.5609 -3.5609 -3.5215 -3.5215 -3.5197 -3.5197 2.2667 2.2667 4.8257 4.8257 4.8320 4.8320 5.0814 5.0814 5.1549 5.1549 5.1644 5.1644 6.1986 6.1986 6.2239 6.2239 6.5000 6.5000 6.6811 6.6811 6.6957 6.6957 12.0394 12.0394 13.4368 13.4368 13.6912 13.6912 13.9802 13.9802 14.9554 14.9554 15.3210 15.3210 k = 0.1310 0.0756 0.0535 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3803 -4.3803 -4.3799 -4.3799 -3.5609 -3.5609 -3.5215 -3.5215 -3.5194 -3.5194 2.2940 2.2940 4.8340 4.8340 4.8415 4.8415 5.0902 5.0902 5.1606 5.1606 5.1723 5.1723 6.1891 6.1891 6.2192 6.2192 6.4916 6.4916 6.6653 6.6653 6.6830 6.6830 11.8116 11.8116 13.3767 13.3767 13.6270 13.6270 13.9319 13.9319 14.9783 14.9783 15.3361 15.3361 k = 0.1429 0.0825 0.0583 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3802 -4.3802 -4.3798 -4.3798 -3.5608 -3.5608 -3.5216 -3.5216 -3.5190 -3.5190 2.3238 2.3238 4.8431 4.8431 4.8518 4.8518 5.0996 5.0996 5.1669 5.1669 5.1811 5.1811 6.1789 6.1789 6.2141 6.2141 6.4824 6.4824 6.6483 6.6483 6.6692 6.6692 11.5859 11.5859 13.3188 13.3188 13.5652 13.5652 13.8845 13.8845 14.9878 14.9878 15.3323 15.3323 k = 0.1548 0.0894 0.0632 ( 8447 PWs) bands (ev): -35.4326 -35.4326 -4.3802 -4.3802 -4.3797 -4.3797 -3.5607 -3.5607 -3.5216 -3.5216 -3.5187 -3.5187 2.3559 2.3559 4.8530 4.8530 4.8628 4.8628 5.1098 5.1098 5.1737 5.1737 5.1907 5.1907 6.1682 6.1682 6.2086 6.2086 6.4726 6.4726 6.6300 6.6300 6.6544 6.6544 11.3624 11.3624 13.2632 13.2632 13.5060 13.5060 13.8384 13.8384 14.9845 14.9845 15.3122 15.3122 k = 0.1667 0.0962 0.0680 ( 8471 PWs) bands (ev): -35.4326 -35.4326 -4.3801 -4.3801 -4.3795 -4.3795 -3.5606 -3.5606 -3.5217 -3.5217 -3.5183 -3.5183 2.3903 2.3903 4.8636 4.8636 4.8745 4.8745 5.1207 5.1207 5.1810 5.1810 5.2012 5.2012 6.1569 6.1569 6.2027 6.2027 6.4622 6.4622 6.6104 6.6104 6.6386 6.6386 11.1415 11.1415 13.2098 13.2098 13.4495 13.4495 13.7936 13.7936 14.9699 14.9699 15.2793 15.2793 k = 0.1786 0.1031 0.0729 ( 8453 PWs) bands (ev): -35.4326 -35.4326 -4.3801 -4.3801 -4.3794 -4.3794 -3.5604 -3.5604 -3.5217 -3.5217 -3.5179 -3.5179 2.4269 2.4269 4.8750 4.8750 4.8869 4.8869 5.1322 5.1322 5.1888 5.1888 5.2125 5.2125 6.1452 6.1452 6.1964 6.1964 6.4511 6.4511 6.5897 6.5897 6.6218 6.6218 10.9232 10.9232 13.1587 13.1587 13.3957 13.3957 13.7504 13.7504 14.9456 14.9456 15.2366 15.2366 k = 0.1905 0.1100 0.0778 ( 8447 PWs) bands (ev): -35.4326 -35.4326 -4.3800 -4.3800 -4.3793 -4.3793 -3.5603 -3.5603 -3.5218 -3.5218 -3.5175 -3.5175 2.4655 2.4655 4.8872 4.8872 4.8999 4.8999 5.1443 5.1443 5.1971 5.1971 5.2248 5.2248 6.1331 6.1331 6.1898 6.1898 6.4394 6.4394 6.5678 6.5678 6.6042 6.6042 10.7077 10.7077 13.1101 13.1101 13.3446 13.3446 13.7089 13.7089 14.9134 14.9134 15.1870 15.1870 k = 0.2024 0.1168 0.0826 ( 8447 PWs) bands (ev): -35.4326 -35.4326 -4.3800 -4.3800 -4.3792 -4.3792 -3.5602 -3.5602 -3.5218 -3.5218 -3.5171 -3.5171 2.5062 2.5062 4.9001 4.9001 4.9134 4.9134 5.1570 5.1570 5.2059 5.2059 5.2379 5.2379 6.1209 6.1209 6.1828 6.1828 6.4272 6.4272 6.5449 6.5449 6.5858 6.5858 10.4952 10.4952 13.0639 13.0639 13.2963 13.2963 13.6691 13.6691 14.8752 14.8752 15.1323 15.1323 k = 0.2143 0.1237 0.0875 ( 8426 PWs) bands (ev): -35.4326 -35.4326 -4.3799 -4.3799 -4.3790 -4.3790 -3.5601 -3.5601 -3.5219 -3.5219 -3.5166 -3.5166 2.5488 2.5488 4.9139 4.9139 4.9275 4.9275 5.1702 5.1702 5.2152 5.2152 5.2520 5.2520 6.1084 6.1084 6.1755 6.1755 6.4145 6.4145 6.5211 6.5211 6.5666 6.5666 10.2857 10.2857 13.0201 13.0201 13.2507 13.2507 13.6311 13.6311 14.8324 14.8324 15.0742 15.0742 k = 0.2262 0.1306 0.0923 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3799 -4.3799 -4.3789 -4.3789 -3.5600 -3.5600 -3.5220 -3.5220 -3.5162 -3.5162 2.5931 2.5931 4.9285 4.9285 4.9421 4.9421 5.1839 5.1839 5.2249 5.2249 5.2669 5.2669 6.0960 6.0960 6.1680 6.1680 6.4013 6.4013 6.4963 6.4963 6.5467 6.5467 10.0793 10.0793 12.9787 12.9787 13.2079 13.2079 13.5950 13.5950 14.7862 14.7862 15.0138 15.0138 k = 0.2381 0.1375 0.0972 ( 8426 PWs) bands (ev): -35.4326 -35.4326 -4.3798 -4.3798 -4.3788 -4.3788 -3.5599 -3.5599 -3.5220 -3.5220 -3.5157 -3.5157 2.6390 2.6390 4.9440 4.9440 4.9571 4.9571 5.1981 5.1981 5.2351 5.2351 5.2828 5.2828 6.0836 6.0836 6.1602 6.1602 6.3875 6.3875 6.4706 6.4706 6.5261 6.5261 9.8763 9.8763 12.9397 12.9397 13.1678 13.1678 13.5606 13.5606 14.7376 14.7376 14.9520 14.9520 k = 0.2500 0.1443 0.1021 ( 8420 PWs) bands (ev): -35.4326 -35.4326 -4.3797 -4.3797 -4.3786 -4.3786 -3.5598 -3.5598 -3.5221 -3.5221 -3.5153 -3.5153 2.6863 2.6863 4.9604 4.9604 4.9724 4.9724 5.2128 5.2128 5.2456 5.2456 5.2995 5.2995 6.0714 6.0714 6.1522 6.1522 6.3734 6.3734 6.4443 6.4443 6.5050 6.5050 9.6766 9.6766 12.9031 12.9031 13.1304 13.1304 13.5281 13.5281 14.6875 14.6875 14.8894 14.8894 k = 0.2619 0.1512 0.1069 ( 8432 PWs) bands (ev): -35.4326 -35.4326 -4.3797 -4.3797 -4.3785 -4.3785 -3.5597 -3.5597 -3.5222 -3.5222 -3.5149 -3.5149 2.7349 2.7349 4.9777 4.9777 4.9880 4.9880 5.2279 5.2279 5.2565 5.2565 5.3171 5.3171 6.0595 6.0595 6.1441 6.1441 6.3587 6.3587 6.4173 6.4173 6.4834 6.4834 9.4804 9.4804 12.8689 12.8689 13.0957 13.0957 13.4973 13.4973 14.6365 14.6365 14.8268 14.8268 k = 0.2738 0.1581 0.1118 ( 8426 PWs) bands (ev): -35.4326 -35.4326 -4.3796 -4.3796 -4.3784 -4.3784 -3.5596 -3.5596 -3.5222 -3.5222 -3.5144 -3.5144 2.7845 2.7845 4.9960 4.9960 5.0039 5.0039 5.2435 5.2435 5.2677 5.2677 5.3355 5.3355 6.0480 6.0480 6.1358 6.1358 6.3436 6.3436 6.3899 6.3899 6.4614 6.4614 9.2879 9.2879 12.8370 12.8370 13.0637 13.0637 13.4683 13.4683 14.5854 14.5854 14.7646 14.7646 k = 0.2857 0.1650 0.1166 ( 8429 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3782 -4.3782 -3.5595 -3.5595 -3.5223 -3.5223 -3.5140 -3.5140 2.8348 2.8348 5.0153 5.0153 5.0199 5.0199 5.2594 5.2594 5.2792 5.2792 5.3547 5.3547 6.0370 6.0370 6.1275 6.1275 6.3277 6.3277 6.3625 6.3625 6.4391 6.4391 9.0991 9.0991 12.8074 12.8074 13.0342 13.0342 13.4411 13.4411 14.5345 14.5345 14.7032 14.7032 k = 0.2976 0.1718 0.1215 ( 8441 PWs) bands (ev): -35.4326 -35.4326 -4.3795 -4.3795 -4.3781 -4.3781 -3.5594 -3.5594 -3.5224 -3.5224 -3.5135 -3.5135 2.8856 2.8856 5.0356 5.0356 5.0359 5.0359 5.2759 5.2759 5.2909 5.2909 5.3746 5.3746 6.0267 6.0267 6.1191 6.1191 6.3104 6.3104 6.3361 6.3361 6.4165 6.4165 8.9141 8.9141 12.7799 12.7799 13.0073 13.0073 13.4157 13.4157 14.4843 14.4843 14.6430 14.6430 k = 0.3095 0.1787 0.1264 ( 8441 PWs) bands (ev): -35.4326 -35.4326 -4.3794 -4.3794 -4.3780 -4.3780 -3.5593 -3.5593 -3.5224 -3.5224 -3.5131 -3.5131 2.9367 2.9367 5.0519 5.0519 5.0569 5.0569 5.2928 5.2928 5.3027 5.3027 5.3952 5.3952 6.0171 6.0171 6.1108 6.1108 6.2895 6.2895 6.3128 6.3128 6.3939 6.3939 8.7332 8.7332 12.7547 12.7547 12.9828 12.9828 13.3919 13.3919 14.4352 14.4352 14.5843 14.5843 k = 0.3214 0.1856 0.1312 ( 8429 PWs) bands (ev): -35.4326 -35.4326 -4.3794 -4.3794 -4.3779 -4.3779 -3.5592 -3.5592 -3.5225 -3.5225 -3.5127 -3.5127 2.9876 2.9876 5.0679 5.0679 5.0792 5.0792 5.3102 5.3102 5.3147 5.3147 5.4164 5.4164 6.0084 6.0084 6.1026 6.1026 6.2640 6.2640 6.2941 6.2941 6.3711 6.3711 8.5564 8.5564 12.7315 12.7315 12.9607 12.9607 13.3697 13.3697 14.3875 14.3875 14.5275 14.5275 k = 0.3333 0.1925 0.1361 ( 8423 PWs) bands (ev): -35.4326 -35.4326 -4.3793 -4.3793 -4.3778 -4.3778 -3.5591 -3.5591 -3.5226 -3.5226 -3.5123 -3.5123 3.0380 3.0380 5.0836 5.0836 5.1025 5.1025 5.3267 5.3267 5.3281 5.3281 5.4383 5.4383 6.0005 6.0005 6.0947 6.0947 6.2356 6.2356 6.2785 6.2785 6.3485 6.3485 8.3839 8.3839 12.7104 12.7104 12.9408 12.9408 13.3492 13.3492 14.3415 14.3415 14.4727 14.4727 k = 0.3452 0.1993 0.1409 ( 8429 PWs) bands (ev): -35.4326 -35.4326 -4.3793 -4.3793 -4.3777 -4.3777 -3.5590 -3.5590 -3.5226 -3.5226 -3.5119 -3.5119 3.0876 3.0876 5.0990 5.0990 5.1264 5.1264 5.3386 5.3386 5.3468 5.3468 5.4607 5.4607 5.9934 5.9934 6.0870 6.0870 6.2061 6.2061 6.2648 6.2648 6.3261 6.3261 8.2159 8.2159 12.6913 12.6913 12.9232 12.9232 13.3303 13.3303 14.2976 14.2976 14.4204 14.4204 k = 0.3571 0.2062 0.1458 ( 8453 PWs) bands (ev): -35.4326 -35.4326 -4.3792 -4.3792 -4.3776 -4.3776 -3.5589 -3.5589 -3.5227 -3.5227 -3.5116 -3.5116 3.1359 3.1359 5.1140 5.1140 5.1508 5.1508 5.3504 5.3504 5.3664 5.3664 5.4836 5.4836 5.9870 5.9870 6.0797 6.0797 6.1760 6.1760 6.2528 6.2528 6.3039 6.3039 8.0525 8.0525 12.6740 12.6740 12.9076 12.9076 13.3129 13.3129 14.2559 14.2559 14.3706 14.3706 k = 0.3690 0.2131 0.1507 ( 8459 PWs) bands (ev): -35.4326 -35.4326 -4.3792 -4.3792 -4.3775 -4.3775 -3.5588 -3.5588 -3.5227 -3.5227 -3.5112 -3.5112 3.1825 3.1825 5.1284 5.1284 5.1754 5.1754 5.3619 5.3619 5.3869 5.3869 5.5069 5.5069 5.9812 5.9812 6.0729 6.0729 6.1458 6.1458 6.2430 6.2430 6.2822 6.2822 7.8941 7.8941 12.6585 12.6585 12.8940 12.8940 13.2971 13.2971 14.2166 14.2166 14.3238 14.3238 k = 0.3810 0.2199 0.1555 ( 8471 PWs) bands (ev): -35.4326 -35.4326 -4.3791 -4.3791 -4.3774 -4.3774 -3.5588 -3.5588 -3.5228 -3.5228 -3.5109 -3.5109 3.2270 3.2270 5.1423 5.1423 5.1997 5.1997 5.3731 5.3731 5.4088 5.4088 5.5307 5.5307 5.9756 5.9756 6.0667 6.0667 6.1156 6.1156 6.2361 6.2361 6.2611 6.2611 7.7407 7.7407 12.6448 12.6448 12.8822 12.8822 13.2827 13.2827 14.1801 14.1801 14.2800 14.2800 k = 0.3929 0.2268 0.1604 ( 8465 PWs) bands (ev): -35.4326 -35.4326 -4.3791 -4.3791 -4.3774 -4.3774 -3.5587 -3.5587 -3.5228 -3.5228 -3.5106 -3.5106 3.2689 3.2689 5.1553 5.1553 5.2230 5.2230 5.3837 5.3837 5.4321 5.4321 5.5547 5.5547 5.9696 5.9696 6.0612 6.0612 6.0858 6.0858 6.2329 6.2329 6.2408 6.2408 7.5928 7.5928 12.6326 12.6326 12.8721 12.8721 13.2698 13.2698 14.1464 14.1464 14.2396 14.2396 k = 0.4048 0.2337 0.1652 ( 8453 PWs) bands (ev): -35.4326 -35.4326 -4.3791 -4.3791 -4.3773 -4.3773 -3.5587 -3.5587 -3.5229 -3.5229 -3.5103 -3.5103 3.3079 3.3079 5.1675 5.1675 5.2449 5.2449 5.3937 5.3937 5.4571 5.4571 5.5791 5.5791 5.9625 5.9625 6.0565 6.0565 6.0568 6.0568 6.2213 6.2213 6.2346 6.2346 7.4505 7.4505 12.6221 12.6221 12.8636 12.8636 13.2583 13.2583 14.1157 14.1157 14.2027 14.2027 k = 0.4167 0.2406 0.1701 ( 8453 PWs) bands (ev): -35.4326 -35.4326 -4.3790 -4.3790 -4.3772 -4.3772 -3.5586 -3.5586 -3.5229 -3.5229 -3.5101 -3.5101 3.3434 3.3434 5.1786 5.1786 5.2647 5.2647 5.4030 5.4030 5.4835 5.4835 5.6037 5.6037 5.9534 5.9534 6.0290 6.0290 6.0527 6.0527 6.2030 6.2030 6.2424 6.2424 7.3144 7.3144 12.6130 12.6130 12.8565 12.8565 13.2483 13.2483 14.0883 14.0883 14.1696 14.1696 k = 0.4286 0.2474 0.1750 ( 8454 PWs) bands (ev): -35.4326 -35.4326 -4.3790 -4.3790 -4.3772 -4.3772 -3.5586 -3.5586 -3.5230 -3.5230 -3.5099 -3.5099 3.3750 3.3750 5.1886 5.1886 5.2820 5.2820 5.4114 5.4114 5.5110 5.5110 5.6284 5.6284 5.9411 5.9411 6.0036 6.0036 6.0498 6.0498 6.1859 6.1859 6.2573 6.2573 7.1847 7.1847 12.6053 12.6053 12.8507 12.8507 13.2396 13.2396 14.0642 14.0642 14.1404 14.1404 k = 0.4405 0.2543 0.1798 ( 8460 PWs) bands (ev): -35.4326 -35.4326 -4.3790 -4.3790 -4.3771 -4.3771 -3.5585 -3.5585 -3.5230 -3.5230 -3.5097 -3.5097 3.4025 3.4025 5.1973 5.1973 5.2967 5.2967 5.4188 5.4188 5.5387 5.5387 5.6532 5.6532 5.9244 5.9244 5.9819 5.9819 6.0479 6.0479 6.1705 6.1705 6.2803 6.2803 7.0622 7.0622 12.5989 12.5989 12.8460 12.8460 13.2323 13.2323 14.0436 14.0436 14.1154 14.1154 k = 0.4524 0.2612 0.1847 ( 8463 PWs) bands (ev): -35.4326 -35.4326 -4.3790 -4.3790 -4.3771 -4.3771 -3.5585 -3.5585 -3.5230 -3.5230 -3.5095 -3.5095 3.4254 3.4254 5.2046 5.2046 5.3085 5.3085 5.4250 5.4250 5.5654 5.5654 5.6779 5.6779 5.9034 5.9034 5.9645 5.9645 6.0469 6.0469 6.1569 6.1569 6.3119 6.3119 6.9473 6.9473 12.5938 12.5938 12.8424 12.8424 13.2263 13.2263 14.0266 14.0266 14.0946 14.0946 k = 0.4643 0.2681 0.1895 ( 8457 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3771 -4.3771 -3.5585 -3.5585 -3.5230 -3.5230 -3.5094 -3.5094 3.4435 3.4435 5.2104 5.2104 5.3176 5.3176 5.4300 5.4300 5.5892 5.5892 5.7024 5.7024 5.8795 5.8795 5.9510 5.9510 6.0466 6.0466 6.1456 6.1456 6.3521 6.3521 6.8412 6.8412 12.5899 12.5899 12.8398 12.8398 13.2217 13.2217 14.0133 14.0133 14.0783 14.0783 k = 0.4762 0.2749 0.1944 ( 8457 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3771 -4.3771 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4566 3.4566 5.2146 5.2146 5.3240 5.3240 5.4336 5.4336 5.6084 5.6084 5.7260 5.7260 5.8551 5.8551 5.9410 5.9410 6.0467 6.0467 6.1370 6.1370 6.3997 6.3997 6.7459 6.7459 12.5871 12.5871 12.8379 12.8379 13.2184 13.2184 14.0037 14.0037 14.0666 14.0666 k = 0.4881 0.2818 0.1993 ( 8436 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5231 -3.5231 -3.5093 -3.5093 3.4645 3.4645 5.2171 5.2171 5.3278 5.3278 5.4358 5.4358 5.6209 5.6209 5.7466 5.7466 5.8336 5.8336 5.9346 5.9346 6.0471 6.0471 6.1315 6.1315 6.4496 6.4496 6.6671 6.6671 12.5855 12.5855 12.8368 12.8368 13.2164 13.2164 13.9980 13.9980 14.0596 14.0596 k = 0.5000 0.2887 0.2041 ( 8424 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5231 -3.5231 -3.5093 -3.5093 3.4672 3.4672 5.2180 5.2180 5.3290 5.3290 5.4365 5.4365 5.6253 5.6253 5.7564 5.7564 5.8234 5.8234 5.9324 5.9324 6.0472 6.0472 6.1297 6.1297 6.4777 6.4777 6.6293 6.6293 12.5849 12.5849 12.8365 12.8365 13.2158 13.2158 13.9960 13.9960 14.0572 14.0572 k = 0.5000 0.2887 0.2041 ( 8424 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5231 -3.5231 -3.5093 -3.5093 3.4672 3.4672 5.2180 5.2180 5.3290 5.3290 5.4365 5.4365 5.6253 5.6253 5.7564 5.7564 5.8234 5.8234 5.9324 5.9324 6.0472 6.0472 6.1297 6.1297 6.4777 6.4777 6.6293 6.6293 12.5849 12.5849 12.8365 12.8365 13.2158 13.2158 13.9960 13.9960 14.0572 14.0572 k = 0.5042 0.2766 0.2109 ( 8435 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4679 3.4679 5.2180 5.2180 5.3290 5.3290 5.4359 5.4359 5.6257 5.6257 5.7547 5.7547 5.8237 5.8237 5.9323 5.9323 6.0482 6.0482 6.1302 6.1302 6.4798 6.4798 6.6298 6.6298 12.5535 12.5535 12.7930 12.7930 13.2622 13.2622 14.0120 14.0120 14.0691 14.0691 k = 0.5083 0.2646 0.2177 ( 8445 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4702 3.4702 5.2182 5.2182 5.3288 5.3288 5.4343 5.4343 5.6271 5.6271 5.7497 5.7497 5.8243 5.8243 5.9319 5.9319 6.0509 6.0509 6.1316 6.1316 6.4862 6.4862 6.6313 6.6313 12.4612 12.4612 12.7079 12.7079 13.3542 13.3542 14.0580 14.0580 14.1069 14.1069 k = 0.5125 0.2526 0.2245 ( 8445 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5584 -3.5584 -3.5229 -3.5229 -3.5093 -3.5093 3.4739 3.4739 5.2183 5.2183 5.3286 5.3286 5.4316 5.4316 5.6292 5.6292 5.7422 5.7422 5.8248 5.8248 5.9314 5.9314 6.0554 6.0554 6.1339 6.1339 6.4966 6.4966 6.6338 6.6338 12.3225 12.3225 12.6173 12.6173 13.4412 13.4412 14.1317 14.1317 14.1732 14.1732 k = 0.5167 0.2406 0.2313 ( 8459 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5584 -3.5584 -3.5228 -3.5228 -3.5094 -3.5094 3.4791 3.4791 5.2186 5.2186 5.3281 5.3281 5.4280 5.4280 5.6319 5.6319 5.7328 5.7328 5.8251 5.8251 5.9306 5.9306 6.0612 6.0612 6.1371 6.1371 6.5110 6.5110 6.6373 6.6373 12.1583 12.1583 12.5227 12.5227 13.5039 13.5039 14.2316 14.2316 14.2660 14.2660 k = 0.5208 0.2285 0.2381 ( 8458 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5227 -3.5227 -3.5094 -3.5094 3.4856 3.4856 5.2187 5.2187 5.3275 5.3275 5.4236 5.4236 5.6350 5.6350 5.7224 5.7224 5.8251 5.8251 5.9299 5.9299 6.0682 6.0682 6.1409 6.1409 6.5290 6.5290 6.6422 6.6422 11.9818 11.9818 12.4226 12.4226 13.5401 13.5401 14.3510 14.3510 14.3835 14.3835 k = 0.5250 0.2165 0.2449 ( 8448 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5226 -3.5226 -3.5095 -3.5095 3.4936 3.4936 5.2188 5.2188 5.3266 5.3266 5.4186 5.4186 5.6380 5.6380 5.7118 5.7118 5.8248 5.8248 5.9291 5.9291 6.0761 6.0761 6.1455 6.1455 6.5501 6.5501 6.6486 6.6486 11.7992 11.7992 12.3180 12.3180 13.5552 13.5552 14.4782 14.4782 14.5250 14.5250 k = 0.5292 0.2045 0.2518 ( 8453 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5224 -3.5224 -3.5095 -3.5095 3.5029 3.5029 5.2187 5.2187 5.3253 5.3253 5.4133 5.4133 5.6403 5.6403 5.7016 5.7016 5.8244 5.8244 5.9285 5.9285 6.0846 6.0846 6.1507 6.1507 6.5733 6.5733 6.6573 6.6573 11.6135 11.6135 12.2100 12.2100 13.5555 13.5555 14.6108 14.6108 14.6825 14.6825 k = 0.5333 0.1925 0.2586 ( 8449 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3770 -4.3770 -3.5583 -3.5583 -3.5222 -3.5222 -3.5096 -3.5096 3.5135 3.5135 5.2183 5.2183 5.3235 5.3235 5.4078 5.4078 5.6408 5.6408 5.6930 5.6930 5.8244 5.8244 5.9281 5.9281 6.0935 6.0935 6.1564 6.1564 6.5970 6.5970 6.6698 6.6698 11.4266 11.4266 12.1000 12.1000 13.5461 13.5461 14.7490 14.7490 14.8480 14.8480 k = 0.5375 0.1804 0.2654 ( 8443 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3769 -4.3769 -3.5583 -3.5583 -3.5220 -3.5220 -3.5097 -3.5097 3.5252 3.5252 5.2176 5.2176 5.3211 5.3211 5.4024 5.4024 5.6384 5.6384 5.6871 5.6871 5.8249 5.8249 5.9281 5.9281 6.1028 6.1028 6.1627 6.1627 6.6184 6.6184 6.6885 6.6885 11.2396 11.2396 11.9892 11.9892 13.5303 13.5303 14.8922 14.8922 15.0172 15.0172 k = 0.5417 0.1684 0.2722 ( 8433 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3769 -4.3769 -3.5583 -3.5583 -3.5218 -3.5218 -3.5098 -3.5098 3.5381 3.5381 5.2164 5.2164 5.3180 5.3180 5.3973 5.3973 5.6325 5.6325 5.6845 5.6845 5.8262 5.8262 5.9287 5.9287 6.1122 6.1122 6.1694 6.1694 6.6356 6.6356 6.7152 6.7152 11.0532 11.0532 11.8782 11.8782 13.5100 13.5100 15.0396 15.0396 15.1875 15.1875 k = 0.5458 0.1564 0.2790 ( 8449 PWs) bands (ev): -35.4326 -35.4326 -4.3786 -4.3786 -4.3769 -4.3769 -3.5583 -3.5583 -3.5216 -3.5216 -3.5099 -3.5099 3.5520 3.5520 5.2146 5.2146 5.3142 5.3142 5.3926 5.3926 5.6239 5.6239 5.6843 5.6843 5.8288 5.8288 5.9300 5.9300 6.1216 6.1216 6.1766 6.1766 6.6490 6.6490 6.7493 6.7493 10.8679 10.8679 11.7678 11.7678 13.4869 13.4869 15.1904 15.1904 15.3576 15.3576 k = 0.5500 0.1443 0.2858 ( 8441 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3768 -4.3768 -3.5582 -3.5582 -3.5213 -3.5213 -3.5100 -3.5100 3.5668 3.5668 5.2123 5.2123 5.3096 5.3096 5.3884 5.3884 5.6136 5.6136 5.6852 5.6852 5.8327 5.8327 5.9322 5.9322 6.1312 6.1312 6.1841 6.1841 6.6604 6.6604 6.7888 6.7888 10.6841 10.6841 11.6584 11.6584 13.4619 13.4619 15.3442 15.3442 15.5263 15.5263 k = 0.5542 0.1323 0.2926 ( 8438 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3768 -4.3768 -3.5582 -3.5582 -3.5210 -3.5210 -3.5100 -3.5100 3.5825 3.5825 5.2092 5.2092 5.3042 5.3042 5.3849 5.3849 5.6026 5.6026 5.6862 5.6862 5.8380 5.8380 5.9354 5.9354 6.1406 6.1406 6.1921 6.1921 6.6709 6.6709 6.8324 6.8324 10.5023 10.5023 11.5504 11.5504 13.4356 13.4356 15.5005 15.5005 15.6929 15.6929 k = 0.5583 0.1203 0.2994 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3767 -4.3767 -3.5582 -3.5582 -3.5208 -3.5208 -3.5101 -3.5101 3.5988 3.5988 5.2054 5.2054 5.2983 5.2983 5.3818 5.3818 5.5913 5.5913 5.6870 5.6870 5.8448 5.8448 5.9399 5.9399 6.1501 6.1501 6.2004 6.2004 6.6814 6.6814 6.8794 6.8794 10.3227 10.3227 11.4442 11.4442 13.4087 13.4087 15.6588 15.6588 15.8569 15.8569 k = 0.5625 0.1083 0.3062 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3766 -4.3766 -3.5582 -3.5582 -3.5205 -3.5205 -3.5102 -3.5102 3.6157 3.6157 5.2008 5.2008 5.2920 5.2920 5.3792 5.3792 5.5801 5.5801 5.6874 5.6874 5.8529 5.8529 5.9455 5.9455 6.1595 6.1595 6.2091 6.2091 6.6921 6.6921 6.9291 6.9291 10.1456 10.1456 11.3400 11.3400 13.3816 13.3816 15.8186 15.8186 16.0174 16.0174 k = 0.5667 0.0962 0.3130 ( 8430 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3766 -4.3766 -3.5582 -3.5582 -3.5202 -3.5202 -3.5102 -3.5102 3.6330 3.6330 5.1952 5.1952 5.2856 5.2856 5.3767 5.3767 5.5690 5.5690 5.6874 5.6874 5.8622 5.8622 5.9524 5.9524 6.1688 6.1688 6.2181 6.2181 6.7035 6.7035 6.9815 6.9815 9.9713 9.9713 11.2381 11.2381 13.3545 13.3545 15.9794 15.9794 16.1730 16.1730 k = 0.5708 0.0842 0.3198 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3765 -4.3765 -3.5582 -3.5582 -3.5200 -3.5200 -3.5103 -3.5103 3.6505 3.6505 5.1888 5.1888 5.2791 5.2791 5.3743 5.3743 5.5584 5.5584 5.6872 5.6872 5.8724 5.8724 5.9604 5.9604 6.1781 6.1781 6.2274 6.2274 6.7157 6.7157 7.0362 7.0362 9.8000 9.8000 11.1387 11.1387 13.3277 13.3277 16.1402 16.1402 16.3211 16.3211 k = 0.5750 0.0722 0.3266 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3764 -4.3764 -3.5582 -3.5582 -3.5197 -3.5197 -3.5103 -3.5103 3.6682 3.6682 5.1813 5.1813 5.2729 5.2729 5.3718 5.3718 5.5483 5.5483 5.6867 5.6867 5.8833 5.8833 5.9694 5.9694 6.1872 6.1872 6.2370 6.2370 6.7289 6.7289 7.0930 7.0930 9.6320 9.6320 11.0420 11.0420 13.3013 13.3013 16.2986 16.2986 16.4572 16.4572 k = 0.5792 0.0601 0.3334 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3763 -4.3763 -3.5582 -3.5582 -3.5195 -3.5195 -3.5103 -3.5103 3.6858 3.6858 5.1727 5.1727 5.2672 5.2672 5.3691 5.3691 5.5389 5.5389 5.6863 5.6863 5.8947 5.8947 5.9792 5.9792 6.1963 6.1963 6.2469 6.2469 6.7433 6.7433 7.1520 7.1520 9.4676 9.4676 10.9481 10.9481 13.2755 13.2755 16.4458 16.4458 16.5762 16.5762 k = 0.5833 0.0481 0.3402 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3762 -4.3762 -3.5582 -3.5582 -3.5193 -3.5193 -3.5103 -3.5103 3.7031 3.7031 5.1631 5.1631 5.2620 5.2620 5.3660 5.3660 5.5304 5.5304 5.6860 5.6860 5.9065 5.9065 5.9894 5.9894 6.2051 6.2051 6.2573 6.2573 6.7592 6.7592 7.2130 7.2130 9.3071 9.3071 10.8573 10.8573 13.2505 13.2505 16.5441 16.5441 16.6937 16.6937 k = 0.5875 0.0361 0.3470 ( 8446 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3762 -4.3762 -3.5582 -3.5582 -3.5191 -3.5191 -3.5102 -3.5102 3.7200 3.7200 5.1523 5.1523 5.2576 5.2576 5.3624 5.3624 5.5229 5.5229 5.6860 5.6860 5.9183 5.9183 5.9999 5.9999 6.2138 6.2138 6.2679 6.2679 6.7767 6.7767 7.2758 7.2758 9.1509 9.1509 10.7696 10.7696 13.2262 13.2262 16.5501 16.5501 16.8383 16.8383 k = 0.5917 0.0241 0.3538 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3761 -4.3761 -3.5582 -3.5582 -3.5189 -3.5189 -3.5101 -3.5101 3.7363 3.7363 5.1404 5.1404 5.2540 5.2540 5.3583 5.3583 5.5164 5.5164 5.6864 5.6864 5.9301 5.9301 6.0103 6.0103 6.2222 6.2222 6.2790 6.2790 6.7960 6.7960 7.3403 7.3403 8.9994 8.9994 10.6854 10.6854 13.2027 13.2027 16.4892 16.4892 16.9960 16.9960 k = 0.5958 0.0120 0.3606 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3760 -4.3760 -3.5582 -3.5582 -3.5188 -3.5188 -3.5100 -3.5100 3.7518 3.7518 5.1274 5.1274 5.2513 5.2513 5.3536 5.3536 5.5111 5.5111 5.6873 5.6873 5.9415 5.9415 6.0204 6.0204 6.2303 6.2303 6.2904 6.2904 6.8172 6.8172 7.4064 7.4064 8.8531 8.8531 10.6046 10.6046 13.1800 13.1800 16.3938 16.3938 17.1563 17.1563 k = 0.6000-0.0000 0.3674 ( 8442 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3759 -4.3759 -3.5582 -3.5582 -3.5187 -3.5187 -3.5098 -3.5098 3.7663 3.7663 5.1133 5.1133 5.2494 5.2494 5.3484 5.3484 5.5069 5.5069 5.6887 5.6887 5.9523 5.9523 6.0298 6.0298 6.2381 6.2381 6.3022 6.3022 6.8401 6.8401 7.4738 7.4738 8.7129 8.7129 10.5276 10.5276 13.1582 13.1582 16.2821 16.2821 17.3156 17.3156 k = 0.6042-0.0120 0.3742 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3758 -4.3758 -3.5583 -3.5583 -3.5187 -3.5187 -3.5097 -3.5097 3.7795 3.7795 5.0982 5.0982 5.2486 5.2486 5.3428 5.3428 5.5040 5.5040 5.6907 5.6907 5.9623 5.9623 6.0385 6.0385 6.2455 6.2455 6.3144 6.3144 6.8647 6.8647 7.5422 7.5422 8.5798 8.5798 10.4543 10.4543 13.1371 13.1371 16.1629 16.1629 17.4712 17.4712 k = 0.6083-0.0241 0.3810 ( 8454 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3757 -4.3757 -3.5583 -3.5583 -3.5186 -3.5186 -3.5095 -3.5095 3.7914 3.7914 5.0821 5.0821 5.2485 5.2485 5.3370 5.3370 5.5022 5.5022 5.6934 5.6934 5.9713 5.9713 6.0462 6.0462 6.2525 6.2525 6.3270 6.3270 6.8904 6.8904 7.6108 7.6108 8.4552 8.4552 10.3851 10.3851 13.1169 13.1169 16.0407 16.0407 17.6204 17.6204 k = 0.6125-0.0361 0.3878 ( 8457 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3756 -4.3756 -3.5583 -3.5583 -3.5187 -3.5187 -3.5093 -3.5093 3.8016 3.8016 5.0652 5.0652 5.2494 5.2494 5.3310 5.3310 5.5014 5.5014 5.6968 5.6968 5.9790 5.9790 6.0527 6.0527 6.2591 6.2591 6.3400 6.3400 6.9164 6.9164 7.6785 7.6785 8.3416 8.3416 10.3200 10.3200 13.0975 13.0975 15.9180 15.9180 17.7596 17.7596 k = 0.6167-0.0481 0.3946 ( 8455 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5187 -3.5187 -3.5091 -3.5091 3.8100 3.8100 5.0475 5.0475 5.2509 5.2509 5.3250 5.3250 5.5017 5.5017 5.7008 5.7008 5.9853 5.9853 6.0580 6.0580 6.2652 6.2652 6.3535 6.3535 6.9414 6.9414 7.7426 7.7426 8.2435 8.2435 10.2593 10.2593 13.0787 13.0787 15.7961 15.7961 17.8843 17.8843 k = 0.6208-0.0601 0.4014 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3755 -4.3755 -3.5584 -3.5584 -3.5187 -3.5187 -3.5088 -3.5088 3.8164 3.8164 5.0292 5.0292 5.2528 5.2528 5.3195 5.3195 5.5029 5.5029 5.7055 5.7055 5.9900 5.9900 6.0619 6.0619 6.2709 6.2709 6.3675 6.3675 6.9633 6.9633 7.7970 7.7970 8.1690 8.1690 10.2029 10.2029 13.0606 13.0606 15.6761 15.6761 17.9900 17.9900 k = 0.6250-0.0722 0.4082 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8207 3.8207 5.0105 5.0105 5.2549 5.2549 5.3148 5.3148 5.5049 5.5049 5.7108 5.7108 5.9932 5.9932 6.0641 6.0641 6.2762 6.2762 6.3820 6.3820 6.9794 6.9794 7.8303 7.8303 8.1326 8.1326 10.1512 10.1512 13.0430 13.0430 15.5586 15.5586 18.0731 18.0731 k = 0.6250-0.0722 0.4082 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8207 3.8207 5.0105 5.0105 5.2549 5.2549 5.3148 5.3148 5.5049 5.5049 5.7108 5.7108 5.9932 5.9932 6.0641 6.0641 6.2762 6.2762 6.3820 6.3820 6.9794 6.9794 7.8303 7.8303 8.1326 8.1326 10.1512 10.1512 13.0430 13.0430 15.5586 15.5586 18.0731 18.0731 k = 0.6176-0.0679 0.4203 ( 8458 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8210 3.8210 5.0111 5.0111 5.2550 5.2550 5.3147 5.3147 5.5044 5.5044 5.7121 5.7121 5.9929 5.9929 6.0636 6.0636 6.2762 6.2762 6.3799 6.3799 6.9809 6.9809 7.8330 7.8330 8.1329 8.1329 10.1386 10.1386 13.0590 13.0590 15.5587 15.5587 18.0533 18.0533 k = 0.6103-0.0637 0.4323 ( 8460 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5187 -3.5187 -3.5087 -3.5087 3.8218 3.8218 5.0129 5.0129 5.2550 5.2550 5.3144 5.3144 5.5030 5.5030 5.7161 5.7161 5.9922 5.9922 6.0622 6.0622 6.2764 6.2764 6.3737 6.3737 6.9854 6.9854 7.8412 7.8412 8.1339 8.1339 10.1018 10.1018 13.1060 13.1060 15.5589 15.5589 17.9989 17.9989 k = 0.6029-0.0594 0.4443 ( 8463 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5187 -3.5187 -3.5087 -3.5087 3.8233 3.8233 5.0159 5.0159 5.2551 5.2551 5.3138 5.3138 5.5013 5.5013 5.7223 5.7223 5.9911 5.9911 6.0597 6.0597 6.2766 6.2766 6.3639 6.3639 6.9926 6.9926 7.8547 7.8547 8.1355 8.1355 10.0431 10.0431 13.1819 13.1819 15.5591 15.5591 17.9204 17.9204 k = 0.5956-0.0552 0.4563 ( 8461 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3754 -4.3754 -3.5584 -3.5584 -3.5186 -3.5186 -3.5088 -3.5088 3.8253 3.8253 5.0200 5.0200 5.2549 5.2549 5.3130 5.3130 5.4999 5.4999 5.7301 5.7301 5.9896 5.9896 6.0559 6.0559 6.2767 6.2767 6.3513 6.3513 7.0022 7.0022 7.8733 7.8733 8.1378 8.1378 9.9658 9.9658 13.2831 13.2831 15.5593 15.5593 17.8273 17.8273 k = 0.5882-0.0509 0.4683 ( 8461 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5184 -3.5184 -3.5090 -3.5090 3.8277 3.8277 5.0251 5.0251 5.2543 5.2543 5.3117 5.3117 5.4996 5.4996 5.7389 5.7389 5.9878 5.9878 6.0508 6.0508 6.2768 6.2768 6.3368 6.3368 7.0137 7.0137 7.8966 7.8966 8.1409 8.1409 9.8737 9.8737 13.4062 13.4062 15.5594 15.5594 17.7259 17.7259 k = 0.5809-0.0467 0.4803 ( 8457 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5183 -3.5183 -3.5091 -3.5091 3.8306 3.8306 5.0313 5.0313 5.2532 5.2532 5.3100 5.3100 5.5011 5.5011 5.7481 5.7481 5.9856 5.9856 6.0441 6.0441 6.2766 6.2766 6.3216 6.3216 7.0269 7.0269 7.9242 7.9242 8.1447 8.1447 9.7703 9.7703 13.5477 13.5477 15.5592 15.5592 17.6189 17.6189 k = 0.5735-0.0425 0.4923 ( 8454 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5181 -3.5181 -3.5093 -3.5093 3.8338 3.8338 5.0383 5.0383 5.2513 5.2513 5.3078 5.3078 5.5050 5.5050 5.7570 5.7570 5.9833 5.9833 6.0356 6.0356 6.2756 6.2756 6.3071 6.3071 7.0414 7.0414 7.9558 7.9558 8.1495 8.1495 9.6590 9.6590 13.7044 13.7044 15.5585 15.5585 17.4905 17.4905 k = 0.5662-0.0382 0.5043 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3755 -4.3755 -3.5584 -3.5584 -3.5179 -3.5179 -3.5095 -3.5095 3.8373 3.8373 5.0460 5.0460 5.2486 5.2486 5.3052 5.3052 5.5119 5.5119 5.7649 5.7649 5.9807 5.9807 6.0254 6.0254 6.2723 6.2723 6.2956 6.2956 7.0568 7.0568 7.9906 7.9906 8.1553 8.1553 9.5427 9.5427 13.8735 13.8735 15.5572 15.5572 17.3172 17.3172 k = 0.5588-0.0340 0.5163 ( 8453 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3755 -4.3755 -3.5584 -3.5584 -3.5177 -3.5177 -3.5097 -3.5097 3.8411 3.8411 5.0544 5.0544 5.2448 5.2448 5.3022 5.3022 5.5218 5.5218 5.7712 5.7712 5.9778 5.9778 6.0138 6.0138 6.2654 6.2654 6.2892 6.2892 7.0730 7.0730 8.0280 8.0280 8.1624 8.1624 9.4239 9.4239 14.0527 14.0527 15.5550 15.5550 17.1365 17.1365 k = 0.5515-0.0297 0.5283 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3755 -4.3755 -3.5584 -3.5584 -3.5175 -3.5175 -3.5099 -3.5099 3.8448 3.8448 5.0634 5.0634 5.2400 5.2400 5.2991 5.2991 5.5348 5.5348 5.7749 5.7749 5.9745 5.9745 6.0017 6.0017 6.2564 6.2564 6.2867 6.2867 7.0896 7.0896 8.0668 8.0668 8.1710 8.1710 9.3051 9.3051 14.2400 14.2400 15.5517 15.5517 16.9565 16.9565 k = 0.5441-0.0255 0.5403 ( 8447 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3755 -4.3755 -3.5584 -3.5584 -3.5173 -3.5173 -3.5101 -3.5101 3.8486 3.8486 5.0727 5.0727 5.2342 5.2342 5.2961 5.2961 5.5507 5.5507 5.7754 5.7754 5.9697 5.9697 5.9909 5.9909 6.2479 6.2479 6.2858 6.2858 7.1064 7.1064 8.1055 8.1055 8.1820 8.1820 9.1887 9.1887 14.4333 14.4333 15.5472 15.5472 16.7785 16.7785 k = 0.5368-0.0212 0.5523 ( 8457 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5171 -3.5171 -3.5103 -3.5103 3.8522 3.8522 5.0821 5.0821 5.2277 5.2277 5.2934 5.2934 5.5692 5.5692 5.7717 5.7717 5.9625 5.9625 5.9836 5.9836 6.2409 6.2409 6.2853 6.2853 7.1229 7.1229 8.1413 8.1413 8.1968 8.1968 9.0773 9.0773 14.6303 14.6303 15.5417 15.5417 16.6029 16.6029 k = 0.5294-0.0170 0.5643 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5169 -3.5169 -3.5105 -3.5105 3.8555 3.8555 5.0915 5.0915 5.2207 5.2207 5.2910 5.2910 5.5900 5.5900 5.7634 5.7634 5.9538 5.9538 5.9798 5.9798 6.2355 6.2355 6.2850 6.2850 7.1386 7.1386 8.1704 8.1704 8.2173 8.2173 8.9744 8.9744 14.8278 14.8278 15.5364 15.5364 16.4299 16.4299 k = 0.5221-0.0127 0.5764 ( 8438 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3756 -4.3756 -3.5584 -3.5584 -3.5167 -3.5167 -3.5106 -3.5106 3.8583 3.8583 5.1003 5.1003 5.2136 5.2136 5.2892 5.2892 5.6126 5.6126 5.7501 5.7501 5.9462 5.9462 5.9779 5.9779 6.2315 6.2315 6.2848 6.2848 7.1530 7.1530 8.1920 8.1920 8.2410 8.2410 8.8844 8.8844 15.0194 15.0194 15.5354 15.5354 16.2597 16.2597 k = 0.5147-0.0085 0.5884 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5584 -3.5584 -3.5166 -3.5166 -3.5107 -3.5107 3.8605 3.8605 5.1080 5.1080 5.2071 5.2071 5.2879 5.2879 5.6363 5.6363 5.7327 5.7327 5.9407 5.9407 5.9769 5.9769 6.2290 6.2290 6.2845 6.2845 7.1649 7.1649 8.2102 8.2102 8.2594 8.2594 8.8135 8.8135 15.1885 15.1885 15.5528 15.5528 16.0927 16.0927 k = 0.5074-0.0042 0.6004 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5584 -3.5584 -3.5165 -3.5165 -3.5108 -3.5108 3.8620 3.8620 5.1135 5.1135 5.2024 5.2024 5.2871 5.2871 5.6601 5.6601 5.7124 5.7124 5.9374 5.9374 5.9765 5.9765 6.2275 6.2275 6.2843 6.2843 7.1732 7.1732 8.2274 8.2274 8.2649 8.2649 8.7687 8.7687 15.2955 15.2955 15.6243 15.6243 15.9292 15.9292 k = 0.5000-0.0000 0.6124 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5165 -3.5165 -3.5109 -3.5109 3.8625 3.8625 5.1156 5.1156 5.2005 5.2005 5.2868 5.2868 5.6767 5.6767 5.6968 5.6968 5.9364 5.9364 5.9764 5.9764 6.2270 6.2270 6.2842 6.2842 7.1763 7.1763 8.2396 8.2396 8.2596 8.2596 8.7540 8.7540 15.3228 15.3228 15.7425 15.7425 15.7901 15.7901 k = 0.5000-0.0000 0.6124 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5165 -3.5165 -3.5109 -3.5109 3.8625 3.8625 5.1156 5.1156 5.2005 5.2005 5.2868 5.2868 5.6767 5.6767 5.6968 5.6968 5.9364 5.9364 5.9764 5.9764 6.2270 6.2270 6.2842 6.2842 7.1763 7.1763 8.2396 8.2396 8.2596 8.2596 8.7540 8.7540 15.3228 15.3228 15.7425 15.7425 15.7901 15.7901 k = 0.5000 0.0085 0.6004 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5165 -3.5165 -3.5109 -3.5109 3.8616 3.8616 5.1160 5.1160 5.2009 5.2009 5.2870 5.2870 5.6753 5.6753 5.6978 5.6978 5.9362 5.9362 5.9759 5.9759 6.2268 6.2268 6.2839 6.2839 7.1721 7.1721 8.2230 8.2230 8.2638 8.2638 8.7780 8.7780 15.2999 15.2999 15.7472 15.7472 15.8045 15.8045 k = 0.5000 0.0170 0.5884 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5166 -3.5166 -3.5109 -3.5109 3.8589 3.8589 5.1172 5.1172 5.2020 5.2020 5.2877 5.2877 5.6718 5.6718 5.7001 5.7001 5.9356 5.9356 5.9744 5.9744 6.2261 6.2261 6.2832 6.2832 7.1600 7.1600 8.1699 8.1699 8.2885 8.2885 8.8410 8.8410 15.2425 15.2425 15.7364 15.7364 15.8620 15.8620 k = 0.5000 0.0255 0.5764 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3756 -4.3756 -3.5583 -3.5583 -3.5166 -3.5166 -3.5109 -3.5109 3.8544 3.8544 5.1190 5.1190 5.2038 5.2038 5.2889 5.2889 5.6671 5.6671 5.7029 5.7029 5.9347 5.9347 5.9719 5.9719 6.2249 6.2249 6.2819 6.2819 7.1410 7.1410 8.0974 8.0974 8.3307 8.3307 8.9278 8.9278 15.1679 15.1679 15.7090 15.7090 15.9479 15.9479 k = 0.5000 0.0340 0.5643 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3757 -4.3757 -3.5583 -3.5583 -3.5167 -3.5167 -3.5109 -3.5109 3.8482 3.8482 5.1217 5.1217 5.2063 5.2063 5.2905 5.2905 5.6615 5.6615 5.7057 5.7057 5.9333 5.9333 5.9685 5.9685 6.2232 6.2232 6.2802 6.2802 7.1168 7.1168 8.0162 8.0162 8.3877 8.3877 9.0283 9.0283 15.0862 15.0862 15.6715 15.6715 16.0476 16.0476 k = 0.5000 0.0425 0.5523 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3757 -4.3757 -3.5583 -3.5583 -3.5168 -3.5168 -3.5109 -3.5109 3.8403 3.8403 5.1250 5.1250 5.2094 5.2094 5.2926 5.2926 5.6556 5.6556 5.7083 5.7083 5.9314 5.9314 5.9643 5.9643 6.2211 6.2211 6.2779 6.2779 7.0889 7.0889 7.9318 7.9318 8.4575 8.4575 9.1376 9.1376 15.0020 15.0020 15.6268 15.6268 16.1557 16.1557 k = 0.5000 0.0509 0.5403 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3757 -4.3757 -3.5583 -3.5583 -3.5170 -3.5170 -3.5109 -3.5109 3.8308 3.8308 5.1290 5.1290 5.2132 5.2132 5.2952 5.2952 5.6493 5.6493 5.7106 5.7106 5.9289 5.9289 5.9596 5.9596 6.2186 6.2186 6.2752 6.2752 7.0589 7.0589 7.8467 7.8467 8.5384 8.5384 9.2528 9.2528 14.9176 14.9176 15.5771 15.5771 16.2695 16.2695 k = 0.5000 0.0594 0.5283 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3758 -4.3758 -3.5583 -3.5583 -3.5171 -3.5171 -3.5109 -3.5109 3.8198 3.8198 5.1336 5.1336 5.2175 5.2175 5.2982 5.2982 5.6429 5.6429 5.7125 5.7125 5.9257 5.9257 5.9545 5.9545 6.2157 6.2157 6.2720 6.2720 7.0278 7.0278 7.7622 7.7622 8.6292 8.6292 9.3727 9.3727 14.8342 14.8342 15.5239 15.5239 16.3878 16.3878 k = 0.5000 0.0679 0.5163 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3759 -4.3759 -3.5583 -3.5583 -3.5173 -3.5173 -3.5109 -3.5109 3.8074 3.8074 5.1387 5.1387 5.2223 5.2223 5.3017 5.3017 5.6365 5.6365 5.7142 5.7142 5.9215 5.9215 5.9495 5.9495 6.2124 6.2124 6.2683 6.2683 6.9965 6.9965 7.6793 7.6793 8.7286 8.7286 9.4965 9.4965 14.7524 14.7524 15.4684 15.4684 16.5099 16.5099 k = 0.5000 0.0764 0.5043 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3759 -4.3759 -3.5582 -3.5582 -3.5175 -3.5175 -3.5109 -3.5109 3.7938 3.7938 5.1443 5.1443 5.2276 5.2276 5.3056 5.3056 5.6303 5.6303 5.7154 5.7154 5.9161 5.9161 5.9449 5.9449 6.2088 6.2088 6.2642 6.2642 6.9657 6.9657 7.5983 7.5983 8.8357 8.8357 9.6234 9.6234 14.6726 14.6726 15.4114 15.4114 16.6354 16.6354 k = 0.5000 0.0849 0.4923 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3760 -4.3760 -3.5582 -3.5582 -3.5177 -3.5177 -3.5108 -3.5108 3.7790 3.7790 5.1502 5.1502 5.2332 5.2332 5.3100 5.3100 5.6244 5.6244 5.7163 5.7163 5.9095 5.9095 5.9409 5.9409 6.2049 6.2049 6.2596 6.2596 6.9359 6.9359 7.5195 7.5195 8.9498 8.9498 9.7532 9.7532 14.5951 14.5951 15.3536 15.3536 16.7639 16.7639 k = 0.5000 0.0934 0.4803 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3761 -4.3761 -3.5582 -3.5582 -3.5180 -3.5180 -3.5108 -3.5108 3.7633 3.7633 5.1565 5.1565 5.2391 5.2391 5.3149 5.3149 5.6189 5.6189 5.7168 5.7168 5.9018 5.9018 5.9375 5.9375 6.2006 6.2006 6.2547 6.2547 6.9072 6.9072 7.4431 7.4431 9.0703 9.0703 9.8856 9.8856 14.5201 14.5201 15.2955 15.2955 16.8953 16.8953 k = 0.5000 0.1019 0.4683 ( 8452 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3761 -4.3761 -3.5582 -3.5582 -3.5182 -3.5182 -3.5108 -3.5108 3.7467 3.7467 5.1629 5.1629 5.2454 5.2454 5.3201 5.3201 5.6139 5.6139 5.7170 5.7170 5.8934 5.8934 5.9347 5.9347 6.1960 6.1960 6.2493 6.2493 6.8800 6.8800 7.3692 7.3692 9.1967 9.1967 10.0202 10.0202 14.4476 14.4476 15.2374 15.2374 17.0293 17.0293 k = 0.5000 0.1104 0.4563 ( 8446 PWs) bands (ev): -35.4325 -35.4325 -4.3782 -4.3782 -4.3762 -4.3762 -3.5582 -3.5582 -3.5185 -3.5185 -3.5107 -3.5107 3.7294 3.7294 5.1694 5.1694 5.2518 5.2518 5.3256 5.3256 5.6097 5.6097 5.7167 5.7167 5.8845 5.8845 5.9323 5.9323 6.1910 6.1910 6.2436 6.2436 6.8543 6.8543 7.2980 7.2980 9.3287 9.3287 10.1570 10.1570 14.3777 14.3777 15.1795 15.1795 17.1655 17.1655 k = 0.5000 0.1189 0.4443 ( 8442 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3763 -4.3763 -3.5582 -3.5582 -3.5188 -3.5188 -3.5107 -3.5107 3.7117 3.7117 5.1758 5.1758 5.2584 5.2584 5.3314 5.3314 5.6064 5.6064 5.7160 5.7160 5.8755 5.8755 5.9303 5.9303 6.1858 6.1858 6.2375 6.2375 6.8301 6.8301 7.2295 7.2295 9.4658 9.4658 10.2957 10.2957 14.3106 14.3106 15.1219 15.1219 17.3030 17.3030 k = 0.5000 0.1274 0.4323 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3764 -4.3764 -3.5582 -3.5582 -3.5191 -3.5191 -3.5106 -3.5106 3.6936 3.6936 5.1821 5.1821 5.2652 5.2652 5.3375 5.3375 5.6041 5.6041 5.7148 5.7148 5.8665 5.8665 5.9285 5.9285 6.1802 6.1802 6.2311 6.2311 6.8074 6.8074 7.1637 7.1637 9.6078 9.6078 10.4360 10.4360 14.2463 14.2463 15.0647 15.0647 17.4371 17.4371 k = 0.5000 0.1358 0.4203 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3764 -4.3764 -3.5582 -3.5582 -3.5194 -3.5194 -3.5105 -3.5105 3.6753 3.6753 5.1880 5.1880 5.2720 5.2720 5.3437 5.3437 5.6029 5.6029 5.7131 5.7131 5.8580 5.8580 5.9271 5.9271 6.1742 6.1742 6.2245 6.2245 6.7863 6.7863 7.1007 7.1007 9.7545 9.7545 10.5779 10.5779 14.1847 14.1847 15.0079 15.0079 17.4437 17.4437 k = 0.5000 0.1443 0.4082 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3765 -4.3765 -3.5582 -3.5582 -3.5197 -3.5197 -3.5105 -3.5105 3.6569 3.6569 5.1935 5.1935 5.2788 5.2788 5.3499 5.3499 5.6030 5.6030 5.7108 5.7108 5.8501 5.8501 5.9260 5.9260 6.1679 6.1679 6.2177 6.2177 6.7665 6.7665 7.0404 7.0404 9.9057 9.9057 10.7209 10.7209 14.1260 14.1260 14.9514 14.9514 17.2147 17.2147 k = 0.5000 0.1528 0.3962 ( 8430 PWs) bands (ev): -35.4325 -35.4325 -4.3783 -4.3783 -4.3766 -4.3766 -3.5582 -3.5582 -3.5200 -3.5200 -3.5104 -3.5104 3.6388 3.6388 5.1986 5.1986 5.2855 5.2855 5.3562 5.3562 5.6044 5.6044 5.7080 5.7080 5.8430 5.8430 5.9251 5.9251 6.1612 6.1612 6.2108 6.2108 6.7482 6.7482 6.9830 6.9830 10.0610 10.0610 10.8650 10.8650 14.0701 14.0701 14.8951 14.8951 16.9724 16.9724 k = 0.5000 0.1613 0.3842 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3767 -4.3767 -3.5582 -3.5582 -3.5203 -3.5203 -3.5103 -3.5103 3.6209 3.6209 5.2030 5.2030 5.2921 5.2921 5.3625 5.3625 5.6072 5.6072 5.7048 5.7048 5.8370 5.8370 5.9246 5.9246 6.1540 6.1540 6.2037 6.2037 6.7310 6.7310 6.9284 6.9284 10.2203 10.2203 11.0099 11.0099 14.0170 14.0170 14.8388 14.8388 16.7296 16.7296 k = 0.5000 0.1698 0.3722 ( 8446 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3767 -4.3767 -3.5582 -3.5582 -3.5206 -3.5206 -3.5102 -3.5102 3.6034 3.6034 5.2069 5.2069 5.2983 5.2983 5.3687 5.3687 5.6113 5.6113 5.7011 5.7011 5.8320 5.8320 5.9242 5.9242 6.1465 6.1465 6.1966 6.1966 6.7150 6.7150 6.8769 6.8769 10.3834 10.3834 11.1552 11.1552 13.9666 13.9666 14.7823 14.7823 16.4879 16.4879 k = 0.5000 0.1783 0.3602 ( 8452 PWs) bands (ev): -35.4326 -35.4326 -4.3785 -4.3785 -4.3768 -4.3768 -3.5582 -3.5582 -3.5209 -3.5209 -3.5101 -3.5101 3.5866 3.5866 5.2102 5.2102 5.3041 5.3041 5.3749 5.3749 5.6167 5.6167 5.6971 5.6971 5.8281 5.8281 5.9242 5.9242 6.1386 6.1386 6.1896 6.1896 6.6999 6.6999 6.8286 6.8286 10.5501 10.5501 11.3006 11.3006 13.9189 13.9189 14.7253 14.7253 16.2481 16.2481 k = 0.5000 0.1868 0.3482 ( 8456 PWs) bands (ev): -35.4326 -35.4326 -4.3785 -4.3785 -4.3768 -4.3768 -3.5582 -3.5582 -3.5212 -3.5212 -3.5100 -3.5100 3.5704 3.5704 5.2129 5.2129 5.3093 5.3093 5.3811 5.3811 5.6229 5.6229 5.6932 5.6932 5.8254 5.8254 5.9243 5.9243 6.1303 6.1303 6.1826 6.1826 6.6853 6.6853 6.7839 6.7839 10.7202 10.7202 11.4457 11.4457 13.8738 13.8738 14.6676 14.6676 16.0107 16.0107 k = 0.5000 0.1953 0.3362 ( 8458 PWs) bands (ev): -35.4326 -35.4326 -4.3786 -4.3786 -4.3769 -4.3769 -3.5583 -3.5583 -3.5215 -3.5215 -3.5099 -3.5099 3.5551 3.5551 5.2150 5.2150 5.3139 5.3139 5.3874 5.3874 5.6296 5.6296 5.6899 5.6899 5.8237 5.8237 5.9247 5.9247 6.1216 6.1216 6.1758 6.1758 6.6704 6.6704 6.7436 6.7436 10.8934 10.8934 11.5900 11.5900 13.8309 13.8309 14.6088 14.6088 15.7764 15.7764 k = 0.5000 0.2038 0.3242 ( 8460 PWs) bands (ev): -35.4326 -35.4326 -4.3786 -4.3786 -4.3769 -4.3769 -3.5583 -3.5583 -3.5217 -3.5217 -3.5098 -3.5098 3.5407 3.5407 5.2166 5.2166 5.3177 5.3177 5.3937 5.3937 5.6359 5.6359 5.6881 5.6881 5.8229 5.8229 5.9253 5.9253 6.1127 6.1127 6.1692 6.1692 6.6533 6.6533 6.7097 6.7097 11.0695 11.0695 11.7328 11.7328 13.7901 13.7901 14.5487 14.5487 15.5457 15.5457 k = 0.5000 0.2123 0.3122 ( 8458 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3769 -4.3769 -3.5583 -3.5583 -3.5220 -3.5220 -3.5097 -3.5097 3.5274 3.5274 5.2177 5.2177 5.3208 5.3208 5.3999 5.3999 5.6403 5.6403 5.6889 5.6889 5.8227 5.8227 5.9260 5.9260 6.1036 6.1036 6.1628 6.1628 6.6315 6.6315 6.6847 6.6847 11.2480 11.2480 11.8736 11.8736 13.7508 13.7508 14.4872 14.4872 15.3196 15.3196 k = 0.5000 0.2208 0.3002 ( 8458 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3770 -4.3770 -3.5583 -3.5583 -3.5222 -3.5222 -3.5096 -3.5096 3.5152 3.5152 5.2184 5.2184 5.3232 5.3232 5.4062 5.4062 5.6420 5.6420 5.6934 5.6934 5.8231 5.8231 5.9269 5.9269 6.0945 6.0945 6.1568 6.1568 6.6054 6.6054 6.6683 6.6683 11.4285 11.4285 12.0113 12.0113 13.7122 13.7122 14.4243 14.4243 15.0992 15.0992 k = 0.5000 0.2292 0.2882 ( 8458 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3770 -4.3770 -3.5584 -3.5584 -3.5224 -3.5224 -3.5096 -3.5096 3.5042 3.5042 5.2187 5.2187 5.3251 5.3251 5.4122 5.4122 5.6411 5.6411 5.7012 5.7012 5.8238 5.8238 5.9278 5.9278 6.0856 6.0856 6.1511 6.1511 6.5786 6.5786 6.6571 6.6571 11.6103 11.6103 12.1449 12.1449 13.6731 13.6731 14.3601 14.3601 14.8865 14.8865 k = 0.5000 0.2377 0.2762 ( 8454 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5226 -3.5226 -3.5095 -3.5095 3.4946 3.4946 5.2188 5.2188 5.3264 5.3264 5.4179 5.4179 5.6385 5.6385 5.7110 5.7110 5.8244 5.8244 5.9288 5.9288 6.0769 6.0769 6.1459 6.1459 6.5534 6.5534 6.6489 6.6489 11.7925 11.7925 12.2730 12.2730 13.6313 13.6313 14.2955 14.2955 14.6842 14.6842 k = 0.5000 0.2462 0.2642 ( 8452 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5227 -3.5227 -3.5094 -3.5094 3.4863 3.4863 5.2188 5.2188 5.3274 5.3274 5.4231 5.4231 5.6354 5.6354 5.7216 5.7216 5.8250 5.8250 5.9297 5.9297 6.0689 6.0689 6.1413 6.1413 6.5311 6.5311 6.6425 6.6425 11.9732 11.9732 12.3940 12.3940 13.5836 13.5836 14.2315 14.2315 14.4969 14.4969 k = 0.5000 0.2547 0.2522 ( 8462 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5584 -3.5584 -3.5228 -3.5228 -3.5094 -3.5094 3.4795 3.4795 5.2186 5.2186 5.3281 5.3281 5.4276 5.4276 5.6322 5.6322 5.7321 5.7321 5.8251 5.8251 5.9306 5.9306 6.0617 6.0617 6.1373 6.1373 6.5123 6.5123 6.6376 6.6376 12.1496 12.1496 12.5062 12.5062 13.5251 13.5251 14.1700 14.1700 14.3316 14.3316 k = 0.5000 0.2632 0.2401 ( 8442 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5584 -3.5584 -3.5229 -3.5229 -3.5093 -3.5093 3.4741 3.4741 5.2184 5.2184 5.3285 5.3285 5.4314 5.4314 5.6293 5.6293 5.7417 5.7417 5.8248 5.8248 5.9313 5.9313 6.0557 6.0557 6.1341 6.1341 6.4974 6.4974 6.6339 6.6339 12.3152 12.3152 12.6089 12.6089 13.4503 13.4503 14.1121 14.1121 14.1990 14.1990 k = 0.5000 0.2717 0.2281 ( 8442 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4703 3.4703 5.2182 5.2182 5.3288 5.3288 5.4342 5.4342 5.6271 5.6271 5.7495 5.7495 5.8243 5.8243 5.9319 5.9319 6.0511 6.0511 6.1317 6.1317 6.4865 6.4865 6.6313 6.6313 12.4569 12.4569 12.7040 12.7040 13.3584 13.3584 14.0571 14.0571 14.1118 14.1118 k = 0.5000 0.2802 0.2161 ( 8436 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4680 3.4680 5.2180 5.2180 5.3290 5.3290 5.4359 5.4359 5.6258 5.6258 5.7546 5.7546 5.8237 5.8237 5.9323 5.9323 6.0482 6.0482 6.1302 6.1302 6.4799 6.4799 6.6298 6.6298 12.5523 12.5523 12.7916 12.7916 13.2637 13.2637 14.0125 14.0125 14.0696 14.0696 k = 0.5000 0.2887 0.2041 ( 8424 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5231 -3.5231 -3.5093 -3.5093 3.4672 3.4672 5.2180 5.2180 5.3290 5.3290 5.4365 5.4365 5.6253 5.6253 5.7564 5.7564 5.8234 5.8234 5.9324 5.9324 6.0472 6.0472 6.1297 6.1297 6.4777 6.4777 6.6293 6.6293 12.5849 12.5849 12.8365 12.8365 13.2158 13.2158 13.9960 13.9960 14.0572 14.0572 k = 0.5000 0.2887 0.2041 ( 8424 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5231 -3.5231 -3.5093 -3.5093 3.4672 3.4672 5.2180 5.2180 5.3290 5.3290 5.4365 5.4365 5.6253 5.6253 5.7564 5.7564 5.8234 5.8234 5.9324 5.9324 6.0472 6.0472 6.1297 6.1297 6.4777 6.4777 6.6293 6.6293 12.5849 12.5849 12.8365 12.8365 13.2158 13.2158 13.9960 13.9960 14.0572 14.0572 k = 0.4958 0.2863 0.2177 ( 8435 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4679 3.4679 5.2180 5.2180 5.3290 5.3290 5.4359 5.4359 5.6257 5.6257 5.7547 5.7547 5.8237 5.8237 5.9323 5.9323 6.0482 6.0482 6.1302 6.1302 6.4798 6.4798 6.6298 6.6298 12.5535 12.5535 12.7930 12.7930 13.2622 13.2622 14.0120 14.0120 14.0691 14.0691 k = 0.4917 0.2839 0.2313 ( 8445 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5585 -3.5585 -3.5230 -3.5230 -3.5093 -3.5093 3.4702 3.4702 5.2182 5.2182 5.3288 5.3288 5.4343 5.4343 5.6271 5.6271 5.7497 5.7497 5.8243 5.8243 5.9319 5.9319 6.0509 6.0509 6.1316 6.1316 6.4862 6.4862 6.6313 6.6313 12.4612 12.4612 12.7079 12.7079 13.3542 13.3542 14.0580 14.0580 14.1069 14.1069 k = 0.4875 0.2815 0.2449 ( 8445 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5584 -3.5584 -3.5229 -3.5229 -3.5093 -3.5093 3.4739 3.4739 5.2183 5.2183 5.3286 5.3286 5.4316 5.4316 5.6292 5.6292 5.7422 5.7422 5.8248 5.8248 5.9314 5.9314 6.0554 6.0554 6.1339 6.1339 6.4966 6.4966 6.6338 6.6338 12.3225 12.3225 12.6173 12.6173 13.4412 13.4412 14.1317 14.1317 14.1732 14.1732 k = 0.4833 0.2791 0.2586 ( 8459 PWs) bands (ev): -35.4326 -35.4326 -4.3789 -4.3789 -4.3770 -4.3770 -3.5584 -3.5584 -3.5228 -3.5228 -3.5094 -3.5094 3.4791 3.4791 5.2186 5.2186 5.3281 5.3281 5.4280 5.4280 5.6319 5.6319 5.7328 5.7328 5.8251 5.8251 5.9306 5.9306 6.0612 6.0612 6.1371 6.1371 6.5110 6.5110 6.6373 6.6373 12.1583 12.1583 12.5227 12.5227 13.5039 13.5039 14.2316 14.2316 14.2660 14.2660 k = 0.4792 0.2766 0.2722 ( 8458 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5227 -3.5227 -3.5094 -3.5094 3.4856 3.4856 5.2187 5.2187 5.3275 5.3275 5.4236 5.4236 5.6350 5.6350 5.7224 5.7224 5.8251 5.8251 5.9299 5.9299 6.0682 6.0682 6.1409 6.1409 6.5290 6.5290 6.6422 6.6422 11.9818 11.9818 12.4226 12.4226 13.5401 13.5401 14.3510 14.3510 14.3835 14.3835 k = 0.4750 0.2742 0.2858 ( 8448 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5226 -3.5226 -3.5095 -3.5095 3.4936 3.4936 5.2188 5.2188 5.3266 5.3266 5.4186 5.4186 5.6380 5.6380 5.7118 5.7118 5.8248 5.8248 5.9291 5.9291 6.0761 6.0761 6.1455 6.1455 6.5501 6.5501 6.6486 6.6486 11.7992 11.7992 12.3180 12.3180 13.5552 13.5552 14.4782 14.4782 14.5250 14.5250 k = 0.4708 0.2718 0.2994 ( 8453 PWs) bands (ev): -35.4326 -35.4326 -4.3788 -4.3788 -4.3770 -4.3770 -3.5584 -3.5584 -3.5224 -3.5224 -3.5095 -3.5095 3.5029 3.5029 5.2187 5.2187 5.3253 5.3253 5.4133 5.4133 5.6403 5.6403 5.7016 5.7016 5.8244 5.8244 5.9285 5.9285 6.0846 6.0846 6.1507 6.1507 6.5733 6.5733 6.6573 6.6573 11.6135 11.6135 12.2100 12.2100 13.5555 13.5555 14.6108 14.6108 14.6825 14.6825 k = 0.4667 0.2694 0.3130 ( 8449 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3770 -4.3770 -3.5583 -3.5583 -3.5222 -3.5222 -3.5096 -3.5096 3.5135 3.5135 5.2183 5.2183 5.3235 5.3235 5.4078 5.4078 5.6408 5.6408 5.6930 5.6930 5.8244 5.8244 5.9281 5.9281 6.0935 6.0935 6.1564 6.1564 6.5970 6.5970 6.6698 6.6698 11.4266 11.4266 12.1000 12.1000 13.5461 13.5461 14.7490 14.7490 14.8480 14.8480 k = 0.4625 0.2670 0.3266 ( 8443 PWs) bands (ev): -35.4326 -35.4326 -4.3787 -4.3787 -4.3769 -4.3769 -3.5583 -3.5583 -3.5220 -3.5220 -3.5097 -3.5097 3.5252 3.5252 5.2176 5.2176 5.3211 5.3211 5.4024 5.4024 5.6384 5.6384 5.6871 5.6871 5.8249 5.8249 5.9281 5.9281 6.1028 6.1028 6.1627 6.1627 6.6184 6.6184 6.6885 6.6885 11.2396 11.2396 11.9892 11.9892 13.5303 13.5303 14.8922 14.8922 15.0172 15.0172 k = 0.4583 0.2646 0.3402 ( 8433 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3769 -4.3769 -3.5583 -3.5583 -3.5218 -3.5218 -3.5098 -3.5098 3.5381 3.5381 5.2164 5.2164 5.3180 5.3180 5.3973 5.3973 5.6325 5.6325 5.6845 5.6845 5.8262 5.8262 5.9287 5.9287 6.1122 6.1122 6.1694 6.1694 6.6356 6.6356 6.7152 6.7152 11.0532 11.0532 11.8782 11.8782 13.5100 13.5100 15.0396 15.0396 15.1875 15.1875 k = 0.4542 0.2622 0.3538 ( 8449 PWs) bands (ev): -35.4326 -35.4326 -4.3786 -4.3786 -4.3769 -4.3769 -3.5583 -3.5583 -3.5216 -3.5216 -3.5099 -3.5099 3.5520 3.5520 5.2146 5.2146 5.3142 5.3142 5.3926 5.3926 5.6239 5.6239 5.6843 5.6843 5.8288 5.8288 5.9300 5.9300 6.1216 6.1216 6.1766 6.1766 6.6490 6.6490 6.7493 6.7493 10.8679 10.8679 11.7678 11.7678 13.4869 13.4869 15.1904 15.1904 15.3576 15.3576 k = 0.4500 0.2598 0.3674 ( 8441 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3768 -4.3768 -3.5582 -3.5582 -3.5213 -3.5213 -3.5100 -3.5100 3.5668 3.5668 5.2123 5.2123 5.3096 5.3096 5.3884 5.3884 5.6136 5.6136 5.6852 5.6852 5.8327 5.8327 5.9322 5.9322 6.1312 6.1312 6.1841 6.1841 6.6604 6.6604 6.7888 6.7888 10.6841 10.6841 11.6584 11.6584 13.4619 13.4619 15.3442 15.3442 15.5263 15.5263 k = 0.4458 0.2574 0.3810 ( 8438 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3768 -4.3768 -3.5582 -3.5582 -3.5210 -3.5210 -3.5100 -3.5100 3.5825 3.5825 5.2092 5.2092 5.3042 5.3042 5.3849 5.3849 5.6026 5.6026 5.6862 5.6862 5.8380 5.8380 5.9354 5.9354 6.1406 6.1406 6.1921 6.1921 6.6709 6.6709 6.8324 6.8324 10.5023 10.5023 11.5504 11.5504 13.4356 13.4356 15.5005 15.5005 15.6929 15.6929 k = 0.4417 0.2550 0.3946 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3767 -4.3767 -3.5582 -3.5582 -3.5208 -3.5208 -3.5101 -3.5101 3.5988 3.5988 5.2054 5.2054 5.2983 5.2983 5.3818 5.3818 5.5913 5.5913 5.6870 5.6870 5.8448 5.8448 5.9399 5.9399 6.1501 6.1501 6.2004 6.2004 6.6814 6.6814 6.8794 6.8794 10.3227 10.3227 11.4442 11.4442 13.4087 13.4087 15.6588 15.6588 15.8569 15.8569 k = 0.4375 0.2526 0.4082 ( 8432 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3766 -4.3766 -3.5582 -3.5582 -3.5205 -3.5205 -3.5102 -3.5102 3.6157 3.6157 5.2008 5.2008 5.2920 5.2920 5.3792 5.3792 5.5801 5.5801 5.6874 5.6874 5.8529 5.8529 5.9455 5.9455 6.1595 6.1595 6.2091 6.2091 6.6921 6.6921 6.9291 6.9291 10.1456 10.1456 11.3400 11.3400 13.3816 13.3816 15.8186 15.8186 16.0174 16.0174 k = 0.4333 0.2502 0.4219 ( 8430 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3766 -4.3766 -3.5582 -3.5582 -3.5202 -3.5202 -3.5102 -3.5102 3.6330 3.6330 5.1952 5.1952 5.2856 5.2856 5.3767 5.3767 5.5690 5.5690 5.6874 5.6874 5.8622 5.8622 5.9524 5.9524 6.1688 6.1688 6.2181 6.2181 6.7035 6.7035 6.9815 6.9815 9.9713 9.9713 11.2381 11.2381 13.3545 13.3545 15.9794 15.9794 16.1730 16.1730 k = 0.4292 0.2478 0.4355 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3765 -4.3765 -3.5582 -3.5582 -3.5200 -3.5200 -3.5103 -3.5103 3.6505 3.6505 5.1888 5.1888 5.2791 5.2791 5.3743 5.3743 5.5584 5.5584 5.6872 5.6872 5.8724 5.8724 5.9604 5.9604 6.1781 6.1781 6.2274 6.2274 6.7157 6.7157 7.0362 7.0362 9.8000 9.8000 11.1387 11.1387 13.3277 13.3277 16.1402 16.1402 16.3211 16.3211 k = 0.4250 0.2454 0.4491 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3764 -4.3764 -3.5582 -3.5582 -3.5197 -3.5197 -3.5103 -3.5103 3.6682 3.6682 5.1813 5.1813 5.2729 5.2729 5.3718 5.3718 5.5483 5.5483 5.6867 5.6867 5.8833 5.8833 5.9694 5.9694 6.1872 6.1872 6.2370 6.2370 6.7289 6.7289 7.0930 7.0930 9.6320 9.6320 11.0420 11.0420 13.3013 13.3013 16.2986 16.2986 16.4572 16.4572 k = 0.4208 0.2430 0.4627 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3763 -4.3763 -3.5582 -3.5582 -3.5195 -3.5195 -3.5103 -3.5103 3.6858 3.6858 5.1727 5.1727 5.2672 5.2672 5.3691 5.3691 5.5389 5.5389 5.6863 5.6863 5.8947 5.8947 5.9792 5.9792 6.1963 6.1963 6.2469 6.2469 6.7433 6.7433 7.1520 7.1520 9.4676 9.4676 10.9481 10.9481 13.2755 13.2755 16.4458 16.4458 16.5762 16.5762 k = 0.4167 0.2406 0.4763 ( 8436 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3762 -4.3762 -3.5582 -3.5582 -3.5193 -3.5193 -3.5103 -3.5103 3.7031 3.7031 5.1631 5.1631 5.2620 5.2620 5.3660 5.3660 5.5304 5.5304 5.6860 5.6860 5.9065 5.9065 5.9894 5.9894 6.2051 6.2051 6.2573 6.2573 6.7592 6.7592 7.2130 7.2130 9.3071 9.3071 10.8573 10.8573 13.2505 13.2505 16.5441 16.5441 16.6937 16.6937 k = 0.4125 0.2382 0.4899 ( 8446 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3762 -4.3762 -3.5582 -3.5582 -3.5191 -3.5191 -3.5102 -3.5102 3.7200 3.7200 5.1523 5.1523 5.2576 5.2576 5.3624 5.3624 5.5229 5.5229 5.6860 5.6860 5.9183 5.9183 5.9999 5.9999 6.2138 6.2138 6.2679 6.2679 6.7767 6.7767 7.2758 7.2758 9.1509 9.1509 10.7696 10.7696 13.2262 13.2262 16.5501 16.5501 16.8383 16.8383 k = 0.4083 0.2358 0.5035 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3761 -4.3761 -3.5582 -3.5582 -3.5189 -3.5189 -3.5101 -3.5101 3.7363 3.7363 5.1404 5.1404 5.2540 5.2540 5.3583 5.3583 5.5164 5.5164 5.6864 5.6864 5.9301 5.9301 6.0103 6.0103 6.2222 6.2222 6.2790 6.2790 6.7960 6.7960 7.3403 7.3403 8.9994 8.9994 10.6854 10.6854 13.2027 13.2027 16.4892 16.4892 16.9960 16.9960 k = 0.4042 0.2333 0.5171 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3760 -4.3760 -3.5582 -3.5582 -3.5188 -3.5188 -3.5100 -3.5100 3.7518 3.7518 5.1274 5.1274 5.2513 5.2513 5.3536 5.3536 5.5111 5.5111 5.6873 5.6873 5.9415 5.9415 6.0204 6.0204 6.2303 6.2303 6.2904 6.2904 6.8172 6.8172 7.4064 7.4064 8.8531 8.8531 10.6046 10.6046 13.1800 13.1800 16.3938 16.3938 17.1563 17.1563 k = 0.4000 0.2309 0.5307 ( 8442 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3759 -4.3759 -3.5582 -3.5582 -3.5187 -3.5187 -3.5098 -3.5098 3.7663 3.7663 5.1133 5.1133 5.2494 5.2494 5.3484 5.3484 5.5069 5.5069 5.6887 5.6887 5.9523 5.9523 6.0298 6.0298 6.2381 6.2381 6.3022 6.3022 6.8401 6.8401 7.4738 7.4738 8.7129 8.7129 10.5276 10.5276 13.1582 13.1582 16.2821 16.2821 17.3156 17.3156 k = 0.3958 0.2285 0.5443 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3784 -4.3784 -4.3758 -4.3758 -3.5583 -3.5583 -3.5187 -3.5187 -3.5097 -3.5097 3.7795 3.7795 5.0982 5.0982 5.2486 5.2486 5.3428 5.3428 5.5040 5.5040 5.6907 5.6907 5.9623 5.9623 6.0385 6.0385 6.2455 6.2455 6.3144 6.3144 6.8647 6.8647 7.5422 7.5422 8.5798 8.5798 10.4543 10.4543 13.1371 13.1371 16.1629 16.1629 17.4712 17.4712 k = 0.3917 0.2261 0.5579 ( 8454 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3757 -4.3757 -3.5583 -3.5583 -3.5186 -3.5186 -3.5095 -3.5095 3.7914 3.7914 5.0821 5.0821 5.2485 5.2485 5.3370 5.3370 5.5022 5.5022 5.6934 5.6934 5.9713 5.9713 6.0462 6.0462 6.2525 6.2525 6.3270 6.3270 6.8904 6.8904 7.6108 7.6108 8.4552 8.4552 10.3851 10.3851 13.1169 13.1169 16.0407 16.0407 17.6204 17.6204 k = 0.3875 0.2237 0.5715 ( 8457 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3756 -4.3756 -3.5583 -3.5583 -3.5187 -3.5187 -3.5093 -3.5093 3.8016 3.8016 5.0652 5.0652 5.2494 5.2494 5.3310 5.3310 5.5014 5.5014 5.6968 5.6968 5.9790 5.9790 6.0527 6.0527 6.2591 6.2591 6.3400 6.3400 6.9164 6.9164 7.6785 7.6785 8.3416 8.3416 10.3200 10.3200 13.0975 13.0975 15.9180 15.9180 17.7596 17.7596 k = 0.3833 0.2213 0.5852 ( 8455 PWs) bands (ev): -35.4325 -35.4325 -4.3785 -4.3785 -4.3755 -4.3755 -3.5584 -3.5584 -3.5187 -3.5187 -3.5091 -3.5091 3.8100 3.8100 5.0475 5.0475 5.2509 5.2509 5.3250 5.3250 5.5017 5.5017 5.7008 5.7008 5.9853 5.9853 6.0580 6.0580 6.2652 6.2652 6.3535 6.3535 6.9414 6.9414 7.7426 7.7426 8.2435 8.2435 10.2593 10.2593 13.0787 13.0787 15.7961 15.7961 17.8843 17.8843 k = 0.3792 0.2189 0.5988 ( 8450 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3755 -4.3755 -3.5584 -3.5584 -3.5187 -3.5187 -3.5088 -3.5088 3.8164 3.8164 5.0292 5.0292 5.2528 5.2528 5.3195 5.3195 5.5029 5.5029 5.7055 5.7055 5.9900 5.9900 6.0619 6.0619 6.2709 6.2709 6.3675 6.3675 6.9633 6.9633 7.7970 7.7970 8.1690 8.1690 10.2029 10.2029 13.0606 13.0606 15.6761 15.6761 17.9900 17.9900 k = 0.3750 0.2165 0.6124 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8207 3.8207 5.0105 5.0105 5.2549 5.2549 5.3148 5.3148 5.5049 5.5049 5.7108 5.7108 5.9932 5.9932 6.0641 6.0641 6.2762 6.2762 6.3820 6.3820 6.9794 6.9794 7.8303 7.8303 8.1326 8.1326 10.1512 10.1512 13.0430 13.0430 15.5586 15.5586 18.0731 18.0731 k = 0.6250-0.0722 0.4082 ( 8428 PWs) bands (ev): -35.4325 -35.4325 -4.3786 -4.3786 -4.3754 -4.3754 -3.5585 -3.5585 -3.5188 -3.5188 -3.5086 -3.5086 3.8207 3.8207 5.0105 5.0105 5.2549 5.2549 5.3148 5.3148 5.5049 5.5049 5.7108 5.7108 5.9932 5.9932 6.0641 6.0641 6.2762 6.2762 6.3820 6.3820 6.9794 6.9794 7.8303 7.8303 8.1326 8.1326 10.1512 10.1512 13.0430 13.0430 15.5586 15.5586 18.0731 18.0731 k = 0.6176-0.0849 0.4082 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3787 -4.3787 -4.3753 -4.3753 -3.5585 -3.5585 -3.5190 -3.5190 -3.5082 -3.5082 3.8253 3.8253 4.9770 4.9770 5.2565 5.2565 5.3095 5.3095 5.5100 5.5100 5.7207 5.7207 5.9970 5.9970 6.0661 6.0661 6.2850 6.2850 6.4086 6.4086 6.9910 6.9910 7.8757 7.8757 8.1125 8.1125 10.0655 10.0655 13.0109 13.0109 15.3569 15.3569 18.1999 18.1999 k = 0.6103-0.0976 0.4082 ( 8456 PWs) bands (ev): -35.4325 -35.4325 -4.3787 -4.3787 -4.3752 -4.3752 -3.5586 -3.5586 -3.5191 -3.5191 -3.5078 -3.5078 3.8286 3.8286 4.9437 4.9437 5.2536 5.2536 5.3090 5.3090 5.5165 5.5165 5.7308 5.7308 6.0004 6.0004 6.0675 6.0675 6.2936 6.2936 6.4359 6.4359 6.9855 6.9855 7.9429 7.9429 8.0954 8.0954 9.9831 9.9831 12.9752 12.9752 15.1625 15.1625 18.3295 18.3295 k = 0.6029-0.1104 0.4082 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3788 -4.3788 -4.3751 -4.3751 -3.5587 -3.5587 -3.5193 -3.5193 -3.5074 -3.5074 3.8307 3.8307 4.9112 4.9112 5.2471 5.2471 5.3126 5.3126 5.5242 5.5242 5.7411 5.7411 6.0034 6.0034 6.0682 6.0682 6.3018 6.3018 6.4632 6.4632 6.9672 6.9672 8.0223 8.0223 8.0862 8.0862 9.9040 9.9040 12.9350 12.9350 14.9769 14.9769 18.4619 18.4619 k = 0.5956-0.1231 0.4082 ( 8444 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3750 -4.3750 -3.5588 -3.5588 -3.5195 -3.5195 -3.5070 -3.5070 3.8317 3.8317 4.8797 4.8797 5.2386 5.2386 5.3184 5.3184 5.5330 5.5330 5.7515 5.7515 6.0061 6.0061 6.0684 6.0684 6.3097 6.3097 6.4900 6.4900 6.9406 6.9406 8.0523 8.0523 8.1415 8.1415 9.8285 9.8285 12.8895 12.8895 14.8018 14.8018 18.5968 18.5968 k = 0.5882-0.1358 0.4082 ( 8448 PWs) bands (ev): -35.4325 -35.4325 -4.3789 -4.3789 -4.3749 -4.3749 -3.5589 -3.5589 -3.5196 -3.5196 -3.5066 -3.5066 3.8320 3.8320 4.8495 4.8495 5.2295 5.2295 5.3252 5.3252 5.5425 5.5425 5.7620 5.7620 6.0085 6.0085 6.0681 6.0681 6.3171 6.3171 6.5155 6.5155 6.9095 6.9095 8.0434 8.0434 8.2465 8.2465 9.7569 9.7569 12.8378 12.8378 14.6389 14.6389 18.7343 18.7343 k = 0.5809-0.1486 0.4082 ( 8446 PWs) bands (ev): -35.4325 -35.4325 -4.3790 -4.3790 -4.3749 -4.3749 -3.5590 -3.5590 -3.5198 -3.5198 -3.5062 -3.5062 3.8315 3.8315 4.8211 4.8211 5.2204 5.2204 5.3322 5.3322 5.5526 5.5526 5.7727 5.7727 6.0106 6.0106 6.0674 6.0674 6.3242 6.3242 6.5388 6.5388 6.8773 6.8773 8.0328 8.0328 8.3605 8.3605 9.6894 9.6894 12.7790 12.7790 14.4897 14.4897 18.8740 18.8740 k = 0.5735-0.1613 0.4082 ( 8440 PWs) bands (ev): -35.4325 -35.4325 -4.3791 -4.3791 -4.3748 -4.3748 -3.5590 -3.5590 -3.5200 -3.5200 -3.5058 -3.5058 3.8306 3.8306 4.7944 4.7944 5.2116 5.2116 5.3392 5.3392 5.5632 5.5632 5.7835 5.7835 6.0125 6.0125 6.0663 6.0663 6.3307 6.3307 6.5586 6.5586 6.8465 6.8465 8.0230 8.0230 8.4784 8.4784 9.6262 9.6262 12.7128 12.7128 14.3557 14.3557 19.0157 19.0157 k = 0.5662-0.1741 0.4082 ( 8442 PWs) bands (ev): -35.4325 -35.4325 -4.3791 -4.3791 -4.3747 -4.3747 -3.5591 -3.5591 -3.5201 -3.5201 -3.5055 -3.5055 3.8293 3.8293 4.7699 4.7699 5.2034 5.2034 5.3458 5.3458 5.5738 5.5738 5.7945 5.7945 6.0141 6.0141 6.0648 6.0648 6.3368 6.3368 6.5732 6.5732 6.8200 6.8200 8.0142 8.0142 8.5974 8.5974 9.5678 9.5678 12.6394 12.6394 14.2376 14.2376 19.1591 19.1591 k = 0.5588-0.1868 0.4082 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3792 -4.3792 -4.3747 -4.3747 -3.5592 -3.5592 -3.5203 -3.5203 -3.5052 -3.5052 3.8278 3.8278 4.7475 4.7475 5.1959 5.1959 5.3519 5.3519 5.5843 5.5843 5.8056 5.8056 6.0155 6.0155 6.0629 6.0629 6.3424 6.3424 6.5809 6.5809 6.8001 6.8001 8.0065 8.0065 8.7152 8.7152 9.5143 9.5143 12.5597 12.5597 14.1360 14.1360 19.3036 19.3036 k = 0.5515-0.1995 0.4082 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3793 -4.3793 -4.3746 -4.3746 -3.5593 -3.5593 -3.5204 -3.5204 -3.5049 -3.5049 3.8262 3.8262 4.7275 4.7275 5.1891 5.1891 5.3574 5.3574 5.5943 5.5943 5.8167 5.8167 6.0167 6.0167 6.0605 6.0605 6.3476 6.3476 6.5803 6.5803 6.7887 6.7887 7.9999 7.9999 8.8295 8.8295 9.4661 9.4661 12.4759 12.4759 14.0505 14.0505 19.4481 19.4481 k = 0.5441-0.2123 0.4082 ( 8446 PWs) bands (ev): -35.4325 -35.4325 -4.3793 -4.3793 -4.3746 -4.3746 -3.5593 -3.5593 -3.5205 -3.5205 -3.5046 -3.5046 3.8246 3.8246 4.7100 4.7100 5.1831 5.1831 5.3622 5.3622 5.6037 5.6037 5.8277 5.8277 6.0177 6.0177 6.0578 6.0578 6.3523 6.3523 6.5722 6.5722 6.7853 6.7853 7.9943 7.9943 8.9378 8.9378 9.4235 9.4235 12.3907 12.3907 13.9802 13.9802 19.5913 19.5913 k = 0.5368-0.2250 0.4082 ( 8426 PWs) bands (ev): -35.4325 -35.4325 -4.3793 -4.3793 -4.3745 -4.3745 -3.5594 -3.5594 -3.5206 -3.5206 -3.5044 -3.5044 3.8231 3.8231 4.6950 4.6950 5.1780 5.1780 5.3663 5.3663 5.6121 5.6121 5.8384 5.8384 6.0185 6.0185 6.0547 6.0547 6.3565 6.3565 6.5593 6.5593 6.7877 6.7877 7.9897 7.9897 9.0376 9.0376 9.3870 9.3870 12.3079 12.3079 13.9238 13.9238 19.7306 19.7306 k = 0.5294-0.2377 0.4082 ( 8438 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5594 -3.5594 -3.5207 -3.5207 -3.5042 -3.5042 3.8218 3.8218 4.6827 4.6827 5.1738 5.1738 5.3697 5.3697 5.6192 5.6192 5.8484 5.8484 6.0191 6.0191 6.0515 6.0515 6.3602 6.3602 6.5447 6.5447 6.7930 6.7930 7.9859 7.9859 9.1256 9.1256 9.3567 9.3567 12.2314 12.2314 13.8800 13.8800 19.8615 19.8615 k = 0.5221-0.2505 0.4082 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3745 -4.3745 -3.5594 -3.5594 -3.5208 -3.5208 -3.5041 -3.5041 3.8207 3.8207 4.6730 4.6730 5.1705 5.1705 5.3724 5.3724 5.6250 5.6250 5.8571 5.8571 6.0196 6.0196 6.0484 6.0484 6.3634 6.3634 6.5310 6.5310 6.7989 6.7989 7.9831 7.9831 9.1985 9.1985 9.3331 9.3331 12.1658 12.1658 13.8475 13.8475 19.9767 19.9767 k = 0.5147-0.2632 0.4082 ( 8434 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5040 -3.5040 3.8198 3.8198 4.6660 4.6660 5.1681 5.1681 5.3742 5.3742 5.6292 5.6292 5.8640 5.8640 6.0199 6.0199 6.0457 6.0457 6.3658 6.3658 6.5199 6.5199 6.8039 6.8039 7.9810 7.9810 9.2527 9.2527 9.3171 9.3171 12.1152 12.1152 13.8250 13.8250 20.0663 20.0663 k = 0.5074-0.2759 0.4082 ( 8454 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5039 -3.5039 3.8193 3.8193 4.6619 4.6619 5.1667 5.1667 5.3754 5.3754 5.6318 5.6318 5.8685 5.8685 6.0201 6.0201 6.0439 6.0439 6.3674 6.3674 6.5128 6.5128 6.8073 6.8073 7.9798 7.9798 9.2828 9.2828 9.3111 9.3111 12.0833 12.0833 13.8119 13.8119 20.1217 20.1217 k = 0.5000-0.2887 0.4082 ( 8480 PWs) bands (ev): -35.4325 -35.4325 -4.3794 -4.3794 -4.3744 -4.3744 -3.5595 -3.5595 -3.5208 -3.5208 -3.5039 -3.5039 3.8192 3.8192 4.6605 4.6605 5.1662 5.1662 5.3758 5.3758 5.6327 5.6327 5.8700 5.8700 6.0202 6.0202 6.0432 6.0432 6.3680 6.3680 6.5104 6.5104 6.8085 6.8085 7.9794 7.9794 9.2890 9.2890 9.3132 9.3132 12.0723 12.0723 13.8076 13.8076 20.1402 20.1402 Writing output data file LiInAg2.save init_run : 0.28s CPU 0.42s WALL ( 1 calls) electrons : 196.60s CPU 198.99s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 196.60s CPU 198.98s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.06s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.11s WALL ( 320 calls) cegterg : 172.94s CPU 174.64s WALL ( 451 calls) Called by sum_band: Called by *egterg: h_psi : 125.60s CPU 126.71s WALL ( 7289 calls) s_psi : 4.74s CPU 4.66s WALL ( 7289 calls) g_psi : 0.32s CPU 0.37s WALL ( 6518 calls) cdiaghg : 38.26s CPU 38.66s WALL ( 6838 calls) cegterg:over : 7.42s CPU 7.47s WALL ( 6518 calls) cegterg:upda : 7.12s CPU 7.35s WALL ( 6518 calls) cegterg:last : 3.58s CPU 3.63s WALL ( 1093 calls) cdiaghg:chol : 2.11s CPU 2.23s WALL ( 6838 calls) cdiaghg:inve : 1.45s CPU 1.37s WALL ( 6838 calls) cdiaghg:para : 2.16s CPU 2.23s WALL ( 13676 calls) Called by h_psi: h_psi:vloc : 114.92s CPU 116.05s WALL ( 7289 calls) h_psi:vnl : 10.34s CPU 10.30s WALL ( 7289 calls) add_vuspsi : 5.21s CPU 5.12s WALL ( 7289 calls) General routines calbec : 5.11s CPU 5.16s WALL ( 7289 calls) fft : 0.00s CPU 0.01s WALL ( 15 calls) fftw : 108.82s CPU 109.94s WALL ( 647568 calls) davcio : 0.28s CPU 0.35s WALL ( 640 calls) Parallel routines fft_scatter : 34.98s CPU 34.82s WALL ( 647583 calls) PWSCF : 3m38.87s CPU 4m 5.45s WALL This run was terminated on: 14:43:42 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=