Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:59: 8 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: ./SiO2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 49 29 8 2963 1298 204 Max 50 30 9 2973 1321 214 Sum 1791 1045 297 106839 47237 7437 bravais-lattice index = 14 lattice parameter (alat) = 8.3817 a.u. unit-cell volume = 1085.2283 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.381710 celldm(2)= 0.992078 celldm(3)= 2.038116 celldm(4)= 0.411338 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 0.992078 0.000000 ) a(3) = ( 0.000000 0.838354 1.857708 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.007985 -0.454887 ) b(3) = ( 0.000000 0.000000 0.538298 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 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. # 2 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 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 O 6.00 15.99940 O( 1.00) Si 4.00 28.08550 Si( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) 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 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.4191768 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.9288541 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( -0.4191768 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.9288541 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 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 C2 2 180 deg rotation - cart. axis [1,0,0] -C2 -2 180 deg rotation - cart. axis [1,0,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,0,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,0,0] E Cartesian axes number of k points= 271 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 2) = ( 0.0000000 0.0000000 0.0134574), wk = 0.0036900 k( 3) = ( 0.0000000 0.0000000 0.0269149), wk = 0.0036900 k( 4) = ( 0.0000000 0.0000000 0.0403723), wk = 0.0036900 k( 5) = ( 0.0000000 0.0000000 0.0538298), wk = 0.0036900 k( 6) = ( 0.0000000 0.0000000 0.0672872), wk = 0.0036900 k( 7) = ( 0.0000000 0.0000000 0.0807446), wk = 0.0036900 k( 8) = ( 0.0000000 0.0000000 0.0942021), wk = 0.0036900 k( 9) = ( 0.0000000 0.0000000 0.1076595), wk = 0.0036900 k( 10) = ( 0.0000000 0.0000000 0.1211170), wk = 0.0036900 k( 11) = ( 0.0000000 0.0000000 0.1345744), wk = 0.0036900 k( 12) = ( 0.0000000 0.0000000 0.1480319), wk = 0.0036900 k( 13) = ( 0.0000000 0.0000000 0.1614893), wk = 0.0036900 k( 14) = ( 0.0000000 0.0000000 0.1749467), wk = 0.0036900 k( 15) = ( 0.0000000 0.0000000 0.1884042), wk = 0.0036900 k( 16) = ( 0.0000000 0.0000000 0.2018616), wk = 0.0036900 k( 17) = ( 0.0000000 0.0000000 0.2153191), wk = 0.0036900 k( 18) = ( 0.0000000 0.0000000 0.2287765), wk = 0.0036900 k( 19) = ( 0.0000000 0.0000000 0.2422339), wk = 0.0036900 k( 20) = ( 0.0000000 0.0000000 0.2556914), wk = 0.0036900 k( 21) = ( 0.0000000 0.0000000 0.2691488), wk = 0.0036900 k( 22) = ( 0.0000000 0.0000000 0.2691488), wk = 0.0036900 k( 23) = ( 0.0000000 0.0138621 0.2691488), wk = 0.0036900 k( 24) = ( 0.0000000 0.0277241 0.2691488), wk = 0.0036900 k( 25) = ( 0.0000000 0.0415862 0.2691488), wk = 0.0036900 k( 26) = ( 0.0000000 0.0554482 0.2691488), wk = 0.0036900 k( 27) = ( 0.0000000 0.0693103 0.2691488), wk = 0.0036900 k( 28) = ( 0.0000000 0.0831723 0.2691488), wk = 0.0036900 k( 29) = ( 0.0000000 0.0970344 0.2691488), wk = 0.0036900 k( 30) = ( 0.0000000 0.1108964 0.2691488), wk = 0.0036900 k( 31) = ( 0.0000000 0.1247585 0.2691488), wk = 0.0036900 k( 32) = ( 0.0000000 0.1386205 0.2691488), wk = 0.0036900 k( 33) = ( 0.0000000 0.1524826 0.2691488), wk = 0.0036900 k( 34) = ( 0.0000000 0.1663446 0.2691488), wk = 0.0036900 k( 35) = ( 0.0000000 0.1802067 0.2691488), wk = 0.0036900 k( 36) = ( 0.0000000 0.1940687 0.2691488), wk = 0.0036900 k( 37) = ( 0.0000000 0.2079308 0.2691488), wk = 0.0036900 k( 38) = ( 0.0000000 0.2217928 0.2691488), wk = 0.0036900 k( 39) = ( 0.0000000 0.2356549 0.2691488), wk = 0.0036900 k( 40) = ( 0.0000000 0.2495169 0.2691488), wk = 0.0036900 k( 41) = ( 0.0000000 0.2633790 0.2691488), wk = 0.0036900 k( 42) = ( 0.0000000 0.2772411 0.2691488), wk = 0.0036900 k( 43) = ( 0.0000000 0.2911031 0.2691488), wk = 0.0036900 k( 44) = ( 0.0000000 0.3049652 0.2691488), wk = 0.0036900 k( 45) = ( 0.0000000 0.3188272 0.2691488), wk = 0.0036900 k( 46) = ( 0.0000000 0.3326893 0.2691488), wk = 0.0036900 k( 47) = ( 0.0000000 0.3465513 0.2691488), wk = 0.0036900 k( 48) = ( 0.0000000 0.3604134 0.2691488), wk = 0.0036900 k( 49) = ( 0.0000000 0.3742754 0.2691488), wk = 0.0036900 k( 50) = ( 0.0000000 0.3881375 0.2691488), wk = 0.0036900 k( 51) = ( 0.0000000 0.4019995 0.2691488), wk = 0.0036900 k( 52) = ( 0.0000000 0.4158616 0.2691488), wk = 0.0036900 k( 53) = ( 0.0000000 0.4297236 0.2691488), wk = 0.0036900 k( 54) = ( 0.0000000 0.4435857 0.2691488), wk = 0.0036900 k( 55) = ( 0.0000000 0.4574477 0.2691488), wk = 0.0036900 k( 56) = ( 0.0000000 0.4713098 0.2691488), wk = 0.0036900 k( 57) = ( 0.0000000 0.4851719 0.2691488), wk = 0.0036900 k( 58) = ( 0.0000000 0.4851719 0.2691488), wk = 0.0036900 k( 59) = ( 0.0000000 0.4862790 0.2557698), wk = 0.0036900 k( 60) = ( 0.0000000 0.4873861 0.2423907), wk = 0.0036900 k( 61) = ( 0.0000000 0.4884932 0.2290117), wk = 0.0036900 k( 62) = ( 0.0000000 0.4896003 0.2156327), wk = 0.0036900 k( 63) = ( 0.0000000 0.4907074 0.2022536), wk = 0.0036900 k( 64) = ( 0.0000000 0.4918145 0.1888746), wk = 0.0036900 k( 65) = ( 0.0000000 0.4929216 0.1754955), wk = 0.0036900 k( 66) = ( 0.0000000 0.4940287 0.1621165), wk = 0.0036900 k( 67) = ( 0.0000000 0.4951358 0.1487374), wk = 0.0036900 k( 68) = ( 0.0000000 0.4962429 0.1353584), wk = 0.0036900 k( 69) = ( 0.0000000 0.4973500 0.1219793), wk = 0.0036900 k( 70) = ( 0.0000000 0.4984571 0.1086003), wk = 0.0036900 k( 71) = ( 0.0000000 0.4995642 0.0952213), wk = 0.0036900 k( 72) = ( 0.0000000 0.5006714 0.0818422), wk = 0.0036900 k( 73) = ( 0.0000000 0.5017785 0.0684632), wk = 0.0036900 k( 74) = ( 0.0000000 0.5028856 0.0550841), wk = 0.0036900 k( 75) = ( 0.0000000 0.5039927 0.0417051), wk = 0.0036900 k( 76) = ( 0.0000000 0.5039927 0.0417051), wk = 0.0036900 k( 77) = ( 0.0138889 0.5039927 0.0417051), wk = 0.0036900 k( 78) = ( 0.0277778 0.5039927 0.0417051), wk = 0.0036900 k( 79) = ( 0.0416667 0.5039927 0.0417051), wk = 0.0036900 k( 80) = ( 0.0555556 0.5039927 0.0417051), wk = 0.0036900 k( 81) = ( 0.0694444 0.5039927 0.0417051), wk = 0.0036900 k( 82) = ( 0.0833333 0.5039927 0.0417051), wk = 0.0036900 k( 83) = ( 0.0972222 0.5039927 0.0417051), wk = 0.0036900 k( 84) = ( 0.1111111 0.5039927 0.0417051), wk = 0.0036900 k( 85) = ( 0.1250000 0.5039927 0.0417051), wk = 0.0036900 k( 86) = ( 0.1388889 0.5039927 0.0417051), wk = 0.0036900 k( 87) = ( 0.1527778 0.5039927 0.0417051), wk = 0.0036900 k( 88) = ( 0.1666667 0.5039927 0.0417051), wk = 0.0036900 k( 89) = ( 0.1805556 0.5039927 0.0417051), wk = 0.0036900 k( 90) = ( 0.1944444 0.5039927 0.0417051), wk = 0.0036900 k( 91) = ( 0.2083333 0.5039927 0.0417051), wk = 0.0036900 k( 92) = ( 0.2222222 0.5039927 0.0417051), wk = 0.0036900 k( 93) = ( 0.2361111 0.5039927 0.0417051), wk = 0.0036900 k( 94) = ( 0.2500000 0.5039927 0.0417051), wk = 0.0036900 k( 95) = ( 0.2638889 0.5039927 0.0417051), wk = 0.0036900 k( 96) = ( 0.2777778 0.5039927 0.0417051), wk = 0.0036900 k( 97) = ( 0.2916667 0.5039927 0.0417051), wk = 0.0036900 k( 98) = ( 0.3055556 0.5039927 0.0417051), wk = 0.0036900 k( 99) = ( 0.3194444 0.5039927 0.0417051), wk = 0.0036900 k( 100) = ( 0.3333333 0.5039927 0.0417051), wk = 0.0036900 k( 101) = ( 0.3472222 0.5039927 0.0417051), wk = 0.0036900 k( 102) = ( 0.3611111 0.5039927 0.0417051), wk = 0.0036900 k( 103) = ( 0.3750000 0.5039927 0.0417051), wk = 0.0036900 k( 104) = ( 0.3888889 0.5039927 0.0417051), wk = 0.0036900 k( 105) = ( 0.4027778 0.5039927 0.0417051), wk = 0.0036900 k( 106) = ( 0.4166667 0.5039927 0.0417051), wk = 0.0036900 k( 107) = ( 0.4305556 0.5039927 0.0417051), wk = 0.0036900 k( 108) = ( 0.4444444 0.5039927 0.0417051), wk = 0.0036900 k( 109) = ( 0.4583333 0.5039927 0.0417051), wk = 0.0036900 k( 110) = ( 0.4722222 0.5039927 0.0417051), wk = 0.0036900 k( 111) = ( 0.4861111 0.5039927 0.0417051), wk = 0.0036900 k( 112) = ( 0.5000000 0.5039927 0.0417051), wk = 0.0036900 k( 113) = ( 0.5000000 0.5039927 0.0417051), wk = 0.0036900 k( 114) = ( 0.5000000 0.5050998 0.0283260), wk = 0.0036900 k( 115) = ( 0.5000000 0.5062069 0.0149470), wk = 0.0036900 k( 116) = ( 0.5000000 0.5073140 0.0015680), wk = 0.0036900 k( 117) = ( 0.5000000 0.5084211 -0.0118111), wk = 0.0036900 k( 118) = ( 0.5000000 0.5095282 -0.0251901), wk = 0.0036900 k( 119) = ( 0.5000000 0.5106353 -0.0385692), wk = 0.0036900 k( 120) = ( 0.5000000 0.5117424 -0.0519482), wk = 0.0036900 k( 121) = ( 0.5000000 0.5128495 -0.0653273), wk = 0.0036900 k( 122) = ( 0.5000000 0.5139566 -0.0787063), wk = 0.0036900 k( 123) = ( 0.5000000 0.5150638 -0.0920854), wk = 0.0036900 k( 124) = ( 0.5000000 0.5161709 -0.1054644), wk = 0.0036900 k( 125) = ( 0.5000000 0.5172780 -0.1188434), wk = 0.0036900 k( 126) = ( 0.5000000 0.5183851 -0.1322225), wk = 0.0036900 k( 127) = ( 0.5000000 0.5194922 -0.1456015), wk = 0.0036900 k( 128) = ( 0.5000000 0.5205993 -0.1589806), wk = 0.0036900 k( 129) = ( 0.5000000 0.5217064 -0.1723596), wk = 0.0036900 k( 130) = ( 0.5000000 0.5228135 -0.1857387), wk = 0.0036900 k( 131) = ( 0.5000000 0.5228135 -0.1857387), wk = 0.0036900 k( 132) = ( 0.5000000 0.5181083 -0.1961649), wk = 0.0036900 k( 133) = ( 0.5000000 0.5134031 -0.2065912), wk = 0.0036900 k( 134) = ( 0.5000000 0.5086979 -0.2170175), wk = 0.0036900 k( 135) = ( 0.5000000 0.5039927 -0.2274437), wk = 0.0036900 k( 136) = ( 0.5000000 0.5039927 -0.2274437), wk = 0.0036900 k( 137) = ( 0.4861111 0.5039927 -0.2274437), wk = 0.0036900 k( 138) = ( 0.4722222 0.5039927 -0.2274437), wk = 0.0036900 k( 139) = ( 0.4583333 0.5039927 -0.2274437), wk = 0.0036900 k( 140) = ( 0.4444444 0.5039927 -0.2274437), wk = 0.0036900 k( 141) = ( 0.4305556 0.5039927 -0.2274437), wk = 0.0036900 k( 142) = ( 0.4166667 0.5039927 -0.2274437), wk = 0.0036900 k( 143) = ( 0.4027778 0.5039927 -0.2274437), wk = 0.0036900 k( 144) = ( 0.3888889 0.5039927 -0.2274437), wk = 0.0036900 k( 145) = ( 0.3750000 0.5039927 -0.2274437), wk = 0.0036900 k( 146) = ( 0.3611111 0.5039927 -0.2274437), wk = 0.0036900 k( 147) = ( 0.3472222 0.5039927 -0.2274437), wk = 0.0036900 k( 148) = ( 0.3333333 0.5039927 -0.2274437), wk = 0.0036900 k( 149) = ( 0.3194444 0.5039927 -0.2274437), wk = 0.0036900 k( 150) = ( 0.3055556 0.5039927 -0.2274437), wk = 0.0036900 k( 151) = ( 0.2916667 0.5039927 -0.2274437), wk = 0.0036900 k( 152) = ( 0.2777778 0.5039927 -0.2274437), wk = 0.0036900 k( 153) = ( 0.2638889 0.5039927 -0.2274437), wk = 0.0036900 k( 154) = ( 0.2500000 0.5039927 -0.2274437), wk = 0.0036900 k( 155) = ( 0.2361111 0.5039927 -0.2274437), wk = 0.0036900 k( 156) = ( 0.2222222 0.5039927 -0.2274437), wk = 0.0036900 k( 157) = ( 0.2083333 0.5039927 -0.2274437), wk = 0.0036900 k( 158) = ( 0.1944444 0.5039927 -0.2274437), wk = 0.0036900 k( 159) = ( 0.1805556 0.5039927 -0.2274437), wk = 0.0036900 k( 160) = ( 0.1666667 0.5039927 -0.2274437), wk = 0.0036900 k( 161) = ( 0.1527778 0.5039927 -0.2274437), wk = 0.0036900 k( 162) = ( 0.1388889 0.5039927 -0.2274437), wk = 0.0036900 k( 163) = ( 0.1250000 0.5039927 -0.2274437), wk = 0.0036900 k( 164) = ( 0.1111111 0.5039927 -0.2274437), wk = 0.0036900 k( 165) = ( 0.0972222 0.5039927 -0.2274437), wk = 0.0036900 k( 166) = ( 0.0833333 0.5039927 -0.2274437), wk = 0.0036900 k( 167) = ( 0.0694444 0.5039927 -0.2274437), wk = 0.0036900 k( 168) = ( 0.0555556 0.5039927 -0.2274437), wk = 0.0036900 k( 169) = ( 0.0416667 0.5039927 -0.2274437), wk = 0.0036900 k( 170) = ( 0.0277778 0.5039927 -0.2274437), wk = 0.0036900 k( 171) = ( 0.0138889 0.5039927 -0.2274437), wk = 0.0036900 k( 172) = ( 0.0000000 0.5039927 -0.2274437), wk = 0.0036900 k( 173) = ( 0.0000000 0.5039927 -0.2274437), wk = 0.0036900 k( 174) = ( 0.0000000 0.5086979 -0.2170175), wk = 0.0036900 k( 175) = ( 0.0000000 0.5134031 -0.2065912), wk = 0.0036900 k( 176) = ( 0.0000000 0.5181083 -0.1961649), wk = 0.0036900 k( 177) = ( 0.0000000 0.5228135 -0.1857387), wk = 0.0036900 k( 178) = ( 0.5000000 0.4851719 0.2691488), wk = 0.0036900 k( 179) = ( 0.5000000 0.4713098 0.2691488), wk = 0.0036900 k( 180) = ( 0.5000000 0.4574477 0.2691488), wk = 0.0036900 k( 181) = ( 0.5000000 0.4435857 0.2691488), wk = 0.0036900 k( 182) = ( 0.5000000 0.4297236 0.2691488), wk = 0.0036900 k( 183) = ( 0.5000000 0.4158616 0.2691488), wk = 0.0036900 k( 184) = ( 0.5000000 0.4019995 0.2691488), wk = 0.0036900 k( 185) = ( 0.5000000 0.3881375 0.2691488), wk = 0.0036900 k( 186) = ( 0.5000000 0.3742754 0.2691488), wk = 0.0036900 k( 187) = ( 0.5000000 0.3604134 0.2691488), wk = 0.0036900 k( 188) = ( 0.5000000 0.3465513 0.2691488), wk = 0.0036900 k( 189) = ( 0.5000000 0.3326893 0.2691488), wk = 0.0036900 k( 190) = ( 0.5000000 0.3188272 0.2691488), wk = 0.0036900 k( 191) = ( 0.5000000 0.3049652 0.2691488), wk = 0.0036900 k( 192) = ( 0.5000000 0.2911031 0.2691488), wk = 0.0036900 k( 193) = ( 0.5000000 0.2772411 0.2691488), wk = 0.0036900 k( 194) = ( 0.5000000 0.2633790 0.2691488), wk = 0.0036900 k( 195) = ( 0.5000000 0.2495169 0.2691488), wk = 0.0036900 k( 196) = ( 0.5000000 0.2356549 0.2691488), wk = 0.0036900 k( 197) = ( 0.5000000 0.2217928 0.2691488), wk = 0.0036900 k( 198) = ( 0.5000000 0.2079308 0.2691488), wk = 0.0036900 k( 199) = ( 0.5000000 0.1940687 0.2691488), wk = 0.0036900 k( 200) = ( 0.5000000 0.1802067 0.2691488), wk = 0.0036900 k( 201) = ( 0.5000000 0.1663446 0.2691488), wk = 0.0036900 k( 202) = ( 0.5000000 0.1524826 0.2691488), wk = 0.0036900 k( 203) = ( 0.5000000 0.1386205 0.2691488), wk = 0.0036900 k( 204) = ( 0.5000000 0.1247585 0.2691488), wk = 0.0036900 k( 205) = ( 0.5000000 0.1108964 0.2691488), wk = 0.0036900 k( 206) = ( 0.5000000 0.0970344 0.2691488), wk = 0.0036900 k( 207) = ( 0.5000000 0.0831723 0.2691488), wk = 0.0036900 k( 208) = ( 0.5000000 0.0693103 0.2691488), wk = 0.0036900 k( 209) = ( 0.5000000 0.0554482 0.2691488), wk = 0.0036900 k( 210) = ( 0.5000000 0.0415862 0.2691488), wk = 0.0036900 k( 211) = ( 0.5000000 0.0277241 0.2691488), wk = 0.0036900 k( 212) = ( 0.5000000 0.0138621 0.2691488), wk = 0.0036900 k( 213) = ( 0.5000000 -0.0000000 0.2691488), wk = 0.0036900 k( 214) = ( 0.5000000 -0.0000000 0.2691488), wk = 0.0036900 k( 215) = ( 0.5000000 -0.0000000 0.2556914), wk = 0.0036900 k( 216) = ( 0.5000000 -0.0000000 0.2422339), wk = 0.0036900 k( 217) = ( 0.5000000 -0.0000000 0.2287765), wk = 0.0036900 k( 218) = ( 0.5000000 -0.0000000 0.2153191), wk = 0.0036900 k( 219) = ( 0.5000000 -0.0000000 0.2018616), wk = 0.0036900 k( 220) = ( 0.5000000 -0.0000000 0.1884042), wk = 0.0036900 k( 221) = ( 0.5000000 -0.0000000 0.1749467), wk = 0.0036900 k( 222) = ( 0.5000000 -0.0000000 0.1614893), wk = 0.0036900 k( 223) = ( 0.5000000 -0.0000000 0.1480319), wk = 0.0036900 k( 224) = ( 0.5000000 -0.0000000 0.1345744), wk = 0.0036900 k( 225) = ( 0.5000000 -0.0000000 0.1211170), wk = 0.0036900 k( 226) = ( 0.5000000 -0.0000000 0.1076595), wk = 0.0036900 k( 227) = ( 0.5000000 -0.0000000 0.0942021), wk = 0.0036900 k( 228) = ( 0.5000000 -0.0000000 0.0807446), wk = 0.0036900 k( 229) = ( 0.5000000 -0.0000000 0.0672872), wk = 0.0036900 k( 230) = ( 0.5000000 -0.0000000 0.0538298), wk = 0.0036900 k( 231) = ( 0.5000000 -0.0000000 0.0403723), wk = 0.0036900 k( 232) = ( 0.5000000 -0.0000000 0.0269149), wk = 0.0036900 k( 233) = ( 0.5000000 -0.0000000 0.0134574), wk = 0.0036900 k( 234) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0036900 k( 235) = ( 0.0000000 0.0000000 0.2691488), wk = 0.0036900 k( 236) = ( 0.0138889 -0.0000000 0.2691488), wk = 0.0036900 k( 237) = ( 0.0277778 -0.0000000 0.2691488), wk = 0.0036900 k( 238) = ( 0.0416667 -0.0000000 0.2691488), wk = 0.0036900 k( 239) = ( 0.0555556 -0.0000000 0.2691488), wk = 0.0036900 k( 240) = ( 0.0694444 -0.0000000 0.2691488), wk = 0.0036900 k( 241) = ( 0.0833333 -0.0000000 0.2691488), wk = 0.0036900 k( 242) = ( 0.0972222 -0.0000000 0.2691488), wk = 0.0036900 k( 243) = ( 0.1111111 -0.0000000 0.2691488), wk = 0.0036900 k( 244) = ( 0.1250000 -0.0000000 0.2691488), wk = 0.0036900 k( 245) = ( 0.1388889 -0.0000000 0.2691488), wk = 0.0036900 k( 246) = ( 0.1527778 -0.0000000 0.2691488), wk = 0.0036900 k( 247) = ( 0.1666667 -0.0000000 0.2691488), wk = 0.0036900 k( 248) = ( 0.1805556 -0.0000000 0.2691488), wk = 0.0036900 k( 249) = ( 0.1944444 -0.0000000 0.2691488), wk = 0.0036900 k( 250) = ( 0.2083333 -0.0000000 0.2691488), wk = 0.0036900 k( 251) = ( 0.2222222 -0.0000000 0.2691488), wk = 0.0036900 k( 252) = ( 0.2361111 -0.0000000 0.2691488), wk = 0.0036900 k( 253) = ( 0.2500000 -0.0000000 0.2691488), wk = 0.0036900 k( 254) = ( 0.2638889 -0.0000000 0.2691488), wk = 0.0036900 k( 255) = ( 0.2777778 -0.0000000 0.2691488), wk = 0.0036900 k( 256) = ( 0.2916667 -0.0000000 0.2691488), wk = 0.0036900 k( 257) = ( 0.3055556 -0.0000000 0.2691488), wk = 0.0036900 k( 258) = ( 0.3194444 -0.0000000 0.2691488), wk = 0.0036900 k( 259) = ( 0.3333333 -0.0000000 0.2691488), wk = 0.0036900 k( 260) = ( 0.3472222 -0.0000000 0.2691488), wk = 0.0036900 k( 261) = ( 0.3611111 -0.0000000 0.2691488), wk = 0.0036900 k( 262) = ( 0.3750000 -0.0000000 0.2691488), wk = 0.0036900 k( 263) = ( 0.3888889 -0.0000000 0.2691488), wk = 0.0036900 k( 264) = ( 0.4027778 -0.0000000 0.2691488), wk = 0.0036900 k( 265) = ( 0.4166667 -0.0000000 0.2691488), wk = 0.0036900 k( 266) = ( 0.4305556 -0.0000000 0.2691488), wk = 0.0036900 k( 267) = ( 0.4444444 -0.0000000 0.2691488), wk = 0.0036900 k( 268) = ( 0.4583333 -0.0000000 0.2691488), wk = 0.0036900 k( 269) = ( 0.4722222 -0.0000000 0.2691488), wk = 0.0036900 k( 270) = ( 0.4861111 -0.0000000 0.2691488), wk = 0.0036900 k( 271) = ( 0.5000000 -0.0000000 0.2691488), wk = 0.0036900 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 2) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0036900 k( 3) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0036900 k( 4) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0036900 k( 5) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0036900 k( 6) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0036900 k( 7) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0036900 k( 8) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0036900 k( 9) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0036900 k( 10) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0036900 k( 11) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0036900 k( 12) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0036900 k( 13) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0036900 k( 14) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0036900 k( 15) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0036900 k( 16) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0036900 k( 17) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0036900 k( 18) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0036900 k( 19) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0036900 k( 20) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0036900 k( 21) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 22) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 23) = ( 0.0000000 0.0137522 0.5116213), wk = 0.0036900 k( 24) = ( 0.0000000 0.0275045 0.5232426), wk = 0.0036900 k( 25) = ( 0.0000000 0.0412567 0.5348639), wk = 0.0036900 k( 26) = ( 0.0000000 0.0550090 0.5464852), wk = 0.0036900 k( 27) = ( 0.0000000 0.0687612 0.5581065), wk = 0.0036900 k( 28) = ( 0.0000000 0.0825134 0.5697278), wk = 0.0036900 k( 29) = ( 0.0000000 0.0962656 0.5813491), wk = 0.0036900 k( 30) = ( 0.0000000 0.1100179 0.5929704), wk = 0.0036900 k( 31) = ( 0.0000000 0.1237701 0.6045917), wk = 0.0036900 k( 32) = ( 0.0000000 0.1375224 0.6162130), wk = 0.0036900 k( 33) = ( 0.0000000 0.1512746 0.6278343), wk = 0.0036900 k( 34) = ( 0.0000000 0.1650268 0.6394556), wk = 0.0036900 k( 35) = ( 0.0000000 0.1787791 0.6510769), wk = 0.0036900 k( 36) = ( 0.0000000 0.1925313 0.6626982), wk = 0.0036900 k( 37) = ( 0.0000000 0.2062835 0.6743195), wk = 0.0036900 k( 38) = ( 0.0000000 0.2200358 0.6859409), wk = 0.0036900 k( 39) = ( 0.0000000 0.2337880 0.6975621), wk = 0.0036900 k( 40) = ( 0.0000000 0.2475402 0.7091835), wk = 0.0036900 k( 41) = ( 0.0000000 0.2612925 0.7208048), wk = 0.0036900 k( 42) = ( 0.0000000 0.2750447 0.7324261), wk = 0.0036900 k( 43) = ( 0.0000000 0.2887970 0.7440474), wk = 0.0036900 k( 44) = ( 0.0000000 0.3025492 0.7556687), wk = 0.0036900 k( 45) = ( 0.0000000 0.3163014 0.7672900), wk = 0.0036900 k( 46) = ( 0.0000000 0.3300537 0.7789113), wk = 0.0036900 k( 47) = ( 0.0000000 0.3438059 0.7905326), wk = 0.0036900 k( 48) = ( 0.0000000 0.3575581 0.8021539), wk = 0.0036900 k( 49) = ( 0.0000000 0.3713104 0.8137752), wk = 0.0036900 k( 50) = ( 0.0000000 0.3850626 0.8253965), wk = 0.0036900 k( 51) = ( 0.0000000 0.3988148 0.8370178), wk = 0.0036900 k( 52) = ( 0.0000000 0.4125671 0.8486391), wk = 0.0036900 k( 53) = ( 0.0000000 0.4263193 0.8602604), wk = 0.0036900 k( 54) = ( 0.0000000 0.4400716 0.8718817), wk = 0.0036900 k( 55) = ( 0.0000000 0.4538238 0.8835030), wk = 0.0036900 k( 56) = ( 0.0000000 0.4675760 0.8951243), wk = 0.0036900 k( 57) = ( 0.0000000 0.4813283 0.9067456), wk = 0.0036900 k( 58) = ( 0.0000000 0.4813283 0.9067456), wk = 0.0036900 k( 59) = ( 0.0000000 0.4824266 0.8828194), wk = 0.0036900 k( 60) = ( 0.0000000 0.4835249 0.8588932), wk = 0.0036900 k( 61) = ( 0.0000000 0.4846233 0.8349670), wk = 0.0036900 k( 62) = ( 0.0000000 0.4857216 0.8110408), wk = 0.0036900 k( 63) = ( 0.0000000 0.4868200 0.7871145), wk = 0.0036900 k( 64) = ( 0.0000000 0.4879183 0.7631883), wk = 0.0036900 k( 65) = ( 0.0000000 0.4890166 0.7392621), wk = 0.0036900 k( 66) = ( 0.0000000 0.4901150 0.7153359), wk = 0.0036900 k( 67) = ( 0.0000000 0.4912133 0.6914097), wk = 0.0036900 k( 68) = ( 0.0000000 0.4923116 0.6674835), wk = 0.0036900 k( 69) = ( 0.0000000 0.4934100 0.6435573), wk = 0.0036900 k( 70) = ( 0.0000000 0.4945083 0.6196311), wk = 0.0036900 k( 71) = ( 0.0000000 0.4956066 0.5957048), wk = 0.0036900 k( 72) = ( 0.0000000 0.4967050 0.5717786), wk = 0.0036900 k( 73) = ( 0.0000000 0.4978033 0.5478524), wk = 0.0036900 k( 74) = ( 0.0000000 0.4989017 0.5239262), wk = 0.0036900 k( 75) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0036900 k( 76) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0036900 k( 77) = ( 0.0138889 0.5000000 0.5000000), wk = 0.0036900 k( 78) = ( 0.0277778 0.5000000 0.5000000), wk = 0.0036900 k( 79) = ( 0.0416667 0.5000000 0.5000000), wk = 0.0036900 k( 80) = ( 0.0555556 0.5000000 0.5000000), wk = 0.0036900 k( 81) = ( 0.0694444 0.5000000 0.5000000), wk = 0.0036900 k( 82) = ( 0.0833333 0.5000000 0.5000000), wk = 0.0036900 k( 83) = ( 0.0972222 0.5000000 0.5000000), wk = 0.0036900 k( 84) = ( 0.1111111 0.5000000 0.5000000), wk = 0.0036900 k( 85) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0036900 k( 86) = ( 0.1388889 0.5000000 0.5000000), wk = 0.0036900 k( 87) = ( 0.1527778 0.5000000 0.5000000), wk = 0.0036900 k( 88) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0036900 k( 89) = ( 0.1805556 0.5000000 0.5000000), wk = 0.0036900 k( 90) = ( 0.1944444 0.5000000 0.5000000), wk = 0.0036900 k( 91) = ( 0.2083333 0.5000000 0.5000000), wk = 0.0036900 k( 92) = ( 0.2222222 0.5000000 0.5000000), wk = 0.0036900 k( 93) = ( 0.2361111 0.5000000 0.5000000), wk = 0.0036900 k( 94) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0036900 k( 95) = ( 0.2638889 0.5000000 0.5000000), wk = 0.0036900 k( 96) = ( 0.2777778 0.5000000 0.5000000), wk = 0.0036900 k( 97) = ( 0.2916667 0.5000000 0.5000000), wk = 0.0036900 k( 98) = ( 0.3055556 0.5000000 0.5000000), wk = 0.0036900 k( 99) = ( 0.3194444 0.5000000 0.5000000), wk = 0.0036900 k( 100) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0036900 k( 101) = ( 0.3472222 0.5000000 0.5000000), wk = 0.0036900 k( 102) = ( 0.3611111 0.5000000 0.5000000), wk = 0.0036900 k( 103) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0036900 k( 104) = ( 0.3888889 0.5000000 0.5000000), wk = 0.0036900 k( 105) = ( 0.4027778 0.5000000 0.5000000), wk = 0.0036900 k( 106) = ( 0.4166667 0.5000000 0.5000000), wk = 0.0036900 k( 107) = ( 0.4305556 0.5000000 0.5000000), wk = 0.0036900 k( 108) = ( 0.4444444 0.5000000 0.5000000), wk = 0.0036900 k( 109) = ( 0.4583333 0.5000000 0.5000000), wk = 0.0036900 k( 110) = ( 0.4722222 0.5000000 0.5000000), wk = 0.0036900 k( 111) = ( 0.4861111 0.5000000 0.5000000), wk = 0.0036900 k( 112) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036900 k( 113) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0036900 k( 114) = ( 0.5000000 0.5010983 0.4760738), wk = 0.0036900 k( 115) = ( 0.5000000 0.5021967 0.4521476), wk = 0.0036900 k( 116) = ( 0.5000000 0.5032950 0.4282214), wk = 0.0036900 k( 117) = ( 0.5000000 0.5043933 0.4042952), wk = 0.0036900 k( 118) = ( 0.5000000 0.5054917 0.3803689), wk = 0.0036900 k( 119) = ( 0.5000000 0.5065900 0.3564427), wk = 0.0036900 k( 120) = ( 0.5000000 0.5076884 0.3325165), wk = 0.0036900 k( 121) = ( 0.5000000 0.5087867 0.3085903), wk = 0.0036900 k( 122) = ( 0.5000000 0.5098850 0.2846641), wk = 0.0036900 k( 123) = ( 0.5000000 0.5109834 0.2607379), wk = 0.0036900 k( 124) = ( 0.5000000 0.5120817 0.2368117), wk = 0.0036900 k( 125) = ( 0.5000000 0.5131800 0.2128855), wk = 0.0036900 k( 126) = ( 0.5000000 0.5142784 0.1889592), wk = 0.0036900 k( 127) = ( 0.5000000 0.5153767 0.1650330), wk = 0.0036900 k( 128) = ( 0.5000000 0.5164751 0.1411068), wk = 0.0036900 k( 129) = ( 0.5000000 0.5175734 0.1171806), wk = 0.0036900 k( 130) = ( 0.5000000 0.5186717 0.0932544), wk = 0.0036900 k( 131) = ( 0.5000000 0.5186717 0.0932544), wk = 0.0036900 k( 132) = ( 0.5000000 0.5140038 0.0699408), wk = 0.0036900 k( 133) = ( 0.5000000 0.5093359 0.0466272), wk = 0.0036900 k( 134) = ( 0.5000000 0.5046679 0.0233136), wk = 0.0036900 k( 135) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0036900 k( 136) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0036900 k( 137) = ( 0.4861111 0.5000000 0.0000000), wk = 0.0036900 k( 138) = ( 0.4722222 0.5000000 0.0000000), wk = 0.0036900 k( 139) = ( 0.4583333 0.5000000 0.0000000), wk = 0.0036900 k( 140) = ( 0.4444444 0.5000000 0.0000000), wk = 0.0036900 k( 141) = ( 0.4305556 0.5000000 0.0000000), wk = 0.0036900 k( 142) = ( 0.4166667 0.5000000 0.0000000), wk = 0.0036900 k( 143) = ( 0.4027778 0.5000000 0.0000000), wk = 0.0036900 k( 144) = ( 0.3888889 0.5000000 0.0000000), wk = 0.0036900 k( 145) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0036900 k( 146) = ( 0.3611111 0.5000000 0.0000000), wk = 0.0036900 k( 147) = ( 0.3472222 0.5000000 0.0000000), wk = 0.0036900 k( 148) = ( 0.3333333 0.5000000 0.0000000), wk = 0.0036900 k( 149) = ( 0.3194444 0.5000000 0.0000000), wk = 0.0036900 k( 150) = ( 0.3055556 0.5000000 0.0000000), wk = 0.0036900 k( 151) = ( 0.2916667 0.5000000 0.0000000), wk = 0.0036900 k( 152) = ( 0.2777778 0.5000000 0.0000000), wk = 0.0036900 k( 153) = ( 0.2638889 0.5000000 0.0000000), wk = 0.0036900 k( 154) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0036900 k( 155) = ( 0.2361111 0.5000000 0.0000000), wk = 0.0036900 k( 156) = ( 0.2222222 0.5000000 0.0000000), wk = 0.0036900 k( 157) = ( 0.2083333 0.5000000 0.0000000), wk = 0.0036900 k( 158) = ( 0.1944444 0.5000000 0.0000000), wk = 0.0036900 k( 159) = ( 0.1805556 0.5000000 0.0000000), wk = 0.0036900 k( 160) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0036900 k( 161) = ( 0.1527778 0.5000000 0.0000000), wk = 0.0036900 k( 162) = ( 0.1388889 0.5000000 0.0000000), wk = 0.0036900 k( 163) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0036900 k( 164) = ( 0.1111111 0.5000000 0.0000000), wk = 0.0036900 k( 165) = ( 0.0972222 0.5000000 0.0000000), wk = 0.0036900 k( 166) = ( 0.0833333 0.5000000 0.0000000), wk = 0.0036900 k( 167) = ( 0.0694444 0.5000000 0.0000000), wk = 0.0036900 k( 168) = ( 0.0555556 0.5000000 0.0000000), wk = 0.0036900 k( 169) = ( 0.0416667 0.5000000 0.0000000), wk = 0.0036900 k( 170) = ( 0.0277778 0.5000000 0.0000000), wk = 0.0036900 k( 171) = ( 0.0138889 0.5000000 0.0000000), wk = 0.0036900 k( 172) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036900 k( 173) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036900 k( 174) = ( 0.0000000 0.5046679 0.0233136), wk = 0.0036900 k( 175) = ( 0.0000000 0.5093359 0.0466272), wk = 0.0036900 k( 176) = ( 0.0000000 0.5140038 0.0699408), wk = 0.0036900 k( 177) = ( 0.0000000 0.5186717 0.0932544), wk = 0.0036900 k( 178) = ( 0.5000000 0.4813283 0.9067456), wk = 0.0036900 k( 179) = ( 0.5000000 0.4675760 0.8951243), wk = 0.0036900 k( 180) = ( 0.5000000 0.4538238 0.8835030), wk = 0.0036900 k( 181) = ( 0.5000000 0.4400716 0.8718817), wk = 0.0036900 k( 182) = ( 0.5000000 0.4263193 0.8602604), wk = 0.0036900 k( 183) = ( 0.5000000 0.4125671 0.8486391), wk = 0.0036900 k( 184) = ( 0.5000000 0.3988148 0.8370178), wk = 0.0036900 k( 185) = ( 0.5000000 0.3850626 0.8253965), wk = 0.0036900 k( 186) = ( 0.5000000 0.3713104 0.8137752), wk = 0.0036900 k( 187) = ( 0.5000000 0.3575581 0.8021539), wk = 0.0036900 k( 188) = ( 0.5000000 0.3438059 0.7905326), wk = 0.0036900 k( 189) = ( 0.5000000 0.3300537 0.7789113), wk = 0.0036900 k( 190) = ( 0.5000000 0.3163014 0.7672900), wk = 0.0036900 k( 191) = ( 0.5000000 0.3025492 0.7556687), wk = 0.0036900 k( 192) = ( 0.5000000 0.2887970 0.7440474), wk = 0.0036900 k( 193) = ( 0.5000000 0.2750447 0.7324261), wk = 0.0036900 k( 194) = ( 0.5000000 0.2612925 0.7208048), wk = 0.0036900 k( 195) = ( 0.5000000 0.2475402 0.7091835), wk = 0.0036900 k( 196) = ( 0.5000000 0.2337880 0.6975621), wk = 0.0036900 k( 197) = ( 0.5000000 0.2200358 0.6859409), wk = 0.0036900 k( 198) = ( 0.5000000 0.2062835 0.6743195), wk = 0.0036900 k( 199) = ( 0.5000000 0.1925313 0.6626982), wk = 0.0036900 k( 200) = ( 0.5000000 0.1787791 0.6510769), wk = 0.0036900 k( 201) = ( 0.5000000 0.1650268 0.6394556), wk = 0.0036900 k( 202) = ( 0.5000000 0.1512746 0.6278343), wk = 0.0036900 k( 203) = ( 0.5000000 0.1375224 0.6162130), wk = 0.0036900 k( 204) = ( 0.5000000 0.1237701 0.6045917), wk = 0.0036900 k( 205) = ( 0.5000000 0.1100179 0.5929704), wk = 0.0036900 k( 206) = ( 0.5000000 0.0962656 0.5813491), wk = 0.0036900 k( 207) = ( 0.5000000 0.0825134 0.5697278), wk = 0.0036900 k( 208) = ( 0.5000000 0.0687612 0.5581065), wk = 0.0036900 k( 209) = ( 0.5000000 0.0550090 0.5464852), wk = 0.0036900 k( 210) = ( 0.5000000 0.0412567 0.5348639), wk = 0.0036900 k( 211) = ( 0.5000000 0.0275045 0.5232426), wk = 0.0036900 k( 212) = ( 0.5000000 0.0137522 0.5116213), wk = 0.0036900 k( 213) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036900 k( 214) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036900 k( 215) = ( 0.5000000 0.0000000 0.4750000), wk = 0.0036900 k( 216) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0036900 k( 217) = ( 0.5000000 0.0000000 0.4250000), wk = 0.0036900 k( 218) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0036900 k( 219) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0036900 k( 220) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0036900 k( 221) = ( 0.5000000 0.0000000 0.3250000), wk = 0.0036900 k( 222) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0036900 k( 223) = ( 0.5000000 0.0000000 0.2750000), wk = 0.0036900 k( 224) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0036900 k( 225) = ( 0.5000000 0.0000000 0.2250000), wk = 0.0036900 k( 226) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0036900 k( 227) = ( 0.5000000 0.0000000 0.1750000), wk = 0.0036900 k( 228) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0036900 k( 229) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0036900 k( 230) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0036900 k( 231) = ( 0.5000000 0.0000000 0.0750000), wk = 0.0036900 k( 232) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0036900 k( 233) = ( 0.5000000 0.0000000 0.0250000), wk = 0.0036900 k( 234) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0036900 k( 235) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 236) = ( 0.0138889 -0.0000000 0.5000000), wk = 0.0036900 k( 237) = ( 0.0277778 -0.0000000 0.5000000), wk = 0.0036900 k( 238) = ( 0.0416667 0.0000000 0.5000000), wk = 0.0036900 k( 239) = ( 0.0555556 -0.0000000 0.5000000), wk = 0.0036900 k( 240) = ( 0.0694444 0.0000000 0.5000000), wk = 0.0036900 k( 241) = ( 0.0833333 0.0000000 0.5000000), wk = 0.0036900 k( 242) = ( 0.0972222 0.0000000 0.5000000), wk = 0.0036900 k( 243) = ( 0.1111111 0.0000000 0.5000000), wk = 0.0036900 k( 244) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0036900 k( 245) = ( 0.1388889 -0.0000000 0.5000000), wk = 0.0036900 k( 246) = ( 0.1527778 -0.0000000 0.5000000), wk = 0.0036900 k( 247) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0036900 k( 248) = ( 0.1805556 -0.0000000 0.5000000), wk = 0.0036900 k( 249) = ( 0.1944444 0.0000000 0.5000000), wk = 0.0036900 k( 250) = ( 0.2083333 -0.0000000 0.5000000), wk = 0.0036900 k( 251) = ( 0.2222222 0.0000000 0.5000000), wk = 0.0036900 k( 252) = ( 0.2361111 0.0000000 0.5000000), wk = 0.0036900 k( 253) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0036900 k( 254) = ( 0.2638889 0.0000000 0.5000000), wk = 0.0036900 k( 255) = ( 0.2777778 -0.0000000 0.5000000), wk = 0.0036900 k( 256) = ( 0.2916667 -0.0000000 0.5000000), wk = 0.0036900 k( 257) = ( 0.3055556 -0.0000000 0.5000000), wk = 0.0036900 k( 258) = ( 0.3194444 0.0000000 0.5000000), wk = 0.0036900 k( 259) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0036900 k( 260) = ( 0.3472222 0.0000000 0.5000000), wk = 0.0036900 k( 261) = ( 0.3611111 0.0000000 0.5000000), wk = 0.0036900 k( 262) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0036900 k( 263) = ( 0.3888889 0.0000000 0.5000000), wk = 0.0036900 k( 264) = ( 0.4027778 0.0000000 0.5000000), wk = 0.0036900 k( 265) = ( 0.4166667 0.0000000 0.5000000), wk = 0.0036900 k( 266) = ( 0.4305556 0.0000000 0.5000000), wk = 0.0036900 k( 267) = ( 0.4444444 0.0000000 0.5000000), wk = 0.0036900 k( 268) = ( 0.4583333 0.0000000 0.5000000), wk = 0.0036900 k( 269) = ( 0.4722222 0.0000000 0.5000000), wk = 0.0036900 k( 270) = ( 0.4861111 0.0000000 0.5000000), wk = 0.0036900 k( 271) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0036900 Dense grid: 106839 G-vectors FFT dimensions: ( 50, 48, 100) Smooth grid: 47237 G-vectors FFT dimensions: ( 40, 40, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.38 Mb ( 330, 76) NL pseudopotentials 0.62 Mb ( 165, 248) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2970) G-vector shells 0.02 Mb ( 2901) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.53 Mb ( 330, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.58 Mb ( 248, 2, 76) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./SiO2.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.9 secs Computing kpt #: 2 total cpu time spent up to now is 6.3 secs Computing kpt #: 3 total cpu time spent up to now is 8.7 secs Computing kpt #: 4 total cpu time spent up to now is 11.5 secs Computing kpt #: 5 total cpu time spent up to now is 13.9 secs Computing kpt #: 6 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 16.7 secs Computing kpt #: 7 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 19.5 secs Computing kpt #: 8 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 22.4 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 25.2 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 28.0 secs Computing kpt #: 11 total cpu time spent up to now is 29.7 secs Computing kpt #: 12 total cpu time spent up to now is 31.4 secs Computing kpt #: 13 total cpu time spent up to now is 32.9 secs Computing kpt #: 14 total cpu time spent up to now is 34.5 secs Computing kpt #: 15 total cpu time spent up to now is 35.9 secs Computing kpt #: 16 total cpu time spent up to now is 37.7 secs Computing kpt #: 17 total cpu time spent up to now is 39.1 secs Computing kpt #: 18 total cpu time spent up to now is 40.4 secs Computing kpt #: 19 total cpu time spent up to now is 41.6 secs Computing kpt #: 20 total cpu time spent up to now is 42.9 secs Computing kpt #: 21 total cpu time spent up to now is 44.2 secs Computing kpt #: 22 total cpu time spent up to now is 45.5 secs Computing kpt #: 23 total cpu time spent up to now is 46.7 secs Computing kpt #: 24 total cpu time spent up to now is 48.1 secs Computing kpt #: 25 total cpu time spent up to now is 49.4 secs Computing kpt #: 26 total cpu time spent up to now is 50.7 secs Computing kpt #: 27 total cpu time spent up to now is 52.1 secs Computing kpt #: 28 total cpu time spent up to now is 53.4 secs Computing kpt #: 29 total cpu time spent up to now is 54.8 secs Computing kpt #: 30 total cpu time spent up to now is 56.1 secs Computing kpt #: 31 total cpu time spent up to now is 57.5 secs Computing kpt #: 32 total cpu time spent up to now is 58.9 secs Computing kpt #: 33 total cpu time spent up to now is 60.2 secs Computing kpt #: 34 total cpu time spent up to now is 61.5 secs Computing kpt #: 35 total cpu time spent up to now is 62.9 secs Computing kpt #: 36 total cpu time spent up to now is 64.2 secs Computing kpt #: 37 total cpu time spent up to now is 65.5 secs Computing kpt #: 38 total cpu time spent up to now is 66.8 secs Computing kpt #: 39 total cpu time spent up to now is 68.0 secs Computing kpt #: 40 total cpu time spent up to now is 69.2 secs Computing kpt #: 41 total cpu time spent up to now is 70.4 secs Computing kpt #: 42 total cpu time spent up to now is 71.5 secs Computing kpt #: 43 total cpu time spent up to now is 72.6 secs Computing kpt #: 44 total cpu time spent up to now is 73.7 secs Computing kpt #: 45 total cpu time spent up to now is 74.8 secs Computing kpt #: 46 total cpu time spent up to now is 75.8 secs Computing kpt #: 47 total cpu time spent up to now is 76.8 secs Computing kpt #: 48 total cpu time spent up to now is 77.9 secs Computing kpt #: 49 total cpu time spent up to now is 79.0 secs Computing kpt #: 50 total cpu time spent up to now is 80.0 secs Computing kpt #: 51 total cpu time spent up to now is 81.2 secs Computing kpt #: 52 total cpu time spent up to now is 82.4 secs Computing kpt #: 53 total cpu time spent up to now is 83.8 secs Computing kpt #: 54 total cpu time spent up to now is 85.1 secs Computing kpt #: 55 total cpu time spent up to now is 86.4 secs Computing kpt #: 56 total cpu time spent up to now is 87.9 secs Computing kpt #: 57 total cpu time spent up to now is 89.5 secs Computing kpt #: 58 total cpu time spent up to now is 90.9 secs Computing kpt #: 59 total cpu time spent up to now is 92.4 secs Computing kpt #: 60 total cpu time spent up to now is 93.9 secs Computing kpt #: 61 total cpu time spent up to now is 95.4 secs Computing kpt #: 62 total cpu time spent up to now is 96.8 secs Computing kpt #: 63 total cpu time spent up to now is 98.3 secs Computing kpt #: 64 total cpu time spent up to now is 99.8 secs Computing kpt #: 65 total cpu time spent up to now is 101.4 secs Computing kpt #: 66 total cpu time spent up to now is 103.1 secs Computing kpt #: 67 total cpu time spent up to now is 104.7 secs Computing kpt #: 68 total cpu time spent up to now is 106.2 secs Computing kpt #: 69 total cpu time spent up to now is 107.8 secs Computing kpt #: 70 total cpu time spent up to now is 109.4 secs Computing kpt #: 71 total cpu time spent up to now is 110.9 secs Computing kpt #: 72 total cpu time spent up to now is 112.4 secs Computing kpt #: 73 total cpu time spent up to now is 113.9 secs Computing kpt #: 74 total cpu time spent up to now is 115.4 secs Computing kpt #: 75 total cpu time spent up to now is 116.9 secs Computing kpt #: 76 total cpu time spent up to now is 118.4 secs Computing kpt #: 77 total cpu time spent up to now is 119.9 secs Computing kpt #: 78 total cpu time spent up to now is 121.4 secs Computing kpt #: 79 total cpu time spent up to now is 122.9 secs Computing kpt #: 80 total cpu time spent up to now is 124.4 secs Computing kpt #: 81 total cpu time spent up to now is 125.9 secs Computing kpt #: 82 total cpu time spent up to now is 127.4 secs Computing kpt #: 83 total cpu time spent up to now is 128.9 secs Computing kpt #: 84 total cpu time spent up to now is 130.4 secs Computing kpt #: 85 total cpu time spent up to now is 131.9 secs Computing kpt #: 86 total cpu time spent up to now is 133.5 secs Computing kpt #: 87 total cpu time spent up to now is 135.2 secs Computing kpt #: 88 total cpu time spent up to now is 136.8 secs Computing kpt #: 89 total cpu time spent up to now is 138.4 secs Computing kpt #: 90 total cpu time spent up to now is 140.0 secs Computing kpt #: 91 total cpu time spent up to now is 141.6 secs Computing kpt #: 92 total cpu time spent up to now is 143.3 secs Computing kpt #: 93 total cpu time spent up to now is 144.9 secs Computing kpt #: 94 total cpu time spent up to now is 146.5 secs Computing kpt #: 95 total cpu time spent up to now is 148.1 secs Computing kpt #: 96 total cpu time spent up to now is 149.8 secs Computing kpt #: 97 total cpu time spent up to now is 151.4 secs Computing kpt #: 98 total cpu time spent up to now is 153.1 secs Computing kpt #: 99 total cpu time spent up to now is 154.8 secs Computing kpt #: 100 total cpu time spent up to now is 156.6 secs Computing kpt #: 101 total cpu time spent up to now is 158.3 secs Computing kpt #: 102 total cpu time spent up to now is 160.0 secs Computing kpt #: 103 total cpu time spent up to now is 161.8 secs Computing kpt #: 104 total cpu time spent up to now is 163.6 secs Computing kpt #: 105 total cpu time spent up to now is 165.4 secs Computing kpt #: 106 total cpu time spent up to now is 167.4 secs Computing kpt #: 107 total cpu time spent up to now is 169.5 secs Computing kpt #: 108 total cpu time spent up to now is 171.6 secs Computing kpt #: 109 total cpu time spent up to now is 173.4 secs Computing kpt #: 110 total cpu time spent up to now is 175.2 secs Computing kpt #: 111 total cpu time spent up to now is 177.1 secs Computing kpt #: 112 total cpu time spent up to now is 178.9 secs Computing kpt #: 113 total cpu time spent up to now is 180.6 secs Computing kpt #: 114 total cpu time spent up to now is 182.4 secs Computing kpt #: 115 total cpu time spent up to now is 184.2 secs Computing kpt #: 116 total cpu time spent up to now is 186.3 secs Computing kpt #: 117 total cpu time spent up to now is 188.3 secs Computing kpt #: 118 total cpu time spent up to now is 190.0 secs Computing kpt #: 119 total cpu time spent up to now is 192.0 secs Computing kpt #: 120 total cpu time spent up to now is 194.1 secs Computing kpt #: 121 total cpu time spent up to now is 195.9 secs Computing kpt #: 122 total cpu time spent up to now is 198.0 secs Computing kpt #: 123 total cpu time spent up to now is 200.2 secs Computing kpt #: 124 total cpu time spent up to now is 202.4 secs Computing kpt #: 125 total cpu time spent up to now is 204.4 secs Computing kpt #: 126 total cpu time spent up to now is 206.3 secs Computing kpt #: 127 total cpu time spent up to now is 208.8 secs Computing kpt #: 128 total cpu time spent up to now is 211.0 secs Computing kpt #: 129 total cpu time spent up to now is 212.9 secs Computing kpt #: 130 total cpu time spent up to now is 215.2 secs Computing kpt #: 131 total cpu time spent up to now is 217.2 secs Computing kpt #: 132 total cpu time spent up to now is 219.6 secs Computing kpt #: 133 total cpu time spent up to now is 221.9 secs Computing kpt #: 134 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 224.8 secs Computing kpt #: 135 total cpu time spent up to now is 227.6 secs Computing kpt #: 136 total cpu time spent up to now is 230.1 secs Computing kpt #: 137 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 233.0 secs Computing kpt #: 138 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 235.9 secs Computing kpt #: 139 total cpu time spent up to now is 237.7 secs Computing kpt #: 140 total cpu time spent up to now is 239.4 secs Computing kpt #: 141 total cpu time spent up to now is 241.0 secs Computing kpt #: 142 total cpu time spent up to now is 242.7 secs Computing kpt #: 143 total cpu time spent up to now is 244.4 secs Computing kpt #: 144 total cpu time spent up to now is 245.9 secs Computing kpt #: 145 total cpu time spent up to now is 247.5 secs Computing kpt #: 146 total cpu time spent up to now is 249.0 secs Computing kpt #: 147 total cpu time spent up to now is 250.5 secs Computing kpt #: 148 total cpu time spent up to now is 252.0 secs Computing kpt #: 149 total cpu time spent up to now is 253.5 secs Computing kpt #: 150 total cpu time spent up to now is 255.0 secs Computing kpt #: 151 total cpu time spent up to now is 256.5 secs Computing kpt #: 152 total cpu time spent up to now is 258.1 secs Computing kpt #: 153 total cpu time spent up to now is 259.6 secs Computing kpt #: 154 total cpu time spent up to now is 261.1 secs Computing kpt #: 155 total cpu time spent up to now is 262.7 secs Computing kpt #: 156 total cpu time spent up to now is 264.2 secs Computing kpt #: 157 total cpu time spent up to now is 265.8 secs Computing kpt #: 158 total cpu time spent up to now is 267.4 secs Computing kpt #: 159 total cpu time spent up to now is 268.9 secs Computing kpt #: 160 total cpu time spent up to now is 270.5 secs Computing kpt #: 161 total cpu time spent up to now is 272.1 secs Computing kpt #: 162 total cpu time spent up to now is 273.6 secs Computing kpt #: 163 total cpu time spent up to now is 275.1 secs Computing kpt #: 164 total cpu time spent up to now is 276.5 secs Computing kpt #: 165 total cpu time spent up to now is 278.1 secs Computing kpt #: 166 total cpu time spent up to now is 279.7 secs Computing kpt #: 167 total cpu time spent up to now is 281.1 secs Computing kpt #: 168 total cpu time spent up to now is 282.4 secs Computing kpt #: 169 total cpu time spent up to now is 284.0 secs Computing kpt #: 170 total cpu time spent up to now is 285.2 secs Computing kpt #: 171 total cpu time spent up to now is 286.6 secs Computing kpt #: 172 total cpu time spent up to now is 287.9 secs Computing kpt #: 173 total cpu time spent up to now is 289.4 secs Computing kpt #: 174 total cpu time spent up to now is 290.8 secs Computing kpt #: 175 total cpu time spent up to now is 292.3 secs Computing kpt #: 176 total cpu time spent up to now is 293.9 secs Computing kpt #: 177 total cpu time spent up to now is 295.4 secs Computing kpt #: 178 total cpu time spent up to now is 297.4 secs Computing kpt #: 179 total cpu time spent up to now is 299.4 secs Computing kpt #: 180 total cpu time spent up to now is 301.6 secs Computing kpt #: 181 total cpu time spent up to now is 303.4 secs Computing kpt #: 182 total cpu time spent up to now is 305.2 secs Computing kpt #: 183 total cpu time spent up to now is 306.9 secs Computing kpt #: 184 total cpu time spent up to now is 309.1 secs Computing kpt #: 185 total cpu time spent up to now is 311.2 secs Computing kpt #: 186 total cpu time spent up to now is 313.1 secs Computing kpt #: 187 total cpu time spent up to now is 315.0 secs Computing kpt #: 188 total cpu time spent up to now is 316.6 secs Computing kpt #: 189 total cpu time spent up to now is 318.3 secs Computing kpt #: 190 total cpu time spent up to now is 320.0 secs Computing kpt #: 191 total cpu time spent up to now is 321.7 secs Computing kpt #: 192 total cpu time spent up to now is 323.1 secs Computing kpt #: 193 total cpu time spent up to now is 324.7 secs Computing kpt #: 194 total cpu time spent up to now is 326.2 secs Computing kpt #: 195 total cpu time spent up to now is 327.8 secs Computing kpt #: 196 total cpu time spent up to now is 329.4 secs Computing kpt #: 197 total cpu time spent up to now is 330.7 secs Computing kpt #: 198 total cpu time spent up to now is 332.3 secs Computing kpt #: 199 total cpu time spent up to now is 333.6 secs Computing kpt #: 200 total cpu time spent up to now is 335.1 secs Computing kpt #: 201 total cpu time spent up to now is 336.4 secs Computing kpt #: 202 total cpu time spent up to now is 337.8 secs Computing kpt #: 203 total cpu time spent up to now is 339.1 secs Computing kpt #: 204 total cpu time spent up to now is 340.4 secs Computing kpt #: 205 total cpu time spent up to now is 341.7 secs Computing kpt #: 206 total cpu time spent up to now is 343.0 secs Computing kpt #: 207 total cpu time spent up to now is 344.3 secs Computing kpt #: 208 total cpu time spent up to now is 345.6 secs Computing kpt #: 209 total cpu time spent up to now is 346.9 secs Computing kpt #: 210 total cpu time spent up to now is 348.1 secs Computing kpt #: 211 total cpu time spent up to now is 349.3 secs Computing kpt #: 212 total cpu time spent up to now is 350.6 secs Computing kpt #: 213 total cpu time spent up to now is 351.8 secs Computing kpt #: 214 total cpu time spent up to now is 353.0 secs Computing kpt #: 215 total cpu time spent up to now is 354.3 secs Computing kpt #: 216 total cpu time spent up to now is 355.5 secs Computing kpt #: 217 total cpu time spent up to now is 356.8 secs Computing kpt #: 218 total cpu time spent up to now is 358.1 secs Computing kpt #: 219 total cpu time spent up to now is 359.5 secs Computing kpt #: 220 total cpu time spent up to now is 360.9 secs Computing kpt #: 221 total cpu time spent up to now is 362.2 secs Computing kpt #: 222 total cpu time spent up to now is 363.7 secs Computing kpt #: 223 total cpu time spent up to now is 365.0 secs Computing kpt #: 224 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 367.8 secs Computing kpt #: 225 total cpu time spent up to now is 370.6 secs Computing kpt #: 226 total cpu time spent up to now is 373.1 secs Computing kpt #: 227 total cpu time spent up to now is 375.0 secs Computing kpt #: 228 total cpu time spent up to now is 376.7 secs Computing kpt #: 229 total cpu time spent up to now is 378.3 secs Computing kpt #: 230 total cpu time spent up to now is 379.9 secs Computing kpt #: 231 total cpu time spent up to now is 381.9 secs Computing kpt #: 232 total cpu time spent up to now is 383.4 secs Computing kpt #: 233 total cpu time spent up to now is 385.0 secs Computing kpt #: 234 total cpu time spent up to now is 386.6 secs Computing kpt #: 235 total cpu time spent up to now is 387.8 secs Computing kpt #: 236 total cpu time spent up to now is 389.1 secs Computing kpt #: 237 total cpu time spent up to now is 390.4 secs Computing kpt #: 238 total cpu time spent up to now is 391.7 secs Computing kpt #: 239 total cpu time spent up to now is 392.9 secs Computing kpt #: 240 total cpu time spent up to now is 394.2 secs Computing kpt #: 241 total cpu time spent up to now is 395.5 secs Computing kpt #: 242 total cpu time spent up to now is 396.7 secs Computing kpt #: 243 total cpu time spent up to now is 398.0 secs Computing kpt #: 244 total cpu time spent up to now is 399.3 secs Computing kpt #: 245 total cpu time spent up to now is 400.5 secs Computing kpt #: 246 total cpu time spent up to now is 401.8 secs Computing kpt #: 247 total cpu time spent up to now is 403.0 secs Computing kpt #: 248 total cpu time spent up to now is 404.2 secs Computing kpt #: 249 total cpu time spent up to now is 405.5 secs Computing kpt #: 250 total cpu time spent up to now is 406.7 secs Computing kpt #: 251 total cpu time spent up to now is 407.9 secs Computing kpt #: 252 total cpu time spent up to now is 409.2 secs Computing kpt #: 253 total cpu time spent up to now is 410.5 secs Computing kpt #: 254 total cpu time spent up to now is 411.7 secs Computing kpt #: 255 total cpu time spent up to now is 413.0 secs Computing kpt #: 256 total cpu time spent up to now is 414.2 secs Computing kpt #: 257 total cpu time spent up to now is 415.3 secs Computing kpt #: 258 total cpu time spent up to now is 416.4 secs Computing kpt #: 259 total cpu time spent up to now is 417.6 secs Computing kpt #: 260 total cpu time spent up to now is 418.7 secs Computing kpt #: 261 total cpu time spent up to now is 419.8 secs Computing kpt #: 262 total cpu time spent up to now is 421.0 secs Computing kpt #: 263 total cpu time spent up to now is 422.2 secs Computing kpt #: 264 total cpu time spent up to now is 423.3 secs Computing kpt #: 265 total cpu time spent up to now is 424.5 secs Computing kpt #: 266 total cpu time spent up to now is 425.7 secs Computing kpt #: 267 total cpu time spent up to now is 426.9 secs Computing kpt #: 268 total cpu time spent up to now is 428.1 secs Computing kpt #: 269 total cpu time spent up to now is 429.4 secs Computing kpt #: 270 total cpu time spent up to now is 430.6 secs Computing kpt #: 271 total cpu time spent up to now is 431.8 secs ethr = 1.56E-08, avg # of iterations = 47.6 total cpu time spent up to now is 431.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5873 PWs) bands (ev): -17.6089 -17.6089 -17.2174 -17.2174 -16.4487 -16.4487 -15.9384 -15.9384 -14.5319 -14.5319 -14.5316 -14.5316 -13.7725 -13.7725 -13.6669 -13.6669 -7.8478 -7.8478 -6.8463 -6.8463 -4.7496 -4.7496 -4.2791 -4.2791 -3.8560 -3.8560 -3.8105 -3.8105 -2.3159 -2.3159 -2.2183 -2.2183 -1.3104 -1.3104 -1.1427 -1.1427 -1.0778 -1.0778 -0.4167 -0.4167 -0.3323 -0.3323 -0.1378 -0.1378 0.0328 0.0328 0.0686 0.0686 1.5275 1.5275 1.5370 1.5370 1.8167 1.8167 1.8760 1.8760 3.3880 3.3880 3.4124 3.4124 4.6853 4.6853 4.6867 4.6867 5.1508 5.1508 6.1594 6.1594 8.8510 8.8510 10.6208 10.6208 11.0834 11.0834 11.6704 11.6704 k = 0.0000 0.0000 0.0135 ( 5874 PWs) bands (ev): -17.6085 -17.6085 -17.2184 -17.2184 -16.4475 -16.4475 -15.9390 -15.9390 -14.5319 -14.5319 -14.5316 -14.5316 -13.7724 -13.7724 -13.6671 -13.6671 -7.8465 -7.8465 -6.8483 -6.8483 -4.7485 -4.7485 -4.2796 -4.2796 -3.8558 -3.8558 -3.8105 -3.8105 -2.3157 -2.3157 -2.2184 -2.2184 -1.3103 -1.3103 -1.1438 -1.1438 -1.0771 -1.0771 -0.4154 -0.4154 -0.3312 -0.3312 -0.1392 -0.1392 0.0325 0.0325 0.0683 0.0683 1.5275 1.5275 1.5369 1.5369 1.8164 1.8164 1.8756 1.8756 3.3879 3.3879 3.4121 3.4121 4.6852 4.6852 4.6867 4.6867 5.1528 5.1528 6.1583 6.1583 8.8530 8.8530 10.6149 10.6149 11.0848 11.0848 11.6721 11.6721 k = 0.0000 0.0000 0.0269 ( 5868 PWs) bands (ev): -17.6072 -17.6072 -17.2213 -17.2213 -16.4440 -16.4440 -15.9408 -15.9408 -14.5319 -14.5319 -14.5316 -14.5316 -13.7720 -13.7720 -13.6677 -13.6677 -7.8426 -7.8426 -6.8542 -6.8542 -4.7449 -4.7449 -4.2810 -4.2810 -3.8554 -3.8554 -3.8106 -3.8106 -2.3151 -2.3151 -2.2187 -2.2187 -1.3099 -1.3099 -1.1470 -1.1470 -1.0749 -1.0749 -0.4117 -0.4117 -0.3280 -0.3280 -0.1435 -0.1435 0.0318 0.0318 0.0673 0.0673 1.5274 1.5274 1.5368 1.5368 1.8157 1.8157 1.8743 1.8743 3.3876 3.3876 3.4115 3.4115 4.6852 4.6852 4.6866 4.6866 5.1588 5.1588 6.1548 6.1548 8.8591 8.8591 10.5977 10.5977 11.0889 11.0889 11.6774 11.6774 k = 0.0000 0.0000 0.0404 ( 5876 PWs) bands (ev): -17.6051 -17.6051 -17.2262 -17.2262 -16.4382 -16.4382 -15.9438 -15.9438 -14.5319 -14.5319 -14.5316 -14.5316 -13.7713 -13.7713 -13.6687 -13.6687 -7.8362 -7.8362 -6.8641 -6.8641 -4.7392 -4.7392 -4.2835 -4.2835 -3.8548 -3.8548 -3.8107 -3.8107 -2.3142 -2.3142 -2.2192 -2.2192 -1.3095 -1.3095 -1.1522 -1.1522 -1.0710 -1.0710 -0.4057 -0.4057 -0.3227 -0.3227 -0.1506 -0.1506 0.0306 0.0306 0.0657 0.0657 1.5274 1.5274 1.5365 1.5365 1.8145 1.8145 1.8721 1.8721 3.3872 3.3872 3.4103 3.4103 4.6852 4.6852 4.6865 4.6865 5.1687 5.1687 6.1490 6.1490 8.8691 8.8691 10.5700 10.5700 11.0958 11.0958 11.6862 11.6862 k = 0.0000 0.0000 0.0538 ( 5880 PWs) bands (ev): -17.6022 -17.6022 -17.2328 -17.2328 -16.4303 -16.4303 -15.9480 -15.9480 -14.5319 -14.5319 -14.5316 -14.5316 -13.7703 -13.7703 -13.6700 -13.6700 -7.8272 -7.8272 -6.8777 -6.8777 -4.7313 -4.7313 -4.2868 -4.2868 -3.8540 -3.8540 -3.8108 -3.8108 -2.3130 -2.3130 -2.2199 -2.2199 -1.3090 -1.3090 -1.1592 -1.1592 -1.0654 -1.0654 -0.3978 -0.3978 -0.3155 -0.3155 -0.1603 -0.1603 0.0289 0.0289 0.0634 0.0634 1.5273 1.5273 1.5361 1.5361 1.8128 1.8128 1.8691 1.8691 3.3865 3.3865 3.4088 3.4088 4.6851 4.6851 4.6863 4.6863 5.1824 5.1824 6.1409 6.1409 8.8830 8.8830 10.5331 10.5331 11.1053 11.1053 11.6985 11.6985 k = 0.0000 0.0000 0.0673 ( 5878 PWs) bands (ev): -17.5984 -17.5984 -17.2411 -17.2411 -16.4204 -16.4204 -15.9534 -15.9534 -14.5319 -14.5319 -14.5316 -14.5316 -13.7691 -13.7691 -13.6716 -13.6716 -7.8157 -7.8157 -6.8948 -6.8948 -4.7214 -4.7214 -4.2912 -4.2912 -3.8529 -3.8529 -3.8109 -3.8109 -2.3114 -2.3114 -2.2208 -2.2208 -1.3087 -1.3087 -1.1678 -1.1678 -1.0577 -1.0577 -0.3884 -0.3884 -0.3064 -0.3064 -0.1721 -0.1721 0.0266 0.0266 0.0604 0.0604 1.5272 1.5272 1.5356 1.5356 1.8108 1.8108 1.8654 1.8654 3.3857 3.3857 3.4069 3.4069 4.6850 4.6850 4.6861 4.6861 5.1997 5.1997 6.1305 6.1305 8.9008 8.9008 10.4886 10.4886 11.1174 11.1174 11.7144 11.7144 k = 0.0000 0.0000 0.0807 ( 5883 PWs) bands (ev): -17.5938 -17.5938 -17.2509 -17.2509 -16.4086 -16.4086 -15.9599 -15.9599 -14.5319 -14.5319 -14.5316 -14.5316 -13.7676 -13.7676 -13.6737 -13.6737 -7.8018 -7.8018 -6.9153 -6.9153 -4.7096 -4.7096 -4.2965 -4.2965 -3.8516 -3.8516 -3.8111 -3.8111 -2.3094 -2.3094 -2.2219 -2.2219 -1.3087 -1.3087 -1.1776 -1.1776 -1.0477 -1.0477 -0.3784 -0.3784 -0.2957 -0.2957 -0.1856 -0.1856 0.0238 0.0238 0.0568 0.0568 1.5271 1.5271 1.5350 1.5350 1.8084 1.8084 1.8610 1.8610 3.3848 3.3848 3.4047 3.4047 4.6849 4.6849 4.6859 4.6859 5.2204 5.2204 6.1178 6.1178 8.9224 8.9224 10.4379 10.4379 11.1320 11.1320 11.7337 11.7337 k = 0.0000 0.0000 0.0942 ( 5887 PWs) bands (ev): -17.5884 -17.5884 -17.2619 -17.2619 -16.3953 -16.3953 -15.9675 -15.9675 -14.5319 -14.5319 -14.5316 -14.5316 -13.7659 -13.7659 -13.6760 -13.6760 -7.7855 -7.7855 -6.9389 -6.9389 -4.6963 -4.6963 -4.3027 -4.3027 -3.8501 -3.8501 -3.8114 -3.8114 -2.3072 -2.3072 -2.2233 -2.2233 -1.3091 -1.3091 -1.1884 -1.1884 -1.0353 -1.0353 -0.3689 -0.3689 -0.2836 -0.2836 -0.1998 -0.1998 0.0205 0.0205 0.0525 0.0525 1.5270 1.5270 1.5344 1.5344 1.8058 1.8058 1.8560 1.8560 3.3838 3.3838 3.4023 3.4023 4.6848 4.6848 4.6857 4.6857 5.2444 5.2444 6.1028 6.1028 8.9477 8.9477 10.3824 10.3824 11.1490 11.1490 11.7566 11.7566 k = 0.0000 0.0000 0.1077 ( 5892 PWs) bands (ev): -17.5821 -17.5821 -17.2741 -17.2741 -16.3805 -16.3805 -15.9763 -15.9763 -14.5319 -14.5319 -14.5316 -14.5316 -13.7639 -13.7639 -13.6786 -13.6786 -7.7668 -7.7668 -6.9654 -6.9654 -4.6815 -4.6815 -4.3099 -4.3099 -3.8484 -3.8484 -3.8117 -3.8117 -2.3046 -2.3046 -2.2248 -2.2248 -1.3099 -1.3099 -1.1999 -1.1999 -1.0202 -1.0202 -0.3616 -0.3616 -0.2705 -0.2705 -0.2129 -0.2129 0.0166 0.0166 0.0475 0.0475 1.5269 1.5269 1.5338 1.5338 1.8030 1.8030 1.8506 1.8506 3.3826 3.3826 3.3997 3.3997 4.6847 4.6847 4.6854 4.6854 5.2714 5.2714 6.0855 6.0855 8.9765 8.9765 10.3231 10.3231 11.1682 11.1682 11.7830 11.8092 k = 0.0000 0.0000 0.1211 ( 5900 PWs) bands (ev): -17.5751 -17.5751 -17.2872 -17.2872 -16.3644 -16.3644 -15.9862 -15.9862 -14.5319 -14.5319 -14.5317 -14.5317 -13.7616 -13.7616 -13.6815 -13.6815 -7.7459 -7.7459 -6.9944 -6.9944 -4.6655 -4.6655 -4.3180 -4.3180 -3.8466 -3.8466 -3.8121 -3.8121 -2.3018 -2.3018 -2.2266 -2.2266 -1.3111 -1.3111 -1.2117 -1.2117 -1.0026 -1.0026 -0.3592 -0.3592 -0.2566 -0.2566 -0.2222 -0.2222 0.0120 0.0120 0.0418 0.0418 1.5268 1.5268 1.5331 1.5331 1.8001 1.8001 1.8447 1.8447 3.3815 3.3815 3.3970 3.3970 4.6845 4.6845 4.6852 4.6852 5.3010 5.3010 6.0659 6.0659 9.0088 9.0088 10.2611 10.2611 11.1895 11.1895 11.8027 11.8029 k = 0.0000 0.0000 0.1346 ( 5898 PWs) bands (ev): -17.5673 -17.5673 -17.3011 -17.3011 -16.3473 -16.3473 -15.9971 -15.9971 -14.5319 -14.5319 -14.5317 -14.5317 -13.7592 -13.7592 -13.6847 -13.6847 -7.7228 -7.7228 -7.0256 -7.0256 -4.6485 -4.6485 -4.3271 -4.3271 -3.8446 -3.8446 -3.8126 -3.8126 -2.2987 -2.2987 -2.2286 -2.2286 -1.3126 -1.3126 -1.2237 -1.2237 -0.9822 -0.9822 -0.3645 -0.3645 -0.2430 -0.2430 -0.2243 -0.2243 0.0068 0.0068 0.0355 0.0355 1.5267 1.5267 1.5324 1.5324 1.7972 1.7972 1.8386 1.8386 3.3803 3.3803 3.3943 3.3943 4.6844 4.6844 4.6849 4.6849 5.3331 5.3331 6.0440 6.0440 9.0444 9.0444 10.1972 10.1972 11.2127 11.2127 11.7842 11.7842 k = 0.0000 0.0000 0.1480 ( 5895 PWs) bands (ev): -17.5588 -17.5588 -17.3156 -17.3156 -16.3294 -16.3294 -16.0090 -16.0090 -14.5319 -14.5319 -14.5317 -14.5317 -13.7564 -13.7564 -13.6881 -13.6881 -7.6977 -7.6977 -7.0588 -7.0588 -4.6307 -4.6307 -4.3370 -4.3370 -3.8426 -3.8426 -3.8132 -3.8132 -2.2954 -2.2954 -2.2309 -2.2309 -1.3143 -1.3143 -1.2356 -1.2356 -0.9594 -0.9594 -0.3787 -0.3787 -0.2310 -0.2310 -0.2170 -0.2170 0.0009 0.0009 0.0284 0.0284 1.5267 1.5267 1.5317 1.5317 1.7944 1.7944 1.8324 1.8324 3.3792 3.3792 3.3916 3.3916 4.6843 4.6843 4.6847 4.6847 5.3673 5.3673 6.0200 6.0200 9.0832 9.0832 10.1319 10.1319 11.2378 11.2378 11.7633 11.7633 k = 0.0000 0.0000 0.1615 ( 5888 PWs) bands (ev): -17.5495 -17.5495 -17.3305 -17.3305 -16.3107 -16.3107 -16.0219 -16.0219 -14.5319 -14.5319 -14.5317 -14.5317 -13.7535 -13.7535 -13.6917 -13.6917 -7.6706 -7.6706 -7.0936 -7.0936 -4.6123 -4.6123 -4.3478 -4.3478 -3.8405 -3.8405 -3.8138 -3.8138 -2.2918 -2.2918 -2.2333 -2.2333 -1.3160 -1.3160 -1.2472 -1.2472 -0.9341 -0.9341 -0.4002 -0.4002 -0.2191 -0.2191 -0.2035 -0.2035 -0.0058 -0.0058 0.0206 0.0206 1.5266 1.5266 1.5310 1.5310 1.7918 1.7918 1.8261 1.8261 3.3781 3.3781 3.3890 3.3890 4.6842 4.6842 4.6845 4.6845 5.4033 5.4033 5.9938 5.9938 9.1250 9.1250 10.0659 10.0659 11.2644 11.2644 11.7405 11.7405 k = 0.0000 0.0000 0.1749 ( 5890 PWs) bands (ev): -17.5395 -17.5395 -17.3458 -17.3458 -16.2916 -16.2916 -16.0357 -16.0357 -14.5319 -14.5319 -14.5317 -14.5317 -13.7504 -13.7504 -13.6955 -13.6955 -7.6417 -7.6417 -7.1298 -7.1298 -4.5935 -4.5935 -4.3595 -4.3595 -3.8383 -3.8383 -3.8146 -3.8146 -2.2881 -2.2881 -2.2360 -2.2360 -1.3176 -1.3176 -1.2583 -1.2583 -0.9066 -0.9066 -0.4270 -0.4270 -0.2055 -0.2055 -0.1878 -0.1878 -0.0131 -0.0131 0.0121 0.0121 1.5265 1.5265 1.5304 1.5304 1.7895 1.7895 1.8200 1.8200 3.3771 3.3771 3.3865 3.3865 4.6840 4.6840 4.6843 4.6843 5.4408 5.4408 5.9655 5.9655 9.1697 9.1697 9.9994 9.9994 11.2923 11.2923 11.7160 11.7160 k = 0.0000 0.0000 0.1884 ( 5889 PWs) bands (ev): -17.5288 -17.5288 -17.3612 -17.3612 -16.2720 -16.2720 -16.0504 -16.0504 -14.5319 -14.5319 -14.5318 -14.5318 -13.7471 -13.7471 -13.6994 -13.6994 -7.6110 -7.6110 -7.1670 -7.1670 -4.5746 -4.5746 -4.3721 -4.3721 -3.8361 -3.8361 -3.8156 -3.8156 -2.2843 -2.2843 -2.2389 -2.2389 -1.3188 -1.3188 -1.2687 -1.2687 -0.8771 -0.8771 -0.4574 -0.4574 -0.1905 -0.1905 -0.1717 -0.1717 -0.0212 -0.0212 0.0029 0.0029 1.5265 1.5265 1.5298 1.5298 1.7876 1.7876 1.8140 1.8140 3.3762 3.3762 3.3841 3.3841 4.6839 4.6839 4.6842 4.6842 5.4795 5.4795 5.9353 5.9353 9.2170 9.2170 9.9330 9.9330 11.3215 11.3215 11.6898 11.6898 k = 0.0000 0.0000 0.2019 ( 5896 PWs) bands (ev): -17.5174 -17.5174 -17.3767 -17.3767 -16.2523 -16.2523 -16.0660 -16.0660 -14.5319 -14.5319 -14.5318 -14.5318 -13.7436 -13.7436 -13.7034 -13.7034 -7.5787 -7.5787 -7.2051 -7.2051 -4.5555 -4.5555 -4.3855 -4.3855 -3.8339 -3.8339 -3.8166 -3.8166 -2.2803 -2.2803 -2.2420 -2.2420 -1.3196 -1.3196 -1.2783 -1.2783 -0.8458 -0.8458 -0.4902 -0.4902 -0.1749 -0.1749 -0.1556 -0.1556 -0.0299 -0.0299 -0.0070 -0.0070 1.5265 1.5265 1.5292 1.5292 1.7862 1.7862 1.8084 1.8084 3.3755 3.3755 3.3820 3.3820 4.6838 4.6838 4.6840 4.6840 5.5190 5.5190 5.9032 5.9032 9.2669 9.2669 9.8668 9.8668 11.3517 11.3517 11.6623 11.6623 k = 0.0000 0.0000 0.2153 ( 5898 PWs) bands (ev): -17.5055 -17.5055 -17.3922 -17.3922 -16.2324 -16.2324 -16.0823 -16.0823 -14.5319 -14.5319 -14.5318 -14.5318 -13.7399 -13.7399 -13.7075 -13.7075 -7.5450 -7.5450 -7.2438 -7.2438 -4.5365 -4.5365 -4.3997 -4.3997 -3.8318 -3.8318 -3.8178 -3.8178 -2.2763 -2.2763 -2.2453 -2.2453 -1.3197 -1.3197 -1.2870 -1.2870 -0.8129 -0.8129 -0.5248 -0.5248 -0.1592 -0.1592 -0.1401 -0.1401 -0.0391 -0.0391 -0.0175 -0.0175 1.5266 1.5266 1.5287 1.5287 1.7853 1.7853 1.8033 1.8033 3.3750 3.3750 3.3801 3.3801 4.6838 4.6838 4.6839 4.6839 5.5592 5.5592 5.8693 5.8693 9.3191 9.3191 9.8012 9.8012 11.3826 11.3826 11.6335 11.6335 k = 0.0000 0.0000 0.2288 ( 5895 PWs) bands (ev): -17.4929 -17.4929 -17.4075 -17.4075 -16.2125 -16.2125 -16.0994 -16.0994 -14.5319 -14.5319 -14.5318 -14.5318 -13.7361 -13.7361 -13.7116 -13.7116 -7.5100 -7.5100 -7.2827 -7.2827 -4.5178 -4.5178 -4.4146 -4.4146 -3.8297 -3.8297 -3.8191 -3.8191 -2.2722 -2.2722 -2.2488 -2.2488 -1.3190 -1.3190 -1.2947 -1.2947 -0.7787 -0.7787 -0.5605 -0.5605 -0.1439 -0.1439 -0.1256 -0.1256 -0.0485 -0.0485 -0.0285 -0.0285 1.5266 1.5266 1.5282 1.5282 1.7851 1.7851 1.7986 1.7986 3.3748 3.3748 3.3785 3.3785 4.6837 4.6837 4.6838 4.6838 5.5997 5.5997 5.8339 5.8339 9.3736 9.3736 9.7363 9.7363 11.4141 11.4141 11.6037 11.6037 k = 0.0000 0.0000 0.2422 ( 5906 PWs) bands (ev): -17.4798 -17.4798 -17.4226 -17.4226 -16.1928 -16.1928 -16.1171 -16.1171 -14.5319 -14.5319 -14.5318 -14.5318 -13.7322 -13.7322 -13.7158 -13.7158 -7.4739 -7.4739 -7.3217 -7.3217 -4.4993 -4.4993 -4.4303 -4.4303 -3.8277 -3.8277 -3.8206 -3.8206 -2.2682 -2.2682 -2.2524 -2.2524 -1.3175 -1.3175 -1.3014 -1.3014 -0.7434 -0.7434 -0.5970 -0.5970 -0.1295 -0.1295 -0.1132 -0.1132 -0.0570 -0.0570 -0.0398 -0.0398 1.5268 1.5268 1.5278 1.5278 1.7856 1.7856 1.7946 1.7946 3.3747 3.3747 3.3772 3.3772 4.6836 4.6836 4.6837 4.6837 5.6402 5.6402 5.7972 5.7972 9.4300 9.4300 9.6724 9.6724 11.4460 11.4460 11.5731 11.5731 k = 0.0000 0.0000 0.2557 ( 5909 PWs) bands (ev): -17.4661 -17.4661 -17.4375 -17.4375 -16.1733 -16.1733 -16.1353 -16.1353 -14.5319 -14.5319 -14.5319 -14.5319 -13.7282 -13.7282 -13.7200 -13.7200 -7.4368 -7.4368 -7.3605 -7.3605 -4.4812 -4.4812 -4.4467 -4.4467 -3.8257 -3.8257 -3.8222 -3.8222 -2.2641 -2.2641 -2.2562 -2.2562 -1.3150 -1.3150 -1.3070 -1.3070 -0.7074 -0.7074 -0.6338 -0.6338 -0.1167 -0.1167 -0.1060 -0.1060 -0.0619 -0.0619 -0.0506 -0.0506 1.5269 1.5269 1.5275 1.5275 1.7867 1.7867 1.7913 1.7913 3.3749 3.3749 3.3761 3.3761 4.6836 4.6836 4.6836 4.6836 5.6805 5.6805 5.7592 5.7592 9.4883 9.4883 9.6096 9.6096 11.4781 11.4781 11.5418 11.5418 k = 0.0000 0.0000 0.2691 ( 5908 PWs) bands (ev): -17.4520 -17.4520 -17.4520 -17.4520 -16.1541 -16.1541 -16.1541 -16.1541 -14.5319 -14.5319 -14.5319 -14.5319 -13.7241 -13.7241 -13.7241 -13.7241 -7.3990 -7.3990 -7.3990 -7.3990 -4.4637 -4.4637 -4.4637 -4.4637 -3.8239 -3.8239 -3.8239 -3.8239 -2.2601 -2.2601 -2.2601 -2.2601 -1.3116 -1.3116 -1.3116 -1.3116 -0.6707 -0.6707 -0.6707 -0.6707 -0.1076 -0.1076 -0.1076 -0.1076 -0.0592 -0.0592 -0.0592 -0.0592 1.5272 1.5272 1.5272 1.5272 1.7886 1.7886 1.7886 1.7886 3.3754 3.3754 3.3754 3.3754 4.6836 4.6836 4.6836 4.6836 5.7202 5.7202 5.7202 5.7202 9.5482 9.5482 9.5482 9.5482 11.5100 11.5100 11.5100 11.5100 k = 0.0000 0.0000 0.2691 ( 5908 PWs) bands (ev): -17.4520 -17.4520 -17.4520 -17.4520 -16.1541 -16.1541 -16.1541 -16.1541 -14.5319 -14.5319 -14.5319 -14.5319 -13.7241 -13.7241 -13.7241 -13.7241 -7.3990 -7.3990 -7.3990 -7.3990 -4.4637 -4.4637 -4.4637 -4.4637 -3.8239 -3.8239 -3.8239 -3.8239 -2.2601 -2.2601 -2.2601 -2.2601 -1.3116 -1.3116 -1.3116 -1.3116 -0.6707 -0.6707 -0.6707 -0.6707 -0.1076 -0.1076 -0.1076 -0.1076 -0.0592 -0.0592 -0.0592 -0.0592 1.5272 1.5272 1.5272 1.5272 1.7886 1.7886 1.7886 1.7886 3.3754 3.3754 3.3754 3.3754 4.6836 4.6836 4.6836 4.6836 5.7202 5.7202 5.7202 5.7202 9.5482 9.5482 9.5482 9.5482 11.5100 11.5100 11.5100 11.5100 k = 0.0000 0.0139 0.2691 ( 5912 PWs) bands (ev): -17.4555 -17.4555 -17.4474 -17.4474 -16.1612 -16.1612 -16.1472 -16.1472 -14.5329 -14.5329 -14.5317 -14.5317 -13.7270 -13.7270 -13.7230 -13.7230 -7.4082 -7.4082 -7.3864 -7.3864 -4.4643 -4.4643 -4.4638 -4.4638 -3.8310 -3.8310 -3.8148 -3.8148 -2.2610 -2.2610 -2.2599 -2.2599 -1.3195 -1.3195 -1.3024 -1.3024 -0.6760 -0.6760 -0.6667 -0.6667 -0.1295 -0.1295 -0.0878 -0.0878 -0.0656 -0.0656 -0.0506 -0.0506 1.5224 1.5224 1.5306 1.5306 1.7782 1.7782 1.7982 1.7982 3.3730 3.3730 3.3746 3.3746 4.6801 4.6801 4.6827 4.6827 5.7175 5.7175 5.7289 5.7289 9.5439 9.5439 9.5552 9.5552 11.4997 11.4997 11.5198 11.5198 k = 0.0000 0.0277 0.2691 ( 5895 PWs) bands (ev): -17.4578 -17.4578 -17.4418 -17.4418 -16.1684 -16.1684 -16.1403 -16.1403 -14.5347 -14.5347 -14.5324 -14.5324 -13.7317 -13.7317 -13.7238 -13.7238 -7.4143 -7.4143 -7.3706 -7.3706 -4.4656 -4.4656 -4.4647 -4.4647 -3.8358 -3.8358 -3.8040 -3.8040 -2.2625 -2.2625 -2.2603 -2.2603 -1.3261 -1.3261 -1.2920 -1.2920 -0.6824 -0.6824 -0.6641 -0.6641 -0.1524 -0.1524 -0.0789 -0.0789 -0.0613 -0.0613 -0.0405 -0.0405 1.5162 1.5162 1.5325 1.5325 1.7670 1.7670 1.8069 1.8069 3.3675 3.3675 3.3707 3.3707 4.6723 4.6723 4.6775 4.6775 5.7208 5.7208 5.7436 5.7436 9.5422 9.5422 9.5648 9.5648 11.4886 11.4886 11.5290 11.5290 k = 0.0000 0.0416 0.2691 ( 5903 PWs) bands (ev): -17.4591 -17.4591 -17.4349 -17.4349 -16.1758 -16.1758 -16.1336 -16.1336 -14.5373 -14.5373 -14.5340 -14.5340 -13.7381 -13.7381 -13.7264 -13.7264 -7.4174 -7.4174 -7.3515 -7.3515 -4.4684 -4.4684 -4.4655 -4.4655 -3.8377 -3.8377 -3.7920 -3.7920 -2.2647 -2.2647 -2.2613 -2.2613 -1.3315 -1.3315 -1.2805 -1.2805 -0.6899 -0.6899 -0.6629 -0.6629 -0.1759 -0.1759 -0.0826 -0.0826 -0.0451 -0.0451 -0.0287 -0.0287 1.5087 1.5087 1.5328 1.5328 1.7552 1.7552 1.8146 1.8146 3.3587 3.3587 3.3638 3.3638 4.6601 4.6601 4.6680 4.6680 5.7300 5.7300 5.7643 5.7643 9.5431 9.5431 9.5771 9.5771 11.4768 11.4768 11.5376 11.5376 k = 0.0000 0.0554 0.2691 ( 5900 PWs) bands (ev): -17.4593 -17.4593 -17.4270 -17.4270 -16.1835 -16.1835 -16.1269 -16.1269 -14.5405 -14.5405 -14.5367 -14.5367 -13.7460 -13.7460 -13.7308 -13.7308 -7.4174 -7.4174 -7.3291 -7.3291 -4.4734 -4.4734 -4.4658 -4.4658 -3.8365 -3.8365 -3.7790 -3.7790 -2.2675 -2.2675 -2.2629 -2.2629 -1.3355 -1.3355 -1.2677 -1.2677 -0.6982 -0.6982 -0.6632 -0.6632 -0.1998 -0.1998 -0.0873 -0.0873 -0.0291 -0.0291 -0.0151 -0.0151 1.4999 1.4999 1.5315 1.5315 1.7429 1.7429 1.8213 1.8213 3.3467 3.3467 3.3538 3.3538 4.6439 4.6439 4.6545 4.6545 5.7449 5.7449 5.7909 5.7909 9.5467 9.5467 9.5919 9.5919 11.4640 11.4640 11.5453 11.5453 k = 0.0000 0.0693 0.2691 ( 5902 PWs) bands (ev): -17.4585 -17.4585 -17.4178 -17.4178 -16.1915 -16.1915 -16.1203 -16.1203 -14.5444 -14.5444 -14.5405 -14.5405 -13.7555 -13.7555 -13.7370 -13.7370 -7.4146 -7.4146 -7.3034 -7.3034 -4.4807 -4.4807 -4.4654 -4.4654 -3.8319 -3.8319 -3.7652 -3.7652 -2.2709 -2.2709 -2.2651 -2.2651 -1.3382 -1.3382 -1.2539 -1.2539 -0.7073 -0.7073 -0.6650 -0.6650 -0.2238 -0.2238 -0.0914 -0.0914 -0.0144 -0.0144 -0.0003 -0.0003 1.4900 1.4900 1.5284 1.5284 1.7304 1.7304 1.8270 1.8270 3.3312 3.3312 3.3408 3.3408 4.6239 4.6239 4.6372 4.6372 5.7656 5.7656 5.8234 5.8234 9.5529 9.5529 9.6093 9.6093 11.4501 11.4501 11.5520 11.5520 k = 0.0000 0.0832 0.2691 ( 5901 PWs) bands (ev): -17.4566 -17.4566 -17.4076 -17.4076 -16.1998 -16.1998 -16.1136 -16.1136 -14.5489 -14.5489 -14.5455 -14.5455 -13.7662 -13.7662 -13.7448 -13.7448 -7.4091 -7.4091 -7.2746 -7.2746 -4.4908 -4.4908 -4.4639 -4.4639 -3.8237 -3.8237 -3.7510 -3.7510 -2.2750 -2.2750 -2.2679 -2.2679 -1.3396 -1.3396 -1.2389 -1.2389 -0.7169 -0.7169 -0.6684 -0.6684 -0.2477 -0.2477 -0.0950 -0.0950 -0.0002 -0.0002 0.0146 0.0146 1.4789 1.4789 1.5234 1.5234 1.7178 1.7178 1.8317 1.8317 3.3122 3.3122 3.3247 3.3247 4.6004 4.6004 4.6164 4.6164 5.7917 5.7917 5.8615 5.8615 9.5616 9.5616 9.6292 9.6292 11.4346 11.4346 11.5573 11.5573 k = 0.0000 0.0970 0.2691 ( 5903 PWs) bands (ev): -17.4538 -17.4538 -17.3962 -17.3962 -16.2084 -16.2084 -16.1069 -16.1069 -14.5541 -14.5541 -14.5517 -14.5517 -13.7781 -13.7781 -13.7541 -13.7541 -7.4010 -7.4010 -7.2427 -7.2427 -4.5038 -4.5038 -4.4613 -4.4613 -3.8117 -3.8117 -3.7365 -3.7365 -2.2797 -2.2797 -2.2712 -2.2712 -1.3396 -1.3396 -1.2230 -1.2230 -0.7270 -0.7270 -0.6733 -0.6733 -0.2714 -0.2714 -0.0980 -0.0980 0.0140 0.0140 0.0289 0.0289 1.4667 1.4667 1.5163 1.5163 1.7054 1.7054 1.8354 1.8354 3.2896 3.2896 3.3056 3.3056 4.5738 4.5738 4.5926 4.5926 5.8231 5.8231 5.9051 5.9051 9.5728 9.5728 9.6515 9.6515 11.4175 11.4175 11.5607 11.5607 k = 0.0000 0.1109 0.2691 ( 5894 PWs) bands (ev): -17.4501 -17.4501 -17.3837 -17.3837 -16.2174 -16.2174 -16.1001 -16.1001 -14.5600 -14.5600 -14.5591 -14.5591 -13.7910 -13.7910 -13.7649 -13.7649 -7.3907 -7.3907 -7.2078 -7.2078 -4.5198 -4.5198 -4.4573 -4.4573 -3.7959 -3.7959 -3.7218 -3.7218 -2.2850 -2.2850 -2.2750 -2.2750 -1.3381 -1.3381 -1.2061 -1.2061 -0.7374 -0.7374 -0.6796 -0.6796 -0.2946 -0.2946 -0.1006 -0.1006 0.0283 0.0283 0.0423 0.0423 1.4535 1.4535 1.5072 1.5072 1.6934 1.6934 1.8381 1.8381 3.2633 3.2633 3.2833 3.2833 4.5445 4.5445 4.5660 4.5660 5.8596 5.8596 5.9541 5.9541 9.5864 9.5864 9.6762 9.6762 11.3982 11.3982 11.5617 11.5617 k = 0.0000 0.1248 0.2691 ( 5892 PWs) bands (ev): -17.4454 -17.4454 -17.3700 -17.3700 -16.2269 -16.2269 -16.0933 -16.0933 -14.5686 -14.5686 -14.5659 -14.5659 -13.8045 -13.8045 -13.7769 -13.7769 -7.3782 -7.3782 -7.1700 -7.1700 -4.5387 -4.5387 -4.4519 -4.4519 -3.7765 -3.7765 -3.7072 -3.7072 -2.2910 -2.2910 -2.2793 -2.2793 -1.3353 -1.3353 -1.1884 -1.1884 -0.7478 -0.7478 -0.6873 -0.6873 -0.3170 -0.3170 -0.1026 -0.1026 0.0422 0.0422 0.0552 0.0552 1.4393 1.4393 1.4958 1.4958 1.6821 1.6821 1.8400 1.8400 3.2331 3.2331 3.2577 3.2577 4.5131 4.5131 4.5372 4.5372 5.9010 5.9010 6.0082 6.0082 9.6023 9.6023 9.7031 9.7031 11.3766 11.3766 11.5596 11.5596 k = 0.0000 0.1386 0.2691 ( 5892 PWs) bands (ev): -17.4399 -17.4399 -17.3552 -17.3552 -16.2368 -16.2368 -16.0864 -16.0864 -14.5792 -14.5792 -14.5728 -14.5728 -13.8186 -13.8186 -13.7901 -13.7901 -7.3638 -7.3638 -7.1294 -7.1294 -4.5605 -4.5605 -4.4449 -4.4449 -3.7536 -3.7536 -3.6928 -3.6928 -2.2976 -2.2976 -2.2841 -2.2841 -1.3309 -1.3309 -1.1700 -1.1700 -0.7582 -0.7582 -0.6963 -0.6963 -0.3386 -0.3386 -0.1044 -0.1044 0.0549 0.0549 0.0684 0.0684 1.4242 1.4242 1.4823 1.4823 1.6715 1.6715 1.8409 1.8409 3.1990 3.1990 3.2289 3.2289 4.4800 4.4800 4.5066 4.5066 5.9471 5.9471 6.0671 6.0671 9.6205 9.6205 9.7322 9.7322 11.3523 11.3523 11.5536 11.5536 k = 0.0000 0.1525 0.2691 ( 5891 PWs) bands (ev): -17.4336 -17.4336 -17.3393 -17.3393 -16.2472 -16.2472 -16.0794 -16.0794 -14.5914 -14.5914 -14.5801 -14.5801 -13.8330 -13.8330 -13.8042 -13.8042 -7.3477 -7.3477 -7.0863 -7.0863 -4.5850 -4.5850 -4.4363 -4.4363 -3.7274 -3.7274 -3.6785 -3.6785 -2.3049 -2.3049 -2.2892 -2.2892 -1.3251 -1.3251 -1.1512 -1.1512 -0.7685 -0.7685 -0.7062 -0.7062 -0.3592 -0.3592 -0.1058 -0.1058 0.0652 0.0652 0.0828 0.0828 1.4082 1.4082 1.4666 1.4666 1.6619 1.6619 1.8411 1.8411 3.1607 3.1607 3.1968 3.1968 4.4458 4.4458 4.4749 4.4749 5.9976 5.9976 6.1308 6.1308 9.6409 9.6409 9.7633 9.7633 11.3250 11.3250 11.5426 11.5426 k = 0.0000 0.1663 0.2691 ( 5897 PWs) bands (ev): -17.4265 -17.4265 -17.3224 -17.3224 -16.2581 -16.2581 -16.0722 -16.0722 -14.6053 -14.6053 -14.5879 -14.5879 -13.8475 -13.8475 -13.8191 -13.8191 -7.3302 -7.3302 -7.0407 -7.0407 -4.6122 -4.6122 -4.4260 -4.4260 -3.6983 -3.6983 -3.6647 -3.6647 -2.3128 -2.3128 -2.2947 -2.2947 -1.3177 -1.3177 -1.1322 -1.1322 -0.7784 -0.7784 -0.7167 -0.7167 -0.3786 -0.3786 -0.1070 -0.1070 0.0729 0.0729 0.0984 0.0984 1.3916 1.3916 1.4488 1.4488 1.6532 1.6532 1.8404 1.8404 3.1182 3.1182 3.1613 3.1613 4.4109 4.4109 4.4424 4.4424 6.0522 6.0522 6.1988 6.1988 9.6633 9.6633 9.7962 9.7962 11.2946 11.2946 11.5257 11.5257 k = 0.0000 0.1802 0.2691 ( 5905 PWs) bands (ev): -17.4187 -17.4187 -17.3044 -17.3044 -16.2696 -16.2696 -16.0649 -16.0649 -14.6209 -14.6209 -14.5963 -14.5963 -13.8618 -13.8618 -13.8345 -13.8345 -7.3114 -7.3114 -6.9929 -6.9929 -4.6418 -4.6418 -4.4141 -4.4141 -3.6665 -3.6665 -3.6512 -3.6512 -2.3214 -2.3214 -2.3004 -2.3004 -1.3088 -1.3088 -1.1134 -1.1134 -0.7878 -0.7878 -0.7274 -0.7274 -0.3967 -0.3967 -0.1081 -0.1081 0.0784 0.0784 0.1149 0.1149 1.3742 1.3742 1.4291 1.4291 1.6456 1.6456 1.8391 1.8391 3.0715 3.0715 3.1224 3.1224 4.3761 4.3761 4.4096 4.4096 6.1106 6.1106 6.2711 6.2711 9.6876 9.6876 9.8310 9.8310 11.2607 11.2607 11.5019 11.5019 k = 0.0000 0.1941 0.2691 ( 5906 PWs) bands (ev): -17.4102 -17.4102 -17.2853 -17.2853 -16.2818 -16.2818 -16.0574 -16.0574 -14.6381 -14.6381 -14.6050 -14.6050 -13.8759 -13.8759 -13.8504 -13.8504 -7.2916 -7.2916 -6.9430 -6.9430 -4.6736 -4.6736 -4.4005 -4.4005 -3.6390 -3.6390 -3.6316 -3.6316 -2.3306 -2.3306 -2.3064 -2.3064 -1.2983 -1.2983 -1.0955 -1.0955 -0.7966 -0.7966 -0.7376 -0.7376 -0.4134 -0.4134 -0.1091 -0.1091 0.0821 0.0821 0.1320 0.1320 1.3563 1.3563 1.4077 1.4077 1.6389 1.6389 1.8371 1.8371 3.0206 3.0206 3.0802 3.0802 4.3416 4.3416 4.3772 4.3772 6.1726 6.1726 6.3472 6.3472 9.7137 9.7137 9.8672 9.8672 11.2235 11.2235 11.4706 11.4706 k = 0.0000 0.2079 0.2691 ( 5908 PWs) bands (ev): -17.4011 -17.4011 -17.2653 -17.2653 -16.2945 -16.2945 -16.0498 -16.0498 -14.6570 -14.6570 -14.6142 -14.6142 -13.8895 -13.8895 -13.8666 -13.8666 -7.2710 -7.2710 -6.8912 -6.8912 -4.7075 -4.7075 -4.3854 -4.3854 -3.6264 -3.6264 -3.5954 -3.5954 -2.3405 -2.3405 -2.3125 -2.3125 -1.2861 -1.2861 -1.0791 -1.0791 -0.8048 -0.8048 -0.7463 -0.7463 -0.4288 -0.4288 -0.1102 -0.1102 0.0841 0.0841 0.1493 0.1493 1.3380 1.3380 1.3847 1.3847 1.6333 1.6333 1.8344 1.8344 2.9655 2.9655 3.0346 3.0346 4.3080 4.3080 4.3454 4.3454 6.2378 6.2378 6.4271 6.4271 9.7414 9.7414 9.9048 9.9048 11.1830 11.1830 11.4312 11.4312 k = 0.0000 0.2218 0.2691 ( 5917 PWs) bands (ev): -17.3915 -17.3915 -17.2443 -17.2443 -16.3080 -16.3080 -16.0420 -16.0420 -14.6775 -14.6775 -14.6238 -14.6238 -13.9025 -13.9025 -13.8828 -13.8828 -7.2498 -7.2498 -6.8377 -6.8377 -4.7433 -4.7433 -4.3687 -4.3687 -3.6148 -3.6148 -3.5571 -3.5571 -2.3511 -2.3511 -2.3187 -2.3187 -1.2722 -1.2722 -1.0652 -1.0652 -0.8121 -0.8121 -0.7525 -0.7525 -0.4428 -0.4428 -0.1114 -0.1114 0.0844 0.0844 0.1669 0.1669 1.3193 1.3193 1.3604 1.3604 1.6286 1.6286 1.8312 1.8312 2.9062 2.9062 2.9859 2.9859 4.2755 4.2755 4.3146 4.3146 6.3060 6.3060 6.5103 6.5103 9.7705 9.7705 9.9434 9.9434 11.1393 11.1393 11.3838 11.3838 k = 0.0000 0.2357 0.2691 ( 5913 PWs) bands (ev): -17.3815 -17.3815 -17.2223 -17.2223 -16.3222 -16.3222 -16.0341 -16.0341 -14.6995 -14.6995 -14.6338 -14.6338 -13.9148 -13.9148 -13.8989 -13.8989 -7.2282 -7.2282 -6.7827 -6.7827 -4.7809 -4.7809 -4.3507 -4.3507 -3.6040 -3.6040 -3.5172 -3.5172 -2.3624 -2.3624 -2.3250 -2.3250 -1.2567 -1.2567 -1.0549 -1.0549 -0.8185 -0.8185 -0.7550 -0.7550 -0.4554 -0.4554 -0.1129 -0.1129 0.0832 0.0832 0.1846 0.1846 1.3004 1.3004 1.3349 1.3349 1.6251 1.6251 1.8274 1.8274 2.8432 2.8432 2.9342 2.9342 4.2445 4.2445 4.2852 4.2852 6.3767 6.3767 6.5967 6.5967 9.8009 9.8009 9.9828 9.9828 11.0927 11.0927 11.3289 11.3289 k = 0.0000 0.2495 0.2691 ( 5915 PWs) bands (ev): -17.3710 -17.3710 -17.1995 -17.1995 -16.3370 -16.3370 -16.0260 -16.0260 -14.7229 -14.7229 -14.6440 -14.6440 -13.9263 -13.9263 -13.9148 -13.9148 -7.2064 -7.2064 -6.7263 -6.7263 -4.8201 -4.8201 -4.3315 -4.3315 -3.5939 -3.5939 -3.4759 -3.4759 -2.3745 -2.3745 -2.3313 -2.3313 -1.2394 -1.2394 -1.0491 -1.0491 -0.8240 -0.8240 -0.7527 -0.7527 -0.4666 -0.4666 -0.1147 -0.1147 0.0806 0.0806 0.2025 0.2025 1.2813 1.2813 1.3084 1.3084 1.6225 1.6225 1.8232 1.8232 2.7766 2.7766 2.8799 2.8799 4.2152 4.2152 4.2573 4.2573 6.4497 6.4497 6.6860 6.6860 9.8322 9.8322 10.0224 10.0224 11.0439 11.0439 11.2670 11.2670 k = 0.0000 0.2634 0.2691 ( 5913 PWs) bands (ev): -17.3603 -17.3603 -17.1758 -17.1758 -16.3526 -16.3526 -16.0178 -16.0178 -14.7475 -14.7475 -14.6546 -14.6546 -13.9370 -13.9370 -13.9303 -13.9303 -7.1846 -7.1846 -6.6689 -6.6689 -4.8608 -4.8608 -4.3112 -4.3112 -3.5846 -3.5846 -3.4336 -3.4336 -2.3873 -2.3873 -2.3375 -2.3375 -1.2204 -1.2204 -1.0484 -1.0484 -0.8284 -0.8284 -0.7450 -0.7450 -0.4765 -0.4765 -0.1171 -0.1171 0.0767 0.0767 0.2206 0.2206 1.2624 1.2624 1.2810 1.2810 1.6212 1.6212 1.8184 1.8184 2.7068 2.7068 2.8232 2.8232 4.1878 4.1878 4.2311 4.2311 6.5244 6.5244 6.7778 6.7778 9.8643 9.8643 10.0616 10.0616 10.9936 10.9936 11.1991 11.1991 k = 0.0000 0.2772 0.2691 ( 5909 PWs) bands (ev): -17.3493 -17.3493 -17.1514 -17.1514 -16.3690 -16.3690 -16.0095 -16.0095 -14.7731 -14.7731 -14.6653 -14.6653 -13.9470 -13.9470 -13.9451 -13.9451 -7.1630 -7.1630 -6.6105 -6.6105 -4.9029 -4.9029 -4.2901 -4.2901 -3.5761 -3.5761 -3.3905 -3.3905 -2.4008 -2.4008 -2.3435 -2.3435 -1.1995 -1.1995 -1.0526 -1.0526 -0.8318 -0.8318 -0.7320 -0.7320 -0.4850 -0.4850 -0.1202 -0.1202 0.0718 0.0718 0.2388 0.2388 1.2435 1.2435 1.2529 1.2529 1.6210 1.6210 1.8131 1.8131 2.6344 2.6344 2.7646 2.7646 4.1623 4.1623 4.2068 4.2068 6.6006 6.6006 6.8720 6.8720 9.8968 9.8968 10.0997 10.0997 10.9427 10.9427 11.1262 11.1262 k = 0.0000 0.2911 0.2691 ( 5910 PWs) bands (ev): -17.3381 -17.3381 -17.1262 -17.1262 -16.3861 -16.3861 -16.0011 -16.0011 -14.7994 -14.7994 -14.6761 -14.6761 -13.9597 -13.9597 -13.9558 -13.9558 -7.1416 -7.1416 -6.5515 -6.5515 -4.9462 -4.9462 -4.2684 -4.2684 -3.5684 -3.5684 -3.3469 -3.3469 -2.4152 -2.4152 -2.3494 -2.3494 -1.1769 -1.1769 -1.0611 -1.0611 -0.8340 -0.8340 -0.7145 -0.7145 -0.4922 -0.4922 -0.1243 -0.1243 0.0660 0.0660 0.2572 0.2572 1.2238 1.2238 1.2253 1.2253 1.6222 1.6222 1.8073 1.8073 2.5598 2.5598 2.7044 2.7044 4.1387 4.1387 4.1843 4.1843 6.6778 6.6778 6.9682 6.9682 9.9292 9.9292 10.1355 10.1355 10.8929 10.8929 11.0494 11.0494 k = 0.0000 0.3050 0.2691 ( 5910 PWs) bands (ev): -17.3269 -17.3269 -17.1004 -17.1004 -16.4040 -16.4040 -15.9927 -15.9927 -14.8262 -14.8262 -14.6869 -14.6869 -13.9733 -13.9733 -13.9640 -13.9640 -7.1206 -7.1206 -6.4919 -6.4919 -4.9906 -4.9906 -4.2465 -4.2465 -3.5614 -3.5614 -3.3029 -3.3029 -2.4305 -2.4305 -2.3551 -2.3551 -1.1525 -1.1525 -1.0729 -1.0729 -0.8351 -0.8351 -0.6936 -0.6936 -0.4977 -0.4977 -0.1297 -0.1297 0.0596 0.0596 0.2758 0.2758 1.1948 1.1948 1.2070 1.2070 1.6247 1.6247 1.8010 1.8010 2.4837 2.4837 2.6433 2.6433 4.1171 4.1171 4.1637 4.1637 6.7554 6.7554 7.0660 7.0660 9.9611 9.9611 10.1675 10.1675 10.8459 10.8459 10.9697 10.9697 k = 0.0000 0.3188 0.2691 ( 5907 PWs) bands (ev): -17.3157 -17.3157 -17.0741 -17.0741 -16.4225 -16.4225 -15.9843 -15.9843 -14.8532 -14.8532 -14.6978 -14.6978 -13.9861 -13.9861 -13.9715 -13.9715 -7.1001 -7.1001 -6.4321 -6.4321 -5.0359 -5.0359 -4.2245 -4.2245 -3.5550 -3.5550 -3.2589 -3.2589 -2.4465 -2.4465 -2.3605 -2.3605 -1.1263 -1.1263 -1.0871 -1.0871 -0.8351 -0.8351 -0.6707 -0.6707 -0.5015 -0.5015 -0.1365 -0.1365 0.0529 0.0529 0.2947 0.2947 1.1653 1.1653 1.1895 1.1895 1.6287 1.6287 1.7939 1.7939 2.4069 2.4069 2.5817 2.5817 4.0974 4.0974 4.1449 4.1449 6.8329 6.8329 7.1652 7.1652 9.9917 9.9917 10.1933 10.1933 10.8044 10.8044 10.8884 10.8884 k = 0.0000 0.3327 0.2691 ( 5910 PWs) bands (ev): -17.3046 -17.3046 -17.0472 -17.0472 -16.4418 -16.4418 -15.9761 -15.9761 -14.8802 -14.8802 -14.7084 -14.7084 -13.9980 -13.9980 -13.9782 -13.9782 -7.0803 -7.0803 -6.3723 -6.3723 -5.0820 -5.0820 -4.2030 -4.2030 -3.5492 -3.5492 -3.2150 -3.2150 -2.4635 -2.4635 -2.3657 -2.3657 -1.1034 -1.1034 -1.0979 -1.0979 -0.8340 -0.8340 -0.6471 -0.6471 -0.5028 -0.5028 -0.1452 -0.1452 0.0463 0.0463 0.3140 0.3140 1.1356 1.1356 1.1727 1.1727 1.6342 1.6342 1.7859 1.7859 2.3302 2.3302 2.5201 2.5201 4.0796 4.0796 4.1279 4.1279 6.9097 6.9097 7.2654 7.2654 10.0200 10.0200 10.2102 10.2102 10.7715 10.7715 10.8072 10.8072 k = 0.0000 0.3466 0.2691 ( 5906 PWs) bands (ev): -17.2937 -17.2937 -17.0201 -17.0201 -16.4616 -16.4616 -15.9681 -15.9681 -14.9067 -14.9067 -14.7189 -14.7189 -14.0090 -14.0090 -13.9842 -13.9842 -7.0612 -7.0612 -6.3128 -6.3128 -5.1286 -5.1286 -4.1822 -4.1822 -3.5438 -3.5438 -3.1715 -3.1715 -2.4815 -2.4815 -2.3706 -2.3706 -1.1197 -1.1197 -1.0688 -1.0688 -0.8318 -0.8318 -0.6248 -0.6248 -0.5010 -0.5010 -0.1560 -0.1560 0.0399 0.0399 0.3338 0.3338 1.1061 1.1061 1.1566 1.1566 1.6415 1.6415 1.7767 1.7767 2.2547 2.2547 2.4590 2.4590 4.0636 4.0636 4.1127 4.1127 6.9852 6.9852 7.3660 7.3660 10.0446 10.0446 10.2156 10.2156 10.7270 10.7270 10.7512 10.7512 k = 0.0000 0.3604 0.2691 ( 5904 PWs) bands (ev): -17.2831 -17.2831 -16.9927 -16.9927 -16.4819 -16.4819 -15.9605 -15.9605 -14.9325 -14.9325 -14.7290 -14.7290 -14.0191 -14.0191 -13.9895 -13.9895 -7.0429 -7.0429 -6.2539 -6.2539 -5.1755 -5.1755 -4.1626 -4.1626 -3.5386 -3.5386 -3.1286 -3.1286 -2.5004 -2.5004 -2.3752 -2.3752 -1.1366 -1.1366 -1.0378 -1.0378 -0.8285 -0.8285 -0.6056 -0.6056 -0.4949 -0.4949 -0.1691 -0.1691 0.0342 0.0342 0.3542 0.3542 1.0769 1.0769 1.1415 1.1415 1.6505 1.6505 1.7658 1.7658 2.1817 2.1817 2.3989 2.3989 4.0492 4.0492 4.0990 4.0990 7.0586 7.0586 7.4666 7.4666 10.0633 10.0633 10.2079 10.2079 10.6521 10.6521 10.7440 10.7440 k = 0.0000 0.3743 0.2691 ( 5903 PWs) bands (ev): -17.2728 -17.2728 -16.9654 -16.9654 -16.5026 -16.5026 -15.9533 -15.9533 -14.9572 -14.9572 -14.7387 -14.7387 -14.0281 -14.0281 -13.9942 -13.9942 -7.0255 -7.0255 -6.1960 -6.1960 -5.2223 -5.2223 -4.1447 -4.1447 -3.5334 -3.5334 -3.0865 -3.0865 -2.5202 -2.5202 -2.3795 -2.3795 -1.1535 -1.1535 -1.0055 -1.0055 -0.8242 -0.8242 -0.5912 -0.5912 -0.4836 -0.4836 -0.1848 -0.1848 0.0291 0.0291 0.3752 0.3752 1.0484 1.0484 1.1275 1.1275 1.6615 1.6615 1.7522 1.7522 2.1128 2.1128 2.3401 2.3401 4.0365 4.0365 4.0869 4.0869 7.1291 7.1291 7.5667 7.5667 10.0729 10.0729 10.1880 10.1880 10.5851 10.5851 10.7506 10.7506 k = 0.0000 0.3881 0.2691 ( 5900 PWs) bands (ev): -17.2630 -17.2630 -16.9383 -16.9383 -16.5234 -16.5234 -15.9468 -15.9468 -14.9804 -14.9804 -14.7479 -14.7479 -14.0361 -14.0361 -13.9984 -13.9984 -7.0089 -7.0089 -6.1397 -6.1397 -5.2686 -5.2686 -4.1288 -4.1288 -3.5281 -3.5281 -3.0453 -3.0453 -2.5412 -2.5412 -2.3835 -2.3835 -1.1701 -1.1701 -0.9724 -0.9724 -0.8187 -0.8187 -0.5819 -0.5819 -0.4676 -0.4676 -0.2030 -0.2030 0.0248 0.0248 0.3969 0.3969 1.0210 1.0210 1.1145 1.1145 1.6744 1.6744 1.7350 1.7350 2.0501 2.0501 2.2832 2.2832 4.0254 4.0254 4.0762 4.0762 7.1958 7.1958 7.6654 7.6654 10.0692 10.0692 10.1586 10.1586 10.5308 10.5308 10.7685 10.7685 k = 0.0000 0.4020 0.2691 ( 5897 PWs) bands (ev): -17.2538 -17.2538 -16.9119 -16.9119 -16.5440 -16.5440 -15.9410 -15.9410 -15.0019 -15.0019 -14.7564 -14.7564 -14.0431 -14.0431 -14.0021 -14.0021 -6.9933 -6.9933 -6.0858 -6.0858 -5.3136 -5.3136 -4.1154 -4.1154 -3.5223 -3.5223 -3.0051 -3.0051 -2.5632 -2.5632 -2.3873 -2.3873 -1.1859 -1.1859 -0.9390 -0.9390 -0.8117 -0.8117 -0.5764 -0.5764 -0.4487 -0.4487 -0.2238 -0.2238 0.0213 0.0213 0.4192 0.4192 0.9950 0.9950 1.1027 1.1027 1.6895 1.6895 1.7126 1.7126 1.9958 1.9958 2.2284 2.2284 4.0157 4.0157 4.0669 4.0669 7.2576 7.2576 7.7620 7.7620 10.0488 10.0488 10.1237 10.1237 10.4935 10.4935 10.7941 10.7941 k = 0.0000 0.4159 0.2691 ( 5901 PWs) bands (ev): -17.2451 -17.2451 -16.8866 -16.8866 -16.5639 -16.5639 -15.9362 -15.9362 -15.0212 -15.0212 -14.7642 -14.7642 -14.0491 -14.0491 -14.0054 -14.0054 -6.9787 -6.9787 -6.0353 -6.0353 -5.3563 -5.3563 -4.1049 -4.1049 -3.5160 -3.5160 -2.9662 -2.9662 -2.5863 -2.5863 -2.3907 -2.3907 -1.2010 -1.2010 -0.9065 -0.9065 -0.8024 -0.8024 -0.5734 -0.5734 -0.4289 -0.4289 -0.2470 -0.2470 0.0186 0.0186 0.4418 0.4418 0.9708 0.9708 1.0922 1.0922 1.6842 1.6842 1.7067 1.7067 1.9520 1.9520 2.1761 2.1761 4.0074 4.0074 4.0589 4.0589 7.3136 7.3136 7.8552 7.8552 10.0116 10.0116 10.0868 10.0868 10.4740 10.4740 10.8242 10.8242 k = 0.0000 0.4297 0.2691 ( 5901 PWs) bands (ev): -17.2371 -17.2371 -16.8634 -16.8634 -16.5824 -16.5824 -15.9326 -15.9326 -15.0380 -15.0380 -14.7713 -14.7713 -14.0540 -14.0540 -14.0082 -14.0082 -6.9652 -6.9652 -5.9899 -5.9899 -5.3951 -5.3951 -4.0976 -4.0976 -3.5090 -3.5090 -2.9286 -2.9286 -2.6104 -2.6104 -2.3939 -2.3939 -1.2150 -1.2150 -0.8771 -0.8771 -0.7892 -0.7892 -0.5718 -0.5718 -0.4100 -0.4100 -0.2724 -0.2724 0.0165 0.0165 0.4645 0.4645 0.9490 0.9490 1.0831 1.0831 1.6504 1.6504 1.7262 1.7262 1.9192 1.9192 2.1264 2.1264 4.0005 4.0005 4.0521 4.0521 7.3625 7.3625 7.9439 7.9439 9.9619 9.9619 10.0511 10.0511 10.4691 10.4691 10.8556 10.8556 k = 0.0000 0.4436 0.2691 ( 5904 PWs) bands (ev): -17.2299 -17.2299 -16.8434 -16.8434 -16.5981 -16.5981 -15.9303 -15.9303 -15.0520 -15.0520 -14.7775 -14.7775 -14.0580 -14.0580 -14.0106 -14.0106 -6.9526 -6.9526 -5.9520 -5.9520 -5.4275 -5.4275 -4.0937 -4.0937 -3.5011 -3.5011 -2.8925 -2.8925 -2.6357 -2.6357 -2.3969 -2.3969 -1.2278 -1.2278 -0.8538 -0.8538 -0.7695 -0.7695 -0.5710 -0.5710 -0.3931 -0.3931 -0.2998 -0.2998 0.0150 0.0150 0.4866 0.4866 0.9298 0.9298 1.0754 1.0754 1.6137 1.6137 1.7481 1.7481 1.8964 1.8964 2.0796 2.0796 3.9948 3.9948 4.0464 4.0464 7.4034 7.4034 8.0262 8.0262 9.9063 9.9063 10.0189 10.0189 10.4739 10.4739 10.8856 10.8856 k = 0.0000 0.4574 0.2691 ( 5905 PWs) bands (ev): -17.2235 -17.2235 -16.8285 -16.8285 -16.6093 -16.6093 -15.9294 -15.9294 -15.0629 -15.0629 -14.7827 -14.7827 -14.0609 -14.0609 -14.0127 -14.0127 -6.9412 -6.9412 -5.9250 -5.9250 -5.4503 -5.4503 -4.0934 -4.0934 -3.4925 -3.4925 -2.8582 -2.8582 -2.6618 -2.6618 -2.3995 -2.3995 -1.2393 -1.2393 -0.8382 -0.8382 -0.7421 -0.7421 -0.5707 -0.5707 -0.3788 -0.3788 -0.3289 -0.3289 0.0139 0.0139 0.5071 0.5071 0.9139 0.9139 1.0693 1.0693 1.5775 1.5775 1.7724 1.7724 1.8814 1.8814 2.0359 2.0359 3.9905 3.9905 4.0419 4.0419 7.4350 7.4350 8.1000 8.1000 9.8508 9.8508 9.9922 9.9922 10.4840 10.4840 10.9116 10.9116 k = 0.0000 0.4713 0.2691 ( 5911 PWs) bands (ev): -17.2180 -17.2180 -16.8208 -16.8208 -16.6139 -16.6139 -15.9301 -15.9301 -15.0706 -15.0706 -14.7870 -14.7870 -14.0628 -14.0628 -14.0144 -14.0144 -6.9309 -6.9309 -5.9124 -5.9124 -5.4600 -5.4600 -4.0967 -4.0967 -3.4832 -3.4832 -2.8260 -2.8260 -2.6884 -2.6884 -2.4019 -2.4019 -1.2494 -1.2494 -0.8291 -0.8291 -0.7091 -0.7091 -0.5708 -0.5708 -0.3683 -0.3683 -0.3588 -0.3588 0.0131 0.0131 0.5251 0.5251 0.9015 0.9015 1.0648 1.0648 1.5453 1.5453 1.7987 1.7987 1.8723 1.8723 1.9956 1.9956 3.9873 3.9873 4.0385 4.0385 7.4566 7.4566 8.1626 8.1626 9.8009 9.8009 9.9724 9.9724 10.4964 10.4964 10.9309 10.9309 k = 0.0000 0.4852 0.2691 ( 5910 PWs) bands (ev): -17.2134 -17.2134 -16.8216 -16.8216 -16.6105 -16.6105 -15.9325 -15.9325 -15.0748 -15.0748 -14.7902 -14.7902 -14.0637 -14.0637 -14.0158 -14.0158 -6.9217 -6.9217 -5.9163 -5.9163 -5.4544 -5.4544 -4.1034 -4.1034 -3.4734 -3.4734 -2.7978 -2.7978 -2.7138 -2.7138 -2.4041 -2.4041 -1.2580 -1.2580 -0.8244 -0.8244 -0.6730 -0.6730 -0.5712 -0.5712 -0.3906 -0.3906 -0.3599 -0.3599 0.0124 0.0124 0.5391 0.5391 0.8930 0.8930 1.0622 1.0622 1.5200 1.5200 1.8265 1.8265 1.8678 1.8678 1.9595 1.9595 3.9853 3.9853 4.0361 4.0361 7.4674 7.4674 8.2113 8.2113 9.7612 9.7612 9.9606 9.9606 10.5092 10.5092 10.9411 10.9411 k = 0.0000 0.4852 0.2691 ( 5910 PWs) bands (ev): -17.2134 -17.2134 -16.8216 -16.8216 -16.6105 -16.6105 -15.9325 -15.9325 -15.0748 -15.0748 -14.7902 -14.7902 -14.0637 -14.0637 -14.0158 -14.0158 -6.9217 -6.9217 -5.9163 -5.9163 -5.4544 -5.4544 -4.1034 -4.1034 -3.4734 -3.4734 -2.7978 -2.7978 -2.7138 -2.7138 -2.4041 -2.4041 -1.2580 -1.2580 -0.8244 -0.8244 -0.6730 -0.6730 -0.5712 -0.5712 -0.3906 -0.3906 -0.3599 -0.3599 0.0124 0.0124 0.5391 0.5391 0.8930 0.8930 1.0622 1.0622 1.5200 1.5200 1.8265 1.8265 1.8678 1.8678 1.9595 1.9595 3.9853 3.9853 4.0361 4.0361 7.4674 7.4674 8.2113 8.2113 9.7612 9.7612 9.9606 9.9606 10.5092 10.5092 10.9411 10.9411 k = 0.0000 0.4863 0.2558 ( 5910 PWs) bands (ev): -17.2119 -17.2119 -16.8306 -16.8306 -16.5994 -16.5994 -15.9372 -15.9372 -15.0716 -15.0716 -14.7925 -14.7925 -14.0635 -14.0635 -14.0160 -14.0160 -6.9171 -6.9171 -5.9367 -5.9367 -5.4328 -5.4328 -4.1192 -4.1192 -3.4600 -3.4600 -2.7968 -2.7968 -2.7153 -2.7153 -2.4066 -2.4066 -1.2529 -1.2529 -0.8220 -0.8220 -0.6977 -0.6977 -0.5699 -0.5699 -0.3643 -0.3643 -0.3602 -0.3602 0.0067 0.0067 0.5318 0.5318 0.8966 0.8966 1.0614 1.0614 1.5253 1.5253 1.8226 1.8226 1.8663 1.8663 1.9571 1.9571 3.9859 3.9859 4.0358 4.0358 7.4796 7.4796 8.1978 8.1978 9.7761 9.7761 9.9648 9.9648 10.5115 10.5115 10.9396 10.9396 k = 0.0000 0.4874 0.2424 ( 5902 PWs) bands (ev): -17.2097 -17.2097 -16.8430 -16.8430 -16.5841 -16.5841 -15.9440 -15.9440 -15.0671 -15.0671 -14.7956 -14.7956 -14.0631 -14.0631 -14.0164 -14.0164 -6.9103 -6.9103 -5.9648 -5.9648 -5.4031 -5.4031 -4.1401 -4.1401 -3.4424 -3.4424 -2.7982 -2.7982 -2.7150 -2.7150 -2.4100 -2.4100 -1.2471 -1.2471 -0.8203 -0.8203 -0.7201 -0.7201 -0.5687 -0.5687 -0.3627 -0.3627 -0.3354 -0.3354 -0.0002 -0.0002 0.5227 0.5227 0.9012 0.9012 1.0605 1.0605 1.5313 1.5313 1.8180 1.8180 1.8648 1.8648 1.9541 1.9541 3.9867 3.9867 4.0355 4.0355 7.4933 7.4933 8.1824 8.1824 9.7937 9.7937 9.9709 9.9709 10.5158 10.5158 10.9361 10.9361 k = 0.0000 0.4885 0.2290 ( 5899 PWs) bands (ev): -17.2068 -17.2068 -16.8579 -16.8579 -16.5657 -16.5657 -15.9528 -15.9528 -15.0615 -15.0615 -14.7994 -14.7994 -14.0624 -14.0624 -14.0170 -14.0170 -6.9012 -6.9012 -5.9984 -5.9984 -5.3676 -5.3676 -4.1655 -4.1655 -3.4216 -3.4216 -2.8024 -2.8024 -2.7125 -2.7125 -2.4143 -2.4143 -1.2407 -1.2407 -0.8208 -0.8208 -0.7389 -0.7389 -0.5678 -0.5678 -0.3637 -0.3637 -0.3078 -0.3078 -0.0080 -0.0080 0.5119 0.5119 0.9065 0.9065 1.0595 1.0595 1.5380 1.5380 1.8128 1.8128 1.8634 1.8634 1.9506 1.9506 3.9876 3.9876 4.0350 4.0350 7.5084 7.5084 8.1653 8.1653 9.8138 9.8138 9.9786 9.9786 10.5220 10.5220 10.9311 10.9311 k = 0.0000 0.4896 0.2156 ( 5908 PWs) bands (ev): -17.2030 -17.2030 -16.8743 -16.8743 -16.5450 -16.5450 -15.9634 -15.9634 -15.0548 -15.0548 -14.8039 -14.8039 -14.0616 -14.0616 -14.0177 -14.0177 -6.8900 -6.8900 -6.0358 -6.0358 -5.3281 -5.3281 -4.1946 -4.1946 -3.3982 -3.3982 -2.8093 -2.8093 -2.7079 -2.7079 -2.4195 -2.4195 -1.2334 -1.2334 -0.8258 -0.8258 -0.7519 -0.7519 -0.5674 -0.5674 -0.3642 -0.3642 -0.2805 -0.2805 -0.0161 -0.0161 0.4993 0.4993 0.9125 0.9125 1.0583 1.0583 1.5453 1.5453 1.8069 1.8069 1.8622 1.8622 1.9467 1.9467 3.9888 3.9888 4.0344 4.0344 7.5248 7.5248 8.1466 8.1466 9.8360 9.8360 9.9878 9.9878 10.5303 10.5303 10.9245 10.9245 k = 0.0000 0.4907 0.2023 ( 5910 PWs) bands (ev): -17.1985 -17.1985 -16.8915 -16.8915 -16.5228 -16.5228 -15.9759 -15.9759 -15.0471 -15.0471 -14.8092 -14.8092 -14.0605 -14.0605 -14.0185 -14.0185 -6.8766 -6.8766 -6.0756 -6.0756 -5.2858 -5.2858 -4.2267 -4.2267 -3.3729 -3.3729 -2.8185 -2.8185 -2.7014 -2.7014 -2.4257 -2.4257 -1.2255 -1.2255 -0.8369 -0.8369 -0.7574 -0.7574 -0.5677 -0.5677 -0.3640 -0.3640 -0.2541 -0.2541 -0.0239 -0.0239 0.4851 0.4851 0.9191 0.9191 1.0569 1.0569 1.5533 1.5533 1.8004 1.8004 1.8611 1.8611 1.9424 1.9424 3.9902 3.9902 4.0336 4.0336 7.5425 7.5425 8.1265 8.1265 9.8599 9.8599 9.9983 9.9983 10.5406 10.5406 10.9168 10.9168 k = 0.0000 0.4918 0.1889 ( 5915 PWs) bands (ev): -17.1933 -17.1933 -16.9092 -16.9092 -16.4994 -16.4994 -15.9899 -15.9899 -15.0385 -15.0385 -14.8151 -14.8151 -14.0593 -14.0593 -14.0196 -14.0196 -6.8611 -6.8611 -6.1170 -6.1170 -5.2417 -5.2417 -4.2613 -4.2613 -3.3463 -3.3463 -2.8299 -2.8299 -2.6933 -2.6933 -2.4327 -2.4327 -1.2167 -1.2167 -0.8530 -0.8530 -0.7567 -0.7567 -0.5688 -0.5688 -0.3628 -0.3628 -0.2296 -0.2296 -0.0302 -0.0302 0.4691 0.4691 0.9262 0.9262 1.0552 1.0552 1.5618 1.5618 1.7933 1.7933 1.8604 1.8604 1.9377 1.9377 3.9917 3.9917 4.0327 4.0327 7.5614 7.5614 8.1051 8.1051 9.8851 9.8851 10.0100 10.0100 10.5530 10.5530 10.9083 10.9083 k = 0.0000 0.4929 0.1755 ( 5919 PWs) bands (ev): -17.1873 -17.1873 -16.9270 -16.9270 -16.4752 -16.4752 -16.0055 -16.0055 -15.0292 -15.0292 -14.8217 -14.8217 -14.0579 -14.0579 -14.0207 -14.0207 -6.8435 -6.8435 -6.1593 -6.1593 -5.1963 -5.1963 -4.2980 -4.2980 -3.3187 -3.3187 -2.8431 -2.8431 -2.6840 -2.6840 -2.4406 -2.4406 -1.2072 -1.2072 -0.8719 -0.8719 -0.7520 -0.7520 -0.5711 -0.5711 -0.3605 -0.3605 -0.2085 -0.2085 -0.0334 -0.0334 0.4514 0.4514 0.9336 0.9336 1.0532 1.0532 1.5710 1.5710 1.7856 1.7856 1.8600 1.8600 1.9328 1.9328 3.9934 3.9934 4.0317 4.0317 7.5814 7.5814 8.0826 8.0826 9.9110 9.9110 10.0225 10.0225 10.5675 10.5675 10.8991 10.8991 k = 0.0000 0.4940 0.1621 ( 5922 PWs) bands (ev): -17.1806 -17.1806 -16.9448 -16.9448 -16.4504 -16.4504 -16.0225 -16.0225 -15.0192 -15.0192 -14.8289 -14.8289 -14.0563 -14.0563 -14.0220 -14.0220 -6.8239 -6.8239 -6.2020 -6.2020 -5.1500 -5.1500 -4.3364 -4.3364 -3.2906 -3.2906 -2.8579 -2.8579 -2.6737 -2.6737 -2.4493 -2.4493 -1.1968 -1.1968 -0.8920 -0.8920 -0.7451 -0.7451 -0.5745 -0.5745 -0.3568 -0.3568 -0.1930 -0.1930 -0.0313 -0.0313 0.4321 0.4321 0.9413 0.9413 1.0508 1.0508 1.5807 1.5807 1.7772 1.7772 1.8599 1.8599 1.9276 1.9276 3.9952 3.9952 4.0306 4.0306 7.6025 7.6025 8.0592 8.0592 9.9372 9.9372 10.0354 10.0354 10.5840 10.5840 10.8896 10.8896 k = 0.0000 0.4951 0.1487 ( 5924 PWs) bands (ev): -17.1731 -17.1731 -16.9624 -16.9624 -16.4251 -16.4251 -16.0408 -16.0408 -15.0087 -15.0087 -14.8368 -14.8368 -14.0546 -14.0546 -14.0234 -14.0234 -6.8023 -6.8023 -6.2447 -6.2447 -5.1031 -5.1031 -4.3762 -4.3762 -3.2621 -3.2621 -2.8742 -2.8742 -2.6625 -2.6625 -2.4588 -2.4588 -1.1856 -1.1856 -0.9125 -0.9125 -0.7367 -0.7367 -0.5792 -0.5792 -0.3516 -0.3516 -0.1850 -0.1850 -0.0219 -0.0219 0.4112 0.4112 0.9492 0.9492 1.0480 1.0480 1.5908 1.5908 1.7684 1.7684 1.8603 1.8603 1.9222 1.9222 3.9971 3.9971 4.0293 4.0293 7.6246 7.6246 8.0350 8.0350 9.9631 9.9631 10.0485 10.0485 10.6025 10.6025 10.8800 10.8800 k = 0.0000 0.4962 0.1354 ( 5920 PWs) bands (ev): -17.1649 -17.1649 -16.9798 -16.9798 -16.3995 -16.3995 -16.0603 -16.0603 -14.9977 -14.9977 -14.8452 -14.8452 -14.0528 -14.0528 -14.0250 -14.0250 -6.7787 -6.7787 -6.2873 -6.2873 -5.0559 -5.0559 -4.4172 -4.4172 -3.2336 -3.2336 -2.8917 -2.8917 -2.6506 -2.6506 -2.4691 -2.4691 -1.1736 -1.1736 -0.9330 -0.9330 -0.7274 -0.7274 -0.5851 -0.5851 -0.3450 -0.3450 -0.1845 -0.1845 -0.0051 -0.0051 0.3887 0.3887 0.9571 0.9571 1.0447 1.0447 1.6014 1.6014 1.7590 1.7590 1.8611 1.8611 1.9167 1.9167 3.9992 3.9992 4.0279 4.0279 7.6475 7.6475 8.0100 8.0100 9.9883 9.9883 10.0613 10.0613 10.6229 10.6229 10.8704 10.8704 k = 0.0000 0.4974 0.1220 ( 5927 PWs) bands (ev): -17.1560 -17.1560 -16.9967 -16.9967 -16.3738 -16.3738 -16.0808 -16.0808 -14.9865 -14.9865 -14.8541 -14.8541 -14.0509 -14.0509 -14.0267 -14.0267 -6.7533 -6.7533 -6.3295 -6.3295 -5.0086 -5.0086 -4.4592 -4.4592 -3.2053 -3.2053 -2.9105 -2.9105 -2.6381 -2.6381 -2.4801 -2.4801 -1.1608 -1.1608 -0.9534 -0.9534 -0.7174 -0.7174 -0.5922 -0.5922 -0.3370 -0.3370 -0.1900 -0.1900 0.0176 0.0176 0.3647 0.3647 0.9651 0.9651 1.0410 1.0410 1.6124 1.6124 1.7491 1.7491 1.8624 1.8624 1.9112 1.9112 4.0013 4.0013 4.0263 4.0263 7.6712 7.6712 7.9845 7.9845 10.0120 10.0120 10.0733 10.0733 10.6449 10.6449 10.8608 10.8608 k = 0.0000 0.4985 0.1086 ( 5929 PWs) bands (ev): -17.1463 -17.1463 -17.0132 -17.0132 -16.3479 -16.3479 -16.1023 -16.1023 -14.9749 -14.9749 -14.8636 -14.8636 -14.0489 -14.0489 -14.0284 -14.0284 -6.7261 -6.7261 -6.3711 -6.3711 -4.9612 -4.9612 -4.5021 -4.5021 -3.1772 -3.1772 -2.9303 -2.9303 -2.6251 -2.6251 -2.4917 -2.4917 -1.1472 -1.1472 -0.9735 -0.9735 -0.7068 -0.7068 -0.6003 -0.6003 -0.3277 -0.3277 -0.1994 -0.1994 0.0441 0.0441 0.3394 0.3394 0.9730 0.9730 1.0369 1.0369 1.6237 1.6237 1.7388 1.7388 1.8642 1.8642 1.9057 1.9057 4.0035 4.0035 4.0246 4.0246 7.6957 7.6957 7.9585 7.9585 10.0339 10.0339 10.0839 10.0839 10.6683 10.6683 10.8512 10.8512 k = 0.0000 0.4996 0.0952 ( 5936 PWs) bands (ev): -17.1359 -17.1359 -17.0292 -17.0292 -16.3221 -16.3221 -16.1245 -16.1245 -14.9633 -14.9633 -14.8735 -14.8735 -14.0469 -14.0469 -14.0303 -14.0303 -6.6971 -6.6971 -6.4120 -6.4120 -4.9138 -4.9138 -4.5458 -4.5458 -3.1495 -3.1495 -2.9513 -2.9513 -2.6118 -2.6118 -2.5039 -2.5039 -1.1327 -1.1327 -0.9933 -0.9933 -0.6959 -0.6959 -0.6092 -0.6092 -0.3171 -0.3171 -0.2111 -0.2111 0.0730 0.0730 0.3127 0.3127 0.9807 0.9807 1.0323 1.0323 1.6353 1.6353 1.7282 1.7282 1.8665 1.8665 1.9002 1.9002 4.0057 4.0057 4.0228 4.0228 7.7208 7.7208 7.9322 7.9322 10.0533 10.0533 10.0927 10.0927 10.6926 10.6926 10.8411 10.8411 k = 0.0000 0.5007 0.0818 ( 5940 PWs) bands (ev): -17.1249 -17.1249 -17.0447 -17.0447 -16.2963 -16.2963 -16.1476 -16.1476 -14.9516 -14.9516 -14.8838 -14.8838 -14.0448 -14.0448 -14.0322 -14.0322 -6.6664 -6.6664 -6.4519 -6.4519 -4.8666 -4.8666 -4.5902 -4.5902 -3.1223 -3.1223 -2.9732 -2.9732 -2.5982 -2.5982 -2.5166 -2.5166 -1.1175 -1.1175 -1.0127 -1.0127 -0.6848 -0.6848 -0.6189 -0.6189 -0.3056 -0.3056 -0.2243 -0.2243 0.1032 0.1032 0.2849 0.2849 0.9883 0.9883 1.0272 1.0272 1.6470 1.6470 1.7171 1.7171 1.8693 1.8693 1.8949 1.8949 4.0080 4.0080 4.0209 4.0209 7.7463 7.7463 7.9056 7.9056 10.0700 10.0700 10.0992 10.0992 10.7171 10.7171 10.8299 10.8299 k = 0.0000 0.5018 0.0685 ( 5930 PWs) bands (ev): -17.1131 -17.1131 -17.0596 -17.0596 -16.2707 -16.2707 -16.1712 -16.1712 -14.9399 -14.9399 -14.8945 -14.8945 -14.0427 -14.0427 -14.0342 -14.0342 -6.6342 -6.6342 -6.4908 -6.4908 -4.8197 -4.8197 -4.6352 -4.6352 -3.0956 -3.0956 -2.9960 -2.9960 -2.5844 -2.5844 -2.5297 -2.5297 -1.1016 -1.1016 -1.0316 -1.0316 -0.6735 -0.6735 -0.6292 -0.6292 -0.2931 -0.2931 -0.2381 -0.2381 0.1340 0.1340 0.2560 0.2560 0.9956 0.9956 1.0217 1.0217 1.6588 1.6588 1.7058 1.7058 1.8726 1.8726 1.8898 1.8898 4.0102 4.0102 4.0189 4.0189 7.7724 7.7724 7.8788 7.8788 10.0835 10.0835 10.1028 10.1028 10.7411 10.7411 10.8171 10.8171 k = 0.0000 0.5029 0.0551 ( 5921 PWs) bands (ev): -17.1007 -17.1007 -17.0739 -17.0739 -16.2453 -16.2453 -16.1955 -16.1955 -14.9282 -14.9282 -14.9055 -14.9055 -14.0405 -14.0405 -14.0363 -14.0363 -6.6004 -6.6004 -6.5286 -6.5286 -4.7730 -4.7730 -4.6807 -4.6807 -3.0696 -3.0696 -3.0197 -3.0197 -2.5706 -2.5706 -2.5431 -2.5431 -1.0850 -1.0850 -1.0499 -1.0499 -0.6622 -0.6622 -0.6399 -0.6399 -0.2799 -0.2799 -0.2522 -0.2522 0.1651 0.1651 0.2263 0.2263 1.0027 1.0027 1.0157 1.0157 1.6707 1.6707 1.6943 1.6943 1.8763 1.8763 1.8850 1.8850 4.0125 4.0125 4.0168 4.0168 7.7987 7.7987 7.8521 7.8521 10.0937 10.0937 10.1032 10.1032 10.7637 10.7637 10.8020 10.8020 k = 0.0000 0.5040 0.0417 ( 5920 PWs) bands (ev): -17.0876 -17.0876 -17.0876 -17.0876 -16.2202 -16.2202 -16.2202 -16.2202 -14.9168 -14.9168 -14.9168 -14.9168 -14.0384 -14.0384 -14.0384 -14.0384 -6.5652 -6.5652 -6.5652 -6.5652 -4.7266 -4.7266 -4.7266 -4.7266 -3.0443 -3.0443 -3.0443 -3.0443 -2.5568 -2.5568 -2.5568 -2.5568 -1.0678 -1.0678 -1.0678 -1.0678 -0.6510 -0.6510 -0.6510 -0.6510 -0.2662 -0.2662 -0.2662 -0.2662 0.1959 0.1959 0.1959 0.1959 1.0094 1.0094 1.0094 1.0094 1.6825 1.6825 1.6825 1.6825 1.8805 1.8805 1.8805 1.8805 4.0147 4.0147 4.0147 4.0147 7.8253 7.8253 7.8253 7.8253 10.1002 10.1002 10.1002 10.1002 10.7842 10.7842 10.7842 10.7842 k = 0.0000 0.5040 0.0417 ( 5920 PWs) bands (ev): -17.0876 -17.0876 -17.0876 -17.0876 -16.2202 -16.2202 -16.2202 -16.2202 -14.9168 -14.9168 -14.9168 -14.9168 -14.0384 -14.0384 -14.0384 -14.0384 -6.5652 -6.5652 -6.5652 -6.5652 -4.7266 -4.7266 -4.7266 -4.7266 -3.0443 -3.0443 -3.0443 -3.0443 -2.5568 -2.5568 -2.5568 -2.5568 -1.0678 -1.0678 -1.0678 -1.0678 -0.6510 -0.6510 -0.6510 -0.6510 -0.2662 -0.2662 -0.2662 -0.2662 0.1959 0.1959 0.1959 0.1959 1.0094 1.0094 1.0094 1.0094 1.6825 1.6825 1.6825 1.6825 1.8805 1.8805 1.8805 1.8805 4.0147 4.0147 4.0147 4.0147 7.8253 7.8253 7.8253 7.8253 10.1002 10.1002 10.1002 10.1002 10.7842 10.7842 10.7842 10.7842 k = 0.0139 0.5040 0.0417 ( 5920 PWs) bands (ev): -17.0871 -17.0871 -17.0871 -17.0871 -16.2201 -16.2201 -16.2200 -16.2200 -14.9168 -14.9168 -14.9168 -14.9168 -14.0398 -14.0398 -14.0398 -14.0398 -6.5636 -6.5636 -6.5635 -6.5635 -4.7264 -4.7264 -4.7262 -4.7262 -3.0445 -3.0445 -3.0444 -3.0444 -2.5572 -2.5572 -2.5572 -2.5572 -1.0673 -1.0673 -1.0672 -1.0672 -0.6517 -0.6517 -0.6517 -0.6517 -0.2651 -0.2651 -0.2651 -0.2651 0.1961 0.1961 0.1961 0.1961 1.0092 1.0092 1.0092 1.0092 1.6823 1.6823 1.6827 1.6827 1.8800 1.8800 1.8803 1.8803 4.0112 4.0112 4.0112 4.0112 7.8262 7.8262 7.8262 7.8262 10.1001 10.1001 10.1001 10.1001 10.7850 10.7850 10.7850 10.7850 k = 0.0278 0.5040 0.0417 ( 5924 PWs) bands (ev): -17.0856 -17.0856 -17.0856 -17.0856 -16.2198 -16.2198 -16.2197 -16.2197 -14.9168 -14.9168 -14.9168 -14.9168 -14.0439 -14.0439 -14.0438 -14.0438 -6.5589 -6.5589 -6.5585 -6.5585 -4.7257 -4.7257 -4.7253 -4.7253 -3.0450 -3.0450 -3.0450 -3.0450 -2.5584 -2.5584 -2.5584 -2.5584 -1.0658 -1.0658 -1.0657 -1.0657 -0.6538 -0.6538 -0.6537 -0.6537 -0.2617 -0.2617 -0.2616 -0.2616 0.1968 0.1968 0.1968 0.1968 1.0087 1.0087 1.0087 1.0087 1.6822 1.6822 1.6829 1.6829 1.8788 1.8788 1.8794 1.8794 4.0007 4.0007 4.0008 4.0008 7.8289 7.8289 7.8289 7.8289 10.0995 10.0995 10.0996 10.0996 10.7874 10.7874 10.7875 10.7875 k = 0.0417 0.5040 0.0417 ( 5926 PWs) bands (ev): -17.0831 -17.0831 -17.0830 -17.0830 -16.2193 -16.2193 -16.2192 -16.2192 -14.9168 -14.9168 -14.9168 -14.9168 -14.0507 -14.0507 -14.0506 -14.0506 -6.5509 -6.5509 -6.5504 -6.5504 -4.7244 -4.7244 -4.7237 -4.7237 -3.0459 -3.0459 -3.0458 -3.0458 -2.5605 -2.5605 -2.5604 -2.5604 -1.0633 -1.0633 -1.0631 -1.0631 -0.6571 -0.6571 -0.6571 -0.6571 -0.2561 -0.2561 -0.2560 -0.2560 0.1979 0.1979 0.1979 0.1979 1.0079 1.0079 1.0079 1.0079 1.6820 1.6820 1.6831 1.6831 1.8770 1.8770 1.8779 1.8779 3.9834 3.9834 3.9834 3.9834 7.8334 7.8334 7.8334 7.8334 10.0987 10.0987 10.0987 10.0987 10.7915 10.7915 10.7917 10.7917 k = 0.0556 0.5040 0.0417 ( 5930 PWs) bands (ev): -17.0796 -17.0796 -17.0795 -17.0795 -16.2186 -16.2186 -16.2184 -16.2184 -14.9168 -14.9168 -14.9168 -14.9168 -14.0602 -14.0602 -14.0600 -14.0600 -6.5399 -6.5399 -6.5392 -6.5392 -4.7224 -4.7224 -4.7215 -4.7215 -3.0471 -3.0471 -3.0470 -3.0470 -2.5633 -2.5633 -2.5633 -2.5633 -1.0597 -1.0597 -1.0595 -1.0595 -0.6616 -0.6616 -0.6615 -0.6615 -0.2484 -0.2484 -0.2483 -0.2483 0.1995 0.1995 0.1995 0.1995 1.0067 1.0067 1.0067 1.0067 1.6818 1.6818 1.6832 1.6832 1.8745 1.8745 1.8757 1.8757 3.9593 3.9593 3.9594 3.9594 7.8396 7.8396 7.8396 7.8396 10.0974 10.0974 10.0975 10.0975 10.7972 10.7972 10.7975 10.7975 k = 0.0694 0.5040 0.0417 ( 5934 PWs) bands (ev): -17.0751 -17.0751 -17.0749 -17.0749 -16.2177 -16.2177 -16.2174 -16.2174 -14.9169 -14.9169 -14.9168 -14.9168 -14.0723 -14.0723 -14.0720 -14.0720 -6.5259 -6.5259 -6.5251 -6.5251 -4.7198 -4.7198 -4.7187 -4.7187 -3.0486 -3.0486 -3.0485 -3.0485 -2.5671 -2.5671 -2.5670 -2.5670 -1.0552 -1.0552 -1.0550 -1.0550 -0.6671 -0.6671 -0.6670 -0.6670 -0.2389 -0.2389 -0.2387 -0.2387 0.2015 0.2015 0.2016 0.2016 1.0051 1.0051 1.0052 1.0052 1.6815 1.6815 1.6833 1.6833 1.8715 1.8715 1.8730 1.8730 3.9286 3.9286 3.9286 3.9286 7.8477 7.8477 7.8477 7.8477 10.0956 10.0956 10.0957 10.0957 10.8046 10.8046 10.8049 10.8049 k = 0.0833 0.5040 0.0417 ( 5926 PWs) bands (ev): -17.0696 -17.0696 -17.0694 -17.0694 -16.2166 -16.2166 -16.2163 -16.2163 -14.9169 -14.9169 -14.9169 -14.9169 -14.0868 -14.0868 -14.0865 -14.0865 -6.5091 -6.5091 -6.5081 -6.5081 -4.7165 -4.7165 -4.7152 -4.7152 -3.0503 -3.0503 -3.0502 -3.0502 -2.5716 -2.5716 -2.5715 -2.5715 -1.0498 -1.0498 -1.0494 -1.0494 -0.6732 -0.6732 -0.6731 -0.6731 -0.2276 -0.2276 -0.2273 -0.2273 0.2040 0.2040 0.2041 0.2041 1.0032 1.0032 1.0033 1.0033 1.6812 1.6812 1.6833 1.6833 1.8679 1.8679 1.8697 1.8697 3.8915 3.8915 3.8915 3.8915 7.8575 7.8575 7.8575 7.8575 10.0932 10.0932 10.0934 10.0934 10.8137 10.8137 10.8140 10.8140 k = 0.0972 0.5040 0.0417 ( 5932 PWs) bands (ev): -17.0632 -17.0632 -17.0630 -17.0630 -16.2153 -16.2153 -16.2149 -16.2149 -14.9170 -14.9170 -14.9169 -14.9169 -14.1037 -14.1037 -14.1034 -14.1034 -6.4896 -6.4896 -6.4884 -6.4884 -4.7125 -4.7125 -4.7109 -4.7109 -3.0523 -3.0523 -3.0522 -3.0522 -2.5771 -2.5771 -2.5769 -2.5769 -1.0434 -1.0434 -1.0430 -1.0430 -0.6800 -0.6800 -0.6798 -0.6798 -0.2147 -0.2147 -0.2143 -0.2143 0.2068 0.2068 0.2070 0.2070 1.0009 1.0009 1.0011 1.0011 1.6808 1.6808 1.6832 1.6832 1.8639 1.8639 1.8660 1.8660 3.8482 3.8482 3.8483 3.8483 7.8691 7.8691 7.8691 7.8691 10.0902 10.0902 10.0904 10.0904 10.8243 10.8243 10.8247 10.8247 k = 0.1111 0.5040 0.0417 ( 5926 PWs) bands (ev): -17.0558 -17.0558 -17.0556 -17.0556 -16.2138 -16.2138 -16.2133 -16.2133 -14.9170 -14.9170 -14.9170 -14.9170 -14.1229 -14.1229 -14.1225 -14.1225 -6.4677 -6.4677 -6.4664 -6.4664 -4.7076 -4.7076 -4.7059 -4.7059 -3.0545 -3.0545 -3.0544 -3.0544 -2.5834 -2.5834 -2.5832 -2.5832 -1.0361 -1.0361 -1.0356 -1.0356 -0.6870 -0.6870 -0.6869 -0.6869 -0.2003 -0.2003 -0.1998 -0.1998 0.2101 0.2101 0.2104 0.2104 0.9982 0.9982 0.9984 0.9984 1.6803 1.6803 1.6829 1.6829 1.8595 1.8595 1.8618 1.8618 3.7990 3.7990 3.7991 3.7991 7.8824 7.8824 7.8824 7.8824 10.0865 10.0865 10.0867 10.0867 10.8366 10.8366 10.8370 10.8370 k = 0.1250 0.5040 0.0417 ( 5922 PWs) bands (ev): -17.0476 -17.0476 -17.0474 -17.0474 -16.2121 -16.2121 -16.2115 -16.2115 -14.9171 -14.9171 -14.9171 -14.9171 -14.1442 -14.1442 -14.1438 -14.1438 -6.4436 -6.4436 -6.4421 -6.4421 -4.7019 -4.7019 -4.6999 -4.6999 -3.0569 -3.0569 -3.0568 -3.0568 -2.5907 -2.5907 -2.5905 -2.5905 -1.0279 -1.0279 -1.0275 -1.0275 -0.6943 -0.6943 -0.6941 -0.6941 -0.1847 -0.1847 -0.1840 -0.1840 0.2138 0.2138 0.2142 0.2142 0.9951 0.9951 0.9953 0.9953 1.6795 1.6795 1.6824 1.6824 1.8548 1.8548 1.8573 1.8573 3.7442 3.7442 3.7443 3.7443 7.8975 7.8975 7.8975 7.8975 10.0820 10.0820 10.0823 10.0823 10.8505 10.8505 10.8509 10.8509 k = 0.1389 0.5040 0.0417 ( 5918 PWs) bands (ev): -17.0386 -17.0386 -17.0383 -17.0383 -16.2101 -16.2101 -16.2095 -16.2095 -14.9172 -14.9172 -14.9172 -14.9172 -14.1675 -14.1675 -14.1670 -14.1670 -6.4175 -6.4175 -6.4159 -6.4159 -4.6951 -4.6951 -4.6930 -4.6930 -3.0594 -3.0594 -3.0592 -3.0592 -2.5988 -2.5988 -2.5986 -2.5986 -1.0190 -1.0190 -1.0185 -1.0185 -0.7016 -0.7016 -0.7014 -0.7014 -0.1678 -0.1678 -0.1670 -0.1670 0.2179 0.2179 0.2184 0.2184 0.9915 0.9915 0.9918 0.9918 1.6786 1.6786 1.6816 1.6816 1.8499 1.8499 1.8525 1.8525 3.6842 3.6842 3.6843 3.6843 7.9143 7.9143 7.9143 7.9143 10.0766 10.0766 10.0769 10.0769 10.8659 10.8659 10.8663 10.8663 k = 0.1528 0.5040 0.0417 ( 5912 PWs) bands (ev): -17.0288 -17.0288 -17.0284 -17.0284 -16.2080 -16.2080 -16.2073 -16.2073 -14.9174 -14.9174 -14.9173 -14.9173 -14.1926 -14.1926 -14.1920 -14.1920 -6.3898 -6.3898 -6.3881 -6.3881 -4.6874 -4.6874 -4.6850 -4.6850 -3.0620 -3.0620 -3.0618 -3.0618 -2.6079 -2.6079 -2.6077 -2.6077 -1.0094 -1.0094 -1.0088 -1.0088 -0.7088 -0.7088 -0.7086 -0.7086 -0.1498 -0.1498 -0.1488 -0.1488 0.2224 0.2224 0.2230 0.2230 0.9875 0.9875 0.9878 0.9878 1.6773 1.6773 1.6805 1.6805 1.8449 1.8449 1.8476 1.8476 3.6194 3.6194 3.6195 3.6195 7.9328 7.9328 7.9328 7.9328 10.0702 10.0702 10.0706 10.0706 10.8828 10.8828 10.8832 10.8832 k = 0.1667 0.5040 0.0417 ( 5912 PWs) bands (ev): -17.0182 -17.0182 -17.0179 -17.0179 -16.2056 -16.2056 -16.2049 -16.2049 -14.9175 -14.9175 -14.9175 -14.9175 -14.2193 -14.2193 -14.2187 -14.2187 -6.3607 -6.3607 -6.3588 -6.3588 -4.6785 -4.6785 -4.6759 -4.6759 -3.0647 -3.0647 -3.0645 -3.0645 -2.6180 -2.6180 -2.6177 -2.6177 -0.9990 -0.9990 -0.9984 -0.9984 -0.7158 -0.7158 -0.7155 -0.7155 -0.1307 -0.1307 -0.1294 -0.1294 0.2273 0.2273 0.2281 0.2281 0.9831 0.9831 0.9833 0.9833 1.6758 1.6758 1.6790 1.6790 1.8398 1.8398 1.8426 1.8426 3.5500 3.5500 3.5501 3.5501 7.9529 7.9529 7.9529 7.9529 10.0629 10.0629 10.0633 10.0633 10.9012 10.9012 10.9014 10.9014 k = 0.1806 0.5040 0.0417 ( 5902 PWs) bands (ev): -17.0070 -17.0070 -17.0066 -17.0066 -16.2030 -16.2030 -16.2023 -16.2023 -14.9177 -14.9177 -14.9177 -14.9177 -14.2475 -14.2475 -14.2469 -14.2469 -6.3306 -6.3306 -6.3286 -6.3286 -4.6684 -4.6684 -4.6656 -4.6656 -3.0674 -3.0674 -3.0672 -3.0672 -2.6289 -2.6289 -2.6286 -2.6286 -0.9881 -0.9881 -0.9874 -0.9874 -0.7224 -0.7224 -0.7221 -0.7221 -0.1105 -0.1105 -0.1091 -0.1091 0.2325 0.2325 0.2335 0.2335 0.9781 0.9781 0.9784 0.9784 1.6739 1.6739 1.6771 1.6771 1.8347 1.8347 1.8375 1.8375 3.4765 3.4765 3.4766 3.4766 7.9746 7.9746 7.9746 7.9746 10.0545 10.0545 10.0550 10.0550 10.9208 10.9208 10.9210 10.9210 k = 0.1944 0.5040 0.0417 ( 5894 PWs) bands (ev): -16.9951 -16.9951 -16.9947 -16.9947 -16.2002 -16.2002 -16.1994 -16.1994 -14.9180 -14.9180 -14.9179 -14.9179 -14.2769 -14.2769 -14.2763 -14.2763 -6.2997 -6.2997 -6.2976 -6.2976 -4.6570 -4.6570 -4.6540 -4.6540 -3.0701 -3.0701 -3.0699 -3.0699 -2.6407 -2.6407 -2.6404 -2.6404 -0.9767 -0.9767 -0.9760 -0.9760 -0.7286 -0.7286 -0.7282 -0.7282 -0.0894 -0.0894 -0.0876 -0.0876 0.2382 0.2382 0.2394 0.2394 0.9728 0.9728 0.9731 0.9731 1.6716 1.6716 1.6747 1.6747 1.8298 1.8298 1.8325 1.8325 3.3994 3.3994 3.3995 3.3995 7.9977 7.9977 7.9978 7.9978 10.0452 10.0452 10.0456 10.0456 10.9417 10.9417 10.9419 10.9419 k = 0.2083 0.5040 0.0417 ( 5894 PWs) bands (ev): -16.9828 -16.9828 -16.9823 -16.9823 -16.1972 -16.1972 -16.1964 -16.1964 -14.9182 -14.9182 -14.9182 -14.9182 -14.3074 -14.3074 -14.3067 -14.3067 -6.2684 -6.2684 -6.2661 -6.2661 -4.6442 -4.6442 -4.6411 -4.6411 -3.0728 -3.0728 -3.0725 -3.0725 -2.6534 -2.6534 -2.6531 -2.6531 -0.9649 -0.9649 -0.9641 -0.9641 -0.7343 -0.7343 -0.7339 -0.7339 -0.0673 -0.0673 -0.0653 -0.0653 0.2442 0.2442 0.2458 0.2458 0.9669 0.9669 0.9673 0.9673 1.6688 1.6688 1.6719 1.6719 1.8250 1.8250 1.8276 1.8276 3.3190 3.3190 3.3191 3.3191 8.0223 8.0223 8.0224 8.0224 10.0348 10.0348 10.0353 10.0353 10.9637 10.9637 10.9638 10.9638 k = 0.2222 0.5040 0.0417 ( 5906 PWs) bands (ev): -16.9699 -16.9699 -16.9695 -16.9695 -16.1940 -16.1940 -16.1931 -16.1931 -14.9186 -14.9186 -14.9185 -14.9185 -14.3387 -14.3387 -14.3380 -14.3380 -6.2370 -6.2370 -6.2347 -6.2347 -4.6300 -4.6300 -4.6267 -4.6267 -3.0755 -3.0755 -3.0752 -3.0752 -2.6670 -2.6670 -2.6666 -2.6666 -0.9529 -0.9529 -0.9520 -0.9520 -0.7394 -0.7394 -0.7388 -0.7388 -0.0444 -0.0444 -0.0420 -0.0420 0.2508 0.2508 0.2527 0.2527 0.9607 0.9607 0.9610 0.9610 1.6656 1.6656 1.6685 1.6685 1.8204 1.8204 1.8228 1.8228 3.2358 3.2358 3.2359 3.2359 8.0482 8.0482 8.0483 8.0483 10.0234 10.0234 10.0239 10.0239 10.9867 10.9867 10.9867 10.9867 k = 0.2361 0.5040 0.0417 ( 5908 PWs) bands (ev): -16.9567 -16.9567 -16.9562 -16.9562 -16.1906 -16.1906 -16.1897 -16.1897 -14.9190 -14.9190 -14.9189 -14.9189 -14.3706 -14.3706 -14.3699 -14.3699 -6.2058 -6.2058 -6.2034 -6.2034 -4.6144 -4.6144 -4.6110 -4.6110 -3.0781 -3.0781 -3.0779 -3.0779 -2.6813 -2.6813 -2.6809 -2.6809 -0.9407 -0.9407 -0.9397 -0.9397 -0.7438 -0.7438 -0.7431 -0.7431 -0.0207 -0.0207 -0.0179 -0.0179 0.2580 0.2580 0.2603 0.2603 0.9541 0.9541 0.9544 0.9544 1.6619 1.6619 1.6646 1.6646 1.8159 1.8159 1.8182 1.8182 3.1504 3.1504 3.1505 3.1505 8.0753 8.0753 8.0754 8.0754 10.0112 10.0112 10.0117 10.0117 11.0105 11.0105 11.0106 11.0106 k = 0.2500 0.5040 0.0417 ( 5906 PWs) bands (ev): -16.9432 -16.9432 -16.9427 -16.9427 -16.1870 -16.1870 -16.1860 -16.1860 -14.9195 -14.9195 -14.9193 -14.9193 -14.4030 -14.4030 -14.4022 -14.4022 -6.1751 -6.1751 -6.1726 -6.1726 -4.5972 -4.5972 -4.5937 -4.5937 -3.0808 -3.0808 -3.0805 -3.0805 -2.6962 -2.6962 -2.6959 -2.6959 -0.9286 -0.9286 -0.9274 -0.9274 -0.7474 -0.7474 -0.7466 -0.7466 0.0036 0.0036 0.0067 0.0067 0.2659 0.2659 0.2686 0.2686 0.9472 0.9472 0.9475 0.9475 1.6577 1.6577 1.6601 1.6601 1.8117 1.8117 1.8137 1.8137 3.0632 3.0632 3.0633 3.0633 8.1034 8.1034 8.1035 8.1035 9.9980 9.9980 9.9985 9.9985 11.0351 11.0351 11.0353 11.0353 k = 0.2639 0.5040 0.0417 ( 5902 PWs) bands (ev): -16.9295 -16.9295 -16.9289 -16.9289 -16.1831 -16.1831 -16.1822 -16.1822 -14.9200 -14.9200 -14.9199 -14.9199 -14.4355 -14.4355 -14.4347 -14.4347 -6.1452 -6.1452 -6.1427 -6.1427 -4.5786 -4.5786 -4.5751 -4.5751 -3.0834 -3.0834 -3.0831 -3.0831 -2.7118 -2.7118 -2.7114 -2.7114 -0.9167 -0.9167 -0.9154 -0.9154 -0.7501 -0.7501 -0.7491 -0.7491 0.0282 0.0282 0.0318 0.0318 0.2749 0.2749 0.2780 0.2780 0.9400 0.9400 0.9403 0.9403 1.6530 1.6530 1.6551 1.6551 1.8076 1.8076 1.8093 1.8093 2.9747 2.9747 2.9748 2.9748 8.1324 8.1324 8.1325 8.1325 9.9841 9.9841 9.9846 9.9846 11.0602 11.0602 11.0605 11.0605 k = 0.2778 0.5040 0.0417 ( 5906 PWs) bands (ev): -16.9157 -16.9157 -16.9151 -16.9151 -16.1791 -16.1791 -16.1781 -16.1781 -14.9207 -14.9207 -14.9205 -14.9205 -14.4679 -14.4679 -14.4671 -14.4671 -6.1164 -6.1164 -6.1139 -6.1139 -4.5587 -4.5587 -4.5550 -4.5550 -3.0860 -3.0860 -3.0857 -3.0857 -2.7279 -2.7279 -2.7275 -2.7275 -0.9053 -0.9053 -0.9039 -0.9039 -0.7517 -0.7517 -0.7505 -0.7505 0.0528 0.0528 0.0569 0.0569 0.2851 0.2851 0.2887 0.2887 0.9327 0.9327 0.9330 0.9330 1.6477 1.6477 1.6496 1.6496 1.8035 1.8035 1.8049 1.8049 2.8855 2.8855 2.8856 2.8856 8.1621 8.1621 8.1622 8.1622 9.9695 9.9695 9.9700 9.9700 11.0857 11.0857 11.0862 11.0862 k = 0.2917 0.5040 0.0417 ( 5910 PWs) bands (ev): -16.9019 -16.9019 -16.9013 -16.9013 -16.1750 -16.1750 -16.1740 -16.1740 -14.9214 -14.9214 -14.9213 -14.9213 -14.4999 -14.4999 -14.4991 -14.4991 -6.0888 -6.0888 -6.0863 -6.0863 -4.5374 -4.5374 -4.5337 -4.5337 -3.0887 -3.0887 -3.0884 -3.0884 -2.7444 -2.7444 -2.7440 -2.7440 -0.8946 -0.8946 -0.8930 -0.8930 -0.7521 -0.7521 -0.7508 -0.7508 0.0770 0.0770 0.0816 0.0816 0.2971 0.2971 0.3011 0.3011 0.9253 0.9253 0.9255 0.9255 1.6420 1.6420 1.6436 1.6436 1.7994 1.7994 1.8005 1.8005 2.7962 2.7962 2.7963 2.7963 8.1923 8.1923 8.1925 8.1925 9.9543 9.9543 9.9548 9.9548 11.1115 11.1115 11.1121 11.1121 k = 0.3056 0.5040 0.0417 ( 5908 PWs) bands (ev): -16.8882 -16.8882 -16.8877 -16.8877 -16.1707 -16.1707 -16.1697 -16.1697 -14.9224 -14.9224 -14.9222 -14.9222 -14.5314 -14.5314 -14.5306 -14.5306 -6.0627 -6.0627 -6.0602 -6.0602 -4.5150 -4.5150 -4.5113 -4.5113 -3.0914 -3.0914 -3.0910 -3.0910 -2.7611 -2.7611 -2.7607 -2.7607 -0.8849 -0.8849 -0.8831 -0.8831 -0.7512 -0.7512 -0.7496 -0.7496 0.1002 0.1002 0.1051 0.1051 0.3114 0.3114 0.3158 0.3158 0.9181 0.9181 0.9182 0.9182 1.6355 1.6355 1.6369 1.6369 1.7950 1.7950 1.7958 1.7958 2.7074 2.7074 2.7076 2.7076 8.2228 8.2228 8.2230 8.2230 9.9387 9.9387 9.9392 9.9392 11.1374 11.1374 11.1381 11.1381 k = 0.3194 0.5040 0.0417 ( 5924 PWs) bands (ev): -16.8748 -16.8748 -16.8742 -16.8742 -16.1662 -16.1662 -16.1652 -16.1652 -14.9234 -14.9234 -14.9232 -14.9232 -14.5620 -14.5620 -14.5612 -14.5612 -6.0382 -6.0382 -6.0358 -6.0358 -4.4916 -4.4916 -4.4879 -4.4879 -3.0942 -3.0942 -3.0938 -3.0938 -2.7779 -2.7779 -2.7775 -2.7775 -0.8764 -0.8764 -0.8745 -0.8745 -0.7488 -0.7488 -0.7471 -0.7471 0.1217 0.1217 0.1269 0.1269 0.3286 0.3286 0.3332 0.3332 0.9111 0.9111 0.9111 0.9111 1.6284 1.6284 1.6295 1.6295 1.7904 1.7904 1.7909 1.7909 2.6200 2.6200 2.6201 2.6201 8.2534 8.2534 8.2535 8.2535 9.9228 9.9228 9.9233 9.9233 11.1633 11.1633 11.1640 11.1640 k = 0.3333 0.5040 0.0417 ( 5918 PWs) bands (ev): -16.8617 -16.8617 -16.8612 -16.8612 -16.1617 -16.1617 -16.1607 -16.1607 -14.9247 -14.9247 -14.9245 -14.9245 -14.5916 -14.5916 -14.5907 -14.5907 -6.0155 -6.0155 -6.0131 -6.0131 -4.4675 -4.4675 -4.4639 -4.4639 -3.0970 -3.0970 -3.0966 -3.0966 -2.7946 -2.7946 -2.7942 -2.7942 -0.8693 -0.8693 -0.8673 -0.8673 -0.7449 -0.7449 -0.7430 -0.7430 0.1410 0.1410 0.1463 0.1463 0.3492 0.3492 0.3539 0.3539 0.9045 0.9045 0.9046 0.9046 1.6204 1.6204 1.6213 1.6213 1.7852 1.7852 1.7854 1.7854 2.5346 2.5346 2.5348 2.5348 8.2836 8.2836 8.2838 8.2838 9.9068 9.9068 9.9073 9.9073 11.1888 11.1888 11.1896 11.1896 k = 0.3472 0.5040 0.0417 ( 5914 PWs) bands (ev): -16.8491 -16.8491 -16.8486 -16.8486 -16.1572 -16.1572 -16.1562 -16.1562 -14.9261 -14.9261 -14.9259 -14.9259 -14.6197 -14.6197 -14.6188 -14.6188 -5.9946 -5.9946 -5.9923 -5.9923 -4.4430 -4.4430 -4.4395 -4.4395 -3.1000 -3.1000 -3.0996 -3.0996 -2.8109 -2.8109 -2.8105 -2.8105 -0.8635 -0.8635 -0.8615 -0.8615 -0.7395 -0.7395 -0.7376 -0.7376 0.1577 0.1577 0.1627 0.1627 0.3735 0.3735 0.3780 0.3780 0.8985 0.8985 0.8988 0.8988 1.6112 1.6112 1.6119 1.6119 1.7793 1.7793 1.7794 1.7794 2.4524 2.4524 2.4526 2.4526 8.3134 8.3134 8.3135 8.3135 9.8909 9.8909 9.8913 9.8913 11.2139 11.2139 11.2148 11.2148 k = 0.3611 0.5040 0.0417 ( 5910 PWs) bands (ev): -16.8372 -16.8372 -16.8367 -16.8367 -16.1526 -16.1526 -16.1517 -16.1517 -14.9278 -14.9278 -14.9275 -14.9275 -14.6461 -14.6461 -14.6453 -14.6453 -5.9756 -5.9756 -5.9734 -5.9734 -4.4184 -4.4184 -4.4151 -4.4151 -3.1032 -3.1032 -3.1028 -3.1028 -2.8268 -2.8268 -2.8264 -2.8264 -0.8591 -0.8591 -0.8571 -0.8571 -0.7330 -0.7330 -0.7311 -0.7311 0.1716 0.1716 0.1763 0.1763 0.4012 0.4012 0.4053 0.4053 0.8935 0.8935 0.8940 0.8940 1.6004 1.6004 1.6011 1.6011 1.7724 1.7724 1.7727 1.7727 2.3743 2.3743 2.3746 2.3746 8.3422 8.3422 8.3424 8.3424 9.8751 9.8751 9.8755 9.8755 11.2383 11.2383 11.2392 11.2392 k = 0.3750 0.5040 0.0417 ( 5910 PWs) bands (ev): -16.8259 -16.8259 -16.8254 -16.8254 -16.1481 -16.1481 -16.1472 -16.1472 -14.9297 -14.9297 -14.9294 -14.9294 -14.6706 -14.6706 -14.6699 -14.6699 -5.9584 -5.9584 -5.9565 -5.9565 -4.3941 -4.3941 -4.3910 -4.3910 -3.1065 -3.1065 -3.1061 -3.1061 -2.8418 -2.8418 -2.8415 -2.8415 -0.8558 -0.8558 -0.8539 -0.8539 -0.7256 -0.7256 -0.7238 -0.7238 0.1828 0.1828 0.1870 0.1870 0.4317 0.4317 0.4353 0.4353 0.8898 0.8898 0.8906 0.8906 1.5875 1.5875 1.5882 1.5882 1.7646 1.7646 1.7651 1.7651 2.3017 2.3017 2.3020 2.3020 8.3699 8.3699 8.3700 8.3700 9.8599 9.8599 9.8602 9.8602 11.2617 11.2617 11.2627 11.2627 k = 0.3889 0.5040 0.0417 ( 5904 PWs) bands (ev): -16.8155 -16.8155 -16.8150 -16.8150 -16.1438 -16.1438 -16.1430 -16.1430 -14.9318 -14.9318 -14.9316 -14.9316 -14.6930 -14.6930 -14.6922 -14.6922 -5.9432 -5.9432 -5.9414 -5.9414 -4.3706 -4.3706 -4.3677 -4.3677 -3.1099 -3.1099 -3.1095 -3.1095 -2.8559 -2.8559 -2.8556 -2.8556 -0.8534 -0.8534 -0.8517 -0.8517 -0.7178 -0.7178 -0.7161 -0.7161 0.1918 0.1918 0.1955 0.1955 0.4640 0.4640 0.4669 0.4669 0.8878 0.8878 0.8889 0.8889 1.5719 1.5719 1.5726 1.5726 1.7559 1.7559 1.7565 1.7565 2.2358 2.2358 2.2362 2.2362 8.3960 8.3960 8.3962 8.3962 9.8453 9.8453 9.8456 9.8456 11.2839 11.2839 11.2849 11.2849 k = 0.4028 0.5040 0.0417 ( 5898 PWs) bands (ev): -16.8060 -16.8060 -16.8056 -16.8056 -16.1397 -16.1397 -16.1389 -16.1389 -14.9341 -14.9341 -14.9339 -14.9339 -14.7129 -14.7129 -14.7122 -14.7122 -5.9299 -5.9299 -5.9283 -5.9283 -4.3483 -4.3483 -4.3457 -4.3457 -3.1134 -3.1134 -3.1130 -3.1130 -2.8688 -2.8688 -2.8685 -2.8685 -0.8517 -0.8517 -0.8502 -0.8502 -0.7099 -0.7099 -0.7084 -0.7084 0.1988 0.1988 0.2019 0.2019 0.4969 0.4969 0.4991 0.4991 0.8881 0.8881 0.8894 0.8894 1.5528 1.5528 1.5536 1.5536 1.7466 1.7466 1.7473 1.7473 2.1780 2.1780 2.1784 2.1784 8.4202 8.4202 8.4204 8.4204 9.8316 9.8316 9.8319 9.8319 11.3046 11.3046 11.3056 11.3056 k = 0.4167 0.5040 0.0417 ( 5894 PWs) bands (ev): -16.7975 -16.7975 -16.7972 -16.7972 -16.1359 -16.1359 -16.1352 -16.1352 -14.9366 -14.9366 -14.9364 -14.9364 -14.7303 -14.7303 -14.7297 -14.7297 -5.9185 -5.9185 -5.9171 -5.9171 -4.3277 -4.3277 -4.3254 -4.3254 -3.1170 -3.1170 -3.1166 -3.1166 -2.8803 -2.8803 -2.8800 -2.8800 -0.8506 -0.8506 -0.8493 -0.8493 -0.7023 -0.7023 -0.7010 -0.7010 0.2042 0.2042 0.2068 0.2068 0.5290 0.5290 0.5306 0.5306 0.8910 0.8910 0.8926 0.8926 1.5299 1.5299 1.5308 1.5308 1.7372 1.7372 1.7378 1.7378 2.1291 2.1291 2.1295 2.1295 8.4422 8.4422 8.4423 8.4423 9.8191 9.8191 9.8193 9.8193 11.3235 11.3235 11.3244 11.3244 k = 0.4306 0.5040 0.0417 ( 5890 PWs) bands (ev): -16.7902 -16.7902 -16.7899 -16.7899 -16.1324 -16.1324 -16.1319 -16.1319 -14.9391 -14.9391 -14.9389 -14.9389 -14.7450 -14.7450 -14.7445 -14.7445 -5.9089 -5.9089 -5.9077 -5.9077 -4.3092 -4.3092 -4.3072 -4.3072 -3.1204 -3.1204 -3.1201 -3.1201 -2.8902 -2.8902 -2.8900 -2.8900 -0.8498 -0.8498 -0.8487 -0.8487 -0.6954 -0.6954 -0.6942 -0.6942 0.2084 0.2084 0.2105 0.2105 0.5587 0.5587 0.5597 0.5597 0.8969 0.8969 0.8987 0.8987 1.5034 1.5034 1.5044 1.5044 1.7282 1.7282 1.7287 1.7287 2.0895 2.0895 2.0899 2.0899 8.4615 8.4615 8.4616 8.4616 9.8080 9.8080 9.8082 9.8082 11.3402 11.3402 11.3411 11.3411 k = 0.4444 0.5040 0.0417 ( 5886 PWs) bands (ev): -16.7841 -16.7841 -16.7839 -16.7839 -16.1295 -16.1295 -16.1290 -16.1290 -14.9415 -14.9415 -14.9414 -14.9414 -14.7569 -14.7569 -14.7565 -14.7565 -5.9010 -5.9010 -5.9001 -5.9001 -4.2933 -4.2933 -4.2917 -4.2917 -3.1236 -3.1236 -3.1233 -3.1233 -2.8985 -2.8985 -2.8983 -2.8983 -0.8493 -0.8493 -0.8484 -0.8484 -0.6893 -0.6893 -0.6884 -0.6884 0.2115 0.2115 0.2132 0.2132 0.5845 0.5845 0.5851 0.5851 0.9059 0.9059 0.9078 0.9078 1.4745 1.4745 1.4756 1.4756 1.7203 1.7203 1.7207 1.7207 2.0590 2.0590 2.0594 2.0594 8.4779 8.4779 8.4779 8.4779 9.7985 9.7985 9.7986 9.7986 11.3545 11.3545 11.3553 11.3553 k = 0.4583 0.5040 0.0417 ( 5888 PWs) bands (ev): -16.7793 -16.7793 -16.7791 -16.7791 -16.1271 -16.1271 -16.1267 -16.1267 -14.9437 -14.9437 -14.9435 -14.9435 -14.7661 -14.7661 -14.7658 -14.7658 -5.8950 -5.8950 -5.8942 -5.8942 -4.2804 -4.2804 -4.2791 -4.2791 -3.1263 -3.1263 -3.1261 -3.1261 -2.9049 -2.9049 -2.9048 -2.9048 -0.8490 -0.8490 -0.8483 -0.8483 -0.6843 -0.6843 -0.6836 -0.6836 0.2138 0.2138 0.2150 0.2150 0.6053 0.6053 0.6055 0.6055 0.9171 0.9171 0.9189 0.9189 1.4459 1.4459 1.4469 1.4469 1.7140 1.7140 1.7143 1.7143 2.0368 2.0368 2.0371 2.0371 8.4909 8.4909 8.4910 8.4910 9.7908 9.7908 9.7909 9.7909 11.3661 11.3661 11.3666 11.3666 k = 0.4722 0.5040 0.0417 ( 5882 PWs) bands (ev): -16.7758 -16.7758 -16.7757 -16.7757 -16.1253 -16.1253 -16.1250 -16.1250 -14.9454 -14.9454 -14.9453 -14.9453 -14.7726 -14.7726 -14.7724 -14.7724 -5.8906 -5.8906 -5.8901 -5.8901 -4.2708 -4.2708 -4.2700 -4.2700 -3.1284 -3.1284 -3.1282 -3.1282 -2.9096 -2.9096 -2.9095 -2.9095 -0.8488 -0.8488 -0.8483 -0.8483 -0.6806 -0.6806 -0.6801 -0.6801 0.2154 0.2154 0.2162 0.2162 0.6203 0.6203 0.6204 0.6204 0.9287 0.9287 0.9301 0.9301 1.4210 1.4210 1.4218 1.4218 1.7094 1.7094 1.7096 1.7096 2.0219 2.0219 2.0221 2.0221 8.5005 8.5005 8.5005 8.5005 9.7852 9.7852 9.7853 9.7853 11.3746 11.3746 11.3750 11.3750 k = 0.4861 0.5040 0.0417 ( 5884 PWs) bands (ev): -16.7737 -16.7737 -16.7736 -16.7736 -16.1242 -16.1242 -16.1240 -16.1240 -14.9464 -14.9464 -14.9464 -14.9464 -14.7765 -14.7765 -14.7764 -14.7764 -5.8880 -5.8880 -5.8877 -5.8877 -4.2649 -4.2649 -4.2645 -4.2645 -3.1297 -3.1297 -3.1296 -3.1296 -2.9124 -2.9124 -2.9123 -2.9123 -0.8486 -0.8486 -0.8484 -0.8484 -0.6782 -0.6782 -0.6780 -0.6780 0.2164 0.2164 0.2168 0.2168 0.6292 0.6292 0.6293 0.6293 0.9377 0.9377 0.9385 0.9385 1.4039 1.4039 1.4043 1.4043 1.7067 1.7067 1.7068 1.7068 2.0134 2.0134 2.0135 2.0135 8.5063 8.5063 8.5063 8.5063 9.7818 9.7818 9.7819 9.7819 11.3798 11.3798 11.3800 11.3800 k = 0.5000 0.5040 0.0417 ( 5884 PWs) bands (ev): -16.7729 -16.7729 -16.7729 -16.7729 -16.1237 -16.1237 -16.1237 -16.1237 -14.9468 -14.9468 -14.9468 -14.9468 -14.7777 -14.7777 -14.7777 -14.7777 -5.8870 -5.8870 -5.8870 -5.8870 -4.2628 -4.2628 -4.2628 -4.2628 -3.1301 -3.1301 -3.1301 -3.1301 -2.9133 -2.9133 -2.9133 -2.9133 -0.8485 -0.8485 -0.8485 -0.8485 -0.6774 -0.6774 -0.6774 -0.6774 0.2168 0.2168 0.2168 0.2168 0.6322 0.6322 0.6322 0.6322 0.9414 0.9414 0.9414 0.9414 1.3979 1.3979 1.3979 1.3979 1.7058 1.7058 1.7058 1.7058 2.0106 2.0106 2.0106 2.0106 8.5083 8.5083 8.5083 8.5083 9.7807 9.7807 9.7807 9.7807 11.3816 11.3816 11.3816 11.3816 k = 0.5000 0.5040 0.0417 ( 5884 PWs) bands (ev): -16.7729 -16.7729 -16.7729 -16.7729 -16.1237 -16.1237 -16.1237 -16.1237 -14.9468 -14.9468 -14.9468 -14.9468 -14.7777 -14.7777 -14.7777 -14.7777 -5.8870 -5.8870 -5.8870 -5.8870 -4.2628 -4.2628 -4.2628 -4.2628 -3.1301 -3.1301 -3.1301 -3.1301 -2.9133 -2.9133 -2.9133 -2.9133 -0.8485 -0.8485 -0.8485 -0.8485 -0.6774 -0.6774 -0.6774 -0.6774 0.2168 0.2168 0.2168 0.2168 0.6322 0.6322 0.6322 0.6322 0.9414 0.9414 0.9414 0.9414 1.3979 1.3979 1.3979 1.3979 1.7058 1.7058 1.7058 1.7058 2.0106 2.0106 2.0106 2.0106 8.5083 8.5083 8.5083 8.5083 9.7807 9.7807 9.7807 9.7807 11.3816 11.3816 11.3816 11.3816 k = 0.5000 0.5051 0.0283 ( 5884 PWs) bands (ev): -16.7766 -16.7766 -16.7692 -16.7692 -16.1412 -16.1412 -16.1060 -16.1060 -14.9652 -14.9652 -14.9291 -14.9291 -14.7792 -14.7792 -14.7759 -14.7759 -5.9246 -5.9246 -5.8486 -5.8486 -4.2682 -4.2682 -4.2567 -4.2567 -3.1348 -3.1348 -3.1278 -3.1278 -2.9511 -2.9511 -2.8747 -2.8747 -0.8529 -0.8529 -0.8437 -0.8437 -0.6816 -0.6816 -0.6734 -0.6734 0.2106 0.2106 0.2244 0.2244 0.6291 0.6291 0.6340 0.6340 0.9405 0.9405 0.9422 0.9422 1.3851 1.3851 1.4105 1.4105 1.7039 1.7039 1.7078 1.7078 2.0092 2.0092 2.0121 2.0121 8.4781 8.4781 8.5389 8.5389 9.7625 9.7625 9.7975 9.7975 11.3741 11.3741 11.3913 11.3913 k = 0.5000 0.5062 0.0149 ( 5882 PWs) bands (ev): -16.7801 -16.7801 -16.7652 -16.7652 -16.1583 -16.1583 -16.0879 -16.0879 -14.9842 -14.9842 -14.9124 -14.9124 -14.7803 -14.7803 -14.7738 -14.7738 -5.9612 -5.9612 -5.8096 -5.8096 -4.2729 -4.2729 -4.2500 -4.2500 -3.1432 -3.1432 -3.1272 -3.1272 -2.9867 -2.9867 -2.8363 -2.8363 -0.8571 -0.8571 -0.8388 -0.8388 -0.6860 -0.6860 -0.6696 -0.6696 0.2059 0.2059 0.2333 0.2333 0.6249 0.6249 0.6346 0.6346 0.9397 0.9397 0.9430 0.9430 1.3722 1.3722 1.4228 1.4228 1.7022 1.7022 1.7101 1.7101 2.0080 2.0080 2.0137 2.0137 8.4486 8.4486 8.5700 8.5700 9.7430 9.7430 9.8128 9.8128 11.3687 11.3687 11.4029 11.4029 k = 0.5000 0.5073 0.0016 ( 5886 PWs) bands (ev): -16.7834 -16.7834 -16.7613 -16.7613 -16.1749 -16.1749 -16.0698 -16.0698 -15.0036 -15.0036 -14.8967 -14.8967 -14.7813 -14.7813 -14.7711 -14.7711 -5.9967 -5.9967 -5.7702 -5.7702 -4.2771 -4.2771 -4.2426 -4.2426 -3.1573 -3.1573 -3.1277 -3.1277 -3.0178 -3.0178 -2.7986 -2.7986 -0.8609 -0.8609 -0.8337 -0.8337 -0.6908 -0.6908 -0.6661 -0.6661 0.2028 0.2028 0.2432 0.2432 0.6196 0.6196 0.6337 0.6337 0.9388 0.9388 0.9437 0.9437 1.3595 1.3595 1.4345 1.4345 1.7007 1.7007 1.7126 1.7126 2.0069 2.0069 2.0153 2.0153 8.4198 8.4198 8.6014 8.6014 9.7222 9.7222 9.8266 9.8266 11.3656 11.3656 11.4162 11.4162 k = 0.5000 0.5084-0.0118 ( 5894 PWs) bands (ev): -16.7866 -16.7866 -16.7572 -16.7572 -16.1910 -16.1910 -16.0516 -16.0516 -15.0233 -15.0233 -14.8823 -14.8823 -14.7821 -14.7821 -14.7678 -14.7678 -6.0310 -6.0310 -5.7306 -5.7306 -4.2806 -4.2806 -4.2346 -4.2346 -3.1792 -3.1792 -3.1292 -3.1292 -3.0422 -3.0422 -2.7621 -2.7621 -0.8643 -0.8643 -0.8284 -0.8284 -0.6958 -0.6958 -0.6627 -0.6627 0.2013 0.2013 0.2541 0.2541 0.6133 0.6133 0.6315 0.6315 0.9380 0.9380 0.9443 0.9443 1.3472 1.3472 1.4455 1.4455 1.6994 1.6994 1.7153 1.7153 2.0060 2.0060 2.0169 2.0169 8.3919 8.3919 8.6329 8.6329 9.7005 9.7005 9.8388 9.8388 11.3647 11.3647 11.4311 11.4311 k = 0.5000 0.5095-0.0252 ( 5896 PWs) bands (ev): -16.7895 -16.7895 -16.7532 -16.7532 -16.2064 -16.2064 -16.0335 -16.0335 -15.0432 -15.0432 -14.8693 -14.8693 -14.7828 -14.7828 -14.7638 -14.7638 -6.0639 -6.0639 -5.6909 -5.6909 -4.2835 -4.2835 -4.2260 -4.2260 -3.2094 -3.2094 -3.1313 -3.1313 -3.0593 -3.0593 -2.7269 -2.7269 -0.8674 -0.8674 -0.8230 -0.8230 -0.7010 -0.7010 -0.6594 -0.6594 0.2015 0.2015 0.2657 0.2657 0.6061 0.6061 0.6279 0.6279 0.9372 0.9372 0.9447 0.9447 1.3352 1.3352 1.4557 1.4557 1.6982 1.6982 1.7183 1.7183 2.0054 2.0054 2.0185 2.0185 8.3650 8.3650 8.6645 8.6645 9.6778 9.6778 9.8495 9.8495 11.3661 11.3661 11.4474 11.4474 k = 0.5000 0.5106-0.0386 ( 5898 PWs) bands (ev): -16.7922 -16.7922 -16.7492 -16.7492 -16.2212 -16.2212 -16.0155 -16.0155 -15.0630 -15.0630 -14.8579 -14.8579 -14.7833 -14.7833 -14.7590 -14.7590 -6.0952 -6.0952 -5.6514 -5.6514 -4.2858 -4.2858 -4.2167 -4.2167 -3.2459 -3.2459 -3.1340 -3.1340 -3.0705 -3.0705 -2.6934 -2.6934 -0.8701 -0.8701 -0.8176 -0.8176 -0.7066 -0.7066 -0.6563 -0.6563 0.2035 0.2035 0.2781 0.2781 0.5982 0.5982 0.6229 0.6229 0.9365 0.9365 0.9450 0.9450 1.3239 1.3239 1.4648 1.4648 1.6971 1.6971 1.7216 1.7216 2.0050 2.0050 2.0200 2.0200 8.3393 8.3393 8.6959 8.6959 9.6544 9.6544 9.8586 9.8586 11.3695 11.3695 11.4647 11.4647 k = 0.5000 0.5117-0.0519 ( 5904 PWs) bands (ev): -16.7946 -16.7946 -16.7454 -16.7454 -16.2352 -16.2352 -15.9978 -15.9978 -15.0827 -15.0827 -14.8482 -14.8482 -14.7837 -14.7837 -14.7535 -14.7535 -6.1250 -6.1250 -5.6125 -5.6125 -4.2876 -4.2876 -4.2069 -4.2069 -3.2864 -3.2864 -3.1372 -3.1372 -3.0781 -3.0781 -2.6616 -2.6616 -0.8724 -0.8724 -0.8122 -0.8122 -0.7124 -0.7124 -0.6532 -0.6532 0.2072 0.2072 0.2908 0.2908 0.5896 0.5896 0.6166 0.6166 0.9358 0.9358 0.9450 0.9450 1.3132 1.3132 1.4727 1.4727 1.6963 1.6963 1.7251 1.7251 2.0051 2.0051 2.0216 2.0216 8.3148 8.3148 8.7271 8.7271 9.6306 9.6306 9.8663 9.8663 11.3748 11.3748 11.4827 11.4827 k = 0.5000 0.5128-0.0653 ( 5908 PWs) bands (ev): -16.7968 -16.7968 -16.7416 -16.7416 -16.2484 -16.2484 -15.9806 -15.9806 -15.1019 -15.1019 -14.8400 -14.8400 -14.7841 -14.7841 -14.7472 -14.7472 -6.1531 -6.1531 -5.5742 -5.5742 -4.2889 -4.2889 -4.1965 -4.1965 -3.3290 -3.3290 -3.1407 -3.1407 -3.0834 -3.0834 -2.6318 -2.6318 -0.8743 -0.8743 -0.8070 -0.8070 -0.7185 -0.7185 -0.6503 -0.6503 0.2126 0.2126 0.3038 0.3038 0.5804 0.5804 0.6090 0.6090 0.9352 0.9352 0.9449 0.9449 1.3032 1.3032 1.4795 1.4795 1.6956 1.6956 1.7289 1.7289 2.0055 2.0055 2.0231 2.0231 8.2916 8.2916 8.7577 8.7577 9.6065 9.6065 9.8726 9.8726 11.3818 11.3818 11.5013 11.5013 k = 0.5000 0.5140-0.0787 ( 5910 PWs) bands (ev): -16.7988 -16.7988 -16.7381 -16.7381 -16.2606 -16.2606 -15.9639 -15.9639 -15.1207 -15.1207 -14.8334 -14.8334 -14.7843 -14.7843 -14.7404 -14.7404 -6.1793 -6.1793 -5.5370 -5.5370 -4.2897 -4.2897 -4.1857 -4.1857 -3.3724 -3.3724 -3.1445 -3.1445 -3.0874 -3.0874 -2.6041 -2.6041 -0.8757 -0.8757 -0.8019 -0.8019 -0.7247 -0.7247 -0.6475 -0.6475 0.2197 0.2197 0.3170 0.3170 0.5707 0.5707 0.6002 0.6002 0.9347 0.9347 0.9444 0.9444 1.2941 1.2941 1.4851 1.4851 1.6951 1.6951 1.7328 1.7328 2.0063 2.0063 2.0245 2.0245 8.2699 8.2699 8.7877 8.7877 9.5824 9.5824 9.8776 9.8776 11.3901 11.3901 11.5202 11.5202 k = 0.5000 0.5151-0.0921 ( 5914 PWs) bands (ev): -16.8005 -16.8005 -16.7349 -16.7349 -16.2718 -16.2718 -15.9480 -15.9480 -15.1387 -15.1387 -14.8281 -14.8281 -14.7846 -14.7846 -14.7333 -14.7333 -6.2036 -6.2036 -5.5011 -5.5011 -4.2899 -4.2899 -4.1747 -4.1747 -3.4158 -3.4158 -3.1484 -3.1484 -3.0904 -3.0904 -2.5785 -2.5785 -0.8768 -0.8768 -0.7971 -0.7971 -0.7311 -0.7311 -0.6447 -0.6447 0.2284 0.2284 0.3301 0.3301 0.5606 0.5606 0.5904 0.5904 0.9342 0.9342 0.9438 0.9438 1.2859 1.2859 1.4896 1.4896 1.6948 1.6948 1.7368 1.7368 2.0075 2.0075 2.0259 2.0259 8.2499 8.2499 8.8167 8.8167 9.5588 9.5588 9.8814 9.8814 11.3995 11.3995 11.5390 11.5390 k = 0.5000 0.5162-0.1055 ( 5916 PWs) bands (ev): -16.8019 -16.8019 -16.7319 -16.7319 -16.2819 -16.2819 -15.9331 -15.9331 -15.1558 -15.1558 -14.8239 -14.8239 -14.7847 -14.7847 -14.7263 -14.7263 -6.2260 -6.2260 -5.4668 -5.4668 -4.2898 -4.2898 -4.1636 -4.1636 -3.4583 -3.4583 -3.1525 -3.1525 -3.0928 -3.0928 -2.5553 -2.5553 -0.8774 -0.8774 -0.7927 -0.7927 -0.7375 -0.7375 -0.6420 -0.6420 0.2384 0.2384 0.3429 0.3429 0.5502 0.5502 0.5798 0.5798 0.9337 0.9337 0.9429 0.9429 1.2786 1.2786 1.4931 1.4931 1.6948 1.6948 1.7408 1.7408 2.0091 2.0091 2.0272 2.0272 8.2315 8.2315 8.8443 8.8443 9.5358 9.5358 9.8841 9.8841 11.4095 11.4095 11.5574 11.5574 k = 0.5000 0.5173-0.1188 ( 5922 PWs) bands (ev): -16.8031 -16.8031 -16.7294 -16.7294 -16.2908 -16.2908 -15.9193 -15.9193 -15.1716 -15.1716 -14.8205 -14.8205 -14.7848 -14.7848 -14.7195 -14.7195 -6.2463 -6.2463 -5.4346 -5.4346 -4.2892 -4.2892 -4.1528 -4.1528 -3.4993 -3.4993 -3.1566 -3.1566 -3.0946 -3.0946 -2.5344 -2.5344 -0.8777 -0.8777 -0.7889 -0.7889 -0.7436 -0.7436 -0.6393 -0.6393 0.2496 0.2496 0.3553 0.3553 0.5395 0.5395 0.5685 0.5685 0.9333 0.9333 0.9417 0.9417 1.2722 1.2722 1.4956 1.4956 1.6949 1.6949 1.7446 1.7446 2.0111 2.0111 2.0283 2.0283 8.2150 8.2150 8.8702 8.8702 9.5141 9.5141 9.8857 9.8857 11.4195 11.4195 11.5753 11.5753 k = 0.5000 0.5184-0.1322 ( 5924 PWs) bands (ev): -16.8040 -16.8040 -16.7274 -16.7274 -16.2984 -16.2984 -15.9068 -15.9068 -15.1861 -15.1861 -14.8178 -14.8178 -14.7849 -14.7849 -14.7132 -14.7132 -6.2645 -6.2645 -5.4046 -5.4046 -4.2883 -4.2883 -4.1426 -4.1426 -3.5377 -3.5377 -3.1606 -3.1606 -3.0959 -3.0959 -2.5159 -2.5159 -0.8775 -0.8775 -0.7862 -0.7862 -0.7491 -0.7491 -0.6367 -0.6367 0.2618 0.2618 0.3671 0.3671 0.5286 0.5286 0.5568 0.5568 0.9330 0.9330 0.9403 0.9403 1.2667 1.2667 1.4975 1.4975 1.6952 1.6952 1.7483 1.7483 2.0134 2.0134 2.0294 2.0294 8.2004 8.2004 8.8938 8.8938 9.4942 9.4942 9.8864 9.8864 11.4291 11.4291 11.5924 11.5924 k = 0.5000 0.5195-0.1456 ( 5924 PWs) bands (ev): -16.8046 -16.8046 -16.7259 -16.7259 -16.3047 -16.3047 -15.8960 -15.8960 -15.1988 -15.1988 -14.8156 -14.8156 -14.7849 -14.7849 -14.7075 -14.7075 -6.2805 -6.2805 -5.3772 -5.3772 -4.2869 -4.2869 -4.1336 -4.1336 -3.5728 -3.5728 -3.1645 -3.1645 -3.0967 -3.0967 -2.5000 -2.5000 -0.8770 -0.8770 -0.7852 -0.7852 -0.7534 -0.7534 -0.6342 -0.6342 0.2747 0.2747 0.3782 0.3782 0.5176 0.5176 0.5451 0.5451 0.9327 0.9327 0.9387 0.9387 1.2622 1.2622 1.4987 1.4987 1.6956 1.6956 1.7516 1.7516 2.0161 2.0161 2.0303 2.0303 8.1878 8.1878 8.9147 8.9147 9.4767 9.4767 9.8864 9.8864 11.4378 11.4378 11.6084 11.6084 k = 0.5000 0.5206-0.1590 ( 5918 PWs) bands (ev): -16.8050 -16.8050 -16.7250 -16.7250 -16.3096 -16.3096 -15.8870 -15.8870 -15.2096 -15.2096 -14.8138 -14.8138 -14.7849 -14.7849 -14.7027 -14.7027 -6.2943 -6.2943 -5.3528 -5.3528 -4.2853 -4.2853 -4.1267 -4.1267 -3.6034 -3.6034 -3.1682 -3.1682 -3.0970 -3.0970 -2.4867 -2.4867 -0.8760 -0.8760 -0.7866 -0.7866 -0.7556 -0.7556 -0.6317 -0.6317 0.2876 0.2876 0.3883 0.3883 0.5065 0.5065 0.5338 0.5338 0.9324 0.9324 0.9369 0.9369 1.2587 1.2587 1.4997 1.4997 1.6963 1.6963 1.7546 1.7546 2.0189 2.0189 2.0311 2.0311 8.1774 8.1774 8.9319 8.9319 9.4624 9.4624 9.8856 9.8856 11.4449 11.4449 11.6232 11.6232 k = 0.5000 0.5217-0.1724 ( 5918 PWs) bands (ev): -16.8050 -16.8050 -16.7247 -16.7247 -16.3131 -16.3131 -15.8801 -15.8801 -15.2183 -15.2183 -14.8124 -14.8124 -14.7848 -14.7848 -14.6987 -14.6987 -6.3058 -6.3058 -5.3318 -5.3318 -4.2833 -4.2833 -4.1225 -4.1225 -3.6283 -3.6283 -3.1717 -3.1717 -3.0967 -3.0967 -2.4760 -2.4760 -0.8747 -0.8747 -0.7905 -0.7905 -0.7558 -0.7558 -0.6293 -0.6293 0.3002 0.3002 0.3972 0.3972 0.4956 0.4956 0.5236 0.5236 0.9320 0.9320 0.9350 0.9350 1.2561 1.2561 1.5004 1.5004 1.6971 1.6971 1.7571 1.7571 2.0219 2.0219 2.0318 2.0318 8.1691 8.1691 8.9449 8.9449 9.4519 9.4519 9.8842 9.8842 11.4498 11.4498 11.6366 11.6366 k = 0.5000 0.5228-0.1857 ( 5920 PWs) bands (ev): -16.8048 -16.8048 -16.7251 -16.7251 -16.3151 -16.3151 -15.8754 -15.8754 -15.2246 -15.2246 -14.8112 -14.8112 -14.7847 -14.7847 -14.6958 -14.6958 -6.3150 -6.3150 -5.3143 -5.3143 -4.2811 -4.2811 -4.1221 -4.1221 -3.6463 -3.6463 -3.1749 -3.1749 -3.0959 -3.0959 -2.4680 -2.4680 -0.8730 -0.8730 -0.7962 -0.7962 -0.7545 -0.7545 -0.6269 -0.6269 0.3117 0.3117 0.4044 0.4044 0.4852 0.4852 0.5151 0.5151 0.9315 0.9315 0.9332 0.9332 1.2544 1.2544 1.5011 1.5011 1.6981 1.6981 1.7590 1.7590 2.0248 2.0248 2.0324 2.0324 8.1631 8.1631 8.9530 8.9530 9.4461 9.4461 9.8821 9.8821 11.4520 11.4520 11.6484 11.6484 k = 0.5000 0.5228-0.1857 ( 5920 PWs) bands (ev): -16.8048 -16.8048 -16.7251 -16.7251 -16.3151 -16.3151 -15.8754 -15.8754 -15.2246 -15.2246 -14.8112 -14.8112 -14.7847 -14.7847 -14.6958 -14.6958 -6.3150 -6.3150 -5.3143 -5.3143 -4.2811 -4.2811 -4.1221 -4.1221 -3.6463 -3.6463 -3.1749 -3.1749 -3.0959 -3.0959 -2.4680 -2.4680 -0.8730 -0.8730 -0.7962 -0.7962 -0.7545 -0.7545 -0.6269 -0.6269 0.3117 0.3117 0.4044 0.4044 0.4852 0.4852 0.5151 0.5151 0.9315 0.9315 0.9332 0.9332 1.2544 1.2544 1.5011 1.5011 1.6981 1.6981 1.7590 1.7590 2.0248 2.0248 2.0324 2.0324 8.1631 8.1631 8.9530 8.9530 9.4461 9.4461 9.8821 9.8821 11.4520 11.4520 11.6484 11.6484 k = 0.5000 0.5181-0.1962 ( 5920 PWs) bands (ev): -16.8032 -16.8032 -16.7261 -16.7261 -16.3140 -16.3140 -15.8740 -15.8740 -15.2284 -15.2284 -14.8119 -14.8119 -14.7854 -14.7854 -14.6947 -14.6947 -6.3209 -6.3209 -5.2997 -5.2997 -4.2744 -4.2744 -4.1303 -4.1303 -3.6505 -3.6505 -3.1801 -3.1801 -3.0957 -3.0957 -2.4646 -2.4646 -0.8680 -0.8680 -0.7948 -0.7948 -0.7623 -0.7623 -0.6237 -0.6237 0.3205 0.3205 0.4061 0.4061 0.4774 0.4774 0.5175 0.5175 0.9344 0.9344 0.9378 0.9378 1.2425 1.2425 1.4985 1.4985 1.6961 1.6961 1.7599 1.7599 2.0243 2.0243 2.0312 2.0312 8.1626 8.1626 8.9555 8.9555 9.4472 9.4472 9.8779 9.8779 11.4504 11.4504 11.6617 11.6617 k = 0.5000 0.5134-0.2066 ( 5924 PWs) bands (ev): -16.8019 -16.8019 -16.7269 -16.7269 -16.3132 -16.3132 -15.8731 -15.8731 -15.2311 -15.2311 -14.8124 -14.8124 -14.7858 -14.7858 -14.6939 -14.6939 -6.3250 -6.3250 -5.2890 -5.2890 -4.2697 -4.2697 -4.1365 -4.1365 -3.6534 -3.6534 -3.1840 -3.1840 -3.0956 -3.0956 -2.4622 -2.4622 -0.8644 -0.8644 -0.7928 -0.7928 -0.7688 -0.7688 -0.6213 -0.6213 0.3269 0.3269 0.4077 0.4077 0.4714 0.4714 0.5192 0.5192 0.9363 0.9363 0.9415 0.9415 1.2335 1.2335 1.4967 1.4967 1.6947 1.6947 1.7605 1.7605 2.0239 2.0239 2.0304 2.0304 8.1622 8.1622 8.9573 8.9573 9.4479 9.4479 9.8749 9.8749 11.4492 11.4492 11.6712 11.6712 k = 0.5000 0.5087-0.2170 ( 5918 PWs) bands (ev): -16.8012 -16.8012 -16.7274 -16.7274 -16.3126 -16.3126 -15.8725 -15.8725 -15.2327 -15.2327 -14.8127 -14.8127 -14.7861 -14.7861 -14.6935 -14.6935 -6.3275 -6.3275 -5.2825 -5.2825 -4.2668 -4.2668 -4.1403 -4.1403 -3.6552 -3.6552 -3.1863 -3.1863 -3.0956 -3.0956 -2.4607 -2.4607 -0.8622 -0.8622 -0.7906 -0.7906 -0.7738 -0.7738 -0.6199 -0.6199 0.3308 0.3308 0.4089 0.4089 0.4675 0.4675 0.5202 0.5202 0.9374 0.9374 0.9439 0.9439 1.2279 1.2279 1.4956 1.4956 1.6938 1.6938 1.7608 1.7608 2.0237 2.0237 2.0300 2.0300 8.1620 8.1620 8.9583 8.9583 9.4484 9.4484 9.8731 9.8731 11.4486 11.4486 11.6769 11.6769 k = 0.5000 0.5040-0.2274 ( 5920 PWs) bands (ev): -16.8010 -16.8010 -16.7275 -16.7275 -16.3125 -16.3125 -15.8723 -15.8723 -15.2332 -15.2332 -14.8128 -14.8128 -14.7862 -14.7862 -14.6933 -14.6933 -6.3284 -6.3284 -5.2803 -5.2803 -4.2658 -4.2658 -4.1417 -4.1417 -3.6557 -3.6557 -3.1870 -3.1870 -3.0955 -3.0955 -2.4602 -2.4602 -0.8615 -0.8615 -0.7895 -0.7895 -0.7759 -0.7759 -0.6194 -0.6194 0.3321 0.3321 0.4093 0.4093 0.4662 0.4662 0.5206 0.5206 0.9378 0.9378 0.9448 0.9448 1.2261 1.2261 1.4952 1.4952 1.6936 1.6936 1.7609 1.7609 2.0236 2.0236 2.0299 2.0299 8.1619 8.1619 8.9587 8.9587 9.4486 9.4486 9.8724 9.8724 11.4484 11.4484 11.6788 11.6788 k = 0.5000 0.5040-0.2274 ( 5920 PWs) bands (ev): -16.8010 -16.8010 -16.7275 -16.7275 -16.3125 -16.3125 -15.8723 -15.8723 -15.2332 -15.2332 -14.8128 -14.8128 -14.7862 -14.7862 -14.6933 -14.6933 -6.3284 -6.3284 -5.2803 -5.2803 -4.2658 -4.2658 -4.1417 -4.1417 -3.6557 -3.6557 -3.1870 -3.1870 -3.0955 -3.0955 -2.4602 -2.4602 -0.8615 -0.8615 -0.7895 -0.7895 -0.7759 -0.7759 -0.6194 -0.6194 0.3321 0.3321 0.4093 0.4093 0.4662 0.4662 0.5206 0.5206 0.9378 0.9378 0.9448 0.9448 1.2261 1.2261 1.4952 1.4952 1.6936 1.6936 1.7609 1.7609 2.0236 2.0236 2.0299 2.0299 8.1619 8.1619 8.9587 8.9587 9.4486 9.4486 9.8724 9.8724 11.4484 11.4484 11.6788 11.6788 k = 0.4861 0.5040-0.2274 ( 5916 PWs) bands (ev): -16.8035 -16.8035 -16.7257 -16.7257 -16.3140 -16.3140 -15.8725 -15.8725 -15.2321 -15.2321 -14.8126 -14.8126 -14.7852 -14.7852 -14.6921 -14.6921 -6.3289 -6.3289 -5.2813 -5.2813 -4.2812 -4.2812 -4.1287 -4.1287 -3.6570 -3.6570 -3.1857 -3.1857 -3.0944 -3.0944 -2.4602 -2.4602 -0.8659 -0.8659 -0.7852 -0.7852 -0.7782 -0.7782 -0.6168 -0.6168 0.3263 0.3263 0.4017 0.4017 0.4684 0.4684 0.5259 0.5259 0.9296 0.9296 0.9434 0.9434 1.2345 1.2345 1.4987 1.4987 1.6938 1.6938 1.7647 1.7647 2.0247 2.0247 2.0335 2.0335 8.1599 8.1599 8.9566 8.9566 9.4497 9.4497 9.8734 9.8734 11.4408 11.4408 11.6874 11.6875 k = 0.4722 0.5040-0.2274 ( 5918 PWs) bands (ev): -16.8104 -16.8104 -16.7207 -16.7207 -16.3186 -16.3186 -15.8731 -15.8731 -15.2286 -15.2286 -14.8119 -14.8119 -14.7822 -14.7822 -14.6885 -14.6885 -6.3305 -6.3305 -5.2845 -5.2845 -4.3166 -4.3166 -4.1004 -4.1004 -3.6607 -3.6607 -3.1818 -3.1818 -3.0911 -3.0911 -2.4600 -2.4600 -0.8767 -0.8767 -0.7884 -0.7884 -0.7713 -0.7713 -0.6095 -0.6095 0.3100 0.3100 0.3826 0.3826 0.4740 0.4740 0.5378 0.5378 0.9085 0.9085 0.9397 0.9397 1.2566 1.2566 1.5083 1.5083 1.6946 1.6946 1.7761 1.7761 2.0275 2.0275 2.0454 2.0454 8.1541 8.1541 8.9504 8.9504 9.4528 9.4528 9.8761 9.8761 11.4208 11.4208 11.7102 11.7494 k = 0.4583 0.5040-0.2274 ( 5912 PWs) bands (ev): -16.8205 -16.8205 -16.7139 -16.7139 -16.3261 -16.3261 -15.8740 -15.8740 -15.2231 -15.2231 -14.8108 -14.8108 -14.7771 -14.7771 -14.6824 -14.6824 -6.3333 -6.3333 -5.2896 -5.2896 -4.3610 -4.3610 -4.0678 -4.0678 -3.6668 -3.6668 -3.1754 -3.1754 -3.0857 -3.0857 -2.4596 -2.4596 -0.8902 -0.8902 -0.8009 -0.8009 -0.7555 -0.7555 -0.5989 -0.5989 0.2859 0.2859 0.3574 0.3574 0.4809 0.4809 0.5494 0.5494 0.8819 0.8819 0.9345 0.9345 1.2862 1.2862 1.5221 1.5221 1.6958 1.6958 1.7952 1.7952 2.0323 2.0323 2.0658 2.0658 8.1445 8.1445 8.9403 8.9403 9.4580 9.4580 9.8805 9.8805 11.3936 11.3936 11.6970 11.6970 k = 0.4444 0.5040-0.2274 ( 5916 PWs) bands (ev): -16.8326 -16.8326 -16.7063 -16.7063 -16.3363 -16.3363 -15.8753 -15.8753 -15.2157 -15.2157 -14.8095 -14.8095 -14.7698 -14.7698 -14.6738 -14.6738 -6.3373 -6.3373 -5.2966 -5.2966 -4.4102 -4.4102 -4.0349 -4.0349 -3.6751 -3.6751 -3.1668 -3.1668 -3.0783 -3.0783 -2.4592 -2.4592 -0.9045 -0.9045 -0.8165 -0.8165 -0.7379 -0.7379 -0.5861 -0.5861 0.2562 0.2562 0.3292 0.3292 0.4874 0.4874 0.5553 0.5553 0.8570 0.8570 0.9286 0.9286 1.3180 1.3180 1.5378 1.5378 1.6975 1.6975 1.8215 1.8215 2.0403 2.0403 2.0948 2.0948 8.1314 8.1314 8.9265 8.9265 9.4651 9.4651 9.8864 9.8864 11.3629 11.3629 11.6401 11.6401 k = 0.4306 0.5040-0.2274 ( 5918 PWs) bands (ev): -16.8462 -16.8462 -16.6985 -16.6985 -16.3490 -16.3490 -15.8770 -15.8770 -15.2069 -15.2069 -14.8080 -14.8080 -14.7604 -14.7604 -14.6627 -14.6627 -6.3424 -6.3424 -5.3054 -5.3054 -4.4627 -4.4627 -4.0028 -4.0028 -3.6852 -3.6852 -3.1562 -3.1562 -3.0690 -3.0690 -2.4586 -2.4586 -0.9187 -0.9187 -0.8341 -0.8341 -0.7193 -0.7193 -0.5724 -0.5724 0.2226 0.2226 0.2995 0.2995 0.4930 0.4930 0.5514 0.5514 0.8398 0.8398 0.9228 0.9228 1.3489 1.3489 1.5534 1.5534 1.6995 1.6995 1.8527 1.8527 2.0541 2.0541 2.1324 2.1324 8.1149 8.1149 8.9092 8.9092 9.4739 9.4739 9.8935 9.8935 11.3309 11.3309 11.5819 11.5819 k = 0.4167 0.5040-0.2274 ( 5928 PWs) bands (ev): -16.8607 -16.8607 -16.6909 -16.6909 -16.3638 -16.3638 -15.8789 -15.8789 -15.1970 -15.1970 -14.8064 -14.8064 -14.7486 -14.7486 -14.6491 -14.6491 -6.3490 -6.3490 -5.3156 -5.3156 -4.5179 -4.5179 -3.9720 -3.9720 -3.6971 -3.6971 -3.1438 -3.1438 -3.0582 -3.0582 -2.4578 -2.4578 -0.9323 -0.9323 -0.8529 -0.8529 -0.7004 -0.7004 -0.5582 -0.5582 0.1862 0.1862 0.2691 0.2691 0.4971 0.4971 0.5354 0.5354 0.8335 0.8335 0.9177 0.9177 1.3772 1.3772 1.5679 1.5679 1.7019 1.7019 1.8845 1.8845 2.0773 2.0773 2.1785 2.1785 8.0954 8.0954 8.8890 8.8890 9.4841 9.4841 9.9016 9.9016 11.2989 11.2989 11.5230 11.5230 k = 0.4028 0.5040-0.2274 ( 5922 PWs) bands (ev): -16.8760 -16.8760 -16.6835 -16.6835 -16.3806 -16.3806 -15.8810 -15.8810 -15.1865 -15.1865 -14.8049 -14.8049 -14.7344 -14.7344 -14.6332 -14.6332 -6.3569 -6.3569 -5.3270 -5.3270 -4.5753 -4.5753 -3.9426 -3.9426 -3.7105 -3.7105 -3.1301 -3.1301 -3.0458 -3.0458 -2.4569 -2.4569 -0.9451 -0.9451 -0.8725 -0.8725 -0.6815 -0.6815 -0.5442 -0.5442 0.1481 0.1481 0.2383 0.2383 0.4986 0.4986 0.5099 0.5099 0.8375 0.8375 0.9135 0.9135 1.4019 1.4019 1.5809 1.5809 1.7046 1.7046 1.9114 1.9114 2.1141 2.1141 2.2325 2.2325 8.0732 8.0732 8.8661 8.8661 9.4957 9.4957 9.9103 9.9103 11.2676 11.2676 11.4640 11.4640 k = 0.3889 0.5040-0.2274 ( 5922 PWs) bands (ev): -16.8919 -16.8919 -16.6766 -16.6766 -16.3990 -16.3990 -15.8833 -15.8833 -15.1757 -15.1757 -14.8035 -14.8035 -14.7178 -14.7178 -14.6149 -14.6149 -6.3664 -6.3664 -5.3395 -5.3395 -4.6345 -4.6345 -3.9145 -3.9145 -3.7250 -3.7250 -3.1152 -3.1152 -3.0323 -3.0323 -2.4558 -2.4558 -0.9570 -0.9570 -0.8926 -0.8926 -0.6627 -0.6627 -0.5307 -0.5307 0.1092 0.1092 0.2075 0.2075 0.4721 0.4721 0.5035 0.5035 0.8491 0.8491 0.9105 0.9105 1.4230 1.4230 1.5926 1.5926 1.7077 1.7077 1.9306 1.9306 2.1661 2.1661 2.2937 2.2937 8.0487 8.0487 8.8410 8.8410 9.5083 9.5083 9.9195 9.9195 11.2374 11.2374 11.4050 11.4050 k = 0.3750 0.5040-0.2274 ( 5918 PWs) bands (ev): -16.9082 -16.9082 -16.6701 -16.6701 -16.4186 -16.4186 -15.8858 -15.8858 -15.1650 -15.1650 -14.8022 -14.8022 -14.6988 -14.6988 -14.5945 -14.5945 -6.3774 -6.3774 -5.3525 -5.3525 -4.6952 -4.6952 -3.8876 -3.8876 -3.7406 -3.7406 -3.0993 -3.0993 -3.0177 -3.0177 -2.4544 -2.4544 -0.9677 -0.9677 -0.9129 -0.9129 -0.6445 -0.6445 -0.5179 -0.5179 0.0702 0.0702 0.1769 0.1769 0.4330 0.4330 0.5043 0.5043 0.8654 0.8654 0.9085 0.9085 1.4405 1.4405 1.6034 1.6034 1.7113 1.7113 1.9427 1.9427 2.2310 2.2310 2.3613 2.3613 8.0221 8.0221 8.8140 8.8140 9.5217 9.5217 9.9287 9.9287 11.2086 11.2086 11.3465 11.3465 k = 0.3611 0.5040-0.2274 ( 5926 PWs) bands (ev): -16.9248 -16.9248 -16.6641 -16.6641 -16.4392 -16.4392 -15.8884 -15.8884 -15.1547 -15.1547 -14.8010 -14.8010 -14.6773 -14.6773 -14.5723 -14.5723 -6.3902 -6.3902 -5.3660 -5.3660 -4.7573 -4.7573 -3.8619 -3.8619 -3.7569 -3.7569 -3.0829 -3.0829 -3.0024 -3.0024 -2.4529 -2.4529 -0.9773 -0.9773 -0.9333 -0.9333 -0.6268 -0.6268 -0.5060 -0.5060 0.0315 0.0315 0.1465 0.1465 0.3914 0.3914 0.5047 0.5047 0.8841 0.8841 0.9074 0.9074 1.4549 1.4549 1.6135 1.6135 1.7153 1.7153 1.9501 1.9501 2.3053 2.3053 2.4342 2.4342 7.9939 7.9939 8.7856 8.7856 9.5357 9.5357 9.9377 9.9377 11.1813 11.1813 11.2888 11.2888 k = 0.3472 0.5040-0.2274 ( 5920 PWs) bands (ev): -16.9416 -16.9416 -16.6586 -16.6586 -16.4606 -16.4606 -15.8911 -15.8911 -15.1451 -15.1451 -14.7999 -14.7999 -14.6536 -14.6536 -14.5483 -14.5483 -6.4048 -6.4048 -5.3794 -5.3794 -4.8202 -4.8202 -3.8373 -3.8373 -3.7740 -3.7740 -3.0659 -3.0659 -2.9865 -2.9865 -2.4511 -2.4511 -0.9856 -0.9856 -0.9536 -0.9536 -0.6098 -0.6098 -0.4952 -0.4952 -0.0061 -0.0061 0.1164 0.1164 0.3491 0.3491 0.5048 0.5048 0.9037 0.9037 0.9073 0.9073 1.4665 1.4665 1.6232 1.6232 1.7199 1.7199 1.9544 1.9544 2.3861 2.3861 2.5114 2.5114 7.9644 7.9644 8.7561 8.7561 9.5500 9.5500 9.9464 9.9464 11.1556 11.1556 11.2321 11.2321 k = 0.3333 0.5040-0.2274 ( 5920 PWs) bands (ev): -16.9585 -16.9585 -16.6535 -16.6535 -16.4824 -16.4824 -15.8938 -15.8938 -15.1362 -15.1362 -14.7989 -14.7989 -14.6278 -14.6278 -14.5228 -14.5228 -6.4212 -6.4212 -5.3927 -5.3927 -4.8839 -4.8839 -3.8136 -3.8136 -3.7915 -3.7915 -3.0486 -3.0486 -2.9702 -2.9702 -2.4491 -2.4491 -0.9926 -0.9926 -0.9738 -0.9738 -0.5938 -0.5938 -0.4856 -0.4856 -0.0424 -0.0424 0.0865 0.0865 0.3074 0.3074 0.5046 0.5046 0.9072 0.9072 0.9238 0.9238 1.4757 1.4757 1.6327 1.6327 1.7252 1.7252 1.9569 1.9569 2.4715 2.4715 2.5922 2.5922 7.9339 7.9339 8.7257 8.7257 9.5645 9.5645 9.9545 9.9545 11.1316 11.1316 11.1767 11.1767 k = 0.3194 0.5040-0.2274 ( 5916 PWs) bands (ev): -16.9754 -16.9754 -16.6490 -16.6490 -16.5045 -16.5045 -15.8964 -15.8964 -15.1282 -15.1282 -14.7980 -14.7980 -14.6001 -14.6001 -14.4960 -14.4960 -6.4394 -6.4394 -5.4054 -5.4054 -4.9480 -4.9480 -3.8095 -3.8095 -3.7904 -3.7904 -3.0312 -3.0312 -2.9538 -2.9538 -2.4469 -2.4469 -0.9985 -0.9985 -0.9935 -0.9935 -0.5789 -0.5789 -0.4773 -0.4773 -0.0770 -0.0770 0.0569 0.0569 0.2670 0.2670 0.5044 0.5044 0.9079 0.9079 0.9431 0.9431 1.4830 1.4830 1.6421 1.6421 1.7313 1.7313 1.9581 1.9581 2.5598 2.5598 2.6756 2.6756 7.9028 7.9028 8.6950 8.6950 9.5789 9.5789 9.9619 9.9619 11.1090 11.1090 11.1233 11.1233 k = 0.3056 0.5040-0.2274 ( 5912 PWs) bands (ev): -16.9922 -16.9922 -16.6449 -16.6449 -16.5267 -16.5267 -15.8991 -15.8991 -15.1210 -15.1210 -14.7971 -14.7971 -14.5707 -14.5707 -14.4682 -14.4682 -6.4595 -6.4595 -5.4174 -5.4174 -5.0121 -5.0121 -3.8276 -3.8276 -3.7683 -3.7683 -3.0137 -3.0137 -2.9373 -2.9373 -2.4445 -2.4445 -1.0137 -1.0137 -1.0022 -1.0022 -0.5652 -0.5652 -0.4705 -0.4705 -0.1095 -0.1095 0.0273 0.0273 0.2285 0.2285 0.5043 0.5043 0.9087 0.9087 0.9614 0.9614 1.4887 1.4887 1.6515 1.6515 1.7381 1.7381 1.9584 1.9584 2.6502 2.6502 2.7608 2.7608 7.8713 7.8713 8.6641 8.6641 9.5932 9.5932 9.9684 9.9684 11.0697 11.0697 11.0899 11.0899 k = 0.2917 0.5040-0.2274 ( 5914 PWs) bands (ev): -17.0088 -17.0088 -16.6412 -16.6412 -16.5487 -16.5487 -15.9017 -15.9017 -15.1147 -15.1147 -14.7964 -14.7964 -14.5401 -14.5401 -14.4396 -14.4396 -6.4814 -6.4814 -5.4285 -5.4285 -5.0761 -5.0761 -3.8458 -3.8458 -3.7468 -3.7468 -2.9964 -2.9964 -2.9209 -2.9209 -2.4420 -2.4420 -1.0329 -1.0329 -1.0050 -1.0050 -0.5529 -0.5529 -0.4652 -0.4652 -0.1398 -0.1398 -0.0025 -0.0025 0.1927 0.1927 0.5043 0.5043 0.9096 0.9096 0.9784 0.9784 1.4930 1.4930 1.6610 1.6610 1.7457 1.7457 1.9580 1.9580 2.7416 2.7416 2.8471 2.8471 7.8398 7.8398 8.6333 8.6333 9.6070 9.6070 9.9740 9.9740 11.0196 11.0196 11.0711 11.0711 k = 0.2778 0.5040-0.2274 ( 5910 PWs) bands (ev): -17.0253 -17.0253 -16.6379 -16.6379 -16.5705 -16.5705 -15.9042 -15.9042 -15.1092 -15.1092 -14.7957 -14.7957 -14.5084 -14.5084 -14.4105 -14.4105 -6.5049 -6.5049 -5.4385 -5.4385 -5.1395 -5.1395 -3.8640 -3.8640 -3.7259 -3.7259 -2.9793 -2.9793 -2.9049 -2.9049 -2.4392 -2.4392 -1.0519 -1.0519 -1.0064 -1.0064 -0.5421 -0.5421 -0.4614 -0.4614 -0.1676 -0.1676 -0.0326 -0.0326 0.1599 0.1599 0.5047 0.5047 0.9104 0.9104 0.9940 0.9940 1.4962 1.4962 1.6706 1.6706 1.7542 1.7542 1.9571 1.9571 2.8334 2.8334 2.9340 2.9340 7.8085 7.8085 8.6028 8.6028 9.6204 9.6204 9.9786 9.9786 10.9712 10.9712 11.0542 11.0542 k = 0.2639 0.5040-0.2274 ( 5918 PWs) bands (ev): -17.0413 -17.0413 -16.6350 -16.6350 -16.5919 -16.5919 -15.9067 -15.9067 -15.1045 -15.1045 -14.7950 -14.7950 -14.4760 -14.4760 -14.3810 -14.3810 -6.5300 -6.5300 -5.4474 -5.4474 -5.2022 -5.2022 -3.8822 -3.8822 -3.7056 -3.7056 -2.9625 -2.9625 -2.8892 -2.8892 -2.4364 -2.4364 -1.0704 -1.0704 -1.0063 -1.0063 -0.5329 -0.5329 -0.4594 -0.4594 -0.1929 -0.1929 -0.0634 -0.0634 0.1306 0.1306 0.5054 0.5054 0.9111 0.9111 1.0079 1.0079 1.4985 1.4985 1.6803 1.6803 1.7634 1.7634 1.9558 1.9558 2.9249 2.9249 3.0208 3.0208 7.7776 7.7776 8.5729 8.5729 9.6330 9.6330 9.9821 9.9821 10.9249 10.9249 11.0390 11.0390 k = 0.2500 0.5040-0.2274 ( 5912 PWs) bands (ev): -17.0570 -17.0570 -16.6324 -16.6324 -16.6127 -16.6127 -15.9090 -15.9090 -15.1004 -15.1004 -14.7944 -14.7944 -14.4432 -14.4432 -14.3514 -14.3514 -6.5563 -6.5563 -5.4550 -5.4550 -5.2638 -5.2638 -3.9001 -3.9001 -3.6859 -3.6859 -2.9461 -2.9461 -2.8739 -2.8739 -2.4335 -2.4335 -1.0884 -1.0884 -1.0048 -1.0048 -0.5254 -0.5254 -0.4589 -0.4589 -0.2156 -0.2156 -0.0948 -0.0948 0.1050 0.1050 0.5066 0.5066 0.9115 0.9115 1.0202 1.0202 1.5000 1.5000 1.6901 1.6901 1.7734 1.7734 1.9542 1.9542 3.0154 3.0154 3.1069 3.1069 7.7473 7.7473 8.5437 8.5437 9.6449 9.6449 9.9845 9.9845 10.8809 10.8809 11.0255 11.0255 k = 0.2361 0.5040-0.2274 ( 5916 PWs) bands (ev): -17.0722 -17.0722 -16.6332 -16.6332 -16.6299 -16.6299 -15.9112 -15.9112 -15.0969 -15.0969 -14.7939 -14.7939 -14.4103 -14.4103 -14.3219 -14.3219 -6.5837 -6.5837 -5.4614 -5.4614 -5.3240 -5.3240 -3.9176 -3.9176 -3.6669 -3.6669 -2.9301 -2.9301 -2.8592 -2.8592 -2.4305 -2.4305 -1.1060 -1.1060 -1.0018 -1.0018 -0.5196 -0.5196 -0.4600 -0.4600 -0.2357 -0.2357 -0.1270 -0.1270 0.0833 0.0833 0.5082 0.5082 0.9117 0.9117 1.0308 1.0308 1.5010 1.5010 1.7000 1.7000 1.7840 1.7840 1.9521 1.9521 3.1046 3.1046 3.1917 3.1917 7.7179 7.7179 8.5155 8.5155 9.6559 9.6559 9.9860 9.9860 10.8393 10.8393 11.0134 11.0134 k = 0.2222 0.5040-0.2274 ( 5914 PWs) bands (ev): -17.0869 -17.0869 -16.6524 -16.6524 -16.6281 -16.6281 -15.9133 -15.9133 -15.0940 -15.0940 -14.7933 -14.7933 -14.3775 -14.3775 -14.2927 -14.2927 -6.6119 -6.6119 -5.4666 -5.4666 -5.3826 -5.3826 -3.9348 -3.9348 -3.6484 -3.6484 -2.9146 -2.9146 -2.8452 -2.8452 -2.4275 -2.4275 -1.1229 -1.1229 -0.9974 -0.9974 -0.5154 -0.5154 -0.4625 -0.4625 -0.2532 -0.2532 -0.1598 -0.1598 0.0652 0.0652 0.5103 0.5103 0.9114 0.9114 1.0397 1.0397 1.5015 1.5015 1.7101 1.7101 1.7952 1.7952 1.9498 1.9498 3.1918 3.1918 3.2749 3.2749 7.6895 7.6895 8.4884 8.4884 9.6659 9.6659 9.9864 9.9864 10.8001 10.8001 11.0028 11.0028 k = 0.2083 0.5040-0.2274 ( 5916 PWs) bands (ev): -17.1010 -17.1010 -16.6710 -16.6710 -16.6263 -16.6263 -15.9153 -15.9153 -15.0915 -15.0915 -14.7928 -14.7928 -14.3453 -14.3453 -14.2640 -14.2640 -6.6405 -6.6405 -5.4707 -5.4707 -5.4392 -5.4392 -3.9515 -3.9515 -3.6306 -3.6306 -2.8997 -2.8997 -2.8319 -2.8319 -2.4245 -2.4245 -1.1392 -1.1392 -0.9916 -0.9916 -0.5129 -0.5129 -0.4662 -0.4662 -0.2684 -0.2684 -0.1931 -0.1931 0.0506 0.0506 0.5128 0.5128 0.9108 0.9108 1.0471 1.0471 1.5016 1.5016 1.7202 1.7202 1.8068 1.8068 1.9472 1.9472 3.2766 3.2766 3.3559 3.3559 7.6624 7.6624 8.4624 8.4624 9.6749 9.6749 9.9859 9.9859 10.7636 10.7636 10.9935 10.9936 k = 0.1944 0.5040-0.2274 ( 5912 PWs) bands (ev): -17.1144 -17.1144 -16.6887 -16.6887 -16.6248 -16.6248 -15.9171 -15.9171 -15.0894 -15.0894 -14.7924 -14.7924 -14.3137 -14.3137 -14.2360 -14.2360 -6.6693 -6.6693 -5.4939 -5.4939 -5.4736 -5.4736 -3.9676 -3.9676 -3.6135 -3.6135 -2.8854 -2.8854 -2.8193 -2.8193 -2.4216 -2.4216 -1.1548 -1.1548 -0.9845 -0.9845 -0.5119 -0.5119 -0.4708 -0.4708 -0.2815 -0.2815 -0.2265 -0.2265 0.0392 0.0392 0.5158 0.5158 0.9097 0.9097 1.0529 1.0529 1.5015 1.5015 1.7305 1.7305 1.8186 1.8186 1.9442 1.9442 3.3584 3.3584 3.4343 3.4343 7.6365 7.6365 8.4378 8.4378 9.6828 9.6828 9.9847 9.9847 10.7296 10.7296 10.9855 10.9855 k = 0.1806 0.5040-0.2274 ( 5904 PWs) bands (ev): -17.1272 -17.1272 -16.7055 -16.7055 -16.6235 -16.6235 -15.9188 -15.9188 -15.0877 -15.0877 -14.7920 -14.7920 -14.2831 -14.2831 -14.2090 -14.2090 -6.6980 -6.6980 -5.5458 -5.5458 -5.4758 -5.4758 -3.9830 -3.9830 -3.5972 -3.5972 -2.8718 -2.8718 -2.8075 -2.8075 -2.4189 -2.4189 -1.1697 -1.1697 -0.9760 -0.9760 -0.5123 -0.5123 -0.4760 -0.4760 -0.2927 -0.2927 -0.2599 -0.2599 0.0306 0.0306 0.5191 0.5191 0.9083 0.9083 1.0575 1.0575 1.5011 1.5011 1.7408 1.7408 1.8306 1.8306 1.9409 1.9409 3.4369 3.4369 3.5095 3.5095 7.6120 7.6120 8.4146 8.4146 9.6897 9.6897 9.9827 9.9827 10.6983 10.6983 10.9785 10.9785 k = 0.1667 0.5040-0.2274 ( 5908 PWs) bands (ev): -17.1391 -17.1391 -16.7212 -16.7212 -16.6224 -16.6224 -15.9204 -15.9204 -15.0863 -15.0863 -14.7916 -14.7916 -14.2538 -14.2538 -14.1831 -14.1831 -6.7261 -6.7261 -5.5950 -5.5950 -5.4771 -5.4771 -3.9976 -3.9976 -3.5816 -3.5816 -2.8589 -2.8589 -2.7965 -2.7965 -2.4163 -2.4163 -1.1838 -1.1838 -0.9662 -0.9662 -0.5137 -0.5137 -0.4815 -0.4815 -0.3025 -0.3025 -0.2930 -0.2930 0.0243 0.0243 0.5228 0.5228 0.9065 0.9065 1.0609 1.0609 1.5006 1.5006 1.7511 1.7511 1.8424 1.8424 1.9373 1.9373 3.5117 3.5117 3.5812 3.5812 7.5892 7.5892 8.3929 8.3929 9.6955 9.6955 9.9801 9.9801 10.6697 10.6697 10.9725 10.9725 k = 0.1528 0.5040-0.2274 ( 5910 PWs) bands (ev): -17.1503 -17.1503 -16.7358 -16.7358 -16.6215 -16.6215 -15.9218 -15.9218 -15.0851 -15.0851 -14.7912 -14.7912 -14.2259 -14.2259 -14.1586 -14.1586 -6.7533 -6.7533 -5.6414 -5.6414 -5.4776 -5.4776 -4.0114 -4.0114 -3.5670 -3.5670 -2.8467 -2.8467 -2.7864 -2.7864 -2.4139 -2.4139 -1.1971 -1.1971 -0.9553 -0.9553 -0.5161 -0.5161 -0.4871 -0.4871 -0.3259 -0.3259 -0.3108 -0.3108 0.0200 0.0200 0.5267 0.5267 0.9044 0.9044 1.0632 1.0632 1.5000 1.5000 1.7615 1.7615 1.8540 1.8540 1.9334 1.9334 3.5822 3.5822 3.6488 3.6488 7.5679 7.5679 8.3728 8.3728 9.7002 9.7002 9.9771 9.9771 10.6438 10.6438 10.9674 10.9674 k = 0.1389 0.5040-0.2274 ( 5918 PWs) bands (ev): -17.1607 -17.1607 -16.7493 -16.7493 -16.6207 -16.6207 -15.9231 -15.9231 -15.0841 -15.0841 -14.7909 -14.7909 -14.1996 -14.1996 -14.1355 -14.1355 -6.7794 -6.7794 -5.6845 -5.6845 -5.4777 -5.4777 -4.0243 -4.0243 -3.5533 -3.5533 -2.8353 -2.8353 -2.7771 -2.7771 -2.4117 -2.4117 -1.2095 -1.2095 -0.9432 -0.9432 -0.5192 -0.5192 -0.4925 -0.4925 -0.3579 -0.3579 -0.3183 -0.3183 0.0173 0.0173 0.5308 0.5308 0.9020 0.9020 1.0646 1.0646 1.4993 1.4993 1.7718 1.7718 1.8653 1.8653 1.9291 1.9291 3.6481 3.6481 3.7122 3.7122 7.5483 7.5483 8.3543 8.3543 9.7039 9.7039 9.9737 9.9737 10.6205 10.6205 10.9630 10.9630 k = 0.1250 0.5040-0.2274 ( 5930 PWs) bands (ev): -17.1701 -17.1701 -16.7616 -16.7616 -16.6201 -16.6201 -15.9243 -15.9243 -15.0833 -15.0833 -14.7906 -14.7906 -14.1753 -14.1753 -14.1140 -14.1140 -6.8041 -6.8041 -5.7242 -5.7242 -5.4773 -5.4773 -4.0363 -4.0363 -3.5406 -3.5406 -2.8247 -2.8247 -2.7688 -2.7688 -2.4098 -2.4098 -1.2209 -1.2209 -0.9302 -0.9302 -0.5228 -0.5228 -0.4976 -0.4976 -0.3892 -0.3892 -0.3249 -0.3249 0.0159 0.0159 0.5350 0.5350 0.8994 0.8994 1.0654 1.0654 1.4985 1.4985 1.7820 1.7820 1.8759 1.8759 1.9245 1.9245 3.7091 3.7091 3.7707 3.7707 7.5305 7.5305 8.3375 8.3375 9.7068 9.7068 9.9702 9.9702 10.5999 10.5999 10.9593 10.9593 k = 0.1111 0.5040-0.2274 ( 5926 PWs) bands (ev): -17.1787 -17.1787 -16.7727 -16.7727 -16.6195 -16.6195 -15.9254 -15.9254 -15.0827 -15.0827 -14.7903 -14.7903 -14.1529 -14.1529 -14.0944 -14.0944 -6.8269 -6.8269 -5.7604 -5.7604 -5.4765 -5.4765 -4.0471 -4.0471 -3.5290 -3.5290 -2.8151 -2.8151 -2.7613 -2.7613 -2.4081 -2.4081 -1.2312 -1.2312 -0.9163 -0.9163 -0.5266 -0.5266 -0.5022 -0.5022 -0.4193 -0.4193 -0.3307 -0.3307 0.0155 0.0155 0.5392 0.5392 0.8968 0.8968 1.0656 1.0656 1.4978 1.4978 1.7922 1.7922 1.8858 1.8858 1.9196 1.9196 3.7647 3.7647 3.8242 3.8242 7.5144 7.5144 8.3224 8.3224 9.7089 9.7089 9.9666 9.9666 10.5818 10.5818 10.9562 10.9562 k = 0.0972 0.5040-0.2274 ( 5926 PWs) bands (ev): -17.1863 -17.1863 -16.7825 -16.7825 -16.6191 -16.6191 -15.9263 -15.9263 -15.0822 -15.0822 -14.7901 -14.7901 -14.1328 -14.1328 -14.0767 -14.0767 -6.8478 -6.8478 -5.7927 -5.7927 -5.4756 -5.4756 -4.0568 -4.0568 -3.5186 -3.5186 -2.8064 -2.8064 -2.7547 -2.7547 -2.4067 -2.4067 -1.2405 -1.2405 -0.9018 -0.9018 -0.5305 -0.5305 -0.5063 -0.5063 -0.4480 -0.4480 -0.3358 -0.3358 0.0157 0.0157 0.5432 0.5432 0.8940 0.8940 1.0654 1.0654 1.4971 1.4971 1.8022 1.8022 1.8949 1.8949 1.9143 1.9143 3.8146 3.8146 3.8722 3.8722 7.5002 7.5002 8.3091 8.3091 9.7103 9.7103 9.9630 9.9630 10.5661 10.5661 10.9537 10.9537 k = 0.0833 0.5040-0.2274 ( 5928 PWs) bands (ev): -17.1930 -17.1930 -16.7911 -16.7911 -16.6187 -16.6187 -15.9271 -15.9271 -15.0818 -15.0818 -14.7899 -14.7899 -14.1150 -14.1150 -14.0611 -14.0611 -6.8664 -6.8664 -5.8211 -5.8211 -5.4746 -5.4746 -4.0654 -4.0654 -3.5095 -3.5095 -2.7987 -2.7987 -2.7490 -2.7490 -2.4055 -2.4055 -1.2487 -1.2487 -0.8870 -0.8870 -0.5343 -0.5343 -0.5101 -0.5101 -0.4747 -0.4747 -0.3403 -0.3403 0.0164 0.0164 0.5471 0.5471 0.8914 0.8914 1.0649 1.0649 1.4965 1.4965 1.8120 1.8120 1.9027 1.9027 1.9089 1.9089 3.8585 3.8585 3.9145 3.9145 7.4878 7.4878 8.2975 8.2975 9.7111 9.7111 9.9597 9.9597 10.5528 10.5528 10.9515 10.9515 k = 0.0694 0.5040-0.2274 ( 5920 PWs) bands (ev): -17.1987 -17.1987 -16.7984 -16.7984 -16.6184 -16.6184 -15.9277 -15.9277 -15.0815 -15.0815 -14.7897 -14.7897 -14.0998 -14.0998 -14.0477 -14.0477 -6.8824 -6.8824 -5.8454 -5.8454 -5.4735 -5.4735 -4.0727 -4.0727 -3.5016 -3.5016 -2.7921 -2.7921 -2.7442 -2.7442 -2.4045 -2.4045 -1.2557 -1.2557 -0.8723 -0.8723 -0.5382 -0.5382 -0.5144 -0.5144 -0.4981 -0.4981 -0.3442 -0.3442 0.0173 0.0173 0.5505 0.5505 0.8890 0.8890 1.0643 1.0643 1.4959 1.4959 1.8217 1.8217 1.9020 1.9020 1.9105 1.9105 3.8962 3.8962 3.9508 3.9508 7.4774 7.4774 8.2877 8.2877 9.7116 9.7116 9.9567 9.9567 10.5417 10.5417 10.9498 10.9498 k = 0.0556 0.5040-0.2274 ( 5904 PWs) bands (ev): -17.2033 -17.2033 -16.8044 -16.8044 -16.6182 -16.6182 -15.9283 -15.9283 -15.0812 -15.0812 -14.7896 -14.7896 -14.0871 -14.0871 -14.0366 -14.0366 -6.8959 -6.8959 -5.8654 -5.8654 -5.4725 -5.4725 -4.0788 -4.0788 -3.4950 -3.4950 -2.7866 -2.7866 -2.7403 -2.7403 -2.4037 -2.4037 -1.2615 -1.2615 -0.8583 -0.8583 -0.5425 -0.5425 -0.5251 -0.5251 -0.5109 -0.5109 -0.3474 -0.3474 0.0183 0.0183 0.5535 0.5535 0.8868 0.8868 1.0637 1.0637 1.4954 1.4954 1.8311 1.8311 1.8958 1.8958 1.9162 1.9162 3.9273 3.9273 3.9808 3.9808 7.4688 7.4688 8.2796 8.2796 9.7117 9.7117 9.9541 9.9541 10.5329 10.5329 10.9485 10.9485 k = 0.0417 0.5040-0.2274 ( 5902 PWs) bands (ev): -17.2070 -17.2070 -16.8091 -16.8091 -16.6180 -16.6180 -15.9287 -15.9287 -15.0811 -15.0811 -14.7894 -14.7894 -14.0771 -14.0771 -14.0279 -14.0279 -6.9065 -6.9065 -5.8811 -5.8811 -5.4717 -5.4717 -4.0835 -4.0835 -3.4899 -3.4899 -2.7823 -2.7823 -2.7372 -2.7372 -2.4031 -2.4031 -1.2660 -1.2660 -0.8456 -0.8456 -0.5507 -0.5507 -0.5370 -0.5370 -0.5144 -0.5144 -0.3499 -0.3499 0.0192 0.0192 0.5560 0.5560 0.8850 0.8850 1.0631 1.0631 1.4950 1.4950 1.8403 1.8403 1.8890 1.8890 1.9209 1.9209 3.9518 3.9518 4.0043 4.0043 7.4621 7.4621 8.2733 8.2733 9.7117 9.7117 9.9520 9.9520 10.5261 10.5261 10.9475 10.9475 k = 0.0278 0.5040-0.2274 ( 5904 PWs) bands (ev): -17.2096 -17.2096 -16.8125 -16.8125 -16.6179 -16.6179 -15.9290 -15.9290 -15.0810 -15.0810 -14.7894 -14.7894 -14.0700 -14.0700 -14.0216 -14.0216 -6.9141 -6.9141 -5.8924 -5.8924 -5.4711 -5.4711 -4.0870 -4.0870 -3.4862 -3.4862 -2.7792 -2.7792 -2.7350 -2.7350 -2.4028 -2.4028 -1.2693 -1.2693 -0.8353 -0.8353 -0.5628 -0.5628 -0.5414 -0.5414 -0.5160 -0.5160 -0.3518 -0.3518 0.0199 0.0199 0.5578 0.5578 0.8836 0.8836 1.0626 1.0626 1.4947 1.4947 1.8491 1.8491 1.8818 1.8818 1.9242 1.9242 3.9693 3.9693 4.0213 4.0213 7.4573 7.4573 8.2689 8.2689 9.7116 9.7116 9.9504 9.9504 10.5213 10.5213 10.9468 10.9468 k = 0.0139 0.5040-0.2274 ( 5906 PWs) bands (ev): -17.2111 -17.2111 -16.8145 -16.8145 -16.6179 -16.6179 -15.9292 -15.9292 -15.0809 -15.0809 -14.7893 -14.7893 -14.0657 -14.0657 -14.0178 -14.0178 -6.9188 -6.9188 -5.8992 -5.8992 -5.4707 -5.4707 -4.0890 -4.0890 -3.4840 -3.4840 -2.7773 -2.7773 -2.7337 -2.7337 -2.4025 -2.4025 -1.2712 -1.2712 -0.8285 -0.8285 -0.5717 -0.5717 -0.5431 -0.5431 -0.5168 -0.5168 -0.3529 -0.3529 0.0203 0.0203 0.5589 0.5589 0.8828 0.8828 1.0623 1.0623 1.4945 1.4945 1.8576 1.8576 1.8744 1.8744 1.9263 1.9263 3.9799 3.9799 4.0315 4.0315 7.4545 7.4545 8.2662 8.2662 9.7116 9.7116 9.9494 9.9494 10.5184 10.5184 10.9464 10.9464 k = 0.0000 0.5040-0.2274 ( 5902 PWs) bands (ev): -17.2117 -17.2117 -16.8152 -16.8152 -16.6178 -16.6178 -15.9292 -15.9292 -15.0809 -15.0809 -14.7893 -14.7893 -14.0642 -14.0642 -14.0165 -14.0165 -6.9203 -6.9203 -5.9014 -5.9014 -5.4706 -5.4706 -4.0897 -4.0897 -3.4832 -3.4832 -2.7766 -2.7766 -2.7333 -2.7333 -2.4025 -2.4025 -1.2719 -1.2719 -0.8261 -0.8261 -0.5749 -0.5749 -0.5436 -0.5436 -0.5171 -0.5171 -0.3532 -0.3532 0.0205 0.0205 0.5593 0.5593 0.8825 0.8825 1.0622 1.0622 1.4944 1.4944 1.8640 1.8640 1.8684 1.8684 1.9269 1.9269 3.9835 3.9835 4.0349 4.0349 7.4535 7.4535 8.2653 8.2653 9.7115 9.7115 9.9491 9.9491 10.5174 10.5174 10.9462 10.9462 k = 0.0000 0.5040-0.2274 ( 5902 PWs) bands (ev): -17.2117 -17.2117 -16.8152 -16.8152 -16.6178 -16.6178 -15.9292 -15.9292 -15.0809 -15.0809 -14.7893 -14.7893 -14.0642 -14.0642 -14.0165 -14.0165 -6.9203 -6.9203 -5.9014 -5.9014 -5.4706 -5.4706 -4.0897 -4.0897 -3.4832 -3.4832 -2.7766 -2.7766 -2.7333 -2.7333 -2.4025 -2.4025 -1.2719 -1.2719 -0.8261 -0.8261 -0.5749 -0.5749 -0.5436 -0.5436 -0.5171 -0.5171 -0.3532 -0.3532 0.0205 0.0205 0.5593 0.5593 0.8825 0.8825 1.0622 1.0622 1.4944 1.4944 1.8640 1.8640 1.8684 1.8684 1.9269 1.9269 3.9835 3.9835 4.0349 4.0349 7.4535 7.4535 8.2653 8.2653 9.7115 9.7115 9.9491 9.9491 10.5174 10.5174 10.9462 10.9462 k = 0.0000 0.5087-0.2170 ( 5902 PWs) bands (ev): -17.2118 -17.2118 -16.8156 -16.8156 -16.6174 -16.6174 -15.9295 -15.9295 -15.0805 -15.0805 -14.7894 -14.7894 -14.0642 -14.0642 -14.0165 -14.0165 -6.9204 -6.9204 -5.9024 -5.9024 -5.4695 -5.4695 -4.0906 -4.0906 -3.4826 -3.4826 -2.7785 -2.7785 -2.7316 -2.7316 -2.4026 -2.4026 -1.2710 -1.2710 -0.8260 -0.8260 -0.5763 -0.5763 -0.5665 -0.5665 -0.4927 -0.4927 -0.3537 -0.3537 0.0200 0.0200 0.5580 0.5580 0.8832 0.8832 1.0622 1.0622 1.4961 1.4961 1.8605 1.8605 1.8684 1.8684 1.9300 1.9300 3.9836 3.9836 4.0350 4.0350 7.4544 7.4544 8.2618 8.2618 9.7148 9.7148 9.9498 9.9498 10.5169 10.5169 10.9459 10.9459 k = 0.0000 0.5134-0.2066 ( 5909 PWs) bands (ev): -17.2121 -17.2121 -16.8168 -16.8168 -16.6160 -16.6160 -15.9301 -15.9301 -15.0793 -15.0793 -14.7895 -14.7895 -14.0641 -14.0641 -14.0164 -14.0164 -6.9207 -6.9207 -5.9052 -5.9052 -5.4664 -5.4664 -4.0932 -4.0932 -3.4807 -3.4807 -2.7833 -2.7833 -2.7271 -2.7271 -2.4029 -2.4029 -1.2684 -1.2684 -0.8257 -0.8257 -0.6036 -0.6036 -0.5729 -0.5729 -0.4588 -0.4588 -0.3550 -0.3550 0.0184 0.0184 0.5541 0.5541 0.8852 0.8852 1.0622 1.0622 1.5010 1.5010 1.8518 1.8518 1.8683 1.8683 1.9379 1.9379 3.9839 3.9839 4.0352 4.0352 7.4570 7.4570 8.2514 8.2514 9.7243 9.7243 9.9520 9.9520 10.5153 10.5153 10.9449 10.9449 k = 0.0000 0.5181-0.1962 ( 5910 PWs) bands (ev): -17.2126 -17.2126 -16.8188 -16.8188 -16.6136 -16.6136 -15.9311 -15.9311 -15.0775 -15.0775 -14.7898 -14.7898 -14.0639 -14.0639 -14.0161 -14.0161 -6.9211 -6.9211 -5.9099 -5.9099 -5.4614 -5.4614 -4.0975 -4.0975 -3.4776 -3.4776 -2.7900 -2.7900 -2.7209 -2.7209 -2.4034 -2.4034 -1.2641 -1.2641 -0.8251 -0.8251 -0.6382 -0.6382 -0.5723 -0.5723 -0.4245 -0.4245 -0.3571 -0.3571 0.0158 0.0158 0.5478 0.5478 0.8884 0.8884 1.0622 1.0622 1.5090 1.5090 1.8400 1.8400 1.8681 1.8681 1.9482 1.9482 3.9845 3.9845 4.0356 4.0356 7.4614 7.4614 8.2344 8.2344 9.7400 9.7400 9.9556 9.9556 10.5128 10.5128 10.9433 10.9433 k = 0.0000 0.5228-0.1857 ( 5910 PWs) bands (ev): -17.2134 -17.2134 -16.8216 -16.8216 -16.6105 -16.6105 -15.9325 -15.9325 -15.0748 -15.0748 -14.7902 -14.7902 -14.0637 -14.0637 -14.0158 -14.0158 -6.9217 -6.9217 -5.9163 -5.9163 -5.4544 -5.4544 -4.1034 -4.1034 -3.4734 -3.4734 -2.7978 -2.7978 -2.7138 -2.7138 -2.4041 -2.4041 -1.2580 -1.2580 -0.8244 -0.8244 -0.6730 -0.6730 -0.5712 -0.5712 -0.3906 -0.3906 -0.3599 -0.3599 0.0124 0.0124 0.5391 0.5391 0.8930 0.8930 1.0622 1.0622 1.5200 1.5200 1.8265 1.8265 1.8678 1.8678 1.9595 1.9595 3.9853 3.9853 4.0361 4.0361 7.4674 7.4674 8.2113 8.2113 9.7612 9.7612 9.9606 9.9606 10.5092 10.5092 10.9411 10.9411 k = 0.5000 0.4852 0.2691 ( 5920 PWs) bands (ev): -16.8048 -16.8048 -16.7251 -16.7251 -16.3151 -16.3151 -15.8754 -15.8754 -15.2246 -15.2246 -14.8112 -14.8112 -14.7847 -14.7847 -14.6958 -14.6958 -6.3150 -6.3150 -5.3143 -5.3143 -4.2811 -4.2811 -4.1221 -4.1221 -3.6463 -3.6463 -3.1749 -3.1749 -3.0959 -3.0959 -2.4680 -2.4680 -0.8730 -0.8730 -0.7962 -0.7962 -0.7545 -0.7545 -0.6269 -0.6269 0.3117 0.3117 0.4044 0.4044 0.4852 0.4852 0.5151 0.5151 0.9315 0.9315 0.9332 0.9332 1.2544 1.2544 1.5011 1.5011 1.6981 1.6981 1.7590 1.7590 2.0248 2.0248 2.0324 2.0324 8.1631 8.1631 8.9530 8.9530 9.4461 9.4461 9.8821 9.8821 11.4520 11.4520 11.6484 11.6484 k = 0.5000 0.4713 0.2691 ( 5920 PWs) bands (ev): -16.8095 -16.8095 -16.7244 -16.7244 -16.3206 -16.3206 -15.8742 -15.8742 -15.2216 -15.2216 -14.8056 -14.8056 -14.7818 -14.7818 -14.6943 -14.6943 -6.3144 -6.3144 -5.3271 -5.3271 -4.2976 -4.2976 -4.1052 -4.1052 -3.6607 -3.6607 -3.1643 -3.1643 -3.0920 -3.0920 -2.4649 -2.4649 -0.8845 -0.8845 -0.8122 -0.8122 -0.7300 -0.7300 -0.6316 -0.6316 0.3065 0.3065 0.4120 0.4120 0.4851 0.4851 0.4915 0.4915 0.9118 0.9118 0.9225 0.9225 1.2909 1.2909 1.5124 1.5124 1.7091 1.7091 1.7600 1.7600 2.0354 2.0354 2.0395 2.0395 8.1544 8.1544 8.9506 8.9506 9.4412 9.4412 9.8896 9.8896 11.4548 11.4548 11.6294 11.6294 k = 0.5000 0.4574 0.2691 ( 5916 PWs) bands (ev): -16.8153 -16.8153 -16.7259 -16.7259 -16.3255 -16.3255 -15.8761 -15.8761 -15.2147 -15.2147 -14.7972 -14.7972 -14.7771 -14.7771 -14.6928 -14.6928 -6.3142 -6.3142 -5.3437 -5.3437 -4.3185 -4.3185 -4.0941 -4.0941 -3.6718 -3.6718 -3.1509 -3.1509 -3.0839 -3.0839 -2.4621 -2.4621 -0.8984 -0.8984 -0.8297 -0.8297 -0.7052 -0.7052 -0.6366 -0.6366 0.2994 0.2994 0.4184 0.4184 0.4594 0.4594 0.4850 0.4850 0.8895 0.8895 0.9103 0.9103 1.3332 1.3332 1.5281 1.5281 1.7268 1.7268 1.7612 1.7612 2.0467 2.0467 2.0583 2.0583 8.1439 8.1439 8.9365 8.9365 9.4455 9.4455 9.8971 9.8971 11.4502 11.4502 11.6058 11.6058 k = 0.5000 0.4436 0.2691 ( 5914 PWs) bands (ev): -16.8221 -16.8221 -16.7296 -16.7296 -16.3298 -16.3298 -15.8810 -15.8810 -15.2042 -15.2042 -14.7862 -14.7862 -14.7707 -14.7707 -14.6914 -14.6914 -6.3145 -6.3145 -5.3641 -5.3641 -4.3434 -4.3434 -4.0892 -4.0892 -3.6788 -3.6788 -3.1349 -3.1349 -3.0718 -3.0718 -2.4596 -2.4596 -0.9143 -0.9143 -0.8481 -0.8481 -0.6810 -0.6810 -0.6418 -0.6418 0.2898 0.2898 0.4205 0.4205 0.4270 0.4270 0.4808 0.4808 0.8700 0.8700 0.8975 0.8975 1.3748 1.3748 1.5459 1.5459 1.7503 1.7503 1.7632 1.7632 2.0612 2.0612 2.0882 2.0882 8.1317 8.1317 8.9122 8.9122 9.4578 9.4578 9.9046 9.9046 11.4385 11.4385 11.5773 11.5773 k = 0.5000 0.4297 0.2691 ( 5914 PWs) bands (ev): -16.8299 -16.8299 -16.7355 -16.7355 -16.3334 -16.3334 -15.8884 -15.8884 -15.1908 -15.1908 -14.7730 -14.7730 -14.7624 -14.7624 -14.6896 -14.6896 -6.3153 -6.3153 -5.3880 -5.3880 -4.3718 -4.3718 -4.0908 -4.0908 -3.6813 -3.6813 -3.1169 -3.1169 -3.0561 -3.0561 -2.4575 -2.4575 -0.9318 -0.9318 -0.8673 -0.8673 -0.6594 -0.6594 -0.6454 -0.6454 0.2763 0.2763 0.3853 0.3853 0.4280 0.4280 0.4736 0.4736 0.8550 0.8550 0.8859 0.8859 1.4121 1.4121 1.5638 1.5638 1.7622 1.7622 1.7816 1.7816 2.0827 2.0827 2.1279 2.1279 8.1181 8.1181 8.8794 8.8794 9.4763 9.4763 9.9121 9.9121 11.4205 11.4205 11.5445 11.5445 k = 0.5000 0.4159 0.2691 ( 5924 PWs) bands (ev): -16.8387 -16.8387 -16.7433 -16.7433 -16.3363 -16.3363 -15.8979 -15.8979 -15.1750 -15.1750 -14.7583 -14.7583 -14.7521 -14.7521 -14.6871 -14.6871 -6.3166 -6.3166 -5.4155 -5.4155 -4.4031 -4.4031 -4.0986 -4.0986 -3.6791 -3.6791 -3.0973 -3.0973 -3.0372 -3.0372 -2.4557 -2.4557 -0.9505 -0.9505 -0.8872 -0.8872 -0.6576 -0.6576 -0.6303 -0.6303 0.2564 0.2564 0.3489 0.3489 0.4305 0.4305 0.4632 0.4632 0.8449 0.8449 0.8771 0.8771 1.4438 1.4438 1.5808 1.5808 1.7637 1.7637 1.8118 1.8118 2.1141 2.1141 2.1768 2.1768 8.1030 8.1030 8.8402 8.8402 9.4991 9.4991 9.9196 9.9196 11.3973 11.3973 11.5081 11.5081 k = 0.5000 0.4020 0.2691 ( 5920 PWs) bands (ev): -16.8483 -16.8483 -16.7530 -16.7530 -16.3384 -16.3384 -15.9091 -15.9091 -15.1577 -15.1577 -14.7433 -14.7433 -14.7395 -14.7395 -14.6826 -14.6826 -6.3185 -6.3185 -5.4464 -5.4464 -4.4368 -4.4368 -4.1118 -4.1118 -3.6724 -3.6724 -3.0763 -3.0763 -3.0157 -3.0157 -2.4542 -2.4542 -0.9700 -0.9700 -0.9077 -0.9077 -0.6646 -0.6646 -0.6075 -0.6075 0.2267 0.2267 0.3190 0.3190 0.4316 0.4316 0.4496 0.4496 0.8393 0.8393 0.8717 0.8717 1.4699 1.4699 1.5961 1.5961 1.7646 1.7646 1.8399 1.8399 2.1578 2.1578 2.2343 2.2343 8.0867 8.0867 8.7964 8.7964 9.5245 9.5245 9.9270 9.9270 11.3698 11.3698 11.4693 11.4693 k = 0.5000 0.3881 0.2691 ( 5912 PWs) bands (ev): -16.8587 -16.8587 -16.7644 -16.7644 -16.3398 -16.3398 -15.9216 -15.9216 -15.1393 -15.1393 -14.7302 -14.7302 -14.7246 -14.7246 -14.6743 -14.6743 -6.3211 -6.3211 -5.4804 -5.4804 -4.4722 -4.4722 -4.1296 -4.1296 -3.6619 -3.6619 -3.0544 -3.0544 -2.9920 -2.9920 -2.4531 -2.4531 -0.9901 -0.9901 -0.9288 -0.9288 -0.6730 -0.6730 -0.5845 -0.5845 0.1870 0.1870 0.2971 0.2971 0.4297 0.4297 0.4348 0.4348 0.8373 0.8373 0.8703 0.8703 1.4916 1.4916 1.6096 1.6096 1.7653 1.7653 1.8629 1.8629 2.2147 2.2147 2.2994 2.2994 8.0692 8.0692 8.7492 8.7492 9.5516 9.5516 9.9343 9.9343 11.3389 11.3389 11.4288 11.4288 k = 0.5000 0.3743 0.2691 ( 5918 PWs) bands (ev): -16.8698 -16.8698 -16.7773 -16.7773 -16.3406 -16.3406 -15.9350 -15.9350 -15.1206 -15.1206 -14.7215 -14.7215 -14.7073 -14.7073 -14.6600 -14.6600 -6.3244 -6.3244 -5.5175 -5.5175 -4.5089 -4.5089 -4.1510 -4.1510 -3.6480 -3.6480 -3.0318 -3.0318 -2.9665 -2.9665 -2.4525 -2.4525 -1.0105 -1.0105 -0.9504 -0.9504 -0.6823 -0.6823 -0.5618 -0.5618 0.1412 0.1412 0.2803 0.2803 0.4126 0.4126 0.4315 0.4315 0.8385 0.8385 0.8725 0.8725 1.5101 1.5101 1.6213 1.6213 1.7659 1.7659 1.8800 1.8800 2.2834 2.2834 2.3710 2.3710 8.0508 8.0508 8.6997 8.6997 9.5792 9.5792 9.9415 9.9415 11.3055 11.3055 11.3874 11.3874 k = 0.5000 0.3604 0.2691 ( 5910 PWs) bands (ev): -16.8816 -16.8816 -16.7915 -16.7915 -16.3408 -16.3408 -15.9490 -15.9490 -15.1021 -15.1021 -14.7171 -14.7171 -14.6874 -14.6874 -14.6397 -14.6397 -6.3285 -6.3285 -5.5572 -5.5572 -4.5463 -4.5463 -4.1751 -4.1751 -3.6314 -3.6314 -3.0089 -3.0089 -2.9397 -2.9397 -2.4523 -2.4523 -1.0308 -1.0308 -0.9724 -0.9724 -0.6925 -0.6925 -0.5393 -0.5393 0.0927 0.0927 0.2661 0.2661 0.3915 0.3915 0.4292 0.4292 0.8421 0.8421 0.8780 0.8780 1.5263 1.5263 1.6316 1.6316 1.7664 1.7664 1.8921 1.8921 2.3614 2.3614 2.4478 2.4478 8.0316 8.0316 8.6487 8.6487 9.6070 9.6070 9.9486 9.9486 11.2704 11.2704 11.3458 11.3458 k = 0.5000 0.3466 0.2691 ( 5912 PWs) bands (ev): -16.8938 -16.8938 -16.8067 -16.8067 -16.3404 -16.3404 -15.9634 -15.9634 -15.0841 -15.0841 -14.7156 -14.7156 -14.6651 -14.6651 -14.6153 -14.6153 -6.3336 -6.3336 -5.5994 -5.5994 -4.5838 -4.5838 -4.2013 -4.2013 -3.6125 -3.6125 -2.9858 -2.9858 -2.9119 -2.9119 -2.4526 -2.4526 -1.0509 -1.0509 -0.9947 -0.9947 -0.7034 -0.7034 -0.5171 -0.5171 0.0435 0.0435 0.2531 0.2531 0.3688 0.3688 0.4260 0.4260 0.8477 0.8477 0.8862 0.8862 1.5410 1.5410 1.6407 1.6407 1.7669 1.7669 1.9005 1.9005 2.4463 2.4463 2.5289 2.5289 8.0118 8.0118 8.5967 8.5967 9.6344 9.6344 9.9556 9.9556 11.2340 11.2340 11.3044 11.3044 k = 0.5000 0.3327 0.2691 ( 5912 PWs) bands (ev): -16.9065 -16.9065 -16.8228 -16.8228 -16.3396 -16.3396 -15.9779 -15.9779 -15.0669 -15.0669 -14.7157 -14.7157 -14.6405 -14.6405 -14.5881 -14.5881 -6.3397 -6.3397 -5.6438 -5.6438 -4.6211 -4.6211 -4.2288 -4.2288 -3.5916 -3.5916 -2.9629 -2.9629 -2.8836 -2.8836 -2.4534 -2.4534 -1.0705 -1.0705 -1.0171 -1.0171 -0.7149 -0.7149 -0.4952 -0.4952 -0.0053 -0.0053 0.2409 0.2409 0.3453 0.3453 0.4220 0.4220 0.8547 0.8547 0.8966 0.8966 1.5546 1.5546 1.6489 1.6489 1.7674 1.7674 1.9062 1.9062 2.5359 2.5359 2.6134 2.6134 7.9915 7.9915 8.5444 8.5444 9.6611 9.6611 9.9624 9.9624 11.1970 11.1970 11.2635 11.2635 k = 0.5000 0.3188 0.2691 ( 5912 PWs) bands (ev): -16.9195 -16.9195 -16.8395 -16.8395 -16.3383 -16.3383 -15.9925 -15.9925 -15.0507 -15.0507 -14.7170 -14.7170 -14.6136 -14.6136 -14.5591 -14.5591 -6.3468 -6.3468 -5.6901 -5.6901 -4.6576 -4.6576 -4.2572 -4.2572 -3.5692 -3.5692 -2.9402 -2.9402 -2.8550 -2.8550 -2.4548 -2.4548 -1.0894 -1.0894 -1.0396 -1.0396 -0.7269 -0.7269 -0.4737 -0.4737 -0.0531 -0.0531 0.2290 0.2290 0.3214 0.3214 0.4170 0.4170 0.8630 0.8630 0.9085 0.9085 1.5676 1.5676 1.6564 1.6564 1.7680 1.7680 1.9100 1.9100 2.6285 2.6285 2.7002 2.7002 7.9710 7.9710 8.4921 8.4921 9.6870 9.6870 9.9690 9.9690 11.1598 11.1598 11.2233 11.2233 k = 0.5000 0.3050 0.2691 ( 5910 PWs) bands (ev): -16.9328 -16.9328 -16.8567 -16.8567 -16.3367 -16.3367 -16.0069 -16.0069 -15.0356 -15.0356 -14.7189 -14.7189 -14.5848 -14.5848 -14.5287 -14.5287 -6.3550 -6.3550 -5.7380 -5.7380 -4.6930 -4.6930 -4.2863 -4.2863 -3.5452 -3.5452 -2.9180 -2.9180 -2.8264 -2.8264 -2.4568 -2.4568 -1.1077 -1.1077 -1.0619 -1.0619 -0.7393 -0.7393 -0.4526 -0.4526 -0.0995 -0.0995 0.2175 0.2175 0.2976 0.2976 0.4113 0.4113 0.8721 0.8721 0.9216 0.9216 1.5802 1.5802 1.6634 1.6634 1.7687 1.7687 1.9123 1.9123 2.7231 2.7231 2.7887 2.7887 7.9503 7.9503 8.4402 8.4402 9.7118 9.7118 9.9753 9.9753 11.1226 11.1226 11.1842 11.1842 k = 0.5000 0.2911 0.2691 ( 5906 PWs) bands (ev): -16.9462 -16.9462 -16.8741 -16.8741 -16.3347 -16.3347 -16.0211 -16.0211 -15.0215 -15.0215 -14.7214 -14.7214 -14.5544 -14.5544 -14.4974 -14.4974 -6.3644 -6.3644 -5.7871 -5.7871 -4.7267 -4.7267 -4.3156 -4.3156 -3.5200 -3.5200 -2.8964 -2.8964 -2.7981 -2.7981 -2.4593 -2.4593 -1.1250 -1.1250 -1.0840 -1.0840 -0.7519 -0.7519 -0.4320 -0.4320 -0.1442 -0.1442 0.2063 0.2063 0.2739 0.2739 0.4048 0.4048 0.8818 0.8818 0.9354 0.9354 1.5924 1.5924 1.6700 1.6700 1.7696 1.7696 1.9137 1.9137 2.8185 2.8185 2.8781 2.8781 7.9297 7.9297 8.3890 8.3890 9.7355 9.7355 9.9813 9.9813 11.0859 11.0859 11.1461 11.1461 k = 0.5000 0.2772 0.2691 ( 5904 PWs) bands (ev): -16.9596 -16.9596 -16.8916 -16.8916 -16.3324 -16.3324 -16.0351 -16.0351 -15.0085 -15.0085 -14.7243 -14.7243 -14.5226 -14.5226 -14.4654 -14.4654 -6.3750 -6.3750 -5.8371 -5.8371 -4.7586 -4.7586 -4.3452 -4.3452 -3.4937 -3.4937 -2.8756 -2.8756 -2.7703 -2.7703 -2.4624 -2.4624 -1.1415 -1.1415 -1.1056 -1.1056 -0.7644 -0.7644 -0.4121 -0.4121 -0.1869 -0.1869 0.1955 0.1955 0.2506 0.2506 0.3976 0.3976 0.8920 0.8920 0.9496 0.9496 1.6043 1.6043 1.6762 1.6762 1.7708 1.7708 1.9142 1.9142 2.9141 2.9141 2.9679 2.9679 7.9093 7.9093 8.3387 8.3387 9.7580 9.7580 9.9869 9.9869 11.0499 11.0499 11.1092 11.1092 k = 0.5000 0.2634 0.2691 ( 5902 PWs) bands (ev): -16.9729 -16.9729 -16.9091 -16.9091 -16.3299 -16.3299 -16.0487 -16.0487 -14.9962 -14.9962 -14.7277 -14.7277 -14.4899 -14.4899 -14.4332 -14.4332 -6.3868 -6.3868 -5.8877 -5.8877 -4.7882 -4.7882 -4.3747 -4.3747 -3.4664 -3.4664 -2.8557 -2.8557 -2.7432 -2.7432 -2.4661 -2.4661 -1.1570 -1.1570 -1.1267 -1.1267 -0.7768 -0.7768 -0.3935 -0.3935 -0.2268 -0.2268 0.1850 0.1850 0.2279 0.2279 0.3897 0.3897 0.9025 0.9025 0.9638 0.9638 1.6160 1.6160 1.6822 1.6822 1.7722 1.7722 1.9142 1.9142 3.0090 3.0090 3.0573 3.0573 7.8894 7.8894 8.2896 8.2896 9.7791 9.7791 9.9920 9.9920 11.0148 11.0148 11.0736 11.0736 k = 0.5000 0.2495 0.2691 ( 5904 PWs) bands (ev): -16.9860 -16.9860 -16.9264 -16.9264 -16.3271 -16.3271 -16.0620 -16.0620 -14.9848 -14.9848 -14.7313 -14.7313 -14.4565 -14.4565 -14.4010 -14.4010 -6.3996 -6.3996 -5.9386 -5.9386 -4.8153 -4.8153 -4.4040 -4.4040 -3.4382 -3.4382 -2.8368 -2.8368 -2.7171 -2.7171 -2.4704 -2.4704 -1.1715 -1.1715 -1.1472 -1.1472 -0.7888 -0.7888 -0.3778 -0.3778 -0.2626 -0.2626 0.1750 0.1750 0.2058 0.2058 0.3812 0.3812 0.9132 0.9132 0.9777 0.9777 1.6275 1.6275 1.6880 1.6880 1.7739 1.7739 1.9137 1.9137 3.1028 3.1028 3.1460 3.1460 7.8699 7.8699 8.2419 8.2419 9.7989 9.7989 9.9967 9.9967 10.9809 10.9809 11.0394 11.0394 k = 0.5000 0.2357 0.2691 ( 5908 PWs) bands (ev): -16.9990 -16.9990 -16.9434 -16.9434 -16.3241 -16.3241 -16.0749 -16.0749 -14.9741 -14.9741 -14.7353 -14.7353 -14.4228 -14.4228 -14.3689 -14.3689 -6.4135 -6.4135 -5.9893 -5.9893 -4.8397 -4.8397 -4.4332 -4.4332 -3.4091 -3.4091 -2.8191 -2.8191 -2.6920 -2.6920 -2.4751 -2.4751 -1.1851 -1.1851 -1.1668 -1.1668 -0.8002 -0.8002 -0.3698 -0.3698 -0.2894 -0.2894 0.1654 0.1654 0.1844 0.1844 0.3721 0.3721 0.9239 0.9239 0.9912 0.9912 1.6387 1.6387 1.6935 1.6935 1.7760 1.7760 1.9127 1.9127 3.1949 3.1949 3.2332 3.2332 7.8512 7.8512 8.1957 8.1957 9.8174 9.8174 10.0007 10.0007 10.9483 10.9483 11.0066 11.0066 k = 0.5000 0.2218 0.2691 ( 5914 PWs) bands (ev): -17.0115 -17.0115 -16.9599 -16.9599 -16.3208 -16.3208 -16.0874 -16.0874 -14.9639 -14.9639 -14.7396 -14.7396 -14.3892 -14.3892 -14.3373 -14.3373 -6.4283 -6.4283 -6.0396 -6.0396 -4.8613 -4.8613 -4.4621 -4.4621 -3.3794 -3.3794 -2.8028 -2.8028 -2.6681 -2.6681 -2.4803 -2.4803 -1.1978 -1.1978 -1.1854 -1.1854 -0.8109 -0.8109 -0.3792 -0.3792 -0.2975 -0.2975 0.1563 0.1563 0.1638 0.1638 0.3624 0.3624 0.9346 0.9346 1.0040 1.0040 1.6496 1.6496 1.6989 1.6989 1.7785 1.7785 1.9114 1.9114 3.2847 3.2847 3.3187 3.3187 7.8332 7.8332 8.1512 8.1512 9.8346 9.8346 10.0042 10.0042 10.9173 10.9173 10.9752 10.9752 k = 0.5000 0.2079 0.2691 ( 5912 PWs) bands (ev): -17.0237 -17.0237 -16.9759 -16.9759 -16.3174 -16.3174 -16.0995 -16.0995 -14.9543 -14.9543 -14.7441 -14.7441 -14.3559 -14.3559 -14.3064 -14.3064 -6.4437 -6.4437 -6.0892 -6.0892 -4.8798 -4.8798 -4.4906 -4.4906 -3.3490 -3.3490 -2.7881 -2.7881 -2.6456 -2.6456 -2.4858 -2.4858 -1.2098 -1.2098 -1.2027 -1.2027 -0.8206 -0.8206 -0.4041 -0.4041 -0.2889 -0.2889 0.1428 0.1428 0.1490 0.1490 0.3523 0.3523 0.9452 0.9452 1.0161 1.0161 1.6601 1.6601 1.7040 1.7040 1.7814 1.7814 1.9099 1.9099 3.3719 3.3719 3.4018 3.4018 7.8162 7.8162 8.1087 8.1087 9.8504 9.8504 10.0070 10.0070 10.8879 10.8879 10.9454 10.9454 k = 0.5000 0.1941 0.2691 ( 5914 PWs) bands (ev): -17.0353 -17.0353 -16.9913 -16.9913 -16.3137 -16.3137 -16.1113 -16.1113 -14.9450 -14.9450 -14.7489 -14.7489 -14.3233 -14.3233 -14.2763 -14.2763 -6.4597 -6.4597 -6.1376 -6.1376 -4.8954 -4.8954 -4.5187 -4.5187 -3.3182 -3.3182 -2.7753 -2.7753 -2.6245 -2.6245 -2.4913 -2.4913 -1.2221 -1.2221 -1.2178 -1.2178 -0.8291 -0.8291 -0.4340 -0.4340 -0.2742 -0.2742 0.1238 0.1238 0.1412 0.1412 0.3416 0.3416 0.9556 0.9556 1.0272 1.0272 1.6702 1.6702 1.7089 1.7089 1.7847 1.7847 1.9081 1.9081 3.4559 3.4559 3.4820 3.4820 7.8003 7.8003 8.0681 8.0681 9.8649 9.8649 10.0090 10.0090 10.8604 10.8604 10.9171 10.9171 k = 0.5000 0.1802 0.2691 ( 5912 PWs) bands (ev): -17.0463 -17.0463 -17.0060 -17.0060 -16.3098 -16.3098 -16.1226 -16.1226 -14.9360 -14.9360 -14.7540 -14.7540 -14.2915 -14.2915 -14.2474 -14.2474 -6.4759 -6.4759 -6.1848 -6.1848 -4.9080 -4.9080 -4.5463 -4.5463 -3.2869 -3.2869 -2.7645 -2.7645 -2.6050 -2.6050 -2.4968 -2.4968 -1.2360 -1.2360 -1.2292 -1.2292 -0.8364 -0.8364 -0.4648 -0.4648 -0.2578 -0.2578 0.1052 0.1052 0.1347 0.1347 0.3305 0.3305 0.9658 0.9658 1.0373 1.0373 1.6798 1.6798 1.7136 1.7136 1.7885 1.7885 1.9060 1.9060 3.5363 3.5363 3.5591 3.5591 7.7855 7.7855 8.0296 8.0296 9.8781 9.8781 10.0104 10.0104 10.8348 10.8348 10.8904 10.8904 k = 0.5000 0.1663 0.2691 ( 5916 PWs) bands (ev): -17.0567 -17.0567 -17.0200 -17.0200 -16.3058 -16.3058 -16.1336 -16.1336 -14.9274 -14.9274 -14.7592 -14.7592 -14.2609 -14.2609 -14.2198 -14.2198 -6.4920 -6.4920 -6.2302 -6.2302 -4.9176 -4.9176 -4.5735 -4.5735 -3.2553 -3.2553 -2.7563 -2.7563 -2.5871 -2.5871 -2.5019 -2.5019 -1.2496 -1.2496 -1.2389 -1.2389 -0.8421 -0.8421 -0.4951 -0.4951 -0.2409 -0.2409 0.0872 0.0872 0.1292 0.1292 0.3190 0.3190 0.9758 0.9758 1.0462 1.0462 1.6888 1.6888 1.7181 1.7181 1.7927 1.7927 1.9038 1.9038 3.6127 3.6127 3.6324 3.6324 7.7720 7.7720 7.9932 7.9932 9.8902 9.8902 10.0110 10.0110 10.8113 10.8113 10.8652 10.8652 k = 0.5000 0.1525 0.2691 ( 5918 PWs) bands (ev): -17.0664 -17.0664 -17.0332 -17.0332 -16.3015 -16.3015 -16.1443 -16.1443 -14.9190 -14.9190 -14.7647 -14.7647 -14.2317 -14.2317 -14.1938 -14.1938 -6.5077 -6.5077 -6.2738 -6.2738 -4.9243 -4.9243 -4.6002 -4.6002 -3.2236 -3.2236 -2.7508 -2.7508 -2.5709 -2.5709 -2.5064 -2.5064 -1.2621 -1.2621 -1.2478 -1.2478 -0.8462 -0.8462 -0.5246 -0.5246 -0.2241 -0.2241 0.0700 0.0700 0.1248 0.1248 0.3071 0.3071 0.9855 0.9855 1.0540 1.0540 1.6973 1.6973 1.7222 1.7222 1.7973 1.7973 1.9013 1.9013 3.6847 3.6847 3.7016 3.7016 7.7598 7.7598 7.9591 7.9591 9.9011 9.9011 10.0108 10.0108 10.7898 10.7898 10.8417 10.8417 k = 0.5000 0.1386 0.2691 ( 5922 PWs) bands (ev): -17.0753 -17.0753 -17.0455 -17.0455 -16.2970 -16.2970 -16.1545 -16.1545 -14.9107 -14.9107 -14.7703 -14.7703 -14.2042 -14.2042 -14.1694 -14.1694 -6.5228 -6.5228 -6.3152 -6.3152 -4.9282 -4.9282 -4.6262 -4.6262 -3.1917 -3.1917 -2.7484 -2.7484 -2.5564 -2.5564 -2.5099 -2.5099 -1.2731 -1.2731 -1.2560 -1.2560 -0.8487 -0.8487 -0.5530 -0.5530 -0.2078 -0.2078 0.0534 0.0534 0.1217 0.1217 0.2949 0.2949 0.9949 0.9949 1.0606 1.0606 1.7051 1.7051 1.7261 1.7261 1.8023 1.8023 1.8987 1.8987 3.7519 3.7519 3.7663 3.7663 7.7491 7.7491 7.9272 7.9272 9.9110 9.9110 10.0100 10.0100 10.7705 10.7705 10.8199 10.8199 k = 0.5000 0.1248 0.2691 ( 5928 PWs) bands (ev): -17.0834 -17.0834 -17.0568 -17.0568 -16.2922 -16.2922 -16.1645 -16.1645 -14.9027 -14.9027 -14.7762 -14.7762 -14.1784 -14.1784 -14.1470 -14.1470 -6.5369 -6.5369 -6.3541 -6.3541 -4.9295 -4.9295 -4.6517 -4.6517 -3.1598 -3.1598 -2.7494 -2.7494 -2.5436 -2.5436 -2.5122 -2.5122 -1.2828 -1.2828 -1.2637 -1.2637 -0.8493 -0.8493 -0.5803 -0.5803 -0.1921 -0.1921 0.0376 0.0376 0.1200 0.1200 0.2825 0.2825 1.0039 1.0039 1.0659 1.0659 1.7122 1.7122 1.7297 1.7297 1.8077 1.8077 1.8958 1.8958 3.8139 3.8139 3.8261 3.8261 7.7398 7.7398 7.8977 7.8977 9.9200 9.9200 10.0085 10.0085 10.7534 10.7534 10.7997 10.7997 k = 0.5000 0.1109 0.2691 ( 5930 PWs) bands (ev): -17.0907 -17.0907 -17.0672 -17.0672 -16.2873 -16.2873 -16.1740 -16.1740 -14.8948 -14.8948 -14.7822 -14.7822 -14.1546 -14.1546 -14.1266 -14.1266 -6.5496 -6.5496 -6.3905 -6.3905 -4.9282 -4.9282 -4.6766 -4.6766 -3.1280 -3.1280 -2.7539 -2.7539 -2.5326 -2.5326 -2.5133 -2.5133 -1.2911 -1.2911 -1.2710 -1.2710 -0.8480 -0.8480 -0.6065 -0.6065 -0.1770 -0.1770 0.0224 0.0224 0.1197 0.1197 0.2698 0.2698 1.0126 1.0126 1.0701 1.0701 1.7186 1.7186 1.7329 1.7329 1.8132 1.8132 1.8928 1.8928 3.8705 3.8705 3.8806 3.8806 7.7322 7.7322 7.8704 7.8704 9.9281 9.9281 10.0063 10.0063 10.7385 10.7385 10.7812 10.7812 k = 0.5000 0.0970 0.2691 ( 5924 PWs) bands (ev): -17.0970 -17.0970 -17.0767 -17.0767 -16.2822 -16.2822 -16.1833 -16.1833 -14.8870 -14.8870 -14.7883 -14.7883 -14.1330 -14.1330 -14.1084 -14.1084 -6.5607 -6.5607 -6.4240 -6.4240 -4.9246 -4.9246 -4.7007 -4.7007 -3.0964 -3.0964 -2.7618 -2.7618 -2.5232 -2.5232 -2.5132 -2.5132 -1.2979 -1.2979 -1.2777 -1.2777 -0.8449 -0.8449 -0.6315 -0.6315 -0.1626 -0.1626 0.0079 0.0079 0.1210 0.1210 0.2569 0.2569 1.0209 1.0209 1.0731 1.0731 1.7243 1.7243 1.7358 1.7358 1.8190 1.8190 1.8895 1.8895 3.9212 3.9212 3.9296 3.9296 7.7262 7.7262 7.8456 7.8456 9.9355 9.9355 10.0036 10.0036 10.7259 10.7259 10.7645 10.7645 k = 0.5000 0.0832 0.2691 ( 5924 PWs) bands (ev): -17.1024 -17.1024 -17.0851 -17.0851 -16.2768 -16.2768 -16.1922 -16.1922 -14.8793 -14.8793 -14.7947 -14.7947 -14.1138 -14.1138 -14.0926 -14.0926 -6.5698 -6.5698 -6.4546 -6.4546 -4.9187 -4.9187 -4.7241 -4.7241 -3.0652 -3.0652 -2.7729 -2.7729 -2.5156 -2.5156 -2.5120 -2.5120 -1.3033 -1.3033 -1.2840 -1.2840 -0.8399 -0.8399 -0.6554 -0.6554 -0.1490 -0.1490 -0.0060 -0.0060 0.1238 0.1238 0.2440 0.2440 1.0288 1.0288 1.0749 1.0749 1.7292 1.7292 1.7383 1.7383 1.8249 1.8249 1.8860 1.8860 3.9659 3.9659 3.9727 3.9727 7.7219 7.7219 7.8230 7.8230 9.9423 9.9423 10.0004 10.0004 10.7154 10.7154 10.7495 10.7495 k = 0.5000 0.0693 0.2691 ( 5918 PWs) bands (ev): -17.1068 -17.1068 -17.0924 -17.0924 -16.2712 -16.2712 -16.2008 -16.2008 -14.8717 -14.8717 -14.8011 -14.8011 -14.0969 -14.0969 -14.0793 -14.0793 -6.5767 -6.5767 -6.4820 -6.4820 -4.9108 -4.9108 -4.7467 -4.7467 -3.0345 -3.0345 -2.7871 -2.7871 -2.5103 -2.5103 -2.5094 -2.5094 -1.3074 -1.3074 -1.2898 -1.2898 -0.8331 -0.8331 -0.6782 -0.6782 -0.1361 -0.1361 -0.0193 -0.0193 0.1281 0.1281 0.2310 0.2310 1.0362 1.0362 1.0757 1.0757 1.7334 1.7334 1.7404 1.7404 1.8309 1.8309 1.8823 1.8823 4.0042 4.0042 4.0095 4.0095 7.7193 7.7193 7.8027 7.8027 9.9486 9.9486 9.9968 9.9968 10.7072 10.7072 10.7362 10.7362 k = 0.5000 0.0554 0.2691 ( 5934 PWs) bands (ev): -17.1101 -17.1101 -17.0987 -17.0987 -16.2653 -16.2653 -16.2091 -16.2091 -14.8642 -14.8642 -14.8077 -14.8077 -14.0827 -14.0827 -14.0685 -14.0685 -6.5811 -6.5811 -6.5062 -6.5062 -4.9009 -4.9009 -4.7684 -4.7684 -3.0044 -3.0044 -2.8041 -2.8041 -2.5079 -2.5079 -2.5050 -2.5050 -1.3101 -1.3101 -1.2951 -1.2951 -0.8245 -0.8245 -0.6998 -0.6998 -0.1238 -0.1238 -0.0320 -0.0320 0.1340 0.1340 0.2182 0.2182 1.0431 1.0431 1.0754 1.0754 1.7369 1.7369 1.7421 1.7421 1.8369 1.8369 1.8782 1.8782 4.0358 4.0358 4.0400 4.0400 7.7186 7.7186 7.7847 7.7847 9.9544 9.9544 9.9929 9.9929 10.7010 10.7010 10.7247 10.7247 k = 0.5000 0.0416 0.2691 ( 5930 PWs) bands (ev): -17.1125 -17.1125 -17.1040 -17.1040 -16.2592 -16.2592 -16.2171 -16.2171 -14.8568 -14.8568 -14.8144 -14.8144 -14.0711 -14.0711 -14.0605 -14.0605 -6.5827 -6.5827 -6.5271 -6.5271 -4.8893 -4.8893 -4.7891 -4.7891 -2.9750 -2.9750 -2.8233 -2.8233 -2.5054 -2.5054 -2.5019 -2.5019 -1.3117 -1.3117 -1.2998 -1.2998 -0.8142 -0.8142 -0.7201 -0.7201 -0.1121 -0.1121 -0.0441 -0.0441 0.1412 0.1412 0.2055 0.2055 1.0495 1.0495 1.0741 1.0741 1.7397 1.7397 1.7434 1.7434 1.8428 1.8428 1.8739 1.8739 4.0608 4.0608 4.0638 4.0638 7.7198 7.7198 7.7690 7.7690 9.9599 9.9599 9.9887 9.9887 10.6970 10.6970 10.7151 10.7151 k = 0.5000 0.0277 0.2691 ( 5934 PWs) bands (ev): -17.1138 -17.1138 -17.1081 -17.1081 -16.2528 -16.2528 -16.2248 -16.2248 -14.8495 -14.8495 -14.8212 -14.8212 -14.0623 -14.0623 -14.0552 -14.0552 -6.5815 -6.5815 -6.5446 -6.5446 -4.8760 -4.8760 -4.8089 -4.8089 -2.9465 -2.9465 -2.8448 -2.8448 -2.5031 -2.5031 -2.5001 -2.5001 -1.3121 -1.3121 -1.3038 -1.3038 -0.8022 -0.8022 -0.7393 -0.7393 -0.1007 -0.1007 -0.0559 -0.0559 0.1497 0.1497 0.1931 0.1931 1.0554 1.0554 1.0720 1.0720 1.7418 1.7418 1.7441 1.7441 1.8485 1.8485 1.8694 1.8694 4.0788 4.0788 4.0808 4.0808 7.7229 7.7229 7.7555 7.7555 9.9651 9.9651 9.9843 9.9843 10.6951 10.6951 10.7073 10.7073 k = 0.5000 0.0139 0.2691 ( 5938 PWs) bands (ev): -17.1140 -17.1140 -17.1111 -17.1111 -16.2462 -16.2462 -16.2322 -16.2322 -14.8423 -14.8423 -14.8282 -14.8282 -14.0563 -14.0563 -14.0527 -14.0527 -6.5772 -6.5772 -6.5588 -6.5588 -4.8612 -4.8612 -4.8276 -4.8276 -2.9191 -2.9191 -2.8680 -2.8680 -2.5012 -2.5012 -2.4995 -2.4995 -1.3114 -1.3114 -1.3072 -1.3072 -0.7886 -0.7886 -0.7571 -0.7571 -0.0895 -0.0895 -0.0672 -0.0672 0.1593 0.1593 0.1812 0.1812 1.0606 1.0606 1.0689 1.0689 1.7433 1.7433 1.7444 1.7444 1.8541 1.8541 1.8645 1.8645 4.0899 4.0899 4.0908 4.0908 7.7279 7.7279 7.7442 7.7442 9.9702 9.9702 9.9797 9.9797 10.6952 10.6952 10.7013 10.7013 k = 0.5000-0.0000 0.2691 ( 5936 PWs) bands (ev): -17.1131 -17.1131 -17.1131 -17.1131 -16.2394 -16.2394 -16.2394 -16.2394 -14.8352 -14.8352 -14.8352 -14.8352 -14.0531 -14.0531 -14.0531 -14.0531 -6.5696 -6.5696 -6.5696 -6.5696 -4.8451 -4.8451 -4.8451 -4.8451 -2.8928 -2.8928 -2.8928 -2.8928 -2.4999 -2.4999 -2.4999 -2.4999 -1.3097 -1.3097 -1.3097 -1.3097 -0.7736 -0.7736 -0.7736 -0.7736 -0.0784 -0.0784 -0.0784 -0.0784 0.1699 0.1699 0.1699 0.1699 1.0651 1.0651 1.0651 1.0651 1.7441 1.7441 1.7441 1.7441 1.8594 1.8594 1.8594 1.8594 4.0939 4.0939 4.0939 4.0939 7.7350 7.7350 7.7350 7.7350 9.9750 9.9750 9.9750 9.9750 10.6973 10.6973 10.6973 10.6973 k = 0.5000-0.0000 0.2691 ( 5936 PWs) bands (ev): -17.1131 -17.1131 -17.1131 -17.1131 -16.2394 -16.2394 -16.2394 -16.2394 -14.8352 -14.8352 -14.8352 -14.8352 -14.0531 -14.0531 -14.0531 -14.0531 -6.5696 -6.5696 -6.5696 -6.5696 -4.8451 -4.8451 -4.8451 -4.8451 -2.8928 -2.8928 -2.8928 -2.8928 -2.4999 -2.4999 -2.4999 -2.4999 -1.3097 -1.3097 -1.3097 -1.3097 -0.7736 -0.7736 -0.7736 -0.7736 -0.0784 -0.0784 -0.0784 -0.0784 0.1699 0.1699 0.1699 0.1699 1.0651 1.0651 1.0651 1.0651 1.7441 1.7441 1.7441 1.7441 1.8594 1.8594 1.8594 1.8594 4.0939 4.0939 4.0939 4.0939 7.7350 7.7350 7.7350 7.7350 9.9750 9.9750 9.9750 9.9750 10.6973 10.6973 10.6973 10.6973 k = 0.5000-0.0000 0.2557 ( 5934 PWs) bands (ev): -17.1254 -17.1254 -17.1003 -17.1003 -16.2622 -16.2622 -16.2168 -16.2168 -14.8469 -14.8469 -14.8237 -14.8237 -14.0549 -14.0549 -14.0513 -14.0513 -6.5913 -6.5913 -6.5468 -6.5468 -4.8949 -4.8949 -4.7954 -4.7954 -2.9242 -2.9242 -2.8618 -2.8618 -2.5146 -2.5146 -2.4855 -2.4855 -1.3387 -1.3387 -1.2794 -1.2794 -0.7757 -0.7757 -0.7713 -0.7713 -0.1014 -0.1014 -0.0581 -0.0581 0.1483 0.1483 0.1932 0.1932 1.0478 1.0478 1.0819 1.0819 1.7432 1.7432 1.7448 1.7448 1.8570 1.8570 1.8615 1.8615 4.0899 4.0899 4.0980 4.0980 7.7158 7.7158 7.7558 7.7558 9.9285 9.9285 10.0214 10.0214 10.6737 10.6737 10.7230 10.7230 k = 0.5000-0.0000 0.2422 ( 5926 PWs) bands (ev): -17.1372 -17.1372 -17.0869 -17.0869 -16.2852 -16.2852 -16.1946 -16.1946 -14.8588 -14.8588 -14.8124 -14.8124 -14.0567 -14.0567 -14.0495 -14.0495 -6.6119 -6.6119 -6.5229 -6.5229 -4.9449 -4.9449 -4.7461 -4.7461 -2.9560 -2.9560 -2.8312 -2.8312 -2.5295 -2.5295 -2.4716 -2.4716 -1.3663 -1.3663 -1.2477 -1.2477 -0.7775 -0.7775 -0.7688 -0.7688 -0.1260 -0.1260 -0.0420 -0.0420 0.1300 0.1300 0.2172 0.2172 1.0302 1.0302 1.0982 1.0982 1.7421 1.7421 1.7452 1.7452 1.8543 1.8543 1.8633 1.8633 4.0860 4.0860 4.1021 4.1021 7.6981 7.6981 7.7781 7.7781 9.8820 9.8820 10.0673 10.0673 10.6519 10.6519 10.7510 10.7510 k = 0.5000-0.0000 0.2288 ( 5928 PWs) bands (ev): -17.1484 -17.1484 -17.0731 -17.0731 -16.3084 -16.3084 -16.1728 -16.1728 -14.8709 -14.8709 -14.8016 -14.8016 -14.0585 -14.0585 -14.0478 -14.0478 -6.6314 -6.6314 -6.4980 -6.4980 -4.9949 -4.9949 -4.6972 -4.6972 -2.9880 -2.9880 -2.8012 -2.8012 -2.5445 -2.5445 -2.4582 -2.4582 -1.3925 -1.3925 -1.2149 -1.2149 -0.7790 -0.7790 -0.7661 -0.7661 -0.1515 -0.1515 -0.0330 -0.0330 0.1175 0.1175 0.2415 0.2415 1.0122 1.0122 1.1139 1.1139 1.7406 1.7406 1.7454 1.7454 1.8513 1.8513 1.8647 1.8647 4.0822 4.0822 4.1062 4.1062 7.6819 7.6819 7.8018 7.8018 9.8356 9.8356 10.1124 10.1124 10.6317 10.6317 10.7817 10.7817 k = 0.5000-0.0000 0.2153 ( 5924 PWs) bands (ev): -17.1591 -17.1591 -17.0588 -17.0588 -16.3317 -16.3317 -16.1515 -16.1515 -14.8830 -14.8830 -14.7910 -14.7910 -14.0604 -14.0604 -14.0461 -14.0461 -6.6497 -6.6497 -6.4719 -6.4719 -5.0449 -5.0449 -4.6487 -4.6487 -3.0203 -3.0203 -2.7717 -2.7717 -2.5593 -2.5593 -2.4455 -2.4455 -1.4171 -1.4171 -1.1809 -1.1809 -0.7803 -0.7803 -0.7633 -0.7633 -0.1777 -0.1777 -0.0337 -0.0337 0.1137 0.1137 0.2657 0.2657 0.9940 0.9940 1.1289 1.1289 1.7389 1.7389 1.7455 1.7455 1.8481 1.8481 1.8657 1.8657 4.0786 4.0786 4.1104 4.1104 7.6671 7.6671 7.8269 7.8269 9.7897 9.7897 10.1566 10.1566 10.6129 10.6129 10.8152 10.8152 k = 0.5000-0.0000 0.2019 ( 5920 PWs) bands (ev): -17.1692 -17.1692 -17.0441 -17.0441 -16.3549 -16.3549 -16.1307 -16.1307 -14.8950 -14.8950 -14.7810 -14.7810 -14.0622 -14.0622 -14.0445 -14.0445 -6.6669 -6.6669 -6.4449 -6.4449 -5.0947 -5.0947 -4.6009 -4.6009 -3.0527 -3.0527 -2.7430 -2.7430 -2.5740 -2.5740 -2.4335 -2.4335 -1.4403 -1.4403 -1.1459 -1.1459 -0.7811 -0.7811 -0.7605 -0.7605 -0.2040 -0.2040 -0.0445 -0.0445 0.1187 0.1187 0.2895 0.2895 0.9757 0.9757 1.1433 1.1433 1.7369 1.7369 1.7453 1.7453 1.8446 1.8446 1.8665 1.8665 4.0751 4.0751 4.1145 4.1145 7.6538 7.6538 7.8533 7.8533 9.7443 9.7443 10.1994 10.1994 10.5953 10.5953 10.8517 10.8517 k = 0.5000-0.0000 0.1884 ( 5928 PWs) bands (ev): -17.1786 -17.1786 -17.0290 -17.0290 -16.3782 -16.3782 -16.1106 -16.1106 -14.9069 -14.9069 -14.7713 -14.7713 -14.0639 -14.0639 -14.0430 -14.0430 -6.6829 -6.6829 -6.4169 -6.4169 -5.1443 -5.1443 -4.5538 -4.5538 -3.0852 -3.0852 -2.7149 -2.7149 -2.5884 -2.5884 -2.4224 -2.4224 -1.4619 -1.4619 -1.1099 -1.1099 -0.7817 -0.7817 -0.7576 -0.7576 -0.2304 -0.2304 -0.0630 -0.0630 0.1299 0.1299 0.3128 0.3128 0.9574 0.9574 1.1568 1.1568 1.7345 1.7345 1.7451 1.7451 1.8411 1.8411 1.8670 1.8670 4.0717 4.0717 4.1186 4.1186 7.6418 7.6418 7.8809 7.8809 9.6996 9.6996 10.2407 10.2407 10.5787 10.5787 10.8916 10.8916 k = 0.5000-0.0000 0.1749 ( 5924 PWs) bands (ev): -17.1875 -17.1875 -17.0135 -17.0135 -16.4013 -16.4013 -16.0912 -16.0912 -14.9187 -14.9187 -14.7622 -14.7622 -14.0657 -14.0657 -14.0415 -14.0415 -6.6978 -6.6978 -6.3880 -6.3880 -5.1936 -5.1936 -4.5075 -4.5075 -3.1177 -3.1177 -2.6877 -2.6877 -2.6023 -2.6023 -2.4122 -2.4122 -1.4819 -1.4819 -1.0732 -1.0732 -0.7819 -0.7819 -0.7546 -0.7546 -0.2565 -0.2565 -0.0863 -0.0863 0.1445 0.1445 0.3354 0.3354 0.9393 0.9393 1.1697 1.1697 1.7319 1.7319 1.7447 1.7447 1.8375 1.8375 1.8672 1.8672 4.0686 4.0686 4.1225 4.1225 7.6311 7.6311 7.9095 7.9095 9.6557 9.6557 10.2800 10.2800 10.5628 10.5628 10.9349 10.9349 k = 0.5000-0.0000 0.1615 ( 5914 PWs) bands (ev): -17.1957 -17.1957 -16.9978 -16.9978 -16.4242 -16.4242 -16.0727 -16.0727 -14.9302 -14.9302 -14.7536 -14.7536 -14.0673 -14.0673 -14.0401 -14.0401 -6.7116 -6.7116 -6.3582 -6.3582 -5.2424 -5.2424 -4.4623 -4.4623 -3.1500 -3.1500 -2.6614 -2.6614 -2.6157 -2.6157 -2.4030 -2.4030 -1.5004 -1.5004 -1.0357 -1.0357 -0.7816 -0.7816 -0.7517 -0.7517 -0.2822 -0.2822 -0.1126 -0.1126 0.1606 0.1606 0.3571 0.3571 0.9215 0.9215 1.1816 1.1816 1.7291 1.7291 1.7442 1.7442 1.8338 1.8338 1.8673 1.8673 4.0657 4.0657 4.1264 4.1264 7.6217 7.6217 7.9388 7.9388 9.6128 9.6128 10.3174 10.3174 10.5476 10.5476 10.9816 10.9816 k = 0.5000-0.0000 0.1480 ( 5908 PWs) bands (ev): -17.2034 -17.2034 -16.9818 -16.9818 -16.4469 -16.4469 -16.0551 -16.0551 -14.9413 -14.9413 -14.7456 -14.7456 -14.0689 -14.0689 -14.0388 -14.0388 -6.7243 -6.7243 -6.3277 -6.3277 -5.2906 -5.2906 -4.4183 -4.4183 -3.1820 -3.1820 -2.6364 -2.6364 -2.6282 -2.6282 -2.3948 -2.3948 -1.5173 -1.5173 -0.9977 -0.9977 -0.7810 -0.7810 -0.7489 -0.7489 -0.3071 -0.3071 -0.1407 -0.1407 0.1769 0.1769 0.3779 0.3779 0.9042 0.9042 1.1928 1.1928 1.7260 1.7260 1.7437 1.7437 1.8302 1.8302 1.8672 1.8672 4.0629 4.0629 4.1300 4.1300 7.6134 7.6134 7.9687 7.9687 9.5712 9.5712 10.3524 10.3524 10.5330 10.5330 11.0319 11.0319 k = 0.5000-0.0000 0.1346 ( 5910 PWs) bands (ev): -17.2103 -17.2103 -16.9657 -16.9657 -16.4692 -16.4692 -16.0385 -16.0385 -14.9519 -14.9519 -14.7382 -14.7382 -14.0704 -14.0704 -14.0376 -14.0376 -6.7358 -6.7358 -6.2965 -6.2965 -5.3381 -5.3381 -4.3757 -4.3757 -3.2136 -3.2136 -2.6404 -2.6404 -2.6121 -2.6121 -2.3877 -2.3877 -1.5327 -1.5327 -0.9592 -0.9592 -0.7801 -0.7801 -0.7461 -0.7461 -0.3311 -0.3311 -0.1702 -0.1702 0.1928 0.1928 0.3974 0.3974 0.8874 0.8874 1.2031 1.2031 1.7227 1.7227 1.7431 1.7431 1.8267 1.8267 1.8669 1.8669 4.0604 4.0604 4.1335 4.1335 7.6061 7.6061 7.9988 7.9988 9.5309 9.5309 10.3849 10.3849 10.5189 10.5189 11.0852 11.0852 k = 0.5000-0.0000 0.1211 ( 5906 PWs) bands (ev): -17.2167 -17.2167 -16.9495 -16.9495 -16.4910 -16.4910 -16.0230 -16.0230 -14.9620 -14.9620 -14.7314 -14.7314 -14.0718 -14.0718 -14.0365 -14.0365 -6.7463 -6.7463 -6.2648 -6.2648 -5.3846 -5.3846 -4.3347 -4.3347 -3.2445 -3.2445 -2.6514 -2.6514 -2.5895 -2.5895 -2.3817 -2.3817 -1.5466 -1.5466 -0.9206 -0.9206 -0.7788 -0.7788 -0.7435 -0.7435 -0.3540 -0.3540 -0.2006 -0.2006 0.2080 0.2080 0.4157 0.4157 0.8715 0.8715 1.2124 1.2124 1.7194 1.7194 1.7424 1.7424 1.8234 1.8234 1.8666 1.8666 4.0581 4.0581 4.1368 4.1368 7.5998 7.5998 8.0288 8.0288 9.4922 9.4922 10.4148 10.4148 10.5053 10.5053 11.0519 11.0519 k = 0.5000-0.0000 0.1077 ( 5910 PWs) bands (ev): -17.2224 -17.2224 -16.9333 -16.9333 -16.5122 -16.5122 -16.0088 -16.0088 -14.9713 -14.9713 -14.7252 -14.7252 -14.0731 -14.0731 -14.0355 -14.0355 -6.7556 -6.7556 -6.2329 -6.2329 -5.4299 -5.4299 -4.2958 -4.2958 -3.2743 -3.2743 -2.6615 -2.6615 -2.5682 -2.5682 -2.3768 -2.3768 -1.5589 -1.5589 -0.8819 -0.8819 -0.7771 -0.7771 -0.7410 -0.7410 -0.3755 -0.3755 -0.2318 -0.2318 0.2221 0.2221 0.4326 0.4326 0.8565 0.8565 1.2209 1.2209 1.7161 1.7161 1.7417 1.7417 1.8204 1.8204 1.8662 1.8662 4.0560 4.0560 4.1398 4.1398 7.5945 7.5945 8.0581 8.0581 9.4555 9.4555 10.4420 10.4420 10.4922 10.4922 11.0124 11.0124 k = 0.5000-0.0000 0.0942 ( 5902 PWs) bands (ev): -17.2274 -17.2274 -16.9174 -16.9174 -16.5326 -16.5326 -15.9959 -15.9959 -14.9799 -14.9799 -14.7198 -14.7198 -14.0743 -14.0743 -14.0347 -14.0347 -6.7638 -6.7638 -6.2009 -6.2009 -5.4738 -5.4738 -4.2592 -4.2592 -3.3028 -3.3028 -2.6706 -2.6706 -2.5486 -2.5486 -2.3729 -2.3729 -1.5698 -1.5698 -0.8434 -0.8434 -0.7752 -0.7752 -0.7388 -0.7388 -0.3954 -0.3954 -0.2634 -0.2634 0.2350 0.2350 0.4479 0.4479 0.8427 0.8427 1.2284 1.2284 1.7128 1.7128 1.7411 1.7411 1.8176 1.8176 1.8658 1.8658 4.0541 4.0541 4.1425 4.1425 7.5899 7.5899 8.0863 8.0863 9.4212 9.4212 10.4661 10.4661 10.4801 10.4801 10.9776 10.9776 k = 0.5000-0.0000 0.0807 ( 5896 PWs) bands (ev): -17.2318 -17.2318 -16.9020 -16.9020 -16.5520 -16.5520 -15.9845 -15.9845 -14.9877 -14.9877 -14.7150 -14.7150 -14.0754 -14.0754 -14.0339 -14.0339 -6.7709 -6.7709 -6.1694 -6.1694 -5.5156 -5.5156 -4.2255 -4.2255 -3.3295 -3.3295 -2.6786 -2.6786 -2.5309 -2.5309 -2.3700 -2.3700 -1.5791 -1.5791 -0.8056 -0.8056 -0.7730 -0.7730 -0.7367 -0.7367 -0.4134 -0.4134 -0.2952 -0.2952 0.2465 0.2465 0.4615 0.4615 0.8302 0.8302 1.2349 1.2349 1.7097 1.7097 1.7404 1.7404 1.8151 1.8151 1.8654 1.8654 4.0525 4.0525 4.1449 4.1449 7.5862 7.5862 8.1128 8.1128 9.3897 9.3897 10.4675 10.4675 10.4885 10.4885 10.9475 10.9475 k = 0.5000-0.0000 0.0673 ( 5904 PWs) bands (ev): -17.2355 -17.2355 -16.8873 -16.8873 -16.5700 -16.5700 -15.9747 -15.9747 -14.9944 -14.9944 -14.7109 -14.7109 -14.0763 -14.0763 -14.0332 -14.0332 -6.7769 -6.7769 -6.1389 -6.1389 -5.5549 -5.5549 -4.1952 -4.1952 -3.3539 -3.3539 -2.6855 -2.6855 -2.5151 -2.5151 -2.3681 -2.3681 -1.5871 -1.5871 -0.7737 -0.7737 -0.7659 -0.7659 -0.7349 -0.7349 -0.4292 -0.4292 -0.3269 -0.3269 0.2565 0.2565 0.4733 0.4733 0.8193 0.8193 1.2405 1.2405 1.7069 1.7069 1.7398 1.7398 1.8129 1.8129 1.8651 1.8651 4.0511 4.0511 4.1470 4.1470 7.5831 7.5831 8.1368 8.1368 9.3616 9.3616 10.4571 10.4571 10.5069 10.5069 10.9222 10.9222 k = 0.5000-0.0000 0.0538 ( 5900 PWs) bands (ev): -17.2385 -17.2385 -16.8739 -16.8739 -16.5862 -16.5862 -15.9664 -15.9664 -15.0000 -15.0000 -14.7075 -14.7075 -14.0770 -14.0770 -14.0327 -14.0327 -6.7818 -6.7818 -6.1103 -6.1103 -5.5908 -5.5908 -4.1689 -4.1689 -3.3753 -3.3753 -2.6912 -2.6912 -2.5017 -2.5017 -2.3669 -2.3669 -1.5935 -1.5935 -0.7697 -0.7697 -0.7351 -0.7351 -0.7307 -0.7307 -0.4427 -0.4427 -0.3578 -0.3578 0.2648 0.2648 0.4831 0.4831 0.8101 0.8101 1.2451 1.2451 1.7044 1.7044 1.7393 1.7393 1.8111 1.8111 1.8648 1.8648 4.0500 4.0500 4.1488 4.1488 7.5806 7.5806 8.1579 8.1579 9.3374 9.3374 10.4479 10.4479 10.5222 10.5222 10.9018 10.9018 k = 0.5000-0.0000 0.0404 ( 5900 PWs) bands (ev): -17.2409 -17.2409 -16.8622 -16.8622 -16.6000 -16.6000 -15.9600 -15.9600 -15.0045 -15.0045 -14.7049 -14.7049 -14.0776 -14.0776 -14.0323 -14.0323 -6.7856 -6.7856 -6.0849 -6.0849 -5.6219 -5.6219 -4.1474 -4.1474 -3.3930 -3.3930 -2.6957 -2.6957 -2.4907 -2.4907 -2.3663 -2.3663 -1.5985 -1.5985 -0.7679 -0.7679 -0.7325 -0.7325 -0.6996 -0.6996 -0.4535 -0.4535 -0.3870 -0.3870 0.2714 0.2714 0.4908 0.4908 0.8027 0.8027 1.2486 1.2486 1.7024 1.7024 1.7389 1.7389 1.8097 1.8097 1.8645 1.8645 4.0491 4.0491 4.1501 4.1501 7.5788 7.5788 8.1752 8.1752 9.3177 9.3177 10.4404 10.4404 10.5343 10.5343 10.8861 10.8861 k = 0.5000-0.0000 0.0269 ( 5890 PWs) bands (ev): -17.2426 -17.2426 -16.8530 -16.8530 -16.6107 -16.6107 -15.9553 -15.9553 -15.0078 -15.0078 -14.7030 -14.7030 -14.0780 -14.0780 -14.0319 -14.0319 -6.7883 -6.7883 -6.0643 -6.0643 -5.6465 -5.6465 -4.1313 -4.1313 -3.4063 -3.4063 -2.6989 -2.6989 -2.4826 -2.4826 -2.3662 -2.3662 -1.6021 -1.6021 -0.7664 -0.7664 -0.7316 -0.7316 -0.6716 -0.6716 -0.4613 -0.4613 -0.4125 -0.4125 0.2762 0.2762 0.4964 0.4964 0.7973 0.7973 1.2512 1.2512 1.7009 1.7009 1.7385 1.7385 1.8087 1.8087 1.8643 1.8643 4.0485 4.0485 4.1511 4.1511 7.5775 7.5775 8.1881 8.1881 9.3032 9.3032 10.4348 10.4348 10.5430 10.5430 10.8750 10.8750 k = 0.5000-0.0000 0.0135 ( 5890 PWs) bands (ev): -17.2436 -17.2436 -16.8471 -16.8471 -16.6175 -16.6175 -15.9524 -15.9524 -15.0097 -15.0097 -14.7019 -14.7019 -14.0783 -14.0783 -14.0318 -14.0318 -6.7899 -6.7899 -6.0506 -6.0506 -5.6626 -5.6626 -4.1214 -4.1214 -3.4146 -3.4146 -2.7008 -2.7008 -2.4776 -2.4776 -2.3662 -2.3662 -1.6042 -1.6042 -0.7655 -0.7655 -0.7310 -0.7310 -0.6517 -0.6517 -0.4660 -0.4660 -0.4310 -0.4310 0.2791 0.2791 0.4998 0.4998 0.7941 0.7941 1.2527 1.2527 1.7000 1.7000 1.7383 1.7383 1.8081 1.8081 1.8642 1.8642 4.0481 4.0481 4.1517 4.1517 7.5767 7.5767 8.1961 8.1961 9.2942 9.2942 10.4313 10.4313 10.5483 10.5483 10.8684 10.8684 k = 0.5000-0.0000-0.0000 ( 5894 PWs) bands (ev): -17.2439 -17.2439 -16.8450 -16.8450 -16.6199 -16.6199 -15.9515 -15.9515 -15.0104 -15.0104 -14.7015 -14.7015 -14.0784 -14.0784 -14.0317 -14.0317 -6.7905 -6.7905 -6.0458 -6.0458 -5.6682 -5.6682 -4.1180 -4.1180 -3.4174 -3.4174 -2.7015 -2.7015 -2.4759 -2.4759 -2.3662 -2.3662 -1.6049 -1.6049 -0.7652 -0.7652 -0.7309 -0.7309 -0.6442 -0.6442 -0.4676 -0.4676 -0.4380 -0.4380 0.2800 0.2800 0.5010 0.5010 0.7930 0.7930 1.2532 1.2532 1.6997 1.6997 1.7383 1.7383 1.8079 1.8079 1.8642 1.8642 4.0480 4.0480 4.1519 4.1519 7.5765 7.5765 8.1988 8.1988 9.2912 9.2912 10.4301 10.4301 10.5501 10.5501 10.8662 10.8662 k = 0.0000 0.0000 0.2691 ( 5908 PWs) bands (ev): -17.4520 -17.4520 -17.4520 -17.4520 -16.1541 -16.1541 -16.1541 -16.1541 -14.5319 -14.5319 -14.5319 -14.5319 -13.7241 -13.7241 -13.7241 -13.7241 -7.3990 -7.3990 -7.3990 -7.3990 -4.4637 -4.4637 -4.4637 -4.4637 -3.8239 -3.8239 -3.8239 -3.8239 -2.2601 -2.2601 -2.2601 -2.2601 -1.3116 -1.3116 -1.3116 -1.3116 -0.6707 -0.6707 -0.6707 -0.6707 -0.1076 -0.1076 -0.1076 -0.1076 -0.0592 -0.0592 -0.0592 -0.0592 1.5272 1.5272 1.5272 1.5272 1.7886 1.7886 1.7886 1.7886 3.3754 3.3754 3.3754 3.3754 4.6836 4.6836 4.6836 4.6836 5.7202 5.7202 5.7202 5.7202 9.5482 9.5482 9.5482 9.5482 11.5100 11.5100 11.5100 11.5100 k = 0.0139-0.0000 0.2691 ( 5908 PWs) bands (ev): -17.4515 -17.4515 -17.4515 -17.4515 -16.1542 -16.1542 -16.1542 -16.1542 -14.5322 -14.5322 -14.5322 -14.5322 -13.7251 -13.7251 -13.7250 -13.7250 -7.3974 -7.3974 -7.3974 -7.3974 -4.4647 -4.4647 -4.4644 -4.4644 -3.8225 -3.8225 -3.8222 -3.8222 -2.2605 -2.2605 -2.2604 -2.2604 -1.3112 -1.3112 -1.3110 -1.3110 -0.6720 -0.6720 -0.6719 -0.6719 -0.1078 -0.1078 -0.1075 -0.1075 -0.0586 -0.0586 -0.0585 -0.0585 1.5266 1.5266 1.5267 1.5267 1.7881 1.7881 1.7882 1.7882 3.3736 3.3736 3.3736 3.3736 4.6816 4.6816 4.6817 4.6817 5.7231 5.7231 5.7232 5.7232 9.5496 9.5496 9.5497 9.5497 11.5090 11.5090 11.5095 11.5095 k = 0.0278-0.0000 0.2691 ( 5908 PWs) bands (ev): -17.4500 -17.4500 -17.4500 -17.4500 -16.1544 -16.1544 -16.1544 -16.1544 -14.5333 -14.5333 -14.5331 -14.5331 -13.7278 -13.7278 -13.7277 -13.7277 -7.3926 -7.3926 -7.3926 -7.3926 -4.4674 -4.4674 -4.4668 -4.4668 -3.8179 -3.8179 -3.8173 -3.8173 -2.2614 -2.2614 -2.2613 -2.2613 -1.3099 -1.3099 -1.3095 -1.3095 -0.6756 -0.6756 -0.6756 -0.6756 -0.1080 -0.1080 -0.1075 -0.1075 -0.0565 -0.0565 -0.0564 -0.0564 1.5250 1.5250 1.5251 1.5251 1.7867 1.7867 1.7867 1.7867 3.3684 3.3684 3.3684 3.3684 4.6757 4.6757 4.6758 4.6758 5.7320 5.7320 5.7321 5.7321 9.5539 9.5539 9.5541 9.5541 11.5064 11.5064 11.5074 11.5074 k = 0.0417-0.0000 0.2691 ( 5898 PWs) bands (ev): -17.4474 -17.4474 -17.4474 -17.4474 -16.1548 -16.1548 -16.1548 -16.1548 -14.5350 -14.5350 -14.5348 -14.5348 -13.7323 -13.7323 -13.7321 -13.7321 -7.3848 -7.3848 -7.3847 -7.3847 -4.4717 -4.4717 -4.4709 -4.4709 -3.8103 -3.8103 -3.8094 -3.8094 -2.2630 -2.2630 -2.2628 -2.2628 -1.3076 -1.3076 -1.3072 -1.3072 -0.6817 -0.6817 -0.6816 -0.6816 -0.1083 -0.1083 -0.1075 -0.1075 -0.0532 -0.0532 -0.0529 -0.0529 1.5222 1.5222 1.5224 1.5224 1.7843 1.7843 1.7843 1.7843 3.3596 3.3596 3.3597 3.3597 4.6661 4.6661 4.6662 4.6662 5.7466 5.7466 5.7468 5.7468 9.5611 9.5611 9.5613 9.5613 11.5021 11.5021 11.5037 11.5037 k = 0.0556-0.0000 0.2691 ( 5890 PWs) bands (ev): -17.4438 -17.4438 -17.4438 -17.4438 -16.1554 -16.1554 -16.1554 -16.1554 -14.5374 -14.5374 -14.5371 -14.5371 -13.7385 -13.7385 -13.7382 -13.7382 -7.3738 -7.3738 -7.3738 -7.3738 -4.4776 -4.4776 -4.4765 -4.4765 -3.7997 -3.7997 -3.7985 -3.7985 -2.2652 -2.2652 -2.2649 -2.2649 -1.3045 -1.3045 -1.3038 -1.3038 -0.6900 -0.6900 -0.6899 -0.6899 -0.1087 -0.1087 -0.1076 -0.1076 -0.0486 -0.0486 -0.0482 -0.0482 1.5184 1.5184 1.5186 1.5186 1.7810 1.7810 1.7811 1.7811 3.3474 3.3474 3.3474 3.3474 4.6528 4.6528 4.6530 4.6530 5.7671 5.7671 5.7673 5.7673 9.5711 9.5711 9.5715 9.5715 11.4959 11.4959 11.4980 11.4980 k = 0.0694-0.0000 0.2691 ( 5892 PWs) bands (ev): -17.4392 -17.4392 -17.4392 -17.4392 -16.1561 -16.1561 -16.1561 -16.1561 -14.5405 -14.5405 -14.5402 -14.5402 -13.7463 -13.7463 -13.7460 -13.7460 -7.3599 -7.3599 -7.3599 -7.3599 -4.4850 -4.4850 -4.4836 -4.4836 -3.7862 -3.7862 -3.7848 -3.7848 -2.2679 -2.2679 -2.2676 -2.2676 -1.3003 -1.3003 -1.2996 -1.2996 -0.7004 -0.7004 -0.7003 -0.7003 -0.1091 -0.1091 -0.1076 -0.1076 -0.0429 -0.0429 -0.0423 -0.0423 1.5134 1.5134 1.5137 1.5137 1.7769 1.7769 1.7770 1.7770 3.3315 3.3315 3.3316 3.3316 4.6362 4.6362 4.6364 4.6364 5.7931 5.7931 5.7934 5.7934 9.5840 9.5840 9.5844 9.5844 11.4878 11.4878 11.4904 11.4904 k = 0.0833-0.0000 0.2691 ( 5892 PWs) bands (ev): -17.4337 -17.4337 -17.4337 -17.4337 -16.1570 -16.1570 -16.1570 -16.1570 -14.5443 -14.5443 -14.5439 -14.5439 -13.7557 -13.7557 -13.7553 -13.7553 -7.3432 -7.3432 -7.3431 -7.3431 -4.4936 -4.4936 -4.4920 -4.4920 -3.7699 -3.7699 -3.7683 -3.7683 -2.2713 -2.2713 -2.2709 -2.2709 -1.2953 -1.2953 -1.2944 -1.2944 -0.7128 -0.7128 -0.7126 -0.7126 -0.1096 -0.1096 -0.1077 -0.1077 -0.0362 -0.0362 -0.0354 -0.0354 1.5073 1.5073 1.5077 1.5077 1.7721 1.7721 1.7722 1.7722 3.3121 3.3121 3.3122 3.3122 4.6165 4.6165 4.6167 4.6167 5.8246 5.8246 5.8250 5.8250 9.5996 9.5996 9.6001 9.6001 11.4773 11.4773 11.4805 11.4805 k = 0.0972-0.0000 0.2691 ( 5898 PWs) bands (ev): -17.4272 -17.4272 -17.4272 -17.4272 -16.1581 -16.1581 -16.1581 -16.1581 -14.5489 -14.5489 -14.5484 -14.5484 -13.7664 -13.7664 -13.7659 -13.7659 -7.3237 -7.3237 -7.3236 -7.3236 -4.5034 -4.5034 -4.5016 -4.5016 -3.7511 -3.7511 -3.7493 -3.7493 -2.2752 -2.2752 -2.2748 -2.2748 -1.2893 -1.2893 -1.2883 -1.2883 -0.7270 -0.7270 -0.7267 -0.7267 -0.1100 -0.1100 -0.1078 -0.1078 -0.0287 -0.0287 -0.0277 -0.0277 1.5000 1.5000 1.5004 1.5004 1.7666 1.7666 1.7667 1.7667 3.2891 3.2891 3.2891 3.2891 4.5941 4.5941 4.5944 4.5944 5.8615 5.8615 5.8619 5.8619 9.6180 9.6180 9.6185 9.6185 11.4643 11.4643 11.4680 11.4680 k = 0.1111-0.0000 0.2691 ( 5894 PWs) bands (ev): -17.4197 -17.4197 -17.4197 -17.4197 -16.1594 -16.1594 -16.1593 -16.1593 -14.5542 -14.5542 -14.5537 -14.5537 -13.7783 -13.7783 -13.7778 -13.7778 -7.3017 -7.3017 -7.3016 -7.3016 -4.5143 -4.5143 -4.5123 -4.5123 -3.7299 -3.7299 -3.7280 -3.7280 -2.2797 -2.2797 -2.2792 -2.2792 -1.2824 -1.2824 -1.2812 -1.2812 -0.7428 -0.7428 -0.7425 -0.7425 -0.1104 -0.1104 -0.1078 -0.1078 -0.0204 -0.0204 -0.0192 -0.0192 1.4915 1.4915 1.4920 1.4920 1.7606 1.7606 1.7608 1.7608 3.2624 3.2624 3.2624 3.2624 4.5694 4.5694 4.5698 4.5698 5.9034 5.9034 5.9039 5.9039 9.6389 9.6389 9.6395 9.6395 11.4484 11.4484 11.4526 11.4526 k = 0.1250-0.0000 0.2691 ( 5896 PWs) bands (ev): -17.4114 -17.4114 -17.4114 -17.4114 -16.1608 -16.1608 -16.1607 -16.1607 -14.5603 -14.5603 -14.5597 -14.5597 -13.7913 -13.7913 -13.7907 -13.7907 -7.2773 -7.2773 -7.2772 -7.2772 -4.5260 -4.5260 -4.5240 -4.5240 -3.7063 -3.7063 -3.7043 -3.7043 -2.2848 -2.2848 -2.2842 -2.2842 -1.2745 -1.2745 -1.2733 -1.2733 -0.7599 -0.7599 -0.7595 -0.7595 -0.1108 -0.1108 -0.1078 -0.1078 -0.0116 -0.0116 -0.0101 -0.0101 1.4817 1.4817 1.4823 1.4823 1.7542 1.7542 1.7544 1.7544 3.2319 3.2319 3.2319 3.2319 4.5429 4.5429 4.5433 4.5433 5.9503 5.9503 5.9508 5.9508 9.6625 9.6625 9.6632 9.6632 11.4293 11.4293 11.4340 11.4340 k = 0.1389-0.0000 0.2691 ( 5894 PWs) bands (ev): -17.4022 -17.4022 -17.4021 -17.4021 -16.1624 -16.1624 -16.1624 -16.1624 -14.5672 -14.5672 -14.5665 -14.5665 -13.8051 -13.8051 -13.8045 -13.8045 -7.2507 -7.2507 -7.2506 -7.2506 -4.5386 -4.5386 -4.5365 -4.5365 -3.6807 -3.6807 -3.6786 -3.6786 -2.2903 -2.2903 -2.2897 -2.2897 -1.2658 -1.2658 -1.2644 -1.2644 -0.7782 -0.7782 -0.7778 -0.7778 -0.1111 -0.1111 -0.1078 -0.1078 -0.0022 -0.0022 -0.0006 -0.0006 1.4707 1.4707 1.4714 1.4714 1.7475 1.7475 1.7477 1.7477 3.1977 3.1977 3.1977 3.1977 4.5151 4.5151 4.5155 4.5155 6.0018 6.0018 6.0024 6.0024 9.6886 9.6886 9.6893 9.6893 11.4066 11.4066 11.4117 11.4117 k = 0.1528-0.0000 0.2691 ( 5886 PWs) bands (ev): -17.3921 -17.3921 -17.3921 -17.3921 -16.1643 -16.1643 -16.1642 -16.1642 -14.5748 -14.5748 -14.5742 -14.5742 -13.8197 -13.8197 -13.8191 -13.8191 -7.2222 -7.2222 -7.2220 -7.2220 -4.5519 -4.5519 -4.5497 -4.5497 -3.6531 -3.6531 -3.6509 -3.6509 -2.2964 -2.2964 -2.2957 -2.2957 -1.2561 -1.2561 -1.2547 -1.2547 -0.7975 -0.7975 -0.7970 -0.7970 -0.1112 -0.1112 -0.1076 -0.1076 0.0075 0.0075 0.0093 0.0093 1.4585 1.4585 1.4592 1.4592 1.7406 1.7406 1.7409 1.7409 3.1597 3.1597 3.1598 3.1598 4.4862 4.4862 4.4867 4.4867 6.0578 6.0578 6.0585 6.0585 9.7170 9.7170 9.7178 9.7178 11.3800 11.3800 11.3856 11.3856 k = 0.1667-0.0000 0.2691 ( 5886 PWs) bands (ev): -17.3813 -17.3813 -17.3813 -17.3813 -16.1663 -16.1663 -16.1662 -16.1662 -14.5833 -14.5833 -14.5826 -14.5826 -13.8348 -13.8348 -13.8341 -13.8341 -7.1919 -7.1919 -7.1917 -7.1917 -4.5658 -4.5658 -4.5635 -4.5635 -3.6236 -3.6236 -3.6213 -3.6213 -2.3029 -2.3029 -2.3022 -2.3022 -1.2457 -1.2457 -1.2442 -1.2442 -0.8175 -0.8175 -0.8169 -0.8169 -0.1112 -0.1112 -0.1074 -0.1074 0.0174 0.0174 0.0194 0.0194 1.4450 1.4450 1.4458 1.4458 1.7336 1.7336 1.7340 1.7340 3.1179 3.1179 3.1180 3.1180 4.4569 4.4569 4.4575 4.4575 6.1179 6.1179 6.1187 6.1187 9.7477 9.7477 9.7486 9.7486 11.3492 11.3492 11.3552 11.3552 k = 0.1806-0.0000 0.2691 ( 5882 PWs) bands (ev): -17.3697 -17.3697 -17.3697 -17.3697 -16.1685 -16.1685 -16.1684 -16.1684 -14.5926 -14.5926 -14.5919 -14.5919 -13.8503 -13.8503 -13.8495 -13.8495 -7.1600 -7.1600 -7.1599 -7.1599 -4.5801 -4.5801 -4.5778 -4.5778 -3.5924 -3.5924 -3.5902 -3.5902 -2.3098 -2.3098 -2.3091 -2.3091 -1.2345 -1.2345 -1.2330 -1.2330 -0.8379 -0.8379 -0.8373 -0.8373 -0.1110 -0.1110 -0.1070 -0.1070 0.0275 0.0275 0.0297 0.0297 1.4304 1.4304 1.4312 1.4312 1.7267 1.7267 1.7271 1.7271 3.0724 3.0724 3.0726 3.0726 4.4276 4.4276 4.4282 4.4282 6.1820 6.1820 6.1828 6.1828 9.7807 9.7807 9.7816 9.7816 11.3140 11.3140 11.3203 11.3203 k = 0.1944-0.0000 0.2691 ( 5880 PWs) bands (ev): -17.3575 -17.3575 -17.3575 -17.3575 -16.1710 -16.1710 -16.1709 -16.1709 -14.6027 -14.6027 -14.6019 -14.6019 -13.8659 -13.8659 -13.8651 -13.8651 -7.1269 -7.1269 -7.1267 -7.1267 -4.5949 -4.5949 -4.5926 -4.5926 -3.5597 -3.5597 -3.5575 -3.5575 -2.3172 -2.3172 -2.3164 -2.3164 -1.2228 -1.2228 -1.2212 -1.2212 -0.8585 -0.8585 -0.8578 -0.8578 -0.1107 -0.1107 -0.1065 -0.1065 0.0377 0.0377 0.0400 0.0400 1.4146 1.4146 1.4155 1.4155 1.7200 1.7200 1.7203 1.7203 3.0234 3.0234 3.0236 3.0236 4.3986 4.3986 4.3992 4.3992 6.2497 6.2497 6.2506 6.2506 9.8156 9.8156 9.8166 9.8166 11.2742 11.2742 11.2809 11.2809 k = 0.2083-0.0000 0.2691 ( 5876 PWs) bands (ev): -17.3447 -17.3447 -17.3447 -17.3447 -16.1736 -16.1736 -16.1735 -16.1735 -14.6136 -14.6136 -14.6128 -14.6128 -13.8814 -13.8814 -13.8806 -13.8806 -7.0927 -7.0927 -7.0925 -7.0925 -4.6100 -4.6100 -4.6077 -4.6077 -3.5256 -3.5256 -3.5234 -3.5234 -2.3250 -2.3250 -2.3241 -2.3241 -1.2106 -1.2106 -1.2091 -1.2091 -0.8790 -0.8790 -0.8781 -0.8781 -0.1102 -0.1102 -0.1058 -0.1058 0.0479 0.0479 0.0503 0.0503 1.3978 1.3978 1.3987 1.3987 1.7134 1.7134 1.7138 1.7138 2.9709 2.9709 2.9712 2.9712 4.3702 4.3702 4.3709 4.3709 6.3207 6.3207 6.3217 6.3217 9.8525 9.8525 9.8535 9.8535 11.2298 11.2298 11.2367 11.2367 k = 0.2222-0.0000 0.2691 ( 5876 PWs) bands (ev): -17.3313 -17.3313 -17.3313 -17.3313 -16.1764 -16.1764 -16.1764 -16.1764 -14.6252 -14.6252 -14.6244 -14.6244 -13.8968 -13.8968 -13.8960 -13.8960 -7.0578 -7.0578 -7.0576 -7.0576 -4.6254 -4.6254 -4.6231 -4.6231 -3.4903 -3.4903 -3.4881 -3.4881 -2.3331 -2.3331 -2.3322 -2.3322 -1.1984 -1.1984 -1.1970 -1.1970 -0.8988 -0.8988 -0.8978 -0.8978 -0.1095 -0.1095 -0.1050 -0.1050 0.0579 0.0579 0.0605 0.0605 1.3800 1.3800 1.3809 1.3809 1.7072 1.7072 1.7076 1.7076 2.9152 2.9152 2.9156 2.9156 4.3428 4.3428 4.3436 4.3436 6.3949 6.3949 6.3959 6.3959 9.8911 9.8911 9.8921 9.8921 11.1808 11.1808 11.1879 11.1879 k = 0.2361-0.0000 0.2691 ( 5882 PWs) bands (ev): -17.3175 -17.3175 -17.3174 -17.3174 -16.1795 -16.1795 -16.1794 -16.1794 -14.6375 -14.6375 -14.6367 -14.6367 -13.9118 -13.9118 -13.9110 -13.9110 -7.0223 -7.0223 -7.0221 -7.0221 -4.6409 -4.6409 -4.6386 -4.6386 -3.4539 -3.4539 -3.4518 -3.4518 -2.3416 -2.3416 -2.3406 -2.3406 -1.1866 -1.1866 -1.1853 -1.1853 -0.9173 -0.9173 -0.9162 -0.9162 -0.1085 -0.1085 -0.1040 -0.1040 0.0679 0.0679 0.0704 0.0704 1.3614 1.3614 1.3623 1.3623 1.7013 1.7013 1.7017 1.7017 2.8565 2.8565 2.8570 2.8570 4.3167 4.3167 4.3174 4.3174 6.4717 6.4717 6.4729 6.4729 9.9313 9.9313 9.9323 9.9323 11.1273 11.1273 11.1346 11.1346 k = 0.2500-0.0000 0.2691 ( 5894 PWs) bands (ev): -17.3032 -17.3032 -17.3032 -17.3032 -16.1828 -16.1828 -16.1827 -16.1827 -14.6505 -14.6505 -14.6496 -14.6496 -13.9264 -13.9264 -13.9255 -13.9255 -6.9865 -6.9865 -6.9863 -6.9863 -4.6566 -4.6566 -4.6543 -4.6543 -3.4166 -3.4166 -3.4145 -3.4145 -2.3503 -2.3503 -2.3493 -2.3493 -1.1760 -1.1760 -1.1748 -1.1748 -0.9339 -0.9339 -0.9325 -0.9325 -0.1074 -0.1074 -0.1028 -0.1028 0.0775 0.0775 0.0802 0.0802 1.3420 1.3420 1.3429 1.3429 1.6958 1.6958 1.6962 1.6962 2.7954 2.7954 2.7959 2.7959 4.2918 4.2918 4.2926 4.2926 6.5510 6.5510 6.5522 6.5522 9.9728 9.9728 9.9738 9.9738 11.0696 11.0696 11.0770 11.0770 k = 0.2639-0.0000 0.2691 ( 5886 PWs) bands (ev): -17.2887 -17.2887 -17.2887 -17.2887 -16.1862 -16.1862 -16.1861 -16.1861 -14.6639 -14.6639 -14.6630 -14.6630 -13.9403 -13.9403 -13.9395 -13.9395 -6.9507 -6.9507 -6.9505 -6.9505 -4.6722 -4.6722 -4.6700 -4.6700 -3.3785 -3.3785 -3.3766 -3.3766 -2.3594 -2.3594 -2.3583 -2.3583 -1.1674 -1.1674 -1.1664 -1.1664 -0.9473 -0.9473 -0.9457 -0.9457 -0.1061 -0.1061 -0.1015 -0.1015 0.0870 0.0870 0.0896 0.0896 1.3221 1.3221 1.3230 1.3230 1.6908 1.6908 1.6912 1.6912 2.7320 2.7320 2.7326 2.7326 4.2685 4.2685 4.2693 4.2693 6.6324 6.6324 6.6337 6.6337 10.0155 10.0155 10.0164 10.0164 11.0082 11.0082 11.0157 11.0157 k = 0.2778-0.0000 0.2691 ( 5890 PWs) bands (ev): -17.2740 -17.2740 -17.2739 -17.2739 -16.1899 -16.1899 -16.1898 -16.1898 -14.6778 -14.6778 -14.6769 -14.6769 -13.9536 -13.9536 -13.9528 -13.9528 -6.9152 -6.9152 -6.9149 -6.9149 -4.6878 -4.6878 -4.6856 -4.6856 -3.3400 -3.3400 -3.3382 -3.3382 -2.3687 -2.3687 -2.3675 -2.3675 -1.1620 -1.1620 -1.1614 -1.1614 -0.9565 -0.9565 -0.9546 -0.9546 -0.1046 -0.1046 -0.1001 -0.1001 0.0961 0.0961 0.0987 0.0987 1.3017 1.3017 1.3026 1.3026 1.6864 1.6864 1.6868 1.6868 2.6670 2.6670 2.6676 2.6676 4.2468 4.2468 4.2475 4.2475 6.7155 6.7155 6.7168 6.7168 10.0589 10.0589 10.0598 10.0598 10.9435 10.9435 10.9511 10.9511 k = 0.2917-0.0000 0.2691 ( 5890 PWs) bands (ev): -17.2592 -17.2592 -17.2591 -17.2591 -16.1937 -16.1937 -16.1936 -16.1936 -14.6920 -14.6920 -14.6911 -14.6911 -13.9661 -13.9661 -13.9653 -13.9653 -6.8801 -6.8801 -6.8799 -6.8799 -4.7032 -4.7032 -4.7011 -4.7011 -3.3012 -3.3012 -3.2995 -3.2995 -2.3782 -2.3782 -2.3770 -2.3770 -1.1610 -1.1610 -1.1607 -1.1607 -0.9601 -0.9601 -0.9580 -0.9580 -0.1029 -0.1029 -0.0985 -0.0985 0.1048 0.1048 0.1073 0.1073 1.2810 1.2810 1.2819 1.2819 1.6826 1.6826 1.6829 1.6829 2.6008 2.6008 2.6015 2.6015 4.2266 4.2266 4.2274 4.2274 6.7998 6.7998 6.8012 6.8012 10.1028 10.1028 10.1035 10.1035 10.8762 10.8762 10.8839 10.8839 k = 0.3056-0.0000 0.2691 ( 5888 PWs) bands (ev): -17.2444 -17.2444 -17.2443 -17.2443 -16.1976 -16.1976 -16.1975 -16.1975 -14.7063 -14.7063 -14.7055 -14.7055 -13.9778 -13.9778 -13.9770 -13.9770 -6.8458 -6.8458 -6.8456 -6.8456 -4.7184 -4.7184 -4.7164 -4.7164 -3.2623 -3.2623 -3.2607 -3.2607 -2.3879 -2.3879 -2.3866 -2.3866 -1.1649 -1.1649 -1.1647 -1.1647 -0.9578 -0.9578 -0.9555 -0.9555 -0.1010 -0.1010 -0.0968 -0.0968 0.1131 0.1131 0.1156 0.1156 1.2602 1.2602 1.2610 1.2610 1.6795 1.6795 1.6798 1.6798 2.5340 2.5340 2.5347 2.5347 4.2081 4.2081 4.2088 4.2088 6.8850 6.8850 6.8864 6.8864 10.1465 10.1465 10.1470 10.1470 10.8073 10.8073 10.8151 10.8151 k = 0.3194-0.0000 0.2691 ( 5892 PWs) bands (ev): -17.2297 -17.2297 -17.2297 -17.2297 -16.2016 -16.2016 -16.2015 -16.2015 -14.7206 -14.7206 -14.7198 -14.7198 -13.9886 -13.9886 -13.9879 -13.9879 -6.8125 -6.8125 -6.8122 -6.8122 -4.7332 -4.7332 -4.7313 -4.7313 -3.2235 -3.2235 -3.2221 -3.2221 -2.3978 -2.3978 -2.3965 -2.3965 -1.1732 -1.1732 -1.1731 -1.1731 -0.9500 -0.9500 -0.9475 -0.9475 -0.0990 -0.0990 -0.0950 -0.0950 0.1209 0.1209 0.1233 0.1233 1.2394 1.2394 1.2402 1.2402 1.6772 1.6772 1.6774 1.6774 2.4670 2.4670 2.4678 2.4678 4.1911 4.1911 4.1918 4.1918 6.9705 6.9705 6.9720 6.9720 10.1891 10.1891 10.1893 10.1893 10.7381 10.7381 10.7460 10.7460 k = 0.3333-0.0000 0.2691 ( 5898 PWs) bands (ev): -17.2153 -17.2153 -17.2153 -17.2153 -16.2058 -16.2058 -16.2057 -16.2057 -14.7348 -14.7348 -14.7340 -14.7340 -13.9986 -13.9986 -13.9979 -13.9979 -6.7804 -6.7804 -6.7802 -6.7802 -4.7476 -4.7476 -4.7458 -4.7458 -3.1853 -3.1853 -3.1840 -3.1840 -2.4078 -2.4078 -2.4065 -2.4065 -1.1849 -1.1849 -1.1848 -1.1848 -0.9376 -0.9376 -0.9352 -0.9352 -0.0969 -0.0969 -0.0931 -0.0931 0.1282 0.1282 0.1305 0.1305 1.2188 1.2188 1.2195 1.2195 1.6757 1.6757 1.6759 1.6759 2.4006 2.4006 2.4014 2.4014 4.1758 4.1758 4.1764 4.1764 7.0559 7.0559 7.0573 7.0573 10.2289 10.2289 10.2290 10.2290 10.6706 10.6706 10.6787 10.6787 k = 0.3472-0.0000 0.2691 ( 5902 PWs) bands (ev): -17.2013 -17.2013 -17.2013 -17.2013 -16.2099 -16.2099 -16.2098 -16.2098 -14.7486 -14.7486 -14.7479 -14.7479 -14.0077 -14.0077 -14.0070 -14.0070 -6.7498 -6.7498 -6.7496 -6.7496 -4.7614 -4.7614 -4.7597 -4.7597 -3.1477 -3.1477 -3.1466 -3.1466 -2.4179 -2.4179 -2.4165 -2.4165 -1.1987 -1.1987 -1.1986 -1.1986 -0.9221 -0.9221 -0.9197 -0.9197 -0.0948 -0.0948 -0.0913 -0.0913 0.1350 0.1350 0.1371 0.1371 1.1986 1.1986 1.1993 1.1993 1.6752 1.6752 1.6754 1.6754 2.3353 2.3353 2.3361 2.3361 4.1619 4.1619 4.1625 4.1625 7.1404 7.1404 7.1418 7.1418 10.2625 10.2625 10.2631 10.2631 10.6082 10.6082 10.6166 10.6166 k = 0.3611-0.0000 0.2691 ( 5898 PWs) bands (ev): -17.1878 -17.1878 -17.1878 -17.1878 -16.2140 -16.2140 -16.2139 -16.2139 -14.7619 -14.7619 -14.7613 -14.7613 -14.0159 -14.0159 -14.0152 -14.0152 -6.7210 -6.7210 -6.7207 -6.7207 -4.7745 -4.7745 -4.7729 -4.7729 -3.1112 -3.1112 -3.1102 -3.1102 -2.4280 -2.4280 -2.4267 -2.4267 -1.2136 -1.2136 -1.2135 -1.2135 -0.9045 -0.9045 -0.9023 -0.9023 -0.0926 -0.0926 -0.0894 -0.0894 0.1412 0.1412 0.1431 0.1431 1.1790 1.1790 1.1796 1.1796 1.6758 1.6758 1.6759 1.6759 2.2716 2.2716 2.2724 2.2724 4.1495 4.1495 4.1500 4.1500 7.2233 7.2233 7.2248 7.2248 10.2840 10.2840 10.2852 10.2852 10.5579 10.5579 10.5665 10.5665 k = 0.3750-0.0000 0.2691 ( 5900 PWs) bands (ev): -17.1751 -17.1751 -17.1750 -17.1750 -16.2180 -16.2180 -16.2180 -16.2180 -14.7746 -14.7746 -14.7740 -14.7740 -14.0232 -14.0232 -14.0226 -14.0226 -6.6940 -6.6940 -6.6937 -6.6937 -4.7869 -4.7869 -4.7854 -4.7854 -3.0761 -3.0761 -3.0752 -3.0752 -2.4381 -2.4381 -2.4368 -2.4368 -1.2288 -1.2288 -1.2287 -1.2287 -0.8858 -0.8858 -0.8837 -0.8837 -0.0904 -0.0904 -0.0875 -0.0875 0.1468 0.1468 0.1485 0.1485 1.1602 1.1602 1.1608 1.1608 1.6776 1.6776 1.6776 1.6776 2.2102 2.2102 2.2110 2.2110 4.1384 4.1384 4.1390 4.1390 7.3039 7.3039 7.3054 7.3054 10.2838 10.2838 10.2849 10.2849 10.5305 10.5305 10.5387 10.5387 k = 0.3889-0.0000 0.2691 ( 5914 PWs) bands (ev): -17.1631 -17.1631 -17.1631 -17.1631 -16.2219 -16.2219 -16.2218 -16.2218 -14.7864 -14.7864 -14.7858 -14.7858 -14.0297 -14.0297 -14.0291 -14.0291 -6.6692 -6.6692 -6.6690 -6.6690 -4.7983 -4.7983 -4.7970 -4.7970 -3.0427 -3.0427 -3.0420 -3.0420 -2.4481 -2.4481 -2.4469 -2.4469 -1.2437 -1.2437 -1.2436 -1.2436 -0.8669 -0.8669 -0.8649 -0.8649 -0.0884 -0.0884 -0.0858 -0.0858 0.1518 0.1518 0.1533 0.1533 1.1424 1.1424 1.1429 1.1429 1.6806 1.6806 1.6807 1.6807 2.1515 2.1515 2.1523 2.1523 4.1287 4.1287 4.1292 4.1292 7.3812 7.3812 7.3826 7.3826 10.2571 10.2571 10.2573 10.2573 10.5313 10.5313 10.5382 10.5382 k = 0.4028-0.0000 0.2691 ( 5912 PWs) bands (ev): -17.1521 -17.1521 -17.1521 -17.1521 -16.2256 -16.2256 -16.2255 -16.2255 -14.7972 -14.7972 -14.7967 -14.7967 -14.0353 -14.0353 -14.0348 -14.0348 -6.6468 -6.6468 -6.6466 -6.6466 -4.8088 -4.8088 -4.8076 -4.8076 -3.0114 -3.0114 -3.0109 -3.0109 -2.4579 -2.4579 -2.4567 -2.4567 -1.2577 -1.2577 -1.2577 -1.2577 -0.8483 -0.8483 -0.8465 -0.8465 -0.0864 -0.0864 -0.0841 -0.0841 0.1561 0.1561 0.1574 0.1574 1.1259 1.1259 1.1263 1.1263 1.6852 1.6852 1.6853 1.6853 2.0962 2.0962 2.0970 2.0970 4.1203 4.1203 4.1208 4.1208 7.4541 7.4541 7.4555 7.4555 10.2121 10.2121 10.2127 10.2127 10.5513 10.5513 10.5569 10.5569 k = 0.4167-0.0000 0.2691 ( 5910 PWs) bands (ev): -17.1423 -17.1423 -17.1423 -17.1423 -16.2289 -16.2289 -16.2289 -16.2289 -14.8069 -14.8069 -14.8065 -14.8065 -14.0401 -14.0401 -14.0397 -14.0397 -6.6269 -6.6269 -6.6267 -6.6267 -4.8181 -4.8181 -4.8171 -4.8171 -2.9827 -2.9827 -2.9824 -2.9824 -2.4673 -2.4673 -2.4662 -2.4662 -1.2706 -1.2706 -1.2706 -1.2706 -0.8307 -0.8307 -0.8292 -0.8292 -0.0845 -0.0845 -0.0826 -0.0826 0.1598 0.1598 0.1609 0.1609 1.1109 1.1109 1.1112 1.1112 1.6913 1.6913 1.6914 1.6914 2.0447 2.0447 2.0454 2.0454 4.1131 4.1131 4.1135 4.1135 7.5215 7.5215 7.5228 7.5228 10.1608 10.1608 10.1619 10.1619 10.5795 10.5795 10.5841 10.5841 k = 0.4306-0.0000 0.2691 ( 5920 PWs) bands (ev): -17.1337 -17.1337 -17.1336 -17.1336 -16.2320 -16.2320 -16.2319 -16.2319 -14.8153 -14.8153 -14.8150 -14.8150 -14.0441 -14.0441 -14.0438 -14.0438 -6.6098 -6.6098 -6.6096 -6.6096 -4.8262 -4.8262 -4.8253 -4.8253 -2.9571 -2.9571 -2.9568 -2.9568 -2.4761 -2.4761 -2.4751 -2.4751 -1.2820 -1.2820 -1.2820 -1.2820 -0.8146 -0.8146 -0.8133 -0.8133 -0.0828 -0.0828 -0.0813 -0.0813 0.1629 0.1629 0.1638 0.1638 1.0976 1.0976 1.0978 1.0978 1.6990 1.6990 1.6993 1.6993 1.9974 1.9974 1.9981 1.9981 4.1071 4.1071 4.1075 4.1075 7.5821 7.5821 7.5833 7.5833 10.1105 10.1105 10.1117 10.1117 10.6095 10.6095 10.6132 10.6132 k = 0.4444-0.0000 0.2691 ( 5928 PWs) bands (ev): -17.1264 -17.1264 -17.1264 -17.1264 -16.2345 -16.2345 -16.2345 -16.2345 -14.8224 -14.8224 -14.8221 -14.8221 -14.0474 -14.0474 -14.0471 -14.0471 -6.5955 -6.5955 -6.5954 -6.5954 -4.8329 -4.8329 -4.8322 -4.8322 -2.9351 -2.9351 -2.9349 -2.9349 -2.4840 -2.4840 -2.4831 -2.4831 -1.2917 -1.2917 -1.2917 -1.2917 -0.8006 -0.8006 -0.7996 -0.7996 -0.0814 -0.0814 -0.0802 -0.0802 0.1654 0.1654 0.1661 0.1661 1.0862 1.0862 1.0865 1.0865 1.7085 1.7085 1.7087 1.7087 1.9550 1.9550 1.9556 1.9556 4.1023 4.1023 4.1026 4.1026 7.6344 7.6344 7.6354 7.6354 10.0650 10.0650 10.0662 10.0662 10.6378 10.6378 10.6408 10.6408 k = 0.4583-0.0000 0.2691 ( 5936 PWs) bands (ev): -17.1207 -17.1207 -17.1207 -17.1207 -16.2366 -16.2366 -16.2366 -16.2366 -14.8280 -14.8280 -14.8277 -14.8277 -14.0499 -14.0499 -14.0497 -14.0497 -6.5843 -6.5843 -6.5842 -6.5842 -4.8382 -4.8382 -4.8377 -4.8377 -2.9171 -2.9171 -2.9170 -2.9170 -2.4907 -2.4907 -2.4900 -2.4900 -1.2995 -1.2995 -1.2995 -1.2995 -0.7892 -0.7892 -0.7884 -0.7884 -0.0802 -0.0802 -0.0793 -0.0793 0.1673 0.1673 0.1678 0.1678 1.0772 1.0772 1.0773 1.0773 1.7192 1.7192 1.7195 1.7195 1.9181 1.9181 1.9187 1.9187 4.0986 4.0986 4.0988 4.0988 7.6771 7.6771 7.6779 7.6779 10.0270 10.0270 10.0280 10.0280 10.6621 10.6621 10.6644 10.6644 k = 0.4722-0.0000 0.2691 ( 5940 PWs) bands (ev): -17.1165 -17.1165 -17.1165 -17.1165 -16.2381 -16.2381 -16.2381 -16.2381 -14.8320 -14.8320 -14.8318 -14.8318 -14.0517 -14.0517 -14.0516 -14.0516 -6.5762 -6.5762 -6.5761 -6.5761 -4.8421 -4.8421 -4.8417 -4.8417 -2.9038 -2.9038 -2.9038 -2.9038 -2.4958 -2.4958 -2.4953 -2.4953 -1.3051 -1.3051 -1.3051 -1.3051 -0.7807 -0.7807 -0.7802 -0.7802 -0.0793 -0.0793 -0.0787 -0.0787 0.1687 0.1687 0.1690 0.1690 1.0705 1.0705 1.0706 1.0706 1.7305 1.7305 1.7308 1.7308 1.8880 1.8880 1.8885 1.8885 4.0959 4.0959 4.0961 4.0961 7.7088 7.7088 7.7093 7.7093 9.9985 9.9985 9.9992 9.9992 10.6809 10.6809 10.6825 10.6825 k = 0.4861-0.0000 0.2691 ( 5944 PWs) bands (ev): -17.1140 -17.1140 -17.1140 -17.1140 -16.2391 -16.2391 -16.2390 -16.2390 -14.8344 -14.8344 -14.8343 -14.8343 -14.0527 -14.0527 -14.0527 -14.0527 -6.5713 -6.5713 -6.5712 -6.5712 -4.8443 -4.8443 -4.8442 -4.8442 -2.8956 -2.8956 -2.8956 -2.8956 -2.4989 -2.4989 -2.4987 -2.4987 -1.3086 -1.3086 -1.3086 -1.3086 -0.7754 -0.7754 -0.7752 -0.7752 -0.0787 -0.0787 -0.0784 -0.0784 0.1696 0.1696 0.1697 0.1697 1.0665 1.0665 1.0665 1.0665 1.7400 1.7400 1.7402 1.7402 1.8671 1.8671 1.8674 1.8674 4.0944 4.0944 4.0944 4.0944 7.7283 7.7283 7.7286 7.7286 9.9809 9.9809 9.9812 9.9812 10.6929 10.6929 10.6937 10.6937 k = 0.5000-0.0000 0.2691 ( 5936 PWs) bands (ev): -17.1131 -17.1131 -17.1131 -17.1131 -16.2394 -16.2394 -16.2394 -16.2394 -14.8352 -14.8352 -14.8352 -14.8352 -14.0531 -14.0531 -14.0531 -14.0531 -6.5696 -6.5696 -6.5696 -6.5696 -4.8451 -4.8451 -4.8451 -4.8451 -2.8928 -2.8928 -2.8928 -2.8928 -2.4999 -2.4999 -2.4999 -2.4999 -1.3097 -1.3097 -1.3097 -1.3097 -0.7736 -0.7736 -0.7736 -0.7736 -0.0784 -0.0784 -0.0784 -0.0784 0.1699 0.1699 0.1699 0.1699 1.0651 1.0651 1.0651 1.0651 1.7441 1.7441 1.7441 1.7441 1.8594 1.8594 1.8594 1.8594 4.0939 4.0939 4.0939 4.0939 7.7350 7.7350 7.7350 7.7350 9.9750 9.9750 9.9750 9.9750 10.6973 10.6973 10.6973 10.6973 Writing output data file SiO2.save init_run : 0.31s CPU 0.46s WALL ( 1 calls) electrons : 425.10s CPU 430.26s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 425.10s CPU 430.24s 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 : 0.08s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.11s WALL ( 271 calls) cegterg : 403.27s CPU 407.43s WALL ( 768 calls) Called by sum_band: Called by *egterg: h_psi : 196.50s CPU 199.15s WALL ( 13950 calls) s_psi : 18.17s CPU 18.29s WALL ( 13950 calls) g_psi : 0.62s CPU 0.55s WALL ( 12911 calls) cdiaghg : 151.43s CPU 153.37s WALL ( 13182 calls) cegterg:over : 19.19s CPU 19.15s WALL ( 12911 calls) cegterg:upda : 18.71s CPU 18.64s WALL ( 12911 calls) cegterg:last : 7.89s CPU 7.88s WALL ( 1581 calls) cdiaghg:chol : 8.60s CPU 8.90s WALL ( 13182 calls) cdiaghg:inve : 6.25s CPU 6.34s WALL ( 13182 calls) cdiaghg:para : 10.66s CPU 10.76s WALL ( 26364 calls) Called by h_psi: h_psi:vloc : 156.92s CPU 159.44s WALL ( 13950 calls) h_psi:vnl : 38.90s CPU 39.01s WALL ( 13950 calls) add_vuspsi : 20.13s CPU 20.13s WALL ( 13950 calls) General routines calbec : 18.71s CPU 18.84s WALL ( 13950 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 146.80s CPU 148.86s WALL ( 1387052 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.26s CPU 0.70s WALL ( 542 calls) Parallel routines fft_scatter : 48.08s CPU 48.33s WALL ( 1387075 calls) PWSCF : 7m26.62s CPU 7m46.52s WALL This run was terminated on: 21: 6:54 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=