Program PWSCF v.5.1.1 starts on 11Dec2015 at 8: 6:10 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./ZrGeTe4.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 37 37 10 2335 2335 350 Max 38 38 11 2342 2342 357 Sum 1795 1795 509 112271 112271 16977 bravais-lattice index = 14 lattice parameter (alat) = 15.5138 a.u. unit-cell volume = 2351.8621 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 200.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.513827 celldm(2)= 1.000000 celldm(3)= 1.339377 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.882520 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.882520 0.470275 0.000000 ) a(3) = ( 0.000000 0.000000 1.339377 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.876602 -0.000000 ) b(2) = ( 0.000000 2.126414 -0.000000 ) b(3) = ( 0.000000 0.000000 0.746616 ) PseudoPot. # 1 for Ge read from file: /home/autes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 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 1207 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 Zr read from file: /home/autes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 3 for Te read from file: /home/autes/Pseudo/Te_MT_PBE.UPF MD5 check sum: 58ccb0a2ae5f507b1c31ab9daa3b9941 Pseudo is Norm-conserving, Zval = 6.0 Generated using "atomic" code by A. Dal Corso (espresso distribution) Using radial grid of 1245 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Zr 4.00 91.22400 Zr( 1.00) Te 6.00 127.60000 Te( 1.00) 2 Sym. Ops. (no inversion) found ( 1 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 [0,0,1] 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 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.6696884 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 C2 2 -E -1 -C2 -2 Cartesian axes number of k points= 294 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034014 k( 2) = ( 0.0063238 0.0253144 -0.0000000), wk = 0.0034014 k( 3) = ( 0.0126477 0.0506289 -0.0000000), wk = 0.0034014 k( 4) = ( 0.0189715 0.0759433 -0.0000000), wk = 0.0034014 k( 5) = ( 0.0252954 0.1012578 -0.0000000), wk = 0.0034014 k( 6) = ( 0.0316192 0.1265722 -0.0000000), wk = 0.0034014 k( 7) = ( 0.0379431 0.1518867 -0.0000000), wk = 0.0034014 k( 8) = ( 0.0442669 0.1772011 -0.0000000), wk = 0.0034014 k( 9) = ( 0.0505908 0.2025156 -0.0000000), wk = 0.0034014 k( 10) = ( 0.0569146 0.2278300 -0.0000000), wk = 0.0034014 k( 11) = ( 0.0632384 0.2531445 -0.0000000), wk = 0.0034014 k( 12) = ( 0.0695623 0.2784589 -0.0000000), wk = 0.0034014 k( 13) = ( 0.0758861 0.3037734 -0.0000000), wk = 0.0034014 k( 14) = ( 0.0822100 0.3290878 -0.0000000), wk = 0.0034014 k( 15) = ( 0.0885338 0.3544023 -0.0000000), wk = 0.0034014 k( 16) = ( 0.0948577 0.3797167 -0.0000000), wk = 0.0034014 k( 17) = ( 0.1011815 0.4050312 -0.0000000), wk = 0.0034014 k( 18) = ( 0.1075054 0.4303456 -0.0000000), wk = 0.0034014 k( 19) = ( 0.1138292 0.4556601 -0.0000000), wk = 0.0034014 k( 20) = ( 0.1201530 0.4809745 -0.0000000), wk = 0.0034014 k( 21) = ( 0.1264769 0.5062890 -0.0000000), wk = 0.0034014 k( 22) = ( 0.1328007 0.5316034 -0.0000000), wk = 0.0034014 k( 23) = ( 0.1391246 0.5569179 -0.0000000), wk = 0.0034014 k( 24) = ( 0.1454484 0.5822323 -0.0000000), wk = 0.0034014 k( 25) = ( 0.1517723 0.6075468 -0.0000000), wk = 0.0034014 k( 26) = ( 0.1580961 0.6328612 -0.0000000), wk = 0.0034014 k( 27) = ( 0.1644200 0.6581757 -0.0000000), wk = 0.0034014 k( 28) = ( 0.1707438 0.6834901 -0.0000000), wk = 0.0034014 k( 29) = ( 0.1770676 0.7088046 -0.0000000), wk = 0.0034014 k( 30) = ( 0.1833915 0.7341190 -0.0000000), wk = 0.0034014 k( 31) = ( 0.1897153 0.7594334 -0.0000000), wk = 0.0034014 k( 32) = ( 0.1960392 0.7847479 -0.0000000), wk = 0.0034014 k( 33) = ( 0.2023630 0.8100623 -0.0000000), wk = 0.0034014 k( 34) = ( 0.2086869 0.8353768 -0.0000000), wk = 0.0034014 k( 35) = ( 0.2150107 0.8606912 -0.0000000), wk = 0.0034014 k( 36) = ( 0.2213346 0.8860057 -0.0000000), wk = 0.0034014 k( 37) = ( 0.2276584 0.9113201 -0.0000000), wk = 0.0034014 k( 38) = ( 0.2339823 0.9366346 -0.0000000), wk = 0.0034014 k( 39) = ( 0.2403061 0.9619490 -0.0000000), wk = 0.0034014 k( 40) = ( 0.2466299 0.9872634 -0.0000000), wk = 0.0034014 k( 41) = ( 0.2529538 1.0125779 -0.0000000), wk = 0.0034014 k( 42) = ( 0.2592776 1.0378923 -0.0000000), wk = 0.0034014 k( 43) = ( 0.2656015 1.0632068 -0.0000000), wk = 0.0034014 k( 44) = ( 0.2656015 1.0632068 -0.0000000), wk = 0.0034014 k( 45) = ( 0.2414559 1.0632068 -0.0000000), wk = 0.0034014 k( 46) = ( 0.2173103 1.0632068 -0.0000000), wk = 0.0034014 k( 47) = ( 0.1931647 1.0632068 -0.0000000), wk = 0.0034014 k( 48) = ( 0.1690191 1.0632068 -0.0000000), wk = 0.0034014 k( 49) = ( 0.1448735 1.0632068 -0.0000000), wk = 0.0034014 k( 50) = ( 0.1207279 1.0632068 -0.0000000), wk = 0.0034014 k( 51) = ( 0.0965823 1.0632068 -0.0000000), wk = 0.0034014 k( 52) = ( 0.0724368 1.0632068 -0.0000000), wk = 0.0034014 k( 53) = ( 0.0482912 1.0632068 -0.0000000), wk = 0.0034014 k( 54) = ( 0.0241456 1.0632068 -0.0000000), wk = 0.0034014 k( 55) = ( 0.0000000 1.0632068 -0.0000000), wk = 0.0034014 k( 56) = ( 0.0000000 1.0632068 -0.0000000), wk = 0.0034014 k( 57) = ( 0.0000000 1.0632068 0.0248872), wk = 0.0034014 k( 58) = ( 0.0000000 1.0632068 0.0497744), wk = 0.0034014 k( 59) = ( 0.0000000 1.0632068 0.0746616), wk = 0.0034014 k( 60) = ( 0.0000000 1.0632068 0.0995488), wk = 0.0034014 k( 61) = ( 0.0000000 1.0632068 0.1244360), wk = 0.0034014 k( 62) = ( 0.0000000 1.0632068 0.1493232), wk = 0.0034014 k( 63) = ( 0.0000000 1.0632068 0.1742104), wk = 0.0034014 k( 64) = ( 0.0000000 1.0632068 0.1990976), wk = 0.0034014 k( 65) = ( 0.0000000 1.0632068 0.2239848), wk = 0.0034014 k( 66) = ( 0.0000000 1.0632068 0.2488720), wk = 0.0034014 k( 67) = ( 0.0000000 1.0632068 0.2737592), wk = 0.0034014 k( 68) = ( 0.0000000 1.0632068 0.2986464), wk = 0.0034014 k( 69) = ( 0.0000000 1.0632068 0.3235335), wk = 0.0034014 k( 70) = ( 0.0000000 1.0632068 0.3484207), wk = 0.0034014 k( 71) = ( 0.0000000 1.0632068 0.3733079), wk = 0.0034014 k( 72) = ( 0.0000000 1.0632068 0.3733079), wk = 0.0034014 k( 73) = ( 0.0241456 1.0632068 0.3733079), wk = 0.0034014 k( 74) = ( 0.0482912 1.0632068 0.3733079), wk = 0.0034014 k( 75) = ( 0.0724368 1.0632068 0.3733079), wk = 0.0034014 k( 76) = ( 0.0965823 1.0632068 0.3733079), wk = 0.0034014 k( 77) = ( 0.1207279 1.0632068 0.3733079), wk = 0.0034014 k( 78) = ( 0.1448735 1.0632068 0.3733079), wk = 0.0034014 k( 79) = ( 0.1690191 1.0632068 0.3733079), wk = 0.0034014 k( 80) = ( 0.1931647 1.0632068 0.3733079), wk = 0.0034014 k( 81) = ( 0.2173103 1.0632068 0.3733079), wk = 0.0034014 k( 82) = ( 0.2414559 1.0632068 0.3733079), wk = 0.0034014 k( 83) = ( 0.2656015 1.0632068 0.3733079), wk = 0.0034014 k( 84) = ( 0.2656015 1.0632068 0.3733079), wk = 0.0034014 k( 85) = ( 0.2592776 1.0378923 0.3733079), wk = 0.0034014 k( 86) = ( 0.2529538 1.0125779 0.3733079), wk = 0.0034014 k( 87) = ( 0.2466299 0.9872634 0.3733079), wk = 0.0034014 k( 88) = ( 0.2403061 0.9619490 0.3733079), wk = 0.0034014 k( 89) = ( 0.2339823 0.9366346 0.3733079), wk = 0.0034014 k( 90) = ( 0.2276584 0.9113201 0.3733079), wk = 0.0034014 k( 91) = ( 0.2213346 0.8860057 0.3733079), wk = 0.0034014 k( 92) = ( 0.2150107 0.8606912 0.3733079), wk = 0.0034014 k( 93) = ( 0.2086869 0.8353768 0.3733079), wk = 0.0034014 k( 94) = ( 0.2023630 0.8100623 0.3733079), wk = 0.0034014 k( 95) = ( 0.1960392 0.7847479 0.3733079), wk = 0.0034014 k( 96) = ( 0.1897153 0.7594334 0.3733079), wk = 0.0034014 k( 97) = ( 0.1833915 0.7341190 0.3733079), wk = 0.0034014 k( 98) = ( 0.1770676 0.7088046 0.3733079), wk = 0.0034014 k( 99) = ( 0.1707438 0.6834901 0.3733079), wk = 0.0034014 k( 100) = ( 0.1644200 0.6581757 0.3733079), wk = 0.0034014 k( 101) = ( 0.1580961 0.6328612 0.3733079), wk = 0.0034014 k( 102) = ( 0.1517723 0.6075468 0.3733079), wk = 0.0034014 k( 103) = ( 0.1454484 0.5822323 0.3733079), wk = 0.0034014 k( 104) = ( 0.1391246 0.5569179 0.3733079), wk = 0.0034014 k( 105) = ( 0.1328007 0.5316034 0.3733079), wk = 0.0034014 k( 106) = ( 0.1264769 0.5062890 0.3733079), wk = 0.0034014 k( 107) = ( 0.1201530 0.4809745 0.3733079), wk = 0.0034014 k( 108) = ( 0.1138292 0.4556601 0.3733079), wk = 0.0034014 k( 109) = ( 0.1075054 0.4303456 0.3733079), wk = 0.0034014 k( 110) = ( 0.1011815 0.4050312 0.3733079), wk = 0.0034014 k( 111) = ( 0.0948577 0.3797167 0.3733079), wk = 0.0034014 k( 112) = ( 0.0885338 0.3544023 0.3733079), wk = 0.0034014 k( 113) = ( 0.0822100 0.3290878 0.3733079), wk = 0.0034014 k( 114) = ( 0.0758861 0.3037734 0.3733079), wk = 0.0034014 k( 115) = ( 0.0695623 0.2784589 0.3733079), wk = 0.0034014 k( 116) = ( 0.0632384 0.2531445 0.3733079), wk = 0.0034014 k( 117) = ( 0.0569146 0.2278300 0.3733079), wk = 0.0034014 k( 118) = ( 0.0505908 0.2025156 0.3733079), wk = 0.0034014 k( 119) = ( 0.0442669 0.1772011 0.3733079), wk = 0.0034014 k( 120) = ( 0.0379431 0.1518867 0.3733079), wk = 0.0034014 k( 121) = ( 0.0316192 0.1265722 0.3733079), wk = 0.0034014 k( 122) = ( 0.0252954 0.1012578 0.3733079), wk = 0.0034014 k( 123) = ( 0.0189715 0.0759433 0.3733079), wk = 0.0034014 k( 124) = ( 0.0126477 0.0506289 0.3733079), wk = 0.0034014 k( 125) = ( 0.0063238 0.0253144 0.3733079), wk = 0.0034014 k( 126) = ( 0.0000000 0.0000000 0.3733079), wk = 0.0034014 k( 127) = ( 0.0000000 0.0000000 0.3733079), wk = 0.0034014 k( 128) = ( 0.0000000 0.0000000 0.3484207), wk = 0.0034014 k( 129) = ( 0.0000000 0.0000000 0.3235335), wk = 0.0034014 k( 130) = ( 0.0000000 0.0000000 0.2986464), wk = 0.0034014 k( 131) = ( 0.0000000 0.0000000 0.2737592), wk = 0.0034014 k( 132) = ( 0.0000000 0.0000000 0.2488720), wk = 0.0034014 k( 133) = ( 0.0000000 0.0000000 0.2239848), wk = 0.0034014 k( 134) = ( 0.0000000 0.0000000 0.1990976), wk = 0.0034014 k( 135) = ( 0.0000000 0.0000000 0.1742104), wk = 0.0034014 k( 136) = ( 0.0000000 0.0000000 0.1493232), wk = 0.0034014 k( 137) = ( 0.0000000 0.0000000 0.1244360), wk = 0.0034014 k( 138) = ( 0.0000000 0.0000000 0.0995488), wk = 0.0034014 k( 139) = ( 0.0000000 0.0000000 0.0746616), wk = 0.0034014 k( 140) = ( 0.0000000 0.0000000 0.0497744), wk = 0.0034014 k( 141) = ( 0.0000000 0.0000000 0.0248872), wk = 0.0034014 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034014 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034014 k( 144) = ( -0.0250000 0.0062453 -0.0000000), wk = 0.0034014 k( 145) = ( -0.0500000 0.0124906 -0.0000000), wk = 0.0034014 k( 146) = ( -0.0750000 0.0187359 -0.0000000), wk = 0.0034014 k( 147) = ( -0.1000000 0.0249812 -0.0000000), wk = 0.0034014 k( 148) = ( -0.1250000 0.0312265 -0.0000000), wk = 0.0034014 k( 149) = ( -0.1500000 0.0374718 -0.0000000), wk = 0.0034014 k( 150) = ( -0.1750000 0.0437170 -0.0000000), wk = 0.0034014 k( 151) = ( -0.2000000 0.0499623 -0.0000000), wk = 0.0034014 k( 152) = ( -0.2250000 0.0562076 -0.0000000), wk = 0.0034014 k( 153) = ( -0.2500000 0.0624529 -0.0000000), wk = 0.0034014 k( 154) = ( -0.2750000 0.0686982 -0.0000000), wk = 0.0034014 k( 155) = ( -0.3000000 0.0749435 -0.0000000), wk = 0.0034014 k( 156) = ( -0.3250000 0.0811888 -0.0000000), wk = 0.0034014 k( 157) = ( -0.3500000 0.0874341 -0.0000000), wk = 0.0034014 k( 158) = ( -0.3750000 0.0936794 -0.0000000), wk = 0.0034014 k( 159) = ( -0.4000000 0.0999247 -0.0000000), wk = 0.0034014 k( 160) = ( -0.4250000 0.1061700 -0.0000000), wk = 0.0034014 k( 161) = ( -0.4500000 0.1124153 -0.0000000), wk = 0.0034014 k( 162) = ( -0.4750000 0.1186605 -0.0000000), wk = 0.0034014 k( 163) = ( -0.5000000 0.1249058 -0.0000000), wk = 0.0034014 k( 164) = ( -0.5000000 0.1249058 -0.0000000), wk = 0.0034014 k( 165) = ( -0.4938316 0.1495980 -0.0000000), wk = 0.0034014 k( 166) = ( -0.4876632 0.1742901 -0.0000000), wk = 0.0034014 k( 167) = ( -0.4814948 0.1989822 -0.0000000), wk = 0.0034014 k( 168) = ( -0.4753265 0.2236744 -0.0000000), wk = 0.0034014 k( 169) = ( -0.4691581 0.2483665 -0.0000000), wk = 0.0034014 k( 170) = ( -0.4629897 0.2730586 -0.0000000), wk = 0.0034014 k( 171) = ( -0.4568213 0.2977508 -0.0000000), wk = 0.0034014 k( 172) = ( -0.4506529 0.3224429 -0.0000000), wk = 0.0034014 k( 173) = ( -0.4444846 0.3471350 -0.0000000), wk = 0.0034014 k( 174) = ( -0.4383162 0.3718271 -0.0000000), wk = 0.0034014 k( 175) = ( -0.4321478 0.3965193 -0.0000000), wk = 0.0034014 k( 176) = ( -0.4259794 0.4212114 -0.0000000), wk = 0.0034014 k( 177) = ( -0.4198110 0.4459035 -0.0000000), wk = 0.0034014 k( 178) = ( -0.4136427 0.4705956 -0.0000000), wk = 0.0034014 k( 179) = ( -0.4074743 0.4952878 -0.0000000), wk = 0.0034014 k( 180) = ( -0.4013059 0.5199799 -0.0000000), wk = 0.0034014 k( 181) = ( -0.3951375 0.5446721 -0.0000000), wk = 0.0034014 k( 182) = ( -0.3889691 0.5693642 -0.0000000), wk = 0.0034014 k( 183) = ( -0.3828007 0.5940563 -0.0000000), wk = 0.0034014 k( 184) = ( -0.3766324 0.6187485 -0.0000000), wk = 0.0034014 k( 185) = ( -0.3704640 0.6434406 -0.0000000), wk = 0.0034014 k( 186) = ( -0.3642956 0.6681327 -0.0000000), wk = 0.0034014 k( 187) = ( -0.3581272 0.6928249 -0.0000000), wk = 0.0034014 k( 188) = ( -0.3519588 0.7175170 -0.0000000), wk = 0.0034014 k( 189) = ( -0.3457904 0.7422091 -0.0000000), wk = 0.0034014 k( 190) = ( -0.3396221 0.7669012 -0.0000000), wk = 0.0034014 k( 191) = ( -0.3334537 0.7915934 -0.0000000), wk = 0.0034014 k( 192) = ( -0.3272853 0.8162855 -0.0000000), wk = 0.0034014 k( 193) = ( -0.3211169 0.8409776 -0.0000000), wk = 0.0034014 k( 194) = ( -0.3149485 0.8656697 -0.0000000), wk = 0.0034014 k( 195) = ( -0.3087801 0.8903619 -0.0000000), wk = 0.0034014 k( 196) = ( -0.3026118 0.9150540 -0.0000000), wk = 0.0034014 k( 197) = ( -0.2964434 0.9397461 -0.0000000), wk = 0.0034014 k( 198) = ( -0.2902750 0.9644383 -0.0000000), wk = 0.0034014 k( 199) = ( -0.2841066 0.9891304 -0.0000000), wk = 0.0034014 k( 200) = ( -0.2779382 1.0138225 -0.0000000), wk = 0.0034014 k( 201) = ( -0.2717698 1.0385147 -0.0000000), wk = 0.0034014 k( 202) = ( -0.2656015 1.0632068 -0.0000000), wk = 0.0034014 k( 203) = ( -0.2656015 1.0632068 -0.0000000), wk = 0.0034014 k( 204) = ( -0.2656015 1.0632068 0.0248872), wk = 0.0034014 k( 205) = ( -0.2656015 1.0632068 0.0497744), wk = 0.0034014 k( 206) = ( -0.2656015 1.0632068 0.0746616), wk = 0.0034014 k( 207) = ( -0.2656015 1.0632068 0.0995488), wk = 0.0034014 k( 208) = ( -0.2656015 1.0632068 0.1244360), wk = 0.0034014 k( 209) = ( -0.2656015 1.0632068 0.1493232), wk = 0.0034014 k( 210) = ( -0.2656015 1.0632068 0.1742104), wk = 0.0034014 k( 211) = ( -0.2656015 1.0632068 0.1990976), wk = 0.0034014 k( 212) = ( -0.2656015 1.0632068 0.2239848), wk = 0.0034014 k( 213) = ( -0.2656015 1.0632068 0.2488720), wk = 0.0034014 k( 214) = ( -0.2656015 1.0632068 0.2737592), wk = 0.0034014 k( 215) = ( -0.2656015 1.0632068 0.2986464), wk = 0.0034014 k( 216) = ( -0.2656015 1.0632068 0.3235335), wk = 0.0034014 k( 217) = ( -0.2656015 1.0632068 0.3484207), wk = 0.0034014 k( 218) = ( -0.2656015 1.0632068 0.3733079), wk = 0.0034014 k( 219) = ( -0.2656015 1.0632068 0.3733079), wk = 0.0034014 k( 220) = ( -0.2717698 1.0385147 0.3733079), wk = 0.0034014 k( 221) = ( -0.2779382 1.0138225 0.3733079), wk = 0.0034014 k( 222) = ( -0.2841066 0.9891304 0.3733079), wk = 0.0034014 k( 223) = ( -0.2902750 0.9644383 0.3733079), wk = 0.0034014 k( 224) = ( -0.2964434 0.9397461 0.3733079), wk = 0.0034014 k( 225) = ( -0.3026118 0.9150540 0.3733079), wk = 0.0034014 k( 226) = ( -0.3087801 0.8903619 0.3733079), wk = 0.0034014 k( 227) = ( -0.3149485 0.8656697 0.3733079), wk = 0.0034014 k( 228) = ( -0.3211169 0.8409776 0.3733079), wk = 0.0034014 k( 229) = ( -0.3272853 0.8162855 0.3733079), wk = 0.0034014 k( 230) = ( -0.3334537 0.7915934 0.3733079), wk = 0.0034014 k( 231) = ( -0.3396221 0.7669012 0.3733079), wk = 0.0034014 k( 232) = ( -0.3457904 0.7422091 0.3733079), wk = 0.0034014 k( 233) = ( -0.3519588 0.7175170 0.3733079), wk = 0.0034014 k( 234) = ( -0.3581272 0.6928249 0.3733079), wk = 0.0034014 k( 235) = ( -0.3642956 0.6681327 0.3733079), wk = 0.0034014 k( 236) = ( -0.3704640 0.6434406 0.3733079), wk = 0.0034014 k( 237) = ( -0.3766324 0.6187485 0.3733079), wk = 0.0034014 k( 238) = ( -0.3828007 0.5940563 0.3733079), wk = 0.0034014 k( 239) = ( -0.3889691 0.5693642 0.3733079), wk = 0.0034014 k( 240) = ( -0.3951375 0.5446721 0.3733079), wk = 0.0034014 k( 241) = ( -0.4013059 0.5199799 0.3733079), wk = 0.0034014 k( 242) = ( -0.4074743 0.4952878 0.3733079), wk = 0.0034014 k( 243) = ( -0.4136427 0.4705956 0.3733079), wk = 0.0034014 k( 244) = ( -0.4198110 0.4459035 0.3733079), wk = 0.0034014 k( 245) = ( -0.4259794 0.4212114 0.3733079), wk = 0.0034014 k( 246) = ( -0.4321478 0.3965193 0.3733079), wk = 0.0034014 k( 247) = ( -0.4383162 0.3718271 0.3733079), wk = 0.0034014 k( 248) = ( -0.4444846 0.3471350 0.3733079), wk = 0.0034014 k( 249) = ( -0.4506529 0.3224429 0.3733079), wk = 0.0034014 k( 250) = ( -0.4568213 0.2977508 0.3733079), wk = 0.0034014 k( 251) = ( -0.4629897 0.2730586 0.3733079), wk = 0.0034014 k( 252) = ( -0.4691581 0.2483665 0.3733079), wk = 0.0034014 k( 253) = ( -0.4753265 0.2236744 0.3733079), wk = 0.0034014 k( 254) = ( -0.4814948 0.1989822 0.3733079), wk = 0.0034014 k( 255) = ( -0.4876632 0.1742901 0.3733079), wk = 0.0034014 k( 256) = ( -0.4938316 0.1495980 0.3733079), wk = 0.0034014 k( 257) = ( -0.5000000 0.1249058 0.3733079), wk = 0.0034014 k( 258) = ( -0.5000000 0.1249058 0.3733079), wk = 0.0034014 k( 259) = ( -0.5000000 0.1249058 0.3484207), wk = 0.0034014 k( 260) = ( -0.5000000 0.1249058 0.3235335), wk = 0.0034014 k( 261) = ( -0.5000000 0.1249058 0.2986464), wk = 0.0034014 k( 262) = ( -0.5000000 0.1249058 0.2737592), wk = 0.0034014 k( 263) = ( -0.5000000 0.1249058 0.2488720), wk = 0.0034014 k( 264) = ( -0.5000000 0.1249058 0.2239848), wk = 0.0034014 k( 265) = ( -0.5000000 0.1249058 0.1990976), wk = 0.0034014 k( 266) = ( -0.5000000 0.1249058 0.1742104), wk = 0.0034014 k( 267) = ( -0.5000000 0.1249058 0.1493232), wk = 0.0034014 k( 268) = ( -0.5000000 0.1249058 0.1244360), wk = 0.0034014 k( 269) = ( -0.5000000 0.1249058 0.0995488), wk = 0.0034014 k( 270) = ( -0.5000000 0.1249058 0.0746616), wk = 0.0034014 k( 271) = ( -0.5000000 0.1249058 0.0497744), wk = 0.0034014 k( 272) = ( -0.5000000 0.1249058 0.0248872), wk = 0.0034014 k( 273) = ( -0.5000000 0.1249058 -0.0000000), wk = 0.0034014 k( 274) = ( 0.0000000 0.0000000 0.3733079), wk = 0.0034014 k( 275) = ( -0.0250000 0.0062453 0.3733079), wk = 0.0034014 k( 276) = ( -0.0500000 0.0124906 0.3733079), wk = 0.0034014 k( 277) = ( -0.0750000 0.0187359 0.3733079), wk = 0.0034014 k( 278) = ( -0.1000000 0.0249812 0.3733079), wk = 0.0034014 k( 279) = ( -0.1250000 0.0312265 0.3733079), wk = 0.0034014 k( 280) = ( -0.1500000 0.0374718 0.3733079), wk = 0.0034014 k( 281) = ( -0.1750000 0.0437170 0.3733079), wk = 0.0034014 k( 282) = ( -0.2000000 0.0499623 0.3733079), wk = 0.0034014 k( 283) = ( -0.2250000 0.0562076 0.3733079), wk = 0.0034014 k( 284) = ( -0.2500000 0.0624529 0.3733079), wk = 0.0034014 k( 285) = ( -0.2750000 0.0686982 0.3733079), wk = 0.0034014 k( 286) = ( -0.3000000 0.0749435 0.3733079), wk = 0.0034014 k( 287) = ( -0.3250000 0.0811888 0.3733079), wk = 0.0034014 k( 288) = ( -0.3500000 0.0874341 0.3733079), wk = 0.0034014 k( 289) = ( -0.3750000 0.0936794 0.3733079), wk = 0.0034014 k( 290) = ( -0.4000000 0.0999247 0.3733079), wk = 0.0034014 k( 291) = ( -0.4250000 0.1061700 0.3733079), wk = 0.0034014 k( 292) = ( -0.4500000 0.1124153 0.3733079), wk = 0.0034014 k( 293) = ( -0.4750000 0.1186605 0.3733079), wk = 0.0034014 k( 294) = ( -0.5000000 0.1249058 0.3733079), wk = 0.0034014 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034014 k( 2) = ( 0.0063238 0.0063238 0.0000000), wk = 0.0034014 k( 3) = ( 0.0126477 0.0126477 0.0000000), wk = 0.0034014 k( 4) = ( 0.0189715 0.0189715 0.0000000), wk = 0.0034014 k( 5) = ( 0.0252954 0.0252954 0.0000000), wk = 0.0034014 k( 6) = ( 0.0316192 0.0316192 0.0000000), wk = 0.0034014 k( 7) = ( 0.0379431 0.0379431 0.0000000), wk = 0.0034014 k( 8) = ( 0.0442669 0.0442669 -0.0000000), wk = 0.0034014 k( 9) = ( 0.0505908 0.0505908 0.0000000), wk = 0.0034014 k( 10) = ( 0.0569146 0.0569146 0.0000000), wk = 0.0034014 k( 11) = ( 0.0632384 0.0632384 0.0000000), wk = 0.0034014 k( 12) = ( 0.0695623 0.0695623 0.0000000), wk = 0.0034014 k( 13) = ( 0.0758861 0.0758861 -0.0000000), wk = 0.0034014 k( 14) = ( 0.0822100 0.0822100 0.0000000), wk = 0.0034014 k( 15) = ( 0.0885338 0.0885338 -0.0000000), wk = 0.0034014 k( 16) = ( 0.0948577 0.0948577 0.0000000), wk = 0.0034014 k( 17) = ( 0.1011815 0.1011815 0.0000000), wk = 0.0034014 k( 18) = ( 0.1075054 0.1075054 0.0000000), wk = 0.0034014 k( 19) = ( 0.1138292 0.1138292 0.0000000), wk = 0.0034014 k( 20) = ( 0.1201530 0.1201530 0.0000000), wk = 0.0034014 k( 21) = ( 0.1264769 0.1264769 -0.0000000), wk = 0.0034014 k( 22) = ( 0.1328007 0.1328007 0.0000000), wk = 0.0034014 k( 23) = ( 0.1391246 0.1391246 0.0000000), wk = 0.0034014 k( 24) = ( 0.1454484 0.1454484 -0.0000000), wk = 0.0034014 k( 25) = ( 0.1517723 0.1517723 -0.0000000), wk = 0.0034014 k( 26) = ( 0.1580961 0.1580961 0.0000000), wk = 0.0034014 k( 27) = ( 0.1644200 0.1644200 0.0000000), wk = 0.0034014 k( 28) = ( 0.1707438 0.1707438 -0.0000000), wk = 0.0034014 k( 29) = ( 0.1770676 0.1770676 -0.0000000), wk = 0.0034014 k( 30) = ( 0.1833915 0.1833915 0.0000000), wk = 0.0034014 k( 31) = ( 0.1897153 0.1897153 0.0000000), wk = 0.0034014 k( 32) = ( 0.1960392 0.1960392 0.0000000), wk = 0.0034014 k( 33) = ( 0.2023630 0.2023630 0.0000000), wk = 0.0034014 k( 34) = ( 0.2086869 0.2086869 0.0000000), wk = 0.0034014 k( 35) = ( 0.2150107 0.2150107 0.0000000), wk = 0.0034014 k( 36) = ( 0.2213346 0.2213346 -0.0000000), wk = 0.0034014 k( 37) = ( 0.2276584 0.2276584 0.0000000), wk = 0.0034014 k( 38) = ( 0.2339823 0.2339823 0.0000000), wk = 0.0034014 k( 39) = ( 0.2403061 0.2403061 -0.0000000), wk = 0.0034014 k( 40) = ( 0.2466299 0.2466299 -0.0000000), wk = 0.0034014 k( 41) = ( 0.2529538 0.2529538 -0.0000000), wk = 0.0034014 k( 42) = ( 0.2592776 0.2592776 0.0000000), wk = 0.0034014 k( 43) = ( 0.2656015 0.2656015 0.0000000), wk = 0.0034014 k( 44) = ( 0.2656015 0.2656015 0.0000000), wk = 0.0034014 k( 45) = ( 0.2414559 0.2869104 0.0000000), wk = 0.0034014 k( 46) = ( 0.2173103 0.3082194 -0.0000000), wk = 0.0034014 k( 47) = ( 0.1931647 0.3295283 -0.0000000), wk = 0.0034014 k( 48) = ( 0.1690191 0.3508373 -0.0000000), wk = 0.0034014 k( 49) = ( 0.1448735 0.3721463 0.0000000), wk = 0.0034014 k( 50) = ( 0.1207279 0.3934552 0.0000000), wk = 0.0034014 k( 51) = ( 0.0965823 0.4147642 0.0000000), wk = 0.0034014 k( 52) = ( 0.0724368 0.4360731 0.0000000), wk = 0.0034014 k( 53) = ( 0.0482912 0.4573821 0.0000000), wk = 0.0034014 k( 54) = ( 0.0241456 0.4786910 -0.0000000), wk = 0.0034014 k( 55) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034014 k( 56) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0034014 k( 57) = ( 0.0000000 0.5000000 0.0333333), wk = 0.0034014 k( 58) = ( 0.0000000 0.5000000 0.0666667), wk = 0.0034014 k( 59) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0034014 k( 60) = ( 0.0000000 0.5000000 0.1333333), wk = 0.0034014 k( 61) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0034014 k( 62) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0034014 k( 63) = ( 0.0000000 0.5000000 0.2333333), wk = 0.0034014 k( 64) = ( 0.0000000 0.5000000 0.2666667), wk = 0.0034014 k( 65) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0034014 k( 66) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0034014 k( 67) = ( 0.0000000 0.5000000 0.3666667), wk = 0.0034014 k( 68) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0034014 k( 69) = ( 0.0000000 0.5000000 0.4333333), wk = 0.0034014 k( 70) = ( 0.0000000 0.5000000 0.4666667), wk = 0.0034014 k( 71) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0034014 k( 72) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0034014 k( 73) = ( 0.0241456 0.4786910 0.5000000), wk = 0.0034014 k( 74) = ( 0.0482912 0.4573821 0.5000000), wk = 0.0034014 k( 75) = ( 0.0724368 0.4360731 0.5000000), wk = 0.0034014 k( 76) = ( 0.0965823 0.4147642 0.5000000), wk = 0.0034014 k( 77) = ( 0.1207279 0.3934552 0.5000000), wk = 0.0034014 k( 78) = ( 0.1448735 0.3721463 0.5000000), wk = 0.0034014 k( 79) = ( 0.1690191 0.3508373 0.5000000), wk = 0.0034014 k( 80) = ( 0.1931647 0.3295283 0.5000000), wk = 0.0034014 k( 81) = ( 0.2173103 0.3082194 0.5000000), wk = 0.0034014 k( 82) = ( 0.2414559 0.2869104 0.5000000), wk = 0.0034014 k( 83) = ( 0.2656015 0.2656015 0.5000000), wk = 0.0034014 k( 84) = ( 0.2656015 0.2656015 0.5000000), wk = 0.0034014 k( 85) = ( 0.2592776 0.2592776 0.5000000), wk = 0.0034014 k( 86) = ( 0.2529538 0.2529538 0.5000000), wk = 0.0034014 k( 87) = ( 0.2466299 0.2466299 0.5000000), wk = 0.0034014 k( 88) = ( 0.2403061 0.2403061 0.5000000), wk = 0.0034014 k( 89) = ( 0.2339823 0.2339823 0.5000000), wk = 0.0034014 k( 90) = ( 0.2276584 0.2276584 0.5000000), wk = 0.0034014 k( 91) = ( 0.2213346 0.2213346 0.5000000), wk = 0.0034014 k( 92) = ( 0.2150107 0.2150107 0.5000000), wk = 0.0034014 k( 93) = ( 0.2086869 0.2086869 0.5000000), wk = 0.0034014 k( 94) = ( 0.2023630 0.2023630 0.5000000), wk = 0.0034014 k( 95) = ( 0.1960392 0.1960392 0.5000000), wk = 0.0034014 k( 96) = ( 0.1897153 0.1897153 0.5000000), wk = 0.0034014 k( 97) = ( 0.1833915 0.1833915 0.5000000), wk = 0.0034014 k( 98) = ( 0.1770676 0.1770676 0.5000000), wk = 0.0034014 k( 99) = ( 0.1707438 0.1707438 0.5000000), wk = 0.0034014 k( 100) = ( 0.1644200 0.1644200 0.5000000), wk = 0.0034014 k( 101) = ( 0.1580961 0.1580961 0.5000000), wk = 0.0034014 k( 102) = ( 0.1517723 0.1517723 0.5000000), wk = 0.0034014 k( 103) = ( 0.1454484 0.1454484 0.5000000), wk = 0.0034014 k( 104) = ( 0.1391246 0.1391246 0.5000000), wk = 0.0034014 k( 105) = ( 0.1328007 0.1328007 0.5000000), wk = 0.0034014 k( 106) = ( 0.1264769 0.1264769 0.5000000), wk = 0.0034014 k( 107) = ( 0.1201530 0.1201530 0.5000000), wk = 0.0034014 k( 108) = ( 0.1138292 0.1138292 0.5000000), wk = 0.0034014 k( 109) = ( 0.1075054 0.1075054 0.5000000), wk = 0.0034014 k( 110) = ( 0.1011815 0.1011815 0.5000000), wk = 0.0034014 k( 111) = ( 0.0948577 0.0948577 0.5000000), wk = 0.0034014 k( 112) = ( 0.0885338 0.0885338 0.5000000), wk = 0.0034014 k( 113) = ( 0.0822100 0.0822100 0.5000000), wk = 0.0034014 k( 114) = ( 0.0758861 0.0758861 0.5000000), wk = 0.0034014 k( 115) = ( 0.0695623 0.0695623 0.5000000), wk = 0.0034014 k( 116) = ( 0.0632384 0.0632384 0.5000000), wk = 0.0034014 k( 117) = ( 0.0569146 0.0569146 0.5000000), wk = 0.0034014 k( 118) = ( 0.0505908 0.0505908 0.5000000), wk = 0.0034014 k( 119) = ( 0.0442669 0.0442669 0.5000000), wk = 0.0034014 k( 120) = ( 0.0379431 0.0379431 0.5000000), wk = 0.0034014 k( 121) = ( 0.0316192 0.0316192 0.5000000), wk = 0.0034014 k( 122) = ( 0.0252954 0.0252954 0.5000000), wk = 0.0034014 k( 123) = ( 0.0189715 0.0189715 0.5000000), wk = 0.0034014 k( 124) = ( 0.0126477 0.0126477 0.5000000), wk = 0.0034014 k( 125) = ( 0.0063238 0.0063238 0.5000000), wk = 0.0034014 k( 126) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034014 k( 127) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034014 k( 128) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0034014 k( 129) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0034014 k( 130) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0034014 k( 131) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0034014 k( 132) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0034014 k( 133) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0034014 k( 134) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0034014 k( 135) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0034014 k( 136) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0034014 k( 137) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0034014 k( 138) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0034014 k( 139) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0034014 k( 140) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0034014 k( 141) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0034014 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034014 k( 143) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034014 k( 144) = ( -0.0250000 0.0250000 0.0000000), wk = 0.0034014 k( 145) = ( -0.0500000 0.0500000 0.0000000), wk = 0.0034014 k( 146) = ( -0.0750000 0.0750000 -0.0000000), wk = 0.0034014 k( 147) = ( -0.1000000 0.1000000 0.0000000), wk = 0.0034014 k( 148) = ( -0.1250000 0.1250000 0.0000000), wk = 0.0034014 k( 149) = ( -0.1500000 0.1500000 -0.0000000), wk = 0.0034014 k( 150) = ( -0.1750000 0.1750000 0.0000000), wk = 0.0034014 k( 151) = ( -0.2000000 0.2000000 0.0000000), wk = 0.0034014 k( 152) = ( -0.2250000 0.2250000 -0.0000000), wk = 0.0034014 k( 153) = ( -0.2500000 0.2500000 0.0000000), wk = 0.0034014 k( 154) = ( -0.2750000 0.2750000 -0.0000000), wk = 0.0034014 k( 155) = ( -0.3000000 0.3000000 -0.0000000), wk = 0.0034014 k( 156) = ( -0.3250000 0.3250000 0.0000000), wk = 0.0034014 k( 157) = ( -0.3500000 0.3500000 0.0000000), wk = 0.0034014 k( 158) = ( -0.3750000 0.3750000 0.0000000), wk = 0.0034014 k( 159) = ( -0.4000000 0.4000000 0.0000000), wk = 0.0034014 k( 160) = ( -0.4250000 0.4250000 0.0000000), wk = 0.0034014 k( 161) = ( -0.4500000 0.4500000 -0.0000000), wk = 0.0034014 k( 162) = ( -0.4750000 0.4750000 0.0000000), wk = 0.0034014 k( 163) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0034014 k( 164) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0034014 k( 165) = ( -0.4938316 0.5061684 0.0000000), wk = 0.0034014 k( 166) = ( -0.4876632 0.5123368 -0.0000000), wk = 0.0034014 k( 167) = ( -0.4814948 0.5185051 0.0000000), wk = 0.0034014 k( 168) = ( -0.4753265 0.5246735 0.0000000), wk = 0.0034014 k( 169) = ( -0.4691581 0.5308419 -0.0000000), wk = 0.0034014 k( 170) = ( -0.4629897 0.5370103 -0.0000000), wk = 0.0034014 k( 171) = ( -0.4568213 0.5431787 -0.0000000), wk = 0.0034014 k( 172) = ( -0.4506529 0.5493471 0.0000000), wk = 0.0034014 k( 173) = ( -0.4444846 0.5555154 0.0000000), wk = 0.0034014 k( 174) = ( -0.4383162 0.5616838 0.0000000), wk = 0.0034014 k( 175) = ( -0.4321478 0.5678522 0.0000000), wk = 0.0034014 k( 176) = ( -0.4259794 0.5740206 -0.0000000), wk = 0.0034014 k( 177) = ( -0.4198110 0.5801890 -0.0000000), wk = 0.0034014 k( 178) = ( -0.4136427 0.5863574 0.0000000), wk = 0.0034014 k( 179) = ( -0.4074743 0.5925257 0.0000000), wk = 0.0034014 k( 180) = ( -0.4013059 0.5986941 -0.0000000), wk = 0.0034014 k( 181) = ( -0.3951375 0.6048625 0.0000000), wk = 0.0034014 k( 182) = ( -0.3889691 0.6110309 -0.0000000), wk = 0.0034014 k( 183) = ( -0.3828007 0.6171993 0.0000000), wk = 0.0034014 k( 184) = ( -0.3766324 0.6233677 0.0000000), wk = 0.0034014 k( 185) = ( -0.3704640 0.6295360 0.0000000), wk = 0.0034014 k( 186) = ( -0.3642956 0.6357044 0.0000000), wk = 0.0034014 k( 187) = ( -0.3581272 0.6418728 0.0000000), wk = 0.0034014 k( 188) = ( -0.3519588 0.6480412 0.0000000), wk = 0.0034014 k( 189) = ( -0.3457904 0.6542096 -0.0000000), wk = 0.0034014 k( 190) = ( -0.3396221 0.6603779 -0.0000000), wk = 0.0034014 k( 191) = ( -0.3334537 0.6665463 -0.0000000), wk = 0.0034014 k( 192) = ( -0.3272853 0.6727147 0.0000000), wk = 0.0034014 k( 193) = ( -0.3211169 0.6788831 0.0000000), wk = 0.0034014 k( 194) = ( -0.3149485 0.6850515 0.0000000), wk = 0.0034014 k( 195) = ( -0.3087801 0.6912199 0.0000000), wk = 0.0034014 k( 196) = ( -0.3026118 0.6973882 0.0000000), wk = 0.0034014 k( 197) = ( -0.2964434 0.7035566 -0.0000000), wk = 0.0034014 k( 198) = ( -0.2902750 0.7097250 0.0000000), wk = 0.0034014 k( 199) = ( -0.2841066 0.7158934 0.0000000), wk = 0.0034014 k( 200) = ( -0.2779382 0.7220618 -0.0000000), wk = 0.0034014 k( 201) = ( -0.2717698 0.7282302 0.0000000), wk = 0.0034014 k( 202) = ( -0.2656015 0.7343985 0.0000000), wk = 0.0034014 k( 203) = ( -0.2656015 0.7343985 0.0000000), wk = 0.0034014 k( 204) = ( -0.2656015 0.7343985 0.0333333), wk = 0.0034014 k( 205) = ( -0.2656015 0.7343985 0.0666667), wk = 0.0034014 k( 206) = ( -0.2656015 0.7343985 0.1000000), wk = 0.0034014 k( 207) = ( -0.2656015 0.7343985 0.1333333), wk = 0.0034014 k( 208) = ( -0.2656015 0.7343985 0.1666667), wk = 0.0034014 k( 209) = ( -0.2656015 0.7343985 0.2000000), wk = 0.0034014 k( 210) = ( -0.2656015 0.7343985 0.2333333), wk = 0.0034014 k( 211) = ( -0.2656015 0.7343985 0.2666667), wk = 0.0034014 k( 212) = ( -0.2656015 0.7343985 0.3000000), wk = 0.0034014 k( 213) = ( -0.2656015 0.7343985 0.3333333), wk = 0.0034014 k( 214) = ( -0.2656015 0.7343985 0.3666667), wk = 0.0034014 k( 215) = ( -0.2656015 0.7343985 0.4000000), wk = 0.0034014 k( 216) = ( -0.2656015 0.7343985 0.4333333), wk = 0.0034014 k( 217) = ( -0.2656015 0.7343985 0.4666667), wk = 0.0034014 k( 218) = ( -0.2656015 0.7343985 0.5000000), wk = 0.0034014 k( 219) = ( -0.2656015 0.7343985 0.5000000), wk = 0.0034014 k( 220) = ( -0.2717698 0.7282302 0.5000000), wk = 0.0034014 k( 221) = ( -0.2779382 0.7220618 0.5000000), wk = 0.0034014 k( 222) = ( -0.2841066 0.7158934 0.5000000), wk = 0.0034014 k( 223) = ( -0.2902750 0.7097250 0.5000000), wk = 0.0034014 k( 224) = ( -0.2964434 0.7035566 0.5000000), wk = 0.0034014 k( 225) = ( -0.3026118 0.6973882 0.5000000), wk = 0.0034014 k( 226) = ( -0.3087801 0.6912199 0.5000000), wk = 0.0034014 k( 227) = ( -0.3149485 0.6850515 0.5000000), wk = 0.0034014 k( 228) = ( -0.3211169 0.6788831 0.5000000), wk = 0.0034014 k( 229) = ( -0.3272853 0.6727147 0.5000000), wk = 0.0034014 k( 230) = ( -0.3334537 0.6665463 0.5000000), wk = 0.0034014 k( 231) = ( -0.3396221 0.6603779 0.5000000), wk = 0.0034014 k( 232) = ( -0.3457904 0.6542096 0.5000000), wk = 0.0034014 k( 233) = ( -0.3519588 0.6480412 0.5000000), wk = 0.0034014 k( 234) = ( -0.3581272 0.6418728 0.5000000), wk = 0.0034014 k( 235) = ( -0.3642956 0.6357044 0.5000000), wk = 0.0034014 k( 236) = ( -0.3704640 0.6295360 0.5000000), wk = 0.0034014 k( 237) = ( -0.3766324 0.6233677 0.5000000), wk = 0.0034014 k( 238) = ( -0.3828007 0.6171993 0.5000000), wk = 0.0034014 k( 239) = ( -0.3889691 0.6110309 0.5000000), wk = 0.0034014 k( 240) = ( -0.3951375 0.6048625 0.5000000), wk = 0.0034014 k( 241) = ( -0.4013059 0.5986941 0.5000000), wk = 0.0034014 k( 242) = ( -0.4074743 0.5925257 0.5000000), wk = 0.0034014 k( 243) = ( -0.4136427 0.5863574 0.5000000), wk = 0.0034014 k( 244) = ( -0.4198110 0.5801890 0.5000000), wk = 0.0034014 k( 245) = ( -0.4259794 0.5740206 0.5000000), wk = 0.0034014 k( 246) = ( -0.4321478 0.5678522 0.5000000), wk = 0.0034014 k( 247) = ( -0.4383162 0.5616838 0.5000000), wk = 0.0034014 k( 248) = ( -0.4444846 0.5555154 0.5000000), wk = 0.0034014 k( 249) = ( -0.4506529 0.5493471 0.5000000), wk = 0.0034014 k( 250) = ( -0.4568213 0.5431787 0.5000000), wk = 0.0034014 k( 251) = ( -0.4629897 0.5370103 0.5000000), wk = 0.0034014 k( 252) = ( -0.4691581 0.5308419 0.5000000), wk = 0.0034014 k( 253) = ( -0.4753265 0.5246735 0.5000000), wk = 0.0034014 k( 254) = ( -0.4814948 0.5185051 0.5000000), wk = 0.0034014 k( 255) = ( -0.4876632 0.5123368 0.5000000), wk = 0.0034014 k( 256) = ( -0.4938316 0.5061684 0.5000000), wk = 0.0034014 k( 257) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0034014 k( 258) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0034014 k( 259) = ( -0.5000000 0.5000000 0.4666667), wk = 0.0034014 k( 260) = ( -0.5000000 0.5000000 0.4333333), wk = 0.0034014 k( 261) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0034014 k( 262) = ( -0.5000000 0.5000000 0.3666667), wk = 0.0034014 k( 263) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0034014 k( 264) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0034014 k( 265) = ( -0.5000000 0.5000000 0.2666667), wk = 0.0034014 k( 266) = ( -0.5000000 0.5000000 0.2333333), wk = 0.0034014 k( 267) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0034014 k( 268) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0034014 k( 269) = ( -0.5000000 0.5000000 0.1333333), wk = 0.0034014 k( 270) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0034014 k( 271) = ( -0.5000000 0.5000000 0.0666667), wk = 0.0034014 k( 272) = ( -0.5000000 0.5000000 0.0333333), wk = 0.0034014 k( 273) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0034014 k( 274) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034014 k( 275) = ( -0.0250000 0.0250000 0.5000000), wk = 0.0034014 k( 276) = ( -0.0500000 0.0500000 0.5000000), wk = 0.0034014 k( 277) = ( -0.0750000 0.0750000 0.5000000), wk = 0.0034014 k( 278) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0034014 k( 279) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0034014 k( 280) = ( -0.1500000 0.1500000 0.5000000), wk = 0.0034014 k( 281) = ( -0.1750000 0.1750000 0.5000000), wk = 0.0034014 k( 282) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0034014 k( 283) = ( -0.2250000 0.2250000 0.5000000), wk = 0.0034014 k( 284) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0034014 k( 285) = ( -0.2750000 0.2750000 0.5000000), wk = 0.0034014 k( 286) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0034014 k( 287) = ( -0.3250000 0.3250000 0.5000000), wk = 0.0034014 k( 288) = ( -0.3500000 0.3500000 0.5000000), wk = 0.0034014 k( 289) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0034014 k( 290) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0034014 k( 291) = ( -0.4250000 0.4250000 0.5000000), wk = 0.0034014 k( 292) = ( -0.4500000 0.4500000 0.5000000), wk = 0.0034014 k( 293) = ( -0.4750000 0.4750000 0.5000000), wk = 0.0034014 k( 294) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0034014 Dense grid: 112271 G-vectors FFT dimensions: ( 72, 72, 96) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.68 Mb ( 590, 76) NL pseudopotentials 0.85 Mb ( 295, 188) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2339) G-vector shells 0.01 Mb ( 1188) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.74 Mb ( 590, 304) Each subspace H/S matrix 1.41 Mb ( 304, 304) Each matrix 0.44 Mb ( 188, 2, 76) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./ZrGeTe4.save/charge-density.dat Starting wfc are 116 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 45.7 secs Computing kpt #: 2 total cpu time spent up to now is 54.0 secs Computing kpt #: 3 total cpu time spent up to now is 62.2 secs Computing kpt #: 4 total cpu time spent up to now is 70.6 secs Computing kpt #: 5 total cpu time spent up to now is 78.7 secs Computing kpt #: 6 total cpu time spent up to now is 87.1 secs Computing kpt #: 7 total cpu time spent up to now is 95.4 secs Computing kpt #: 8 total cpu time spent up to now is 103.5 secs Computing kpt #: 9 total cpu time spent up to now is 111.3 secs Computing kpt #: 10 total cpu time spent up to now is 118.7 secs Computing kpt #: 11 total cpu time spent up to now is 125.8 secs Computing kpt #: 12 total cpu time spent up to now is 133.2 secs Computing kpt #: 13 total cpu time spent up to now is 141.0 secs Computing kpt #: 14 total cpu time spent up to now is 148.5 secs Computing kpt #: 15 total cpu time spent up to now is 155.8 secs Computing kpt #: 16 total cpu time spent up to now is 163.4 secs Computing kpt #: 17 total cpu time spent up to now is 171.7 secs Computing kpt #: 18 total cpu time spent up to now is 180.7 secs Computing kpt #: 19 total cpu time spent up to now is 188.8 secs Computing kpt #: 20 total cpu time spent up to now is 198.2 secs Computing kpt #: 21 total cpu time spent up to now is 205.7 secs Computing kpt #: 22 total cpu time spent up to now is 213.9 secs Computing kpt #: 23 total cpu time spent up to now is 222.4 secs Computing kpt #: 24 total cpu time spent up to now is 231.5 secs Computing kpt #: 25 total cpu time spent up to now is 240.9 secs Computing kpt #: 26 total cpu time spent up to now is 249.2 secs Computing kpt #: 27 total cpu time spent up to now is 259.2 secs Computing kpt #: 28 total cpu time spent up to now is 271.0 secs Computing kpt #: 29 total cpu time spent up to now is 282.5 secs Computing kpt #: 30 total cpu time spent up to now is 291.3 secs Computing kpt #: 31 total cpu time spent up to now is 299.9 secs Computing kpt #: 32 total cpu time spent up to now is 309.4 secs Computing kpt #: 33 total cpu time spent up to now is 318.5 secs Computing kpt #: 34 total cpu time spent up to now is 328.4 secs Computing kpt #: 35 total cpu time spent up to now is 337.2 secs Computing kpt #: 36 total cpu time spent up to now is 346.2 secs Computing kpt #: 37 total cpu time spent up to now is 354.9 secs Computing kpt #: 38 total cpu time spent up to now is 363.8 secs Computing kpt #: 39 total cpu time spent up to now is 372.9 secs Computing kpt #: 40 total cpu time spent up to now is 381.9 secs Computing kpt #: 41 total cpu time spent up to now is 390.9 secs Computing kpt #: 42 total cpu time spent up to now is 400.3 secs Computing kpt #: 43 total cpu time spent up to now is 409.3 secs Computing kpt #: 44 total cpu time spent up to now is 419.9 secs Computing kpt #: 45 total cpu time spent up to now is 430.6 secs Computing kpt #: 46 total cpu time spent up to now is 440.8 secs Computing kpt #: 47 total cpu time spent up to now is 451.2 secs Computing kpt #: 48 total cpu time spent up to now is 460.4 secs Computing kpt #: 49 total cpu time spent up to now is 469.5 secs Computing kpt #: 50 total cpu time spent up to now is 481.1 secs Computing kpt #: 51 total cpu time spent up to now is 492.3 secs Computing kpt #: 52 total cpu time spent up to now is 505.7 secs Computing kpt #: 53 total cpu time spent up to now is 517.5 secs Computing kpt #: 54 total cpu time spent up to now is 529.1 secs Computing kpt #: 55 total cpu time spent up to now is 540.3 secs Computing kpt #: 56 total cpu time spent up to now is 551.7 secs Computing kpt #: 57 total cpu time spent up to now is 560.8 secs Computing kpt #: 58 total cpu time spent up to now is 569.8 secs Computing kpt #: 59 total cpu time spent up to now is 583.3 secs Computing kpt #: 60 total cpu time spent up to now is 592.9 secs Computing kpt #: 61 total cpu time spent up to now is 603.2 secs Computing kpt #: 62 total cpu time spent up to now is 612.3 secs Computing kpt #: 63 total cpu time spent up to now is 621.5 secs Computing kpt #: 64 total cpu time spent up to now is 630.7 secs Computing kpt #: 65 total cpu time spent up to now is 639.9 secs Computing kpt #: 66 total cpu time spent up to now is 649.3 secs Computing kpt #: 67 total cpu time spent up to now is 658.5 secs Computing kpt #: 68 total cpu time spent up to now is 667.4 secs Computing kpt #: 69 total cpu time spent up to now is 677.4 secs Computing kpt #: 70 total cpu time spent up to now is 686.6 secs Computing kpt #: 71 total cpu time spent up to now is 694.6 secs Computing kpt #: 72 total cpu time spent up to now is 703.2 secs Computing kpt #: 73 total cpu time spent up to now is 711.4 secs Computing kpt #: 74 total cpu time spent up to now is 719.8 secs Computing kpt #: 75 total cpu time spent up to now is 728.1 secs Computing kpt #: 76 total cpu time spent up to now is 736.4 secs Computing kpt #: 77 total cpu time spent up to now is 744.6 secs Computing kpt #: 78 total cpu time spent up to now is 752.9 secs Computing kpt #: 79 total cpu time spent up to now is 760.4 secs Computing kpt #: 80 total cpu time spent up to now is 768.6 secs Computing kpt #: 81 total cpu time spent up to now is 777.0 secs Computing kpt #: 82 total cpu time spent up to now is 785.4 secs Computing kpt #: 83 total cpu time spent up to now is 794.5 secs Computing kpt #: 84 total cpu time spent up to now is 803.6 secs Computing kpt #: 85 total cpu time spent up to now is 812.0 secs Computing kpt #: 86 total cpu time spent up to now is 820.7 secs Computing kpt #: 87 total cpu time spent up to now is 829.2 secs Computing kpt #: 88 total cpu time spent up to now is 838.0 secs Computing kpt #: 89 total cpu time spent up to now is 846.9 secs Computing kpt #: 90 total cpu time spent up to now is 855.5 secs Computing kpt #: 91 total cpu time spent up to now is 864.1 secs Computing kpt #: 92 total cpu time spent up to now is 872.7 secs Computing kpt #: 93 total cpu time spent up to now is 881.2 secs Computing kpt #: 94 total cpu time spent up to now is 889.7 secs Computing kpt #: 95 total cpu time spent up to now is 898.1 secs Computing kpt #: 96 total cpu time spent up to now is 906.5 secs Computing kpt #: 97 total cpu time spent up to now is 914.4 secs Computing kpt #: 98 total cpu time spent up to now is 921.9 secs Computing kpt #: 99 total cpu time spent up to now is 929.9 secs Computing kpt #: 100 total cpu time spent up to now is 937.2 secs Computing kpt #: 101 total cpu time spent up to now is 944.5 secs Computing kpt #: 102 total cpu time spent up to now is 951.7 secs Computing kpt #: 103 total cpu time spent up to now is 959.2 secs Computing kpt #: 104 total cpu time spent up to now is 966.2 secs Computing kpt #: 105 total cpu time spent up to now is 973.3 secs Computing kpt #: 106 total cpu time spent up to now is 980.2 secs Computing kpt #: 107 total cpu time spent up to now is 987.2 secs Computing kpt #: 108 total cpu time spent up to now is 994.3 secs Computing kpt #: 109 total cpu time spent up to now is 1001.4 secs Computing kpt #: 110 total cpu time spent up to now is 1008.8 secs Computing kpt #: 111 total cpu time spent up to now is 1016.2 secs Computing kpt #: 112 total cpu time spent up to now is 1024.4 secs Computing kpt #: 113 total cpu time spent up to now is 1032.8 secs Computing kpt #: 114 total cpu time spent up to now is 1041.3 secs Computing kpt #: 115 total cpu time spent up to now is 1050.2 secs Computing kpt #: 116 total cpu time spent up to now is 1059.6 secs Computing kpt #: 117 total cpu time spent up to now is 1069.8 secs Computing kpt #: 118 total cpu time spent up to now is 1079.3 secs Computing kpt #: 119 total cpu time spent up to now is 1088.2 secs Computing kpt #: 120 total cpu time spent up to now is 1098.0 secs Computing kpt #: 121 total cpu time spent up to now is 1106.8 secs Computing kpt #: 122 total cpu time spent up to now is 1115.2 secs Computing kpt #: 123 total cpu time spent up to now is 1123.5 secs Computing kpt #: 124 total cpu time spent up to now is 1131.8 secs Computing kpt #: 125 total cpu time spent up to now is 1140.0 secs Computing kpt #: 126 total cpu time spent up to now is 1148.1 secs Computing kpt #: 127 total cpu time spent up to now is 1156.4 secs Computing kpt #: 128 total cpu time spent up to now is 1164.8 secs Computing kpt #: 129 total cpu time spent up to now is 1173.3 secs Computing kpt #: 130 total cpu time spent up to now is 1182.1 secs Computing kpt #: 131 total cpu time spent up to now is 1191.7 secs Computing kpt #: 132 total cpu time spent up to now is 1200.7 secs Computing kpt #: 133 total cpu time spent up to now is 1211.6 secs Computing kpt #: 134 total cpu time spent up to now is 1221.8 secs Computing kpt #: 135 total cpu time spent up to now is 1232.1 secs Computing kpt #: 136 total cpu time spent up to now is 1241.5 secs Computing kpt #: 137 total cpu time spent up to now is 1250.4 secs Computing kpt #: 138 total cpu time spent up to now is 1259.0 secs Computing kpt #: 139 total cpu time spent up to now is 1268.3 secs Computing kpt #: 140 total cpu time spent up to now is 1276.8 secs Computing kpt #: 141 total cpu time spent up to now is 1285.2 secs Computing kpt #: 142 total cpu time spent up to now is 1293.5 secs Computing kpt #: 143 total cpu time spent up to now is 1301.9 secs Computing kpt #: 144 total cpu time spent up to now is 1310.5 secs Computing kpt #: 145 total cpu time spent up to now is 1318.7 secs Computing kpt #: 146 total cpu time spent up to now is 1327.0 secs Computing kpt #: 147 total cpu time spent up to now is 1335.0 secs Computing kpt #: 148 total cpu time spent up to now is 1342.3 secs Computing kpt #: 149 total cpu time spent up to now is 1349.9 secs Computing kpt #: 150 total cpu time spent up to now is 1357.5 secs Computing kpt #: 151 total cpu time spent up to now is 1364.9 secs Computing kpt #: 152 total cpu time spent up to now is 1372.5 secs Computing kpt #: 153 total cpu time spent up to now is 1380.3 secs Computing kpt #: 154 total cpu time spent up to now is 1387.5 secs Computing kpt #: 155 total cpu time spent up to now is 1395.9 secs Computing kpt #: 156 total cpu time spent up to now is 1403.1 secs Computing kpt #: 157 total cpu time spent up to now is 1410.8 secs Computing kpt #: 158 total cpu time spent up to now is 1420.8 secs Computing kpt #: 159 total cpu time spent up to now is 1428.8 secs Computing kpt #: 160 total cpu time spent up to now is 1437.6 secs Computing kpt #: 161 total cpu time spent up to now is 1446.2 secs Computing kpt #: 162 total cpu time spent up to now is 1454.7 secs Computing kpt #: 163 total cpu time spent up to now is 1462.8 secs Computing kpt #: 164 total cpu time spent up to now is 1471.0 secs Computing kpt #: 165 total cpu time spent up to now is 1479.4 secs Computing kpt #: 166 total cpu time spent up to now is 1487.8 secs Computing kpt #: 167 total cpu time spent up to now is 1496.3 secs Computing kpt #: 168 total cpu time spent up to now is 1503.8 secs Computing kpt #: 169 total cpu time spent up to now is 1511.7 secs Computing kpt #: 170 total cpu time spent up to now is 1519.2 secs Computing kpt #: 171 total cpu time spent up to now is 1526.7 secs Computing kpt #: 172 total cpu time spent up to now is 1534.4 secs Computing kpt #: 173 total cpu time spent up to now is 1542.3 secs Computing kpt #: 174 total cpu time spent up to now is 1550.4 secs Computing kpt #: 175 total cpu time spent up to now is 1558.6 secs Computing kpt #: 176 total cpu time spent up to now is 1567.0 secs Computing kpt #: 177 total cpu time spent up to now is 1575.4 secs Computing kpt #: 178 total cpu time spent up to now is 1583.6 secs Computing kpt #: 179 total cpu time spent up to now is 1594.4 secs Computing kpt #: 180 total cpu time spent up to now is 1603.3 secs Computing kpt #: 181 total cpu time spent up to now is 1611.8 secs Computing kpt #: 182 total cpu time spent up to now is 1621.2 secs Computing kpt #: 183 total cpu time spent up to now is 1630.0 secs Computing kpt #: 184 total cpu time spent up to now is 1638.8 secs Computing kpt #: 185 total cpu time spent up to now is 1648.7 secs Computing kpt #: 186 total cpu time spent up to now is 1657.9 secs Computing kpt #: 187 total cpu time spent up to now is 1668.8 secs Computing kpt #: 188 total cpu time spent up to now is 1678.2 secs Computing kpt #: 189 total cpu time spent up to now is 1687.0 secs Computing kpt #: 190 total cpu time spent up to now is 1697.3 secs Computing kpt #: 191 total cpu time spent up to now is 1706.1 secs Computing kpt #: 192 total cpu time spent up to now is 1714.9 secs Computing kpt #: 193 total cpu time spent up to now is 1723.5 secs Computing kpt #: 194 total cpu time spent up to now is 1732.7 secs Computing kpt #: 195 total cpu time spent up to now is 1744.9 secs Computing kpt #: 196 total cpu time spent up to now is 1756.5 secs Computing kpt #: 197 total cpu time spent up to now is 1766.1 secs Computing kpt #: 198 total cpu time spent up to now is 1776.1 secs Computing kpt #: 199 total cpu time spent up to now is 1785.5 secs Computing kpt #: 200 total cpu time spent up to now is 1794.7 secs Computing kpt #: 201 total cpu time spent up to now is 1808.4 secs Computing kpt #: 202 total cpu time spent up to now is 1817.7 secs Computing kpt #: 203 total cpu time spent up to now is 1827.5 secs Computing kpt #: 204 total cpu time spent up to now is 1840.0 secs Computing kpt #: 205 total cpu time spent up to now is 1848.9 secs Computing kpt #: 206 total cpu time spent up to now is 1857.7 secs Computing kpt #: 207 total cpu time spent up to now is 1866.7 secs Computing kpt #: 208 total cpu time spent up to now is 1875.7 secs Computing kpt #: 209 total cpu time spent up to now is 1884.3 secs Computing kpt #: 210 total cpu time spent up to now is 1892.9 secs Computing kpt #: 211 total cpu time spent up to now is 1901.5 secs Computing kpt #: 212 total cpu time spent up to now is 1909.7 secs Computing kpt #: 213 total cpu time spent up to now is 1918.4 secs Computing kpt #: 214 total cpu time spent up to now is 1926.9 secs Computing kpt #: 215 total cpu time spent up to now is 1935.4 secs Computing kpt #: 216 total cpu time spent up to now is 1944.0 secs Computing kpt #: 217 total cpu time spent up to now is 1952.6 secs Computing kpt #: 218 total cpu time spent up to now is 1960.3 secs Computing kpt #: 219 total cpu time spent up to now is 1967.9 secs Computing kpt #: 220 total cpu time spent up to now is 1975.4 secs Computing kpt #: 221 total cpu time spent up to now is 1983.5 secs Computing kpt #: 222 total cpu time spent up to now is 1991.6 secs Computing kpt #: 223 total cpu time spent up to now is 2001.6 secs Computing kpt #: 224 total cpu time spent up to now is 2009.0 secs Computing kpt #: 225 total cpu time spent up to now is 2016.4 secs Computing kpt #: 226 total cpu time spent up to now is 2024.0 secs Computing kpt #: 227 total cpu time spent up to now is 2031.8 secs Computing kpt #: 228 total cpu time spent up to now is 2039.0 secs Computing kpt #: 229 total cpu time spent up to now is 2046.7 secs Computing kpt #: 230 total cpu time spent up to now is 2054.0 secs Computing kpt #: 231 total cpu time spent up to now is 2061.5 secs Computing kpt #: 232 total cpu time spent up to now is 2069.0 secs Computing kpt #: 233 total cpu time spent up to now is 2076.3 secs Computing kpt #: 234 total cpu time spent up to now is 2083.6 secs Computing kpt #: 235 total cpu time spent up to now is 2090.7 secs Computing kpt #: 236 total cpu time spent up to now is 2097.9 secs Computing kpt #: 237 total cpu time spent up to now is 2105.3 secs Computing kpt #: 238 total cpu time spent up to now is 2112.8 secs Computing kpt #: 239 total cpu time spent up to now is 2120.2 secs Computing kpt #: 240 total cpu time spent up to now is 2127.7 secs Computing kpt #: 241 total cpu time spent up to now is 2135.1 secs Computing kpt #: 242 total cpu time spent up to now is 2142.7 secs Computing kpt #: 243 total cpu time spent up to now is 2150.4 secs Computing kpt #: 244 total cpu time spent up to now is 2158.8 secs Computing kpt #: 245 total cpu time spent up to now is 2167.0 secs Computing kpt #: 246 total cpu time spent up to now is 2175.0 secs Computing kpt #: 247 total cpu time spent up to now is 2183.8 secs Computing kpt #: 248 total cpu time spent up to now is 2192.5 secs Computing kpt #: 249 total cpu time spent up to now is 2201.2 secs Computing kpt #: 250 total cpu time spent up to now is 2209.6 secs Computing kpt #: 251 total cpu time spent up to now is 2217.8 secs Computing kpt #: 252 total cpu time spent up to now is 2225.8 secs Computing kpt #: 253 total cpu time spent up to now is 2234.3 secs Computing kpt #: 254 total cpu time spent up to now is 2242.9 secs Computing kpt #: 255 total cpu time spent up to now is 2250.8 secs Computing kpt #: 256 total cpu time spent up to now is 2258.4 secs Computing kpt #: 257 total cpu time spent up to now is 2265.9 secs Computing kpt #: 258 total cpu time spent up to now is 2273.5 secs Computing kpt #: 259 total cpu time spent up to now is 2281.4 secs Computing kpt #: 260 total cpu time spent up to now is 2289.8 secs Computing kpt #: 261 total cpu time spent up to now is 2300.5 secs Computing kpt #: 262 total cpu time spent up to now is 2308.7 secs Computing kpt #: 263 total cpu time spent up to now is 2317.0 secs Computing kpt #: 264 total cpu time spent up to now is 2326.0 secs Computing kpt #: 265 total cpu time spent up to now is 2337.2 secs Computing kpt #: 266 total cpu time spent up to now is 2350.0 secs Computing kpt #: 267 total cpu time spent up to now is 2360.7 secs Computing kpt #: 268 total cpu time spent up to now is 2372.0 secs Computing kpt #: 269 total cpu time spent up to now is 2382.3 secs Computing kpt #: 270 total cpu time spent up to now is 2391.1 secs Computing kpt #: 271 total cpu time spent up to now is 2399.5 secs Computing kpt #: 272 total cpu time spent up to now is 2407.5 secs Computing kpt #: 273 total cpu time spent up to now is 2415.5 secs Computing kpt #: 274 total cpu time spent up to now is 2423.4 secs Computing kpt #: 275 total cpu time spent up to now is 2431.4 secs Computing kpt #: 276 total cpu time spent up to now is 2439.5 secs Computing kpt #: 277 total cpu time spent up to now is 2447.5 secs Computing kpt #: 278 total cpu time spent up to now is 2455.6 secs Computing kpt #: 279 total cpu time spent up to now is 2464.0 secs Computing kpt #: 280 total cpu time spent up to now is 2472.4 secs Computing kpt #: 281 total cpu time spent up to now is 2480.7 secs Computing kpt #: 282 total cpu time spent up to now is 2489.1 secs Computing kpt #: 283 total cpu time spent up to now is 2497.4 secs Computing kpt #: 284 total cpu time spent up to now is 2505.9 secs Computing kpt #: 285 total cpu time spent up to now is 2514.2 secs Computing kpt #: 286 total cpu time spent up to now is 2522.3 secs Computing kpt #: 287 total cpu time spent up to now is 2530.6 secs Computing kpt #: 288 total cpu time spent up to now is 2538.4 secs Computing kpt #: 289 total cpu time spent up to now is 2546.0 secs Computing kpt #: 290 total cpu time spent up to now is 2554.4 secs Computing kpt #: 291 total cpu time spent up to now is 2561.9 secs Computing kpt #: 292 total cpu time spent up to now is 2570.1 secs Computing kpt #: 293 total cpu time spent up to now is 2577.9 secs Computing kpt #: 294 total cpu time spent up to now is 2585.6 secs ethr = 1.56E-11, avg # of iterations = 47.5 total cpu time spent up to now is 2585.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14051 PWs) bands (ev): -6.6098 -6.6098 -6.0913 -6.0913 -5.6356 -5.6356 -5.4649 -5.4649 -4.5393 -4.5393 -4.2136 -4.2136 -3.9013 -3.9013 -3.4643 -3.4643 -1.3801 -1.3801 -0.2615 -0.2615 1.1033 1.1033 1.6479 1.6479 2.5649 2.5649 2.7441 2.7441 2.9738 2.9738 3.5564 3.5564 3.9445 3.9445 3.9570 3.9570 4.1105 4.1105 4.1888 4.1888 4.4050 4.4050 4.4849 4.4849 4.5700 4.5700 4.8398 4.8398 5.3019 5.3019 5.3593 5.3593 5.4996 5.4996 5.7560 5.7560 5.8901 5.8901 6.0661 6.0661 6.4338 6.4338 6.5252 6.5252 7.0345 7.0345 7.1513 7.1513 7.2312 7.2312 7.8146 7.8146 7.9587 7.9587 8.4122 8.4122 k = 0.0063 0.0253-0.0000 ( 14061 PWs) bands (ev): -6.6088 -6.6088 -6.0908 -6.0905 -5.6345 -5.6344 -5.4643 -5.4642 -4.5387 -4.5385 -4.2130 -4.2130 -3.9009 -3.9009 -3.4639 -3.4637 -1.3800 -1.3797 -0.2627 -0.2619 1.1035 1.1053 1.6485 1.6496 2.5644 2.5653 2.7409 2.7469 2.9663 2.9716 3.5427 3.5630 3.9301 3.9348 3.9494 3.9714 4.1019 4.1116 4.1787 4.1864 4.3696 4.4326 4.4790 4.4803 4.5704 4.5934 4.8351 4.8516 5.2839 5.3085 5.3417 5.3758 5.4840 5.5158 5.7498 5.7578 5.8832 5.8888 6.0611 6.0749 6.4166 6.4307 6.4994 6.5299 7.0409 7.0410 7.1523 7.1566 7.2297 7.2551 7.8133 7.8147 7.9556 7.9616 8.4104 8.4172 k = 0.0126 0.0506-0.0000 ( 14041 PWs) bands (ev): -6.6058 -6.6057 -6.0889 -6.0883 -5.6309 -5.6307 -5.4624 -5.4621 -4.5368 -4.5364 -4.2112 -4.2111 -3.8996 -3.8995 -3.4625 -3.4621 -1.3795 -1.3789 -0.2654 -0.2638 1.1059 1.1096 1.6515 1.6537 2.5637 2.5653 2.7370 2.7493 2.9497 2.9593 3.5240 3.5604 3.8987 3.9145 3.9451 3.9743 4.0905 4.0990 4.1497 4.1808 4.3334 4.4542 4.4655 4.4764 4.5926 4.6204 4.8380 4.8694 5.2555 5.3002 5.3263 5.3908 5.4695 5.5322 5.7378 5.7556 5.8710 5.8781 6.0608 6.0849 6.3801 6.4040 6.4641 6.5131 7.0557 7.0601 7.1588 7.1695 7.2482 7.2996 7.8110 7.8132 7.9522 7.9644 8.4121 8.4248 k = 0.0190 0.0759-0.0000 ( 14047 PWs) bands (ev): -6.6007 -6.6005 -6.0858 -6.0849 -5.6249 -5.6247 -5.4591 -5.4586 -4.5336 -4.5330 -4.2081 -4.2079 -3.8974 -3.8973 -3.4603 -3.4596 -1.3785 -1.3777 -0.2697 -0.2672 1.1105 1.1160 1.6568 1.6601 2.5621 2.5644 2.7319 2.7509 2.9258 2.9377 3.5020 3.5472 3.8590 3.8840 3.9381 3.9602 4.0710 4.0787 4.1025 4.1776 4.3062 4.4514 4.4759 4.4789 4.6153 4.6415 4.8483 4.8903 5.2181 5.2749 5.3159 5.4036 5.4571 5.5479 5.7186 5.7494 5.8565 5.8597 6.0637 6.0935 6.3267 6.3533 6.4303 6.4815 7.0754 7.0870 7.1706 7.1907 7.2829 7.3593 7.8080 7.8102 7.9479 7.9667 8.4169 8.4339 k = 0.0253 0.1013-0.0000 ( 14049 PWs) bands (ev): -6.5936 -6.5933 -6.0813 -6.0801 -5.6165 -5.6163 -5.4544 -5.4538 -4.5291 -4.5283 -4.2039 -4.2036 -3.8944 -3.8942 -3.4570 -3.4562 -1.3772 -1.3761 -0.2757 -0.2723 1.1172 1.1246 1.6645 1.6689 2.5585 2.5612 2.7247 2.7513 2.8969 2.9089 3.4776 3.5233 3.8104 3.8431 3.9262 3.9302 4.0343 4.0422 4.0688 4.1772 4.2914 4.4437 4.4849 4.4952 4.6294 4.6548 4.8649 4.9092 5.1731 5.2385 5.3058 5.4120 5.4495 5.5616 5.6914 5.7385 5.8365 5.8410 6.0670 6.0988 6.2607 6.2902 6.3965 6.4418 7.0988 7.1171 7.1873 7.2190 7.3292 7.4277 7.8043 7.8059 7.9420 7.9682 8.4234 8.4434 k = 0.0316 0.1266-0.0000 ( 14033 PWs) bands (ev): -6.5845 -6.5841 -6.0755 -6.0741 -5.6058 -5.6054 -5.4485 -5.4477 -4.5234 -4.5223 -4.1984 -4.1980 -3.8905 -3.8903 -3.4529 -3.4519 -1.3756 -1.3742 -0.2834 -0.2793 1.1261 1.1354 1.6744 1.6800 2.5506 2.5534 2.7140 2.7492 2.8670 2.8769 3.4506 3.4897 3.7525 3.7919 3.8748 3.9195 3.9797 3.9969 4.0594 4.1782 4.2855 4.4386 4.4925 4.5128 4.6338 4.6611 4.8841 4.9203 5.1218 5.1939 5.2943 5.4130 5.4503 5.5713 5.6565 5.7218 5.8116 5.8247 6.0678 6.0995 6.1879 6.2245 6.3614 6.3986 7.1257 7.1494 7.2085 7.2523 7.3818 7.4987 7.8003 7.8010 7.9341 7.9685 8.4293 8.4514 k = 0.0379 0.1519-0.0000 ( 14053 PWs) bands (ev): -6.5734 -6.5729 -6.0685 -6.0668 -5.5926 -5.5922 -5.4412 -5.4403 -4.5164 -4.5151 -4.1917 -4.1913 -3.8858 -3.8856 -3.4479 -3.4467 -1.3738 -1.3721 -0.2931 -0.2881 1.1370 1.1483 1.6866 1.6935 2.5346 2.5372 2.6995 2.7432 2.8408 2.8478 3.4206 3.4480 3.6863 3.7311 3.8133 3.8849 3.9396 3.9620 4.0512 4.1793 4.2833 4.4338 4.5004 4.5266 4.6316 4.6620 4.9018 4.9197 5.0656 5.1429 5.2810 5.4085 5.4569 5.5730 5.6179 5.6977 5.7877 5.8067 6.0626 6.0947 6.1147 6.1617 6.3262 6.3553 7.1559 7.1840 7.2338 7.2888 7.4352 7.5673 7.7961 7.7972 7.9240 7.9676 8.4312 8.4560 k = 0.0443 0.1772-0.0000 ( 14077 PWs) bands (ev): -6.5603 -6.5598 -6.0603 -6.0583 -5.5771 -5.5767 -5.4326 -5.4316 -4.5082 -4.5067 -4.1840 -4.1835 -3.8803 -3.8800 -3.4420 -3.4406 -1.3719 -1.3700 -0.3049 -0.2991 1.1498 1.1632 1.7010 1.7092 2.5055 2.5078 2.6832 2.7336 2.8218 2.8272 3.3865 3.3999 3.6139 3.6624 3.7476 3.8202 3.9301 3.9309 4.0435 4.1791 4.2813 4.4274 4.5073 4.5344 4.6265 4.6586 4.9053 4.9144 5.0066 5.0869 5.2657 5.4014 5.4636 5.5511 5.5911 5.6660 5.7664 5.7863 6.0316 6.0636 6.0810 6.1078 6.2927 6.3143 7.1890 7.2213 7.2627 7.3273 7.4845 7.6270 7.7922 7.7980 7.9121 7.9661 8.4260 8.4555 k = 0.0506 0.2025-0.0000 ( 14073 PWs) bands (ev): -6.5454 -6.5448 -6.0508 -6.0486 -5.5593 -5.5588 -5.4227 -5.4216 -4.4988 -4.4972 -4.1751 -4.1745 -3.8740 -3.8737 -3.4353 -3.4338 -1.3701 -1.3679 -0.3189 -0.3124 1.1645 1.1801 1.7175 1.7273 2.4600 2.4621 2.6688 2.7237 2.8100 2.8156 3.3467 3.3476 3.5378 3.5886 3.6803 3.7502 3.9045 3.9274 4.0351 4.1768 4.2770 4.4177 4.5122 4.5342 4.6223 4.6520 4.8756 4.9197 4.9489 5.0272 5.2480 5.3903 5.4651 5.5057 5.5769 5.6302 5.7476 5.7635 5.9690 6.0434 6.0434 6.0796 6.2618 6.2772 7.2244 7.2609 7.2944 7.3666 7.5258 7.6685 7.7890 7.8106 7.8988 7.9651 8.4129 8.4494 k = 0.0569 0.2278-0.0000 ( 14067 PWs) bands (ev): -6.5287 -6.5280 -6.0403 -6.0378 -5.5391 -5.5385 -5.4116 -5.4103 -4.4884 -4.4866 -4.1652 -4.1645 -3.8670 -3.8667 -3.4279 -3.4262 -1.3686 -1.3660 -0.3354 -0.3282 1.1811 1.1989 1.7362 1.7476 2.3997 2.4014 2.6569 2.7161 2.8034 2.8096 3.2894 3.3038 3.4606 3.5125 3.6125 3.6799 3.8834 3.9272 4.0250 4.1717 4.2690 4.4034 4.5140 4.5261 4.6200 4.6427 4.8271 4.9004 4.9160 4.9654 5.2275 5.3729 5.4531 5.4565 5.5576 5.5992 5.7299 5.7387 5.9114 5.9995 6.0201 6.0610 6.2334 6.2444 7.2613 7.3025 7.3285 7.4062 7.5557 7.6850 7.7867 7.8385 7.8854 7.9660 8.3945 8.4388 k = 0.0632 0.2531-0.0000 ( 14059 PWs) bands (ev): -6.5101 -6.5094 -6.0287 -6.0259 -5.5166 -5.5160 -5.3991 -5.3978 -4.4770 -4.4750 -4.1542 -4.1535 -3.8594 -3.8590 -3.4197 -3.4179 -1.3674 -1.3646 -0.3547 -0.3468 1.1993 1.2194 1.7568 1.7702 2.3287 2.3298 2.6455 2.7097 2.8004 2.8069 3.2286 3.2554 3.3841 3.4358 3.5456 3.6107 3.8678 3.9285 4.0119 4.1629 4.2564 4.3837 4.5120 4.5127 4.6175 4.6310 4.7623 4.8632 4.8898 4.9161 5.2043 5.3469 5.4090 5.4199 5.5299 5.5820 5.7111 5.7126 5.8641 5.9603 5.9915 6.0410 6.2067 6.2150 7.2991 7.3455 7.3644 7.4452 7.5728 7.6831 7.7846 7.8631 7.8827 7.9701 8.3757 8.4263 k = 0.0696 0.2785-0.0000 ( 14071 PWs) bands (ev): -6.4899 -6.4891 -6.0160 -6.0131 -5.4919 -5.4911 -5.3855 -5.3840 -4.4646 -4.4625 -4.1424 -4.1416 -3.8511 -3.8507 -3.4110 -3.4089 -1.3668 -1.3638 -0.3769 -0.3683 1.2192 1.2416 1.7793 1.7949 2.2511 2.2515 2.6318 2.7013 2.7996 2.8067 3.1651 3.2030 3.3097 3.3589 3.4815 3.5441 3.8572 3.9311 3.9945 4.1496 4.2392 4.3585 4.4967 4.5054 4.6121 4.6163 4.6901 4.8253 4.8337 4.8974 5.1787 5.3116 5.3655 5.3694 5.4941 5.5770 5.6860 5.6893 5.8279 5.9256 5.9584 6.0188 6.1809 6.1876 7.3370 7.3891 7.4017 7.4831 7.5777 7.6711 7.7816 7.8546 7.9106 7.9776 8.3616 8.4146 k = 0.0759 0.3038-0.0000 ( 14067 PWs) bands (ev): -6.4680 -6.4672 -6.0025 -5.9993 -5.4648 -5.4641 -5.3705 -5.3690 -4.4514 -4.4491 -4.1297 -4.1288 -3.8422 -3.8418 -3.4016 -3.3994 -1.3671 -1.3638 -0.4022 -0.3931 1.2405 1.2654 1.8033 1.8217 2.1696 2.1697 2.6141 2.6879 2.7997 2.8092 3.0998 3.1469 3.2378 3.2816 3.4234 3.4818 3.8507 3.9346 3.9720 4.1306 4.2182 4.3286 4.4792 4.4939 4.5879 4.6014 4.6260 4.7541 4.8103 4.8815 5.1511 5.2673 5.3111 5.3256 5.4518 5.5770 5.6600 5.6634 5.8016 5.8937 5.9216 5.9940 6.1555 6.1609 7.3738 7.4323 7.4400 7.5191 7.5728 7.6528 7.7776 7.8441 7.9337 7.9874 8.3552 8.4058 k = 0.0822 0.3291-0.0000 ( 14067 PWs) bands (ev): -6.4446 -6.4437 -5.9880 -5.9847 -5.4356 -5.4348 -5.3544 -5.3528 -4.4374 -4.4351 -4.1162 -4.1153 -3.8328 -3.8323 -3.3917 -3.3894 -1.3685 -1.3649 -0.4309 -0.4213 1.2632 1.2906 1.8285 1.8504 2.0868 2.0870 2.5914 2.6683 2.7985 2.8137 3.0343 3.0873 3.1685 3.2033 3.3742 3.4257 3.8473 3.9345 3.9477 4.1046 4.1950 4.2952 4.4607 4.4768 4.5202 4.5834 4.5992 4.6820 4.7923 4.8676 5.1227 5.2152 5.2519 5.2870 5.4056 5.5775 5.6340 5.6355 5.7819 5.8625 5.8818 5.9659 6.1305 6.1338 7.4085 7.4735 7.4792 7.5496 7.5638 7.6297 7.7740 7.8365 7.9475 7.9976 8.3570 8.4008 k = 0.0885 0.3544-0.0000 ( 14065 PWs) bands (ev): -6.4198 -6.4188 -5.9727 -5.9693 -5.4042 -5.4033 -5.3371 -5.3354 -4.4229 -4.4204 -4.1021 -4.1011 -3.8229 -3.8224 -3.3814 -3.3791 -1.3712 -1.3674 -0.4630 -0.4530 1.2870 1.3170 1.8535 1.8811 2.0047 2.0061 2.5638 2.6429 2.7920 2.8182 2.9705 3.0244 3.1025 3.1245 3.3358 3.3774 3.8455 3.9040 3.9472 4.0710 4.1710 4.2595 4.4338 4.4406 4.4628 4.5507 4.5833 4.6196 4.7788 4.8568 5.0943 5.1569 5.1957 5.2459 5.3589 5.5743 5.6044 5.6130 5.7648 5.8305 5.8396 5.9339 6.1056 6.1058 7.4393 7.5052 7.5187 7.5467 7.5855 7.6035 7.7737 7.8330 7.9541 8.0070 8.3645 8.3994 k = 0.0949 0.3797-0.0000 ( 14063 PWs) bands (ev): -6.3936 -6.3925 -5.9568 -5.9532 -5.3706 -5.3698 -5.3185 -5.3168 -4.4078 -4.4053 -4.0873 -4.0863 -3.8126 -3.8121 -3.3708 -3.3684 -1.3755 -1.3715 -0.4988 -0.4884 1.3120 1.3444 1.8696 1.9133 1.9242 1.9374 2.5322 2.6136 2.7730 2.8181 2.9110 2.9599 3.0437 3.0475 3.3082 3.3374 3.8435 3.8612 3.9521 4.0308 4.1473 4.2228 4.3539 4.4156 4.4380 4.4949 4.5695 4.5820 4.7682 4.8488 5.0664 5.0943 5.1448 5.1993 5.3144 5.5533 5.5884 5.5927 5.7465 5.7959 5.7965 5.8976 6.0767 6.0807 7.4632 7.5005 7.5530 7.5606 7.5823 7.6140 7.7802 7.8348 7.9568 8.0153 8.3742 8.4002 k = 0.1012 0.4050-0.0000 ( 14063 PWs) bands (ev): -6.3663 -6.3651 -5.9402 -5.9365 -5.3350 -5.3341 -5.2987 -5.2971 -4.3925 -4.3898 -4.0722 -4.0711 -3.8020 -3.8015 -3.3599 -3.3574 -1.3815 -1.3773 -0.5381 -0.5275 1.3379 1.3727 1.8294 1.8469 1.9288 1.9470 2.4978 2.5826 2.7348 2.8029 2.8541 2.8959 2.9809 3.0003 3.2895 3.3053 3.8112 3.8385 3.9565 3.9865 4.1244 4.1858 4.2730 4.3722 4.4135 4.4436 4.5570 4.5593 4.7591 4.8425 5.0293 5.0389 5.1000 5.1468 5.2727 5.5163 5.5748 5.5835 5.7229 5.7540 5.7602 5.8571 6.0461 6.0554 7.4723 7.4742 7.5487 7.5803 7.6076 7.6454 7.7955 7.8427 7.9587 8.0233 8.3825 8.4014 k = 0.1075 0.4303-0.0000 ( 14067 PWs) bands (ev): -6.3378 -6.3367 -5.9231 -5.9192 -5.2975 -5.2965 -5.2777 -5.2761 -4.3769 -4.3742 -4.0567 -4.0556 -3.7911 -3.7906 -3.3489 -3.3464 -1.3897 -1.3853 -0.5811 -0.5704 1.3645 1.4014 1.7607 1.7740 1.9529 1.9815 2.4622 2.5519 2.6798 2.7607 2.7924 2.8280 2.9425 2.9780 3.2775 3.2799 3.7552 3.8257 3.9429 3.9593 4.1025 4.1486 4.1947 4.3053 4.3890 4.4161 4.5420 4.5457 4.7503 4.8366 4.9634 5.0106 5.0611 5.0915 5.2322 5.4738 5.5590 5.5777 5.6879 5.7202 5.7216 5.8127 6.0140 6.0293 7.4424 7.4564 7.5478 7.5900 7.6485 7.6814 7.8193 7.8569 7.9618 8.0319 8.3873 8.4018 k = 0.1138 0.4557-0.0000 ( 14073 PWs) bands (ev): -6.3085 -6.3073 -5.9055 -5.9016 -5.2593 -5.2577 -5.2541 -5.2531 -4.3614 -4.3587 -4.0410 -4.0399 -3.7800 -3.7795 -3.3378 -3.3353 -1.4000 -1.3955 -0.6275 -0.6168 1.3918 1.4302 1.6932 1.7064 1.9804 2.0162 2.4265 2.5229 2.6158 2.6991 2.7240 2.7505 2.9322 2.9720 3.2597 3.2696 3.6941 3.7977 3.9068 3.9590 4.0780 4.1089 4.1255 4.2365 4.3651 4.3990 4.5277 4.5355 4.7409 4.8295 4.8979 4.9782 5.0278 5.0393 5.1910 5.4274 5.5451 5.5656 5.6482 5.6810 5.6918 5.7646 5.9804 6.0016 7.4083 7.4246 7.5565 7.5926 7.6903 7.7196 7.8495 7.8776 7.9675 8.0422 8.3880 8.4006 k = 0.1202 0.4810-0.0000 ( 14069 PWs) bands (ev): -6.2785 -6.2772 -5.8877 -5.8837 -5.2330 -5.2311 -5.2155 -5.2147 -4.3462 -4.3434 -4.0254 -4.0243 -3.7688 -3.7683 -3.3267 -3.3242 -1.4127 -1.4080 -0.6772 -0.6666 1.4195 1.4583 1.6306 1.6456 2.0072 2.0499 2.3916 2.4953 2.5486 2.6326 2.6529 2.6683 2.9335 2.9746 3.2431 3.2638 3.6291 3.7525 3.8806 3.9540 4.0298 4.0604 4.0889 4.1825 4.3428 4.3859 4.5158 4.5262 4.7306 4.8192 4.8336 4.9372 4.9974 4.9991 5.1484 5.3774 5.5324 5.5388 5.6178 5.6391 5.6628 5.7136 5.9452 5.9722 7.3734 7.3885 7.5663 7.5919 7.7317 7.7580 7.8841 7.9042 7.9766 8.0549 8.3849 8.3979 k = 0.1265 0.5063-0.0000 ( 14061 PWs) bands (ev): -6.2479 -6.2466 -5.8696 -5.8656 -5.2084 -5.2066 -5.1723 -5.1714 -4.3314 -4.3286 -4.0100 -4.0088 -3.7576 -3.7571 -3.3158 -3.3134 -1.4278 -1.4231 -0.7300 -0.7196 1.4473 1.4831 1.5741 1.5944 2.0319 2.0804 2.3576 2.4648 2.4820 2.5706 2.5838 2.5876 2.9377 2.9812 3.2288 3.2580 3.5613 3.6963 3.8584 3.9426 3.9674 4.0005 4.0772 4.1511 4.3224 4.3748 4.5054 4.5176 4.7193 4.7714 4.8018 4.8924 4.9649 4.9738 5.1048 5.3239 5.4956 5.5198 5.5971 5.6008 5.6317 5.6601 5.9085 5.9405 7.3392 7.3527 7.5747 7.5901 7.7715 7.7953 7.9218 7.9360 7.9897 8.0707 8.3792 8.3943 k = 0.1328 0.5316-0.0000 ( 14045 PWs) bands (ev): -6.2169 -6.2156 -5.8513 -5.8474 -5.1826 -5.1809 -5.1271 -5.1262 -4.3173 -4.3145 -3.9950 -3.9938 -3.7464 -3.7460 -3.3052 -3.3028 -1.4454 -1.4406 -0.7854 -0.7753 1.4748 1.4938 1.5246 1.5639 2.0528 2.1037 2.3232 2.4191 2.4204 2.4981 2.5222 2.5399 2.9414 2.9891 3.2159 3.2504 3.4919 3.6355 3.8352 3.9095 3.9132 3.9474 4.0731 4.1368 4.3046 4.3647 4.4959 4.5092 4.7074 4.7121 4.7718 4.8557 4.9352 4.9506 5.0617 5.2671 5.4441 5.5050 5.5569 5.5897 5.5988 5.6048 5.8703 5.9066 7.3068 7.3192 7.5814 7.5884 7.8090 7.8307 7.9617 7.9722 8.0073 8.0897 8.3725 8.3909 k = 0.1391 0.5569-0.0000 ( 14049 PWs) bands (ev): -6.1858 -6.1844 -5.8331 -5.8292 -5.1557 -5.1540 -5.0803 -5.0794 -4.3042 -4.3014 -3.9807 -3.9795 -3.7353 -3.7349 -3.2948 -3.2925 -1.4653 -1.4605 -0.8431 -0.8333 1.4744 1.4798 1.5045 1.5701 2.0688 2.1134 2.2854 2.3603 2.3641 2.4180 2.4763 2.5278 2.9428 2.9967 3.2036 3.2397 3.4221 3.5738 3.8083 3.8522 3.8611 3.9231 4.0724 4.1325 4.2896 4.3544 4.4865 4.5005 4.6566 4.6955 4.7299 4.8301 4.9038 4.9282 5.0217 5.2073 5.3896 5.4823 5.5230 5.5499 5.5636 5.5804 5.8309 5.8704 7.2771 7.2894 7.5868 7.5871 7.8432 7.8639 8.0030 8.0120 8.0295 8.1121 8.3664 8.3890 k = 0.1454 0.5822-0.0000 ( 14025 PWs) bands (ev): -6.1548 -6.1533 -5.8151 -5.8112 -5.1275 -5.1258 -5.0319 -5.0310 -4.2923 -4.2896 -3.9672 -3.9661 -3.7244 -3.7241 -3.2849 -3.2827 -1.4875 -1.4827 -0.9026 -0.8932 1.4454 1.4455 1.5303 1.5922 2.0788 2.1022 2.2398 2.2940 2.3212 2.3405 2.4548 2.5342 2.9407 3.0030 3.1914 3.2247 3.3531 3.5136 3.7773 3.7879 3.8240 3.9043 4.0727 4.1334 4.2776 4.3426 4.4762 4.4907 4.6062 4.6838 4.6848 4.8086 4.8680 4.9059 4.9881 5.1448 5.3342 5.4479 5.4830 5.5118 5.5276 5.5704 5.7906 5.8322 7.2511 7.2642 7.5864 7.5910 7.8737 7.8948 8.0452 8.0534 8.0571 8.1373 8.3624 8.3901 k = 0.1518 0.6075-0.0000 ( 14023 PWs) bands (ev): -6.1240 -6.1226 -5.7972 -5.7934 -5.0981 -5.0965 -4.9820 -4.9811 -4.2821 -4.2794 -3.9550 -3.9540 -3.7139 -3.7135 -3.2754 -3.2734 -1.5114 -1.5067 -0.9633 -0.9543 1.4178 1.4199 1.5558 1.6165 2.0695 2.0815 2.1865 2.2276 2.2680 2.2905 2.4595 2.5527 2.9342 3.0068 3.1789 3.2051 3.2861 3.4570 3.7282 3.7453 3.7963 3.8858 4.0722 4.1363 4.2685 4.3276 4.4647 4.4777 4.5632 4.6428 4.6727 4.7853 4.8286 4.8833 4.9632 5.0800 5.2789 5.4067 5.4288 5.4905 5.4945 5.5594 5.7499 5.7921 7.2295 7.2442 7.5862 7.5942 7.9009 7.9236 8.0840 8.0870 8.1008 8.1649 8.3618 8.3961 k = 0.1581 0.6329-0.0000 ( 14027 PWs) bands (ev): -6.0938 -6.0923 -5.7797 -5.7760 -5.0674 -5.0658 -4.9308 -4.9300 -4.2736 -4.2711 -3.9444 -3.9433 -3.7037 -3.7034 -3.2665 -3.2646 -1.5369 -1.5322 -1.0247 -1.0163 1.3974 1.4005 1.5794 1.6396 2.0230 2.0735 2.1292 2.1646 2.2049 2.2690 2.4835 2.5801 2.9225 3.0070 3.1659 3.1815 3.2231 3.4058 3.6755 3.7151 3.7749 3.8672 4.0693 4.1391 4.2617 4.3076 4.4518 4.4587 4.5307 4.6066 4.6627 4.7538 4.7923 4.8607 4.9468 5.0135 5.2242 5.3568 5.3809 5.4527 5.4800 5.5473 5.7093 5.7504 7.2127 7.2298 7.5861 7.5963 7.9253 7.9508 8.1139 8.1266 8.1481 8.1953 8.3647 8.4086 k = 0.1644 0.6582-0.0000 ( 14033 PWs) bands (ev): -6.0643 -6.0629 -5.7627 -5.7591 -5.0353 -5.0339 -4.8784 -4.8776 -4.2674 -4.2649 -3.9356 -3.9346 -3.6940 -3.6937 -3.2580 -3.2564 -1.5633 -1.5588 -1.0863 -1.0784 1.3843 1.3877 1.6001 1.6594 1.9714 2.0476 2.0718 2.1057 2.1608 2.2532 2.5187 2.6140 2.9050 3.0014 3.1524 3.1551 3.1669 3.3616 3.6309 3.6868 3.7587 3.8482 4.0632 4.1395 4.2556 4.2814 4.4342 4.4382 4.5089 4.5768 4.6541 4.7109 4.7647 4.8390 4.9379 4.9459 5.1702 5.2991 5.3421 5.4142 5.4650 5.5338 5.6696 5.7077 7.2010 7.2212 7.5860 7.5975 7.9481 7.9768 8.1428 8.1613 8.1967 8.2299 8.3684 8.4275 k = 0.1707 0.6835-0.0000 ( 14029 PWs) bands (ev): -6.0358 -6.0344 -5.7462 -5.7428 -5.0020 -5.0006 -4.8249 -4.8242 -4.2637 -4.2613 -3.9290 -3.9281 -3.6848 -3.6846 -3.2502 -3.2487 -1.5902 -1.5858 -1.1474 -1.1401 1.3782 1.3813 1.6165 1.6736 1.9213 2.0040 2.0167 2.0502 2.1397 2.2417 2.5596 2.6520 2.8816 2.9868 3.1213 3.1278 3.1389 3.3255 3.5951 3.6590 3.7474 3.8285 4.0537 4.1355 4.2475 4.2490 4.4102 4.4242 4.4924 4.5525 4.6474 4.6631 4.7426 4.8187 4.8786 4.9354 5.1170 5.2399 5.3077 5.3753 5.4486 5.5186 5.6317 5.6645 7.1948 7.2184 7.5855 7.5975 7.9699 8.0024 8.1698 8.1896 8.2452 8.2695 8.3686 8.4416 k = 0.1771 0.7088-0.0000 ( 14019 PWs) bands (ev): -6.0086 -6.0072 -5.7305 -5.7272 -4.9675 -4.9661 -4.7706 -4.7699 -4.2627 -4.2605 -3.9250 -3.9242 -3.6764 -3.6763 -3.2429 -3.2416 -1.6169 -1.6126 -1.2076 -1.2008 1.3786 1.3809 1.6268 1.6786 1.8781 1.9543 1.9656 1.9998 2.1314 2.2338 2.6022 2.6918 2.8528 2.9611 3.0903 3.1022 3.1256 3.2978 3.5684 3.6306 3.7402 3.8076 4.0410 4.1249 4.2122 4.2336 4.3932 4.4088 4.4760 4.5332 4.6152 4.6434 4.7241 4.7934 4.8200 4.9385 5.0649 5.1816 5.2765 5.3358 5.4302 5.5010 5.5970 5.6214 7.1941 7.2215 7.5842 7.5962 7.9917 8.0278 8.1950 8.2135 8.2888 8.3117 8.3682 8.4436 k = 0.1834 0.7341-0.0000 ( 14021 PWs) bands (ev): -5.9828 -5.9814 -5.7156 -5.7125 -4.9317 -4.9304 -4.7156 -4.7149 -4.2649 -4.2627 -3.9240 -3.9233 -3.6687 -3.6687 -3.2361 -3.2350 -1.6428 -1.6387 -1.2663 -1.2601 1.3848 1.3858 1.6294 1.6702 1.8468 1.9058 1.9202 1.9570 2.1295 2.2293 2.6424 2.7308 2.8198 2.9292 3.0708 3.0811 3.1144 3.2783 3.5503 3.6013 3.7357 3.7852 4.0256 4.1059 4.1734 4.2122 4.3857 4.3900 4.4568 4.5183 4.5694 4.6426 4.7095 4.7359 4.7988 4.9463 5.0140 5.1255 5.2483 5.2958 5.4092 5.4799 5.5671 5.5795 7.1987 7.2300 7.5819 7.5936 8.0138 8.0537 8.2195 8.2357 8.3112 8.3513 8.3850 8.4469 k = 0.1897 0.7594-0.0000 ( 14025 PWs) bands (ev): -5.9586 -5.9574 -5.7016 -5.6987 -4.8947 -4.8935 -4.6601 -4.6595 -4.2704 -4.2683 -3.9263 -3.9257 -3.6620 -3.6620 -3.2298 -3.2289 -1.6672 -1.6632 -1.3229 -1.3173 1.3951 1.3963 1.6233 1.6473 1.8282 1.8615 1.8821 1.9226 2.1326 2.2285 2.6744 2.7655 2.7840 2.9011 3.0568 3.0680 3.1074 3.2663 3.5397 3.5710 3.7322 3.7611 4.0078 4.0773 4.1350 4.1843 4.3665 4.3863 4.4341 4.5049 4.5286 4.6438 4.6725 4.6998 4.7910 4.9571 4.9653 5.0734 5.2229 5.2555 5.3853 5.4548 5.5399 5.5432 7.2084 7.2438 7.5784 7.5896 8.0369 8.0802 8.2443 8.2584 8.3065 8.3779 8.4260 8.4618 k = 0.1960 0.7847-0.0000 ( 14027 PWs) bands (ev): -5.9363 -5.9351 -5.6886 -5.6860 -4.8567 -4.8556 -4.6044 -4.6038 -4.2793 -4.2774 -3.9323 -3.9318 -3.6563 -3.6563 -3.2239 -3.2232 -1.6893 -1.6856 -1.3771 -1.3721 1.4075 1.4118 1.6091 1.6150 1.8160 1.8227 1.8540 1.8958 2.1408 2.2314 2.6899 2.7469 2.7924 2.8878 3.0442 3.0660 3.1069 3.2612 3.5354 3.5399 3.7280 3.7351 3.9878 4.0399 4.0980 4.1532 4.3387 4.3877 4.4124 4.4752 4.5082 4.6065 4.6514 4.6959 4.7881 4.9200 4.9661 5.0304 5.2000 5.2150 5.3578 5.4264 5.5040 5.5251 7.2230 7.2624 7.5735 7.5841 8.0612 8.1078 8.2702 8.2829 8.2917 8.3838 8.4743 8.4945 k = 0.2024 0.8101-0.0000 ( 14011 PWs) bands (ev): -5.9160 -5.9149 -5.6768 -5.6744 -4.8178 -4.8167 -4.5486 -4.5481 -4.2920 -4.2902 -3.9422 -3.9417 -3.6518 -3.6518 -3.2183 -3.2178 -1.7087 -1.7053 -1.4283 -1.4240 1.4217 1.4301 1.5792 1.5893 1.7909 1.8038 1.8380 1.8742 2.1545 2.2383 2.6844 2.7099 2.8090 2.8931 3.0322 3.0763 3.1149 3.2632 3.5083 3.5355 3.7073 3.7214 3.9649 3.9965 4.0617 4.1223 4.3081 4.3673 4.4109 4.4347 4.4995 4.5497 4.6535 4.6982 4.7890 4.8807 4.9548 5.0151 5.1748 5.1793 5.3268 5.3962 5.4729 5.5116 7.2421 7.2853 7.5671 7.5772 8.0870 8.1366 8.2710 8.3000 8.3092 8.3775 8.5229 8.5360 k = 0.2087 0.8354-0.0000 ( 14001 PWs) bands (ev): -5.8977 -5.8968 -5.6662 -5.6641 -4.7781 -4.7770 -4.4931 -4.4927 -4.3083 -4.3066 -3.9563 -3.9559 -3.6486 -3.6485 -3.2131 -3.2127 -1.7246 -1.7215 -1.4764 -1.4727 1.4361 1.4493 1.5441 1.5671 1.7673 1.7943 1.8293 1.8556 2.1738 2.2491 2.6645 2.6742 2.8159 2.9088 3.0218 3.0958 3.1327 3.2731 3.4768 3.5383 3.6776 3.7110 3.9382 3.9499 4.0265 4.0950 4.2761 4.3329 4.3929 4.4160 4.4903 4.5031 4.6504 4.7063 4.7930 4.8511 4.9235 5.0269 5.1356 5.1607 5.2931 5.3658 5.4474 5.5016 7.2653 7.3120 7.5591 7.5689 8.1146 8.1667 8.2496 8.3308 8.3337 8.3699 8.5693 8.5785 k = 0.2150 0.8607-0.0000 ( 14001 PWs) bands (ev): -5.8817 -5.8809 -5.6570 -5.6551 -4.7378 -4.7368 -4.4384 -4.4380 -4.3283 -4.3267 -3.9746 -3.9743 -3.6466 -3.6466 -3.2081 -3.2079 -1.7367 -1.7339 -1.5208 -1.5178 1.4489 1.4665 1.5117 1.5460 1.7530 1.7925 1.8227 1.8388 2.1983 2.2637 2.6394 2.6407 2.8165 2.9239 3.0141 3.1179 3.1609 3.2924 3.4464 3.5415 3.6464 3.6958 3.9015 3.9068 3.9939 4.0736 4.2434 4.2928 4.3507 4.4058 4.4788 4.4805 4.6385 4.7186 4.7986 4.8352 4.8928 5.0446 5.0981 5.1439 5.2586 5.3363 5.4274 5.4943 7.2919 7.3418 7.5498 7.5595 8.1440 8.1982 8.2263 8.3342 8.3647 8.3857 8.6117 8.6183 k = 0.2213 0.8860-0.0000 ( 13997 PWs) bands (ev): -5.8680 -5.8673 -5.6492 -5.6476 -4.6973 -4.6963 -4.3858 -4.3855 -4.3508 -4.3492 -3.9973 -3.9970 -3.6461 -3.6460 -3.2034 -3.2033 -1.7444 -1.7419 -1.5614 -1.5591 1.4581 1.4776 1.4844 1.5301 1.7483 1.7985 1.8186 1.8247 2.2272 2.2816 2.6102 2.6144 2.8142 2.9330 3.0102 3.1359 3.1983 3.3211 3.4192 3.5431 3.6140 3.6758 3.8524 3.8709 3.9662 4.0581 4.2101 4.2491 4.3084 4.3765 4.4651 4.4833 4.6189 4.7329 4.8015 4.8362 4.8675 5.0613 5.0635 5.1292 5.2265 5.3085 5.4128 5.4893 7.3215 7.3740 7.5393 7.5494 8.1748 8.2021 8.2310 8.3159 8.4016 8.4207 8.6486 8.6533 k = 0.2277 0.9113-0.0000 ( 14005 PWs) bands (ev): -5.8566 -5.8561 -5.6428 -5.6415 -4.6567 -4.6558 -4.3820 -4.3809 -4.3293 -4.3288 -4.0242 -4.0239 -3.6469 -3.6468 -3.1991 -3.1990 -1.7473 -1.7453 -1.5980 -1.5963 1.4515 1.4750 1.4773 1.5248 1.7496 1.7997 1.8177 1.8295 2.2598 2.3023 2.5830 2.5920 2.8113 2.9352 3.0103 3.1459 3.2415 3.3525 3.4020 3.5413 3.5812 3.6521 3.8039 3.8319 3.9449 4.0450 4.1761 4.2053 4.2666 4.3424 4.4503 4.4933 4.5972 4.7464 4.8014 4.8485 4.8498 5.0328 5.0725 5.1173 5.2009 5.2831 5.4034 5.4864 7.3533 7.4075 7.5280 7.5392 8.1751 8.2094 8.2648 8.2931 8.4415 8.4615 8.6787 8.6817 k = 0.2340 0.9366-0.0000 ( 14004 PWs) bands (ev): -5.8475 -5.8472 -5.6381 -5.6370 -4.6165 -4.6155 -4.4123 -4.4111 -4.2789 -4.2785 -4.0552 -4.0550 -3.6491 -3.6489 -3.1951 -3.1951 -1.7453 -1.7437 -1.6304 -1.6293 1.4326 1.4685 1.4811 1.5283 1.7479 1.7934 1.8264 1.8577 2.2953 2.3251 2.5596 2.5735 2.8090 2.9324 3.0135 3.1465 3.2860 3.3588 3.4196 3.5351 3.5491 3.6277 3.7579 3.7916 3.9301 4.0279 4.1417 4.1675 4.2265 4.3078 4.4355 4.5004 4.5808 4.7565 4.8010 4.8355 4.8687 5.0075 5.0739 5.1086 5.1875 5.2606 5.3993 5.4853 7.3865 7.4406 7.5163 7.5304 8.1491 8.2441 8.2652 8.3020 8.4840 8.5060 8.7012 8.7019 k = 0.2403 0.9619-0.0000 ( 13994 PWs) bands (ev): -5.8408 -5.8407 -5.6349 -5.6342 -4.5769 -4.5760 -4.4465 -4.4454 -4.2299 -4.2296 -4.0902 -4.0899 -3.6524 -3.6522 -3.1916 -3.1915 -1.7381 -1.7370 -1.6583 -1.6579 1.4159 1.4584 1.4896 1.5354 1.7398 1.7864 1.8529 1.8954 2.3331 2.3494 2.5402 2.5598 2.8081 2.9260 3.0187 3.1373 3.3256 3.3513 3.4534 3.5194 3.5252 3.6102 3.7179 3.7518 3.9192 4.0000 4.1081 4.1408 4.1894 4.2731 4.4216 4.4989 4.5763 4.7615 4.8007 4.8266 4.8894 4.9889 5.0681 5.1011 5.1879 5.2417 5.4005 5.4859 7.4198 7.4684 7.5054 7.5274 8.1223 8.2371 8.2809 8.3385 8.5289 8.5533 8.7116 8.7154 k = 0.2466 0.9873-0.0000 ( 13996 PWs) bands (ev): -5.8365 -5.8364 -5.6335 -5.6330 -4.5384 -4.5375 -4.4837 -4.4828 -4.1834 -4.1831 -4.1287 -4.1284 -3.6567 -3.6565 -3.1886 -3.1885 -1.7257 -1.7251 -1.6820 -1.6818 1.4027 1.4498 1.5002 1.5449 1.7297 1.7810 1.8914 1.9396 2.3725 2.3744 2.5248 2.5514 2.8089 2.9171 3.0252 3.1189 3.3490 3.3510 3.4686 3.4947 3.5134 3.6135 3.6890 3.7145 3.9069 3.9615 4.0782 4.1233 4.1572 4.2391 4.4091 4.4900 4.5835 4.7625 4.8004 4.8185 4.9097 4.9783 5.0613 5.0958 5.1968 5.2269 5.4067 5.4880 7.4491 7.4796 7.4988 7.5411 8.0952 8.2067 8.3196 8.3764 8.5752 8.6024 8.7073 8.7206 k = 0.2530 1.0126-0.0000 ( 14000 PWs) bands (ev): -5.8346 -5.8342 -5.6337 -5.6335 -4.5238 -4.5229 -4.5013 -4.5004 -4.1704 -4.1701 -4.1400 -4.1397 -3.6616 -3.6614 -3.1863 -3.1861 -1.7080 -1.7080 -1.7015 -1.7007 1.3927 1.4430 1.5138 1.5575 1.7216 1.7783 1.9368 1.9885 2.3989 2.4130 2.5133 2.5490 2.8114 2.9056 3.0328 3.0933 3.3529 3.3532 3.4565 3.4759 3.5032 3.6372 3.6788 3.6852 3.8871 3.9192 4.0535 4.1069 4.1333 4.2079 4.3981 4.4789 4.5977 4.7617 4.8004 4.8083 4.9278 4.9769 5.0557 5.0969 5.2087 5.2168 5.4177 5.4914 7.4609 7.4760 7.5098 7.5694 8.0681 8.1748 8.3601 8.4151 8.6211 8.6512 8.6885 8.7154 k = 0.2593 1.0379-0.0000 ( 13992 PWs) bands (ev): -5.8349 -5.8343 -5.6358 -5.6357 -4.5661 -4.5653 -4.4661 -4.4652 -4.2149 -4.2146 -4.1004 -4.1001 -3.6667 -3.6665 -3.1847 -3.1844 -1.7164 -1.7151 -1.6855 -1.6850 1.3855 1.4378 1.5312 1.5740 1.7178 1.7794 1.9864 2.0407 2.4219 2.4541 2.5057 2.5532 2.8156 2.8915 3.0412 3.0629 3.3330 3.3624 3.4307 3.4589 3.4945 3.6333 3.6904 3.6925 3.8575 3.8829 4.0305 4.0845 4.1232 4.1823 4.3885 4.4683 4.6164 4.7611 4.7963 4.8015 4.9422 4.9850 5.0508 5.1060 5.2114 5.2212 5.4328 5.4959 7.4551 7.4681 7.5380 7.6011 8.0411 8.1419 8.4024 8.4535 8.6591 8.6626 8.6956 8.7027 k = 0.2656 1.0632-0.0000 ( 14008 PWs) bands (ev): -5.8373 -5.8365 -5.6399 -5.6395 -4.6105 -4.6098 -4.4334 -4.4325 -4.2615 -4.2612 -4.0653 -4.0650 -3.6713 -3.6712 -3.1839 -3.1836 -1.7266 -1.7247 -1.6581 -1.6569 1.3805 1.4333 1.5527 1.5948 1.7198 1.7853 2.0382 2.0951 2.4422 2.4947 2.5022 2.5643 2.8213 2.8745 3.0302 3.0500 3.3010 3.3733 3.4032 3.4419 3.4869 3.6080 3.7060 3.7162 3.8226 3.8690 4.0042 4.0544 4.1290 4.1634 4.3799 4.4585 4.6390 4.7618 4.7848 4.8050 4.9545 5.0000 5.0469 5.1218 5.2108 5.2333 5.4512 5.5014 7.4452 7.4597 7.5691 7.6321 8.0147 8.1082 8.4464 8.4891 8.6390 8.6581 8.7064 8.7260 k = 0.2656 1.0632-0.0000 ( 14008 PWs) bands (ev): -5.8373 -5.8365 -5.6399 -5.6395 -4.6105 -4.6098 -4.4334 -4.4325 -4.2615 -4.2612 -4.0653 -4.0650 -3.6713 -3.6712 -3.1839 -3.1836 -1.7266 -1.7247 -1.6581 -1.6569 1.3805 1.4333 1.5527 1.5948 1.7198 1.7853 2.0382 2.0951 2.4422 2.4947 2.5022 2.5643 2.8213 2.8745 3.0302 3.0500 3.3010 3.3733 3.4032 3.4419 3.4869 3.6080 3.7060 3.7162 3.8226 3.8690 4.0042 4.0544 4.1290 4.1634 4.3799 4.4585 4.6390 4.7618 4.7848 4.8050 4.9545 5.0000 5.0469 5.1218 5.2108 5.2333 5.4512 5.5014 7.4452 7.4597 7.5691 7.6321 8.0147 8.1082 8.4464 8.4891 8.6390 8.6581 8.7064 8.7260 k = 0.2415 1.0632-0.0000 ( 13996 PWs) bands (ev): -5.8366 -5.8359 -5.6388 -5.6385 -4.6005 -4.5997 -4.4404 -4.4394 -4.2510 -4.2506 -4.0727 -4.0724 -3.6702 -3.6701 -3.1841 -3.1838 -1.7249 -1.7230 -1.6645 -1.6635 1.3805 1.4322 1.5492 1.5902 1.7176 1.7817 2.0301 2.0859 2.4383 2.4848 2.5027 2.5620 2.8162 2.8703 3.0412 3.0499 3.3063 3.3728 3.4004 3.4483 3.4875 3.6161 3.6957 3.7260 3.8358 3.8679 4.0068 4.0565 4.1319 4.1704 4.3811 4.4627 4.6330 4.7609 4.7885 4.8040 4.9519 4.9957 5.0480 5.1171 5.2099 5.2340 5.4459 5.4992 7.4458 7.4624 7.5619 7.6247 8.0211 8.1158 8.4355 8.4798 8.6352 8.6614 8.7010 8.7213 k = 0.2173 1.0632-0.0000 ( 13984 PWs) bands (ev): -5.8361 -5.8354 -5.6378 -5.6375 -4.5906 -4.5898 -4.4473 -4.4463 -4.2407 -4.2403 -4.0803 -4.0800 -3.6690 -3.6688 -3.1843 -3.1840 -1.7231 -1.7215 -1.6704 -1.6695 1.3785 1.4269 1.5491 1.5869 1.7137 1.7746 2.0291 2.0830 2.4349 2.4737 2.5041 2.5611 2.8043 2.8526 3.0530 3.0567 3.3054 3.3761 3.3857 3.4551 3.4881 3.6262 3.6877 3.7447 3.8567 3.8663 4.0054 4.0522 4.1435 4.1810 4.3810 4.4711 4.6259 4.7589 4.7946 4.8033 4.9496 4.9909 5.0496 5.1116 5.2090 5.2399 5.4388 5.4955 7.4438 7.4665 7.5541 7.6162 8.0283 8.1233 8.4232 8.4671 8.6148 8.6537 8.6942 8.7194 k = 0.1932 1.0632-0.0000 ( 13997 PWs) bands (ev): -5.8358 -5.8351 -5.6369 -5.6367 -4.5809 -4.5801 -4.4542 -4.4532 -4.2305 -4.2302 -4.0880 -4.0877 -3.6676 -3.6674 -3.1846 -3.1844 -1.7215 -1.7200 -1.6756 -1.6749 1.3749 1.4183 1.5517 1.5846 1.7088 1.7651 2.0347 2.0861 2.4319 2.4630 2.5059 2.5610 2.7869 2.8265 3.0590 3.0728 3.2989 3.3637 3.3840 3.4572 3.4916 3.6318 3.6914 3.7640 3.8639 3.8766 4.0077 4.0521 4.1564 4.1910 4.3797 4.4831 4.6180 4.7554 4.8026 4.8032 4.9476 4.9859 5.0512 5.1066 5.2102 5.2493 5.4301 5.4901 7.4404 7.4708 7.5461 7.6070 8.0362 8.1301 8.4103 8.4518 8.5836 8.6263 8.6959 8.7200 k = 0.1690 1.0632-0.0000 ( 14005 PWs) bands (ev): -5.8355 -5.8350 -5.6361 -5.6359 -4.5715 -4.5707 -4.4610 -4.4600 -4.2206 -4.2203 -4.0959 -4.0957 -3.6661 -3.6659 -3.1850 -3.1848 -1.7200 -1.7186 -1.6802 -1.6796 1.3699 1.4075 1.5557 1.5831 1.7038 1.7544 2.0454 2.0939 2.4284 2.4549 2.5081 2.5613 2.7654 2.7954 3.0669 3.0878 3.2882 3.3397 3.3928 3.4551 3.4988 3.6315 3.7059 3.7792 3.8614 3.8855 4.0213 4.0632 4.1657 4.1994 4.3777 4.4970 4.6096 4.7504 4.8037 4.8112 4.9457 4.9813 5.0524 5.1029 5.2140 5.2612 5.4196 5.4830 7.4367 7.4752 7.5376 7.5973 8.0446 8.1357 8.3974 8.4349 8.5469 8.5897 8.7007 8.7215 k = 0.1449 1.0632-0.0000 ( 14004 PWs) bands (ev): -5.8353 -5.8349 -5.6353 -5.6352 -4.5624 -4.5616 -4.4677 -4.4667 -4.2108 -4.2105 -4.1039 -4.1037 -3.6646 -3.6644 -3.1854 -3.1852 -1.7187 -1.7175 -1.6842 -1.6837 1.3643 1.3959 1.5597 1.5817 1.6997 1.7439 2.0596 2.1050 2.4235 2.4509 2.5104 2.5623 2.7406 2.7619 3.0765 3.1013 3.2747 3.3146 3.4019 3.4514 3.5092 3.6301 3.7218 3.7858 3.8631 3.8840 4.0438 4.0852 4.1697 4.2088 4.3756 4.5100 4.6016 4.7435 4.8048 4.8191 4.9438 4.9772 5.0538 5.1011 5.2206 5.2750 5.4076 5.4742 7.4335 7.4797 7.5287 7.5872 8.0534 8.1396 8.3851 8.4176 8.5084 8.5516 8.7056 8.7230 k = 0.1207 1.0632-0.0000 ( 14000 PWs) bands (ev): -5.8353 -5.8348 -5.6347 -5.6346 -4.5537 -4.5528 -4.4744 -4.4734 -4.2012 -4.2009 -4.1122 -4.1119 -3.6632 -3.6630 -3.1858 -3.1857 -1.7176 -1.7165 -1.6875 -1.6871 1.3586 1.3843 1.5630 1.5801 1.6972 1.7345 2.0758 2.1177 2.4184 2.4508 2.5126 2.5643 2.7127 2.7286 3.0875 3.1134 3.2596 3.2896 3.4100 3.4475 3.5225 3.6308 3.7293 3.7817 3.8726 3.8838 4.0634 4.1106 4.1718 4.2246 4.3732 4.5180 4.5964 4.7346 4.8065 4.8248 4.9426 4.9736 5.0562 5.1006 5.2299 5.2907 5.3940 5.4637 7.4317 7.4840 7.5195 7.5771 8.0625 8.1411 8.3732 8.4018 8.4705 8.5157 8.7099 8.7243 k = 0.0966 1.0632-0.0000 ( 13993 PWs) bands (ev): -5.8352 -5.8349 -5.6342 -5.6341 -4.5453 -4.5445 -4.4810 -4.4800 -4.1918 -4.1915 -4.1205 -4.1202 -3.6619 -3.6618 -3.1862 -3.1861 -1.7167 -1.7158 -1.6902 -1.6898 1.3534 1.3736 1.5654 1.5782 1.6965 1.7265 2.0928 2.1301 2.4151 2.4522 2.5151 2.5679 2.6814 2.6985 3.0996 3.1245 3.2437 3.2654 3.4168 3.4439 3.5388 3.6346 3.7232 3.7695 3.8881 3.8946 4.0712 4.1221 4.1856 4.2509 4.3702 4.5157 4.5977 4.7231 4.8087 4.8277 4.9426 4.9703 5.0606 5.1004 5.2418 5.3080 5.3791 5.4513 7.4317 7.4871 7.5112 7.5670 8.0717 8.1397 8.3618 8.3901 8.4354 8.4841 8.7136 8.7251 k = 0.0724 1.0632-0.0000 ( 13988 PWs) bands (ev): -5.8352 -5.8349 -5.6338 -5.6337 -4.5375 -4.5366 -4.4874 -4.4865 -4.1825 -4.1822 -4.1289 -4.1287 -3.6609 -3.6608 -3.1865 -3.1864 -1.7160 -1.7153 -1.6922 -1.6919 1.3494 1.3642 1.5669 1.5760 1.6975 1.7200 2.1092 2.1402 2.4150 2.4529 2.5196 2.5739 2.6484 2.6719 3.1129 3.1347 3.2282 3.2428 3.4222 3.4408 3.5579 3.6413 3.7071 3.7516 3.9092 3.9134 4.0675 4.1121 4.2161 4.2849 4.3660 4.5016 4.6062 4.7089 4.8112 4.8278 4.9441 4.9672 5.0668 5.0995 5.2559 5.3261 5.3632 5.4372 7.4341 7.4852 7.5079 7.5569 8.0810 8.1352 8.3516 8.3835 8.4054 8.4572 8.7168 8.7254 k = 0.0483 1.0632-0.0000 ( 14000 PWs) bands (ev): -5.8351 -5.8350 -5.6335 -5.6334 -4.5303 -4.5295 -4.4935 -4.4926 -4.1734 -4.1731 -4.1375 -4.1372 -3.6601 -3.6600 -3.1867 -3.1867 -1.7155 -1.7150 -1.6935 -1.6933 1.3468 1.3566 1.5680 1.5738 1.6997 1.7147 2.1240 2.1465 2.4188 2.4504 2.5281 2.5825 2.6167 2.6482 3.1268 3.1439 3.2138 3.2227 3.4264 3.4380 3.5793 3.6490 3.6881 3.7312 3.9318 3.9353 4.0579 4.0926 4.2505 4.3169 4.3642 4.4785 4.6196 4.6921 4.8141 4.8261 4.9472 4.9640 5.0741 5.0974 5.2720 5.3398 5.3515 5.4214 7.4390 7.4767 7.5118 7.5468 8.0904 8.1281 8.3447 8.3747 8.3894 8.4347 8.7194 8.7252 k = 0.0241 1.0632-0.0000 ( 14008 PWs) bands (ev): -5.8351 -5.8350 -5.6333 -5.6333 -4.5245 -4.5239 -4.4985 -4.4979 -4.1644 -4.1642 -4.1461 -4.1458 -3.6596 -3.6595 -3.1869 -3.1868 -1.7152 -1.7149 -1.6943 -1.6942 1.3461 1.3510 1.5689 1.5718 1.7028 1.7102 2.1360 2.1479 2.4260 2.4441 2.5423 2.5859 2.5960 2.6273 3.1402 3.1504 3.2025 3.2069 3.4298 3.4353 3.6025 3.6460 3.6807 3.7108 3.9504 3.9549 4.0500 4.0707 4.2822 4.3239 4.3824 4.4491 4.6360 4.6735 4.8171 4.8234 4.9514 4.9602 5.0814 5.0936 5.2895 5.3258 5.3669 5.4042 7.4462 7.4660 7.5190 7.5370 8.1000 8.1193 8.3430 8.3585 8.3926 8.4164 8.7216 8.7245 k = 0.0000 1.0632-0.0000 ( 14014 PWs) bands (ev): -5.8351 -5.8351 -5.6332 -5.6332 -4.5217 -4.5217 -4.5005 -4.5005 -4.1574 -4.1574 -4.1528 -4.1528 -3.6594 -3.6594 -3.1869 -3.1869 -1.7150 -1.7150 -1.6945 -1.6945 1.3475 1.3475 1.5701 1.5701 1.7063 1.7063 2.1443 2.1443 2.4352 2.4352 2.5622 2.5622 2.6096 2.6096 3.1498 3.1498 3.1990 3.1990 3.4327 3.4327 3.6260 3.6260 3.6926 3.6926 3.9607 3.9607 4.0536 4.0536 4.3079 4.3079 4.4157 4.4157 4.6543 4.6543 4.8203 4.8203 4.9559 4.9559 5.0881 5.0881 5.3077 5.3077 5.3858 5.3858 7.4555 7.4555 7.5276 7.5276 8.1097 8.1097 8.3474 8.3474 8.4023 8.4023 8.7233 8.7233 k = 0.0000 1.0632-0.0000 ( 14014 PWs) bands (ev): -5.8351 -5.8351 -5.6332 -5.6332 -4.5217 -4.5217 -4.5005 -4.5005 -4.1574 -4.1574 -4.1528 -4.1528 -3.6594 -3.6594 -3.1869 -3.1869 -1.7150 -1.7150 -1.6945 -1.6945 1.3475 1.3475 1.5701 1.5701 1.7063 1.7063 2.1443 2.1443 2.4352 2.4352 2.5622 2.5622 2.6096 2.6096 3.1498 3.1498 3.1990 3.1990 3.4327 3.4327 3.6260 3.6260 3.6926 3.6926 3.9607 3.9607 4.0536 4.0536 4.3079 4.3079 4.4157 4.4157 4.6543 4.6543 4.8203 4.8203 4.9559 4.9559 5.0881 5.0881 5.3077 5.3077 5.3858 5.3858 7.4555 7.4555 7.5276 7.5276 8.1097 8.1097 8.3474 8.3474 8.4023 8.4023 8.7233 8.7233 k = 0.0000 1.0632 0.0249 ( 14014 PWs) bands (ev): -5.8346 -5.8346 -5.6339 -5.6339 -4.5215 -4.5213 -4.5004 -4.5002 -4.1578 -4.1575 -4.1532 -4.1529 -3.6581 -3.6581 -3.1882 -3.1882 -1.7147 -1.7146 -1.6943 -1.6942 1.3468 1.3492 1.5659 1.5705 1.7046 1.7129 2.1417 2.1456 2.4342 2.4357 2.5624 2.5662 2.6094 2.6129 3.1203 3.1344 3.1890 3.2188 3.4332 3.4516 3.6196 3.6261 3.6962 3.6986 3.9474 3.9667 4.0531 4.0609 4.2996 4.3193 4.4021 4.4351 4.6431 4.6682 4.8158 4.8263 4.9437 4.9649 5.0706 5.1061 5.2935 5.3201 5.3779 5.3952 7.4506 7.4564 7.5237 7.5278 8.0974 8.1091 8.3507 8.3586 8.3941 8.4117 8.7217 8.7236 k = 0.0000 1.0632 0.0498 ( 14012 PWs) bands (ev): -5.8332 -5.8332 -5.6359 -5.6358 -4.5208 -4.5205 -4.5000 -4.4996 -4.1589 -4.1583 -4.1542 -4.1537 -3.6541 -3.6541 -3.1921 -3.1921 -1.7138 -1.7136 -1.6937 -1.6935 1.3473 1.3520 1.5584 1.5668 1.7080 1.7239 2.1382 2.1458 2.4332 2.4351 2.5671 2.5730 2.6131 2.6191 3.0702 3.0917 3.1724 3.2341 3.4474 3.4837 3.6021 3.6291 3.7077 3.7106 3.9321 3.9624 4.0599 4.0744 4.2975 4.3316 4.3950 4.4571 4.6341 4.6849 4.8141 4.8336 4.9300 4.9691 5.0549 5.1231 5.2784 5.3298 5.3726 5.4052 7.4421 7.4535 7.5160 7.5240 8.0773 8.0959 8.3682 8.3748 8.3871 8.4265 8.7192 8.7226 k = 0.0000 1.0632 0.0747 ( 14010 PWs) bands (ev): -5.8308 -5.8308 -5.6391 -5.6390 -4.5196 -4.5191 -4.4993 -4.4987 -4.1605 -4.1597 -4.1559 -4.1551 -3.6476 -3.6476 -3.1986 -3.1985 -1.7123 -1.7120 -1.6926 -1.6923 1.3489 1.3559 1.5487 1.5595 1.7161 1.7385 2.1339 2.1449 2.4326 2.4333 2.5749 2.5808 2.6208 2.6284 3.0141 3.0391 3.1475 3.2376 3.4650 3.5132 3.5818 3.6375 3.7183 3.7273 3.9223 3.9493 4.0741 4.0933 4.3018 4.3439 4.3941 4.4782 4.6270 4.7032 4.8173 4.8417 4.9165 4.9673 5.0421 5.1375 5.2634 5.3354 5.3712 5.4151 7.4308 7.4472 7.5047 7.5163 8.0546 8.0750 8.3711 8.3832 8.4042 8.4525 8.7159 8.7205 k = 0.0000 1.0632 0.0995 ( 14006 PWs) bands (ev): -5.8275 -5.8275 -5.6435 -5.6434 -4.5180 -4.5173 -4.4983 -4.4975 -4.1627 -4.1617 -4.1580 -4.1570 -3.6386 -3.6386 -3.2075 -3.2074 -1.7102 -1.7099 -1.6911 -1.6908 1.3516 1.3605 1.5373 1.5496 1.7283 1.7565 2.1291 2.1432 2.4301 2.4323 2.5827 2.5875 2.6323 2.6413 2.9570 2.9849 3.1197 3.2322 3.4770 3.5117 3.5802 3.6479 3.7299 3.7395 3.9258 3.9347 4.0947 4.1153 4.3103 4.3562 4.3996 4.4959 4.6218 4.7194 4.8288 4.8498 4.9052 4.9598 5.0322 5.1470 5.2504 5.3368 5.3739 5.4241 7.4177 7.4384 7.4901 7.5052 8.0329 8.0514 8.3574 8.3804 8.4410 8.4877 8.7124 8.7177 k = 0.0000 1.0632 0.1244 ( 13988 PWs) bands (ev): -5.8234 -5.8233 -5.6490 -5.6489 -4.5160 -4.5151 -4.4970 -4.4961 -4.1653 -4.1640 -4.1606 -4.1594 -3.6273 -3.6272 -3.2187 -3.2187 -1.7077 -1.7072 -1.6894 -1.6890 1.3552 1.3659 1.5251 1.5379 1.7442 1.7773 2.1241 2.1411 2.4257 2.4320 2.5861 2.5916 2.6459 2.6590 2.9030 2.9347 3.0930 3.2227 3.4786 3.4813 3.5887 3.6548 3.7388 3.7485 3.9304 3.9444 4.1209 4.1369 4.3196 4.3690 4.4126 4.5099 4.6184 4.7304 4.8497 4.8555 4.8991 4.9484 5.0245 5.1482 5.2430 5.3361 5.3783 5.4316 7.4039 7.4278 7.4726 7.4910 8.0143 8.0283 8.3379 8.3681 8.4817 8.5270 8.7092 8.7150 k = 0.0000 1.0632 0.1493 ( 13994 PWs) bands (ev): -5.8183 -5.8182 -5.6556 -5.6555 -4.5135 -4.5125 -4.4957 -4.4945 -4.1682 -4.1667 -4.1636 -4.1621 -3.6137 -3.6136 -3.2322 -3.2322 -1.7048 -1.7042 -1.6875 -1.6870 1.3596 1.3717 1.5124 1.5251 1.7632 1.8010 2.1192 2.1391 2.4199 2.4309 2.5808 2.5905 2.6598 2.6813 2.8564 2.8931 3.0705 3.2130 3.4426 3.4699 3.5847 3.6516 3.7417 3.7583 3.9449 3.9737 4.1521 4.1555 4.3282 4.3828 4.4329 4.5203 4.6171 4.7373 4.8562 4.8760 4.9008 4.9351 5.0188 5.1387 5.2437 5.3355 5.3819 5.4368 7.3902 7.4159 7.4534 7.4749 7.9995 8.0076 8.3124 8.3472 8.5238 8.5671 8.7069 8.7133 k = 0.0000 1.0632 0.1742 ( 14004 PWs) bands (ev): -5.8124 -5.8123 -5.6631 -5.6630 -4.5109 -4.5096 -4.4942 -4.4929 -4.1714 -4.1696 -4.1668 -4.1651 -3.5979 -3.5979 -3.2478 -3.2477 -1.7016 -1.7010 -1.6855 -1.6850 1.3647 1.3779 1.4999 1.5118 1.7851 1.8272 2.1145 2.1376 2.4126 2.4281 2.5643 2.5796 2.6731 2.7070 2.8217 2.8641 3.0543 3.2057 3.4011 3.4531 3.5695 3.6349 3.7406 3.7664 3.9767 4.0089 4.1706 4.1875 4.3364 4.3980 4.4576 4.5274 4.6186 4.7426 4.8539 4.8996 4.9083 4.9225 5.0167 5.1207 5.2509 5.3357 5.3839 5.4393 7.3773 7.4033 7.4335 7.4581 7.9888 7.9904 8.2811 8.3188 8.5655 8.6059 8.7059 8.7129 k = 0.0000 1.0632 0.1991 ( 14004 PWs) bands (ev): -5.8057 -5.8056 -5.6714 -5.6713 -4.5080 -4.5066 -4.4928 -4.4913 -4.1745 -4.1725 -4.1702 -4.1683 -3.5803 -3.5803 -3.2653 -3.2652 -1.6982 -1.6975 -1.6836 -1.6830 1.3704 1.3842 1.4877 1.4985 1.8097 1.8559 2.1100 2.1368 2.4037 2.4227 2.5365 2.5557 2.6865 2.7344 2.8015 2.8488 3.0453 3.2025 3.3584 3.4311 3.5502 3.6083 3.7361 3.7678 4.0184 4.0471 4.1836 4.2257 4.3445 4.4149 4.4806 4.5313 4.6253 4.7476 4.8524 4.8983 4.9173 4.9282 5.0205 5.0980 5.2612 5.3369 5.3840 5.4388 7.3652 7.3904 7.4145 7.4418 7.9770 7.9821 8.2448 8.2844 8.6054 8.6414 8.7061 8.7139 k = 0.0000 1.0632 0.2240 ( 13998 PWs) bands (ev): -5.7983 -5.7982 -5.6805 -5.6803 -4.5050 -4.5035 -4.4915 -4.4899 -4.1776 -4.1754 -4.1736 -4.1714 -3.5610 -3.5610 -3.2845 -3.2844 -1.6948 -1.6941 -1.6818 -1.6811 1.3766 1.3905 1.4763 1.4854 1.8367 1.8868 2.1055 2.1369 2.3931 2.4140 2.5010 2.5206 2.7010 2.7621 2.7933 2.8449 3.0433 3.2036 3.3158 3.4061 3.5325 3.5787 3.7256 3.7600 4.0641 4.0867 4.1971 4.2645 4.3523 4.4333 4.4954 4.5323 4.6398 4.7515 4.8539 4.8808 4.9249 4.9435 5.0301 5.0738 5.2726 5.3384 5.3826 5.4350 7.3542 7.3777 7.3976 7.4271 7.9675 7.9792 8.2052 8.2460 8.6417 8.6710 8.7073 8.7164 k = 0.0000 1.0632 0.2489 ( 14006 PWs) bands (ev): -5.7902 -5.7900 -5.6901 -5.6899 -4.5020 -4.5003 -4.4904 -4.4886 -4.1805 -4.1781 -4.1768 -4.1745 -3.5403 -3.5402 -3.3051 -3.3050 -1.6914 -1.6907 -1.6803 -1.6796 1.3831 1.3966 1.4656 1.4729 1.8659 1.9198 2.1004 2.1375 2.3814 2.4021 2.4622 2.4797 2.7168 2.7886 2.7923 2.8487 3.0466 3.2087 3.2740 3.3799 3.5204 3.5517 3.7078 3.7429 4.1098 4.1269 4.2130 4.3004 4.3590 4.4526 4.4986 4.5322 4.6625 4.7525 4.8586 4.8598 4.9295 4.9596 5.0421 5.0508 5.2842 5.3395 5.3805 5.4281 7.3447 7.3663 7.3835 7.4140 7.9621 7.9798 8.1643 8.2056 8.6718 8.6920 8.7093 8.7198 k = 0.0000 1.0632 0.2738 ( 14006 PWs) bands (ev): -5.7815 -5.7813 -5.7001 -5.6999 -4.4991 -4.4973 -4.4896 -4.4877 -4.1830 -4.1804 -4.1799 -4.1774 -3.5182 -3.5181 -3.3271 -3.3269 -1.6883 -1.6875 -1.6792 -1.6784 1.3900 1.4025 1.4559 1.4610 1.8969 1.9543 2.0936 2.1377 2.3692 2.3876 2.4247 2.4386 2.7335 2.7945 2.8131 2.8566 3.0534 3.2165 3.2340 3.3536 3.5163 3.5315 3.6833 3.7181 4.1525 4.1667 4.2315 4.3285 4.3643 4.4724 4.4918 4.5336 4.6896 4.7501 4.8366 4.8637 4.9316 4.9784 5.0314 5.0526 5.2959 5.3400 5.3777 5.4181 7.3372 7.3575 7.3719 7.4022 7.9608 7.9837 8.1239 8.1655 8.6932 8.7046 8.7116 8.7233 k = 0.0000 1.0632 0.2986 ( 14012 PWs) bands (ev): -5.7722 -5.7721 -5.7104 -5.7102 -4.4965 -4.4946 -4.4891 -4.4871 -4.1849 -4.1825 -4.1823 -4.1799 -3.4952 -3.4951 -3.3500 -3.3499 -1.6854 -1.6846 -1.6785 -1.6776 1.3972 1.4083 1.4472 1.4499 1.9291 1.9899 2.0837 2.1356 2.3574 2.3717 2.3919 2.4017 2.7503 2.7972 2.8344 2.8654 3.0626 3.1965 3.2258 3.3281 3.5215 3.5216 3.6538 3.6878 4.1901 4.2055 4.2506 4.3434 4.3694 4.4779 4.4930 4.5382 4.7181 4.7455 4.8123 4.8626 4.9357 4.9992 5.0163 5.0595 5.3084 5.3407 5.3740 5.4053 7.3327 7.3525 7.3621 7.3911 7.9637 7.9911 8.0861 8.1274 8.7057 8.7119 8.7141 8.7255 k = 0.0000 1.0632 0.3235 ( 14014 PWs) bands (ev): -5.7625 -5.7623 -5.7209 -5.7208 -4.4941 -4.4921 -4.4891 -4.4871 -4.1863 -4.1846 -4.1835 -4.1819 -3.4714 -3.4713 -3.3737 -3.3736 -1.6830 -1.6821 -1.6783 -1.6774 1.4047 1.4140 1.4393 1.4395 1.9617 2.0254 2.0690 2.1284 2.3478 2.3568 2.3666 2.3729 2.7661 2.7984 2.8520 2.8725 3.0742 3.1626 3.2363 3.3041 3.5238 3.5361 3.6216 3.6544 4.2214 4.2423 4.2655 4.3427 4.3776 4.4589 4.5141 4.5446 4.7416 4.7464 4.7883 4.8497 4.9466 5.0040 5.0196 5.0619 5.3223 5.3429 5.3686 5.3899 7.3317 7.3517 7.3533 7.3804 7.9710 8.0024 8.0524 8.0929 8.7121 8.7162 8.7168 8.7260 k = 0.0000 1.0632 0.3484 ( 14022 PWs) bands (ev): -5.7524 -5.7522 -5.7315 -5.7313 -4.4922 -4.4901 -4.4896 -4.4875 -4.1869 -4.1861 -4.1841 -4.1833 -3.4471 -3.4470 -3.3980 -3.3979 -1.6810 -1.6801 -1.6786 -1.6777 1.4126 1.4197 1.4299 1.4322 1.9936 2.0488 2.0595 2.1134 2.3420 2.3466 2.3501 2.3542 2.7798 2.7964 2.8652 2.8755 3.0891 3.1330 3.2486 3.2823 3.5375 3.5588 3.5896 3.6202 4.2458 4.2701 4.2761 4.3288 4.3924 4.4367 4.5328 4.5483 4.7423 4.7668 4.7745 4.8280 4.9619 4.9916 5.0374 5.0591 5.3380 5.3476 5.3617 5.3729 7.3339 7.3455 7.3549 7.3703 7.9832 8.0178 8.0238 8.0629 8.7153 8.7172 8.7205 8.7251 k = 0.0000 1.0632 0.3733 ( 14020 PWs) bands (ev): -5.7421 -5.7421 -5.7419 -5.7419 -4.4907 -4.4907 -4.4886 -4.4886 -4.1869 -4.1869 -4.1840 -4.1840 -3.4225 -3.4225 -3.4224 -3.4224 -1.6795 -1.6795 -1.6786 -1.6786 1.4209 1.4209 1.4258 1.4258 2.0232 2.0232 2.0897 2.0897 2.3423 2.3423 2.3454 2.3454 2.7902 2.7902 2.8732 2.8732 3.1085 3.1085 3.2637 3.2637 3.5605 3.5605 3.5876 3.5876 4.2627 4.2627 4.3056 4.3056 4.4134 4.4134 4.5449 4.5449 4.7506 4.7506 4.8021 4.8021 4.9776 4.9776 5.0509 5.0509 5.3542 5.3542 5.3552 5.3552 7.3387 7.3387 7.3614 7.3614 8.0007 8.0007 8.0379 8.0379 8.7169 8.7169 8.7232 8.7232 k = 0.0000 1.0632 0.3733 ( 14020 PWs) bands (ev): -5.7421 -5.7421 -5.7419 -5.7419 -4.4907 -4.4907 -4.4886 -4.4886 -4.1869 -4.1869 -4.1840 -4.1840 -3.4225 -3.4225 -3.4224 -3.4224 -1.6795 -1.6795 -1.6786 -1.6786 1.4209 1.4209 1.4258 1.4258 2.0232 2.0232 2.0897 2.0897 2.3423 2.3423 2.3454 2.3454 2.7902 2.7902 2.8732 2.8732 3.1085 3.1085 3.2637 3.2637 3.5605 3.5605 3.5876 3.5876 4.2627 4.2627 4.3056 4.3056 4.4134 4.4134 4.5449 4.5449 4.7506 4.7506 4.8021 4.8021 4.9776 4.9776 5.0509 5.0509 5.3542 5.3542 5.3552 5.3552 7.3387 7.3387 7.3614 7.3614 8.0007 8.0007 8.0379 8.0379 8.7169 8.7169 8.7232 8.7232 k = 0.0241 1.0632 0.3733 ( 14028 PWs) bands (ev): -5.7421 -5.7421 -5.7419 -5.7419 -4.4910 -4.4910 -4.4889 -4.4889 -4.1867 -4.1867 -4.1839 -4.1839 -3.4226 -3.4226 -3.4224 -3.4224 -1.6795 -1.6795 -1.6785 -1.6785 1.4216 1.4216 1.4272 1.4272 2.0214 2.0214 2.0878 2.0878 2.3388 2.3388 2.3506 2.3506 2.7908 2.7908 2.8736 2.8736 3.1097 3.1097 3.2650 3.2650 3.5576 3.5576 3.5923 3.5923 4.2570 4.2570 4.3006 4.3006 4.4164 4.4164 4.5442 4.5442 4.7479 4.7479 4.8054 4.8054 4.9778 4.9778 5.0529 5.0529 5.3513 5.3513 5.3575 5.3575 7.3385 7.3385 7.3618 7.3618 8.0008 8.0008 8.0384 8.0384 8.7167 8.7167 8.7231 8.7231 k = 0.0483 1.0632 0.3733 ( 14018 PWs) bands (ev): -5.7422 -5.7422 -5.7419 -5.7419 -4.4921 -4.4921 -4.4899 -4.4899 -4.1863 -4.1863 -4.1835 -4.1835 -3.4227 -3.4227 -3.4225 -3.4225 -1.6793 -1.6793 -1.6780 -1.6780 1.4237 1.4237 1.4310 1.4310 2.0165 2.0165 2.0821 2.0821 2.3361 2.3361 2.3583 2.3583 2.7924 2.7924 2.8751 2.8751 3.1132 3.1132 3.2686 3.2686 3.5526 3.5526 3.6030 3.6030 4.2402 4.2402 4.2876 4.2876 4.4234 4.4234 4.5420 4.5420 4.7423 4.7423 4.8127 4.8127 4.9783 4.9783 5.0586 5.0586 5.3475 5.3475 5.3598 5.3598 7.3380 7.3380 7.3627 7.3627 8.0009 8.0009 8.0398 8.0398 8.7159 8.7159 8.7226 8.7226 k = 0.0724 1.0632 0.3733 ( 14018 PWs) bands (ev): -5.7423 -5.7423 -5.7419 -5.7419 -4.4938 -4.4938 -4.4917 -4.4917 -4.1855 -4.1855 -4.1827 -4.1827 -3.4228 -3.4228 -3.4226 -3.4226 -1.6790 -1.6790 -1.6773 -1.6773 1.4274 1.4274 1.4370 1.4370 2.0089 2.0089 2.0734 2.0734 2.3353 2.3353 2.3664 2.3664 2.7949 2.7949 2.8782 2.8782 3.1183 3.1183 3.2739 3.2739 3.5490 3.5490 3.6164 3.6164 4.2135 4.2135 4.2692 4.2692 4.4315 4.4315 4.5388 4.5388 4.7377 4.7377 4.8204 4.8204 4.9796 4.9796 5.0669 5.0669 5.3433 5.3433 5.3617 5.3617 7.3373 7.3373 7.3640 7.3640 8.0013 8.0013 8.0419 8.0419 8.7148 8.7148 8.7218 8.7218 k = 0.0966 1.0632 0.3733 ( 14020 PWs) bands (ev): -5.7425 -5.7425 -5.7420 -5.7420 -4.4962 -4.4962 -4.4940 -4.4940 -4.1845 -4.1845 -4.1817 -4.1817 -3.4230 -3.4230 -3.4227 -3.4227 -1.6784 -1.6784 -1.6764 -1.6764 1.4326 1.4326 1.4447 1.4447 1.9995 1.9995 2.0626 2.0626 2.3361 2.3361 2.3744 2.3744 2.7977 2.7977 2.8833 2.8833 3.1242 3.1242 3.2801 3.2801 3.5484 3.5484 3.6315 3.6315 4.1795 4.1795 4.2465 4.2465 4.4387 4.4387 4.5353 4.5353 4.7358 4.7358 4.8264 4.8264 4.9816 4.9816 5.0765 5.0765 5.3390 5.3390 5.3634 5.3634 7.3367 7.3367 7.3656 7.3656 8.0019 8.0019 8.0445 8.0445 8.7134 8.7134 8.7206 8.7206 k = 0.1207 1.0632 0.3733 ( 14018 PWs) bands (ev): -5.7428 -5.7428 -5.7422 -5.7422 -4.4993 -4.4993 -4.4971 -4.4971 -4.1831 -4.1831 -4.1804 -4.1804 -3.4232 -3.4232 -3.4229 -3.4229 -1.6777 -1.6777 -1.6753 -1.6753 1.4389 1.4389 1.4536 1.4536 1.9892 1.9892 2.0509 2.0509 2.3378 2.3378 2.3818 2.3818 2.8006 2.8006 2.8909 2.8909 3.1298 3.1298 3.2864 3.2864 3.5513 3.5513 3.6477 3.6477 4.1406 4.1406 4.2201 4.2201 4.4442 4.4442 4.5324 4.5324 4.7367 4.7367 4.8302 4.8302 4.9841 4.9841 5.0862 5.0862 5.3348 5.3348 5.3650 5.3650 7.3364 7.3364 7.3675 7.3675 8.0028 8.0028 8.0473 8.0473 8.7119 8.7119 8.7190 8.7190 k = 0.1449 1.0632 0.3733 ( 14006 PWs) bands (ev): -5.7431 -5.7431 -5.7424 -5.7424 -4.5031 -4.5031 -4.5008 -4.5008 -4.1814 -4.1814 -4.1788 -4.1788 -3.4235 -3.4235 -3.4231 -3.4231 -1.6768 -1.6768 -1.6739 -1.6739 1.4462 1.4462 1.4634 1.4634 1.9790 1.9790 2.0393 2.0393 2.3402 2.3402 2.3883 2.3883 2.8035 2.8035 2.9006 2.9006 3.1341 3.1341 3.2918 3.2918 3.5578 3.5578 3.6649 3.6649 4.0991 4.0991 4.1913 4.1913 4.4481 4.4481 4.5312 4.5312 4.7399 4.7399 4.8315 4.8315 4.9863 4.9863 5.0951 5.0951 5.3310 5.3310 5.3667 5.3667 7.3364 7.3364 7.3694 7.3694 8.0039 8.0039 8.0501 8.0501 8.7103 8.7103 8.7170 8.7170 k = 0.1690 1.0632 0.3733 ( 14006 PWs) bands (ev): -5.7435 -5.7435 -5.7426 -5.7426 -4.5074 -4.5074 -4.5051 -4.5051 -4.1794 -4.1794 -4.1768 -4.1768 -3.4238 -3.4238 -3.4233 -3.4233 -1.6756 -1.6756 -1.6723 -1.6723 1.4537 1.4537 1.4734 1.4734 1.9697 1.9697 2.0289 2.0289 2.3429 2.3429 2.3939 2.3939 2.8063 2.8063 2.9118 2.9118 3.1364 3.1364 3.2959 3.2959 3.5672 3.5672 3.6826 3.6826 4.0570 4.0570 4.1617 4.1617 4.4510 4.4510 4.5321 4.5321 4.7443 4.7443 4.8306 4.8306 4.9879 4.9879 5.1027 5.1027 5.3280 5.3280 5.3687 5.3687 7.3368 7.3368 7.3713 7.3713 8.0053 8.0053 8.0529 8.0529 8.7085 8.7085 8.7148 8.7148 k = 0.1932 1.0632 0.3733 ( 13992 PWs) bands (ev): -5.7440 -5.7440 -5.7430 -5.7430 -4.5124 -4.5124 -4.5100 -4.5100 -4.1771 -4.1771 -4.1745 -4.1745 -3.4241 -3.4241 -3.4237 -3.4237 -1.6743 -1.6743 -1.6705 -1.6705 1.4612 1.4612 1.4830 1.4830 1.9622 1.9622 2.0206 2.0206 2.3456 2.3456 2.3988 2.3988 2.8093 2.8093 2.9230 2.9230 3.1365 3.1365 3.2984 3.2984 3.5782 3.5782 3.6999 3.6999 4.0168 4.0168 4.1336 4.1336 4.4535 4.4535 4.5350 4.5350 4.7490 4.7490 4.8279 4.8279 4.9883 4.9883 5.1084 5.1084 5.3260 5.3260 5.3710 5.3710 7.3375 7.3375 7.3731 7.3731 8.0069 8.0069 8.0554 8.0554 8.7066 8.7066 8.7122 8.7122 k = 0.2173 1.0632 0.3733 ( 13990 PWs) bands (ev): -5.7446 -5.7446 -5.7435 -5.7435 -4.5179 -4.5179 -4.5154 -4.5154 -4.1744 -4.1744 -4.1719 -4.1719 -3.4245 -3.4245 -3.4240 -3.4240 -1.6727 -1.6727 -1.6685 -1.6685 1.4680 1.4680 1.4917 1.4917 1.9572 1.9572 2.0150 2.0150 2.3483 2.3483 2.4030 2.4030 2.8125 2.8125 2.9326 2.9326 3.1349 3.1349 3.2989 3.2989 3.5890 3.5890 3.7152 3.7152 3.9815 3.9815 4.1094 4.1094 4.4563 4.4563 4.5393 4.5393 4.7530 4.7530 4.8239 4.8239 4.9874 4.9874 5.1122 5.1122 5.3251 5.3251 5.3737 5.3737 7.3384 7.3384 7.3748 7.3748 8.0086 8.0086 8.0577 8.0577 8.7045 8.7045 8.7095 8.7095 k = 0.2415 1.0632 0.3733 ( 13978 PWs) bands (ev): -5.7453 -5.7453 -5.7441 -5.7441 -4.5239 -4.5239 -4.5214 -4.5214 -4.1714 -4.1714 -4.1690 -4.1690 -3.4249 -3.4249 -3.4244 -3.4244 -1.6709 -1.6709 -1.6662 -1.6662 1.4739 1.4739 1.4989 1.4989 1.9550 1.9550 2.0125 2.0125 2.3511 2.3511 2.4068 2.4068 2.8160 2.8160 2.9387 2.9387 3.1325 3.1325 3.2972 3.2972 3.5977 3.5977 3.7259 3.7259 3.9551 3.9551 4.0913 4.0913 4.4600 4.4600 4.5448 4.5448 4.7552 4.7552 4.8191 4.8191 4.9850 4.9850 5.1143 5.1143 5.3253 5.3253 5.3767 5.3767 7.3395 7.3395 7.3763 7.3763 8.0104 8.0104 8.0597 8.0597 8.7023 8.7023 8.7065 8.7065 k = 0.2656 1.0632 0.3733 ( 13990 PWs) bands (ev): -5.7461 -5.7461 -5.7448 -5.7448 -4.5304 -4.5304 -4.5278 -4.5278 -4.1681 -4.1681 -4.1658 -4.1658 -3.4254 -3.4254 -3.4249 -3.4249 -1.6688 -1.6688 -1.6637 -1.6637 1.4783 1.4783 1.5042 1.5042 1.9560 1.9560 2.0135 2.0135 2.3539 2.3539 2.4104 2.4104 2.8195 2.8195 2.9397 2.9397 3.1304 3.1304 3.2934 3.2934 3.6026 3.6026 3.7287 3.7287 3.9423 3.9423 4.0811 4.0811 4.4647 4.4647 4.5510 4.5510 4.7550 4.7550 4.8145 4.8145 4.9816 4.9816 5.1149 5.1149 5.3266 5.3266 5.3799 5.3799 7.3406 7.3406 7.3773 7.3773 8.0123 8.0123 8.0615 8.0615 8.6999 8.6999 8.7035 8.7035 k = 0.2656 1.0632 0.3733 ( 13990 PWs) bands (ev): -5.7461 -5.7461 -5.7448 -5.7448 -4.5304 -4.5304 -4.5278 -4.5278 -4.1681 -4.1681 -4.1658 -4.1658 -3.4254 -3.4254 -3.4249 -3.4249 -1.6688 -1.6688 -1.6637 -1.6637 1.4783 1.4783 1.5042 1.5042 1.9560 1.9560 2.0135 2.0135 2.3539 2.3539 2.4104 2.4104 2.8195 2.8195 2.9397 2.9397 3.1304 3.1304 3.2934 3.2934 3.6026 3.6026 3.7287 3.7287 3.9423 3.9423 4.0811 4.0811 4.4647 4.4647 4.5510 4.5510 4.7550 4.7550 4.8145 4.8145 4.9816 4.9816 5.1149 5.1149 5.3266 5.3266 5.3799 5.3799 7.3406 7.3406 7.3773 7.3773 8.0123 8.0123 8.0615 8.0615 8.6999 8.6999 8.7035 8.7035 k = 0.2593 1.0379 0.3733 ( 13978 PWs) bands (ev): -5.7430 -5.7430 -5.7422 -5.7422 -4.5054 -4.5054 -4.5031 -4.5031 -4.1810 -4.1810 -4.1784 -4.1784 -3.4236 -3.4236 -3.4232 -3.4232 -1.6763 -1.6763 -1.6732 -1.6732 1.4642 1.4642 1.4876 1.4876 1.9436 1.9436 2.0005 2.0005 2.3434 2.3434 2.3971 2.3971 2.8046 2.8046 2.9462 2.9462 3.1389 3.1389 3.3133 3.3133 3.5946 3.5946 3.7388 3.7388 3.9675 3.9675 4.1071 4.1071 4.4394 4.4394 4.5222 4.5222 4.7614 4.7614 4.8350 4.8350 5.0013 5.0013 5.1161 5.1161 5.3210 5.3210 5.3664 5.3664 7.3363 7.3363 7.3737 7.3737 8.0047 8.0047 8.0550 8.0550 8.7083 8.7083 8.7154 8.7154 k = 0.2530 1.0126 0.3733 ( 13970 PWs) bands (ev): -5.7419 -5.7419 -5.7415 -5.7415 -4.4921 -4.4921 -4.4900 -4.4900 -4.1871 -4.1871 -4.1843 -4.1843 -3.4228 -3.4228 -3.4223 -3.4223 -1.6794 -1.6794 -1.6781 -1.6781 1.4554 1.4554 1.4766 1.4766 1.9286 1.9286 1.9846 1.9846 2.3375 2.3375 2.3883 2.3883 2.7918 2.7918 2.9494 2.9494 3.1478 3.1478 3.3287 3.3287 3.5966 3.5966 3.7546 3.7546 3.9952 3.9952 4.1314 4.1314 4.4130 4.4130 4.4947 4.4947 4.7666 4.7666 4.8567 4.8567 5.0231 5.0231 5.1188 5.1188 5.3205 5.3205 5.3557 5.3557 7.3331 7.3331 7.3709 7.3709 7.9989 7.9989 8.0502 8.0502 8.7107 8.7107 8.7222 8.7222 k = 0.2466 0.9873 0.3733 ( 13970 PWs) bands (ev): -5.7429 -5.7429 -5.7426 -5.7426 -4.4923 -4.4923 -4.4902 -4.4902 -4.1847 -4.1847 -4.1818 -4.1818 -3.4228 -3.4228 -3.4224 -3.4224 -1.6790 -1.6790 -1.6775 -1.6775 1.4520 1.4520 1.4714 1.4714 1.9111 1.9111 1.9658 1.9658 2.3363 2.3363 2.3842 2.3842 2.7817 2.7817 2.9490 2.9490 3.1566 3.1566 3.3382 3.3382 3.6100 3.6100 3.7770 3.7770 4.0216 4.0216 4.1525 4.1525 4.3881 4.3881 4.4729 4.4729 4.7706 4.7706 4.8779 4.8779 5.0435 5.0435 5.1238 5.1238 5.3257 5.3257 5.3482 5.3482 7.3310 7.3310 7.3693 7.3693 7.9947 7.9947 8.0467 8.0467 8.7060 8.7060 8.7217 8.7217 k = 0.2403 0.9619 0.3733 ( 13978 PWs) bands (ev): -5.7463 -5.7463 -5.7454 -5.7454 -4.5054 -4.5054 -4.5032 -4.5032 -4.1741 -4.1741 -4.1714 -4.1714 -3.4238 -3.4238 -3.4234 -3.4234 -1.6749 -1.6749 -1.6715 -1.6715 1.4538 1.4538 1.4722 1.4722 1.8915 1.8915 1.9442 1.9442 2.3395 2.3395 2.3846 2.3846 2.7746 2.7746 2.9452 2.9452 3.1650 3.1650 3.3424 3.3424 3.6341 3.6341 3.8051 3.8051 4.0432 4.0432 4.1696 4.1696 4.3667 4.3667 4.4610 4.4610 4.7740 4.7740 4.8980 4.8980 5.0587 5.0587 5.1319 5.1319 5.3360 5.3360 5.3457 5.3457 7.3301 7.3301 7.3689 7.3689 7.9921 7.9921 8.0442 8.0442 8.6931 8.6931 8.7123 8.7123 k = 0.2340 0.9366 0.3733 ( 14006 PWs) bands (ev): -5.7516 -5.7516 -5.7503 -5.7503 -4.5288 -4.5288 -4.5264 -4.5264 -4.1580 -4.1580 -4.1555 -4.1555 -3.4259 -3.4259 -3.4254 -3.4254 -1.6664 -1.6664 -1.6610 -1.6610 1.4606 1.4606 1.4791 1.4791 1.8709 1.8709 1.9205 1.9205 2.3467 2.3467 2.3886 2.3886 2.7705 2.7705 2.9384 2.9384 3.1738 3.1738 3.3433 3.3433 3.6659 3.6659 3.8369 3.8369 4.0576 4.0576 4.1829 4.1829 4.3519 4.3519 4.4612 4.4612 4.7773 4.7773 4.9169 4.9169 5.0669 5.0669 5.1422 5.1422 5.3434 5.3434 5.3570 5.3570 7.3306 7.3306 7.3697 7.3697 7.9909 7.9909 8.0426 8.0426 8.6717 8.6717 8.6934 8.6934 k = 0.2277 0.9113 0.3733 ( 14004 PWs) bands (ev): -5.7590 -5.7590 -5.7571 -5.7571 -4.5595 -4.5595 -4.5570 -4.5570 -4.1393 -4.1393 -4.1369 -4.1369 -3.4289 -3.4289 -3.4284 -3.4284 -1.6534 -1.6534 -1.6459 -1.6459 1.4719 1.4719 1.4922 1.4922 1.8502 1.8502 1.8955 1.8955 2.3567 2.3567 2.3955 2.3955 2.7697 2.7697 2.9290 2.9290 3.1837 3.1837 3.3435 3.3435 3.7010 3.7010 3.8688 3.8688 4.0668 4.0668 4.1905 4.1905 4.3495 4.3495 4.4721 4.4721 4.7810 4.7810 4.9348 4.9348 5.0695 5.0695 5.1518 5.1518 5.3509 5.3509 5.3795 5.3795 7.3323 7.3323 7.3717 7.3717 7.9911 7.9911 8.0416 8.0416 8.6428 8.6428 8.6664 8.6664 k = 0.2213 0.8860 0.3733 ( 14018 PWs) bands (ev): -5.7683 -5.7683 -5.7660 -5.7660 -4.5952 -4.5952 -4.5924 -4.5924 -4.1201 -4.1201 -4.1180 -4.1180 -3.4330 -3.4330 -3.4325 -3.4325 -1.6360 -1.6360 -1.6265 -1.6265 1.4871 1.4871 1.5115 1.5115 1.8307 1.8307 1.8702 1.8702 2.3686 2.3686 2.4041 2.4041 2.7721 2.7721 2.9178 2.9178 3.1955 3.1955 3.3450 3.3450 3.7341 3.7341 3.8964 3.8964 4.0772 4.0772 4.1916 4.1916 4.3636 4.3636 4.4907 4.4907 4.7855 4.7855 4.9523 4.9523 5.0688 5.0688 5.1580 5.1580 5.3639 5.3639 5.4069 5.4069 7.3352 7.3352 7.3747 7.3747 7.9928 7.9928 8.0412 8.0412 8.6083 8.6083 8.6333 8.6333 k = 0.2150 0.8607 0.3733 ( 14024 PWs) bands (ev): -5.7796 -5.7796 -5.7769 -5.7769 -4.6341 -4.6341 -4.6311 -4.6311 -4.1020 -4.1020 -4.1002 -4.1002 -3.4382 -3.4382 -3.4376 -3.4376 -1.6145 -1.6145 -1.6029 -1.6029 1.5053 1.5053 1.5365 1.5365 1.8139 1.8139 1.8454 1.8454 2.3810 2.3810 2.4134 2.4134 2.7776 2.7776 2.9058 2.9058 3.2098 3.2098 3.3495 3.3495 3.7596 3.7596 3.9172 3.9172 4.0943 4.0943 4.1914 4.1914 4.3918 4.3918 4.5143 4.5143 4.7909 4.7909 4.9698 4.9698 5.0669 5.0669 5.1602 5.1602 5.3820 5.3820 5.4376 5.4376 7.3389 7.3389 7.3786 7.3786 7.9961 7.9961 8.0415 8.0415 8.5701 8.5701 8.5965 8.5965 k = 0.2087 0.8354 0.3733 ( 14020 PWs) bands (ev): -5.7929 -5.7929 -5.7897 -5.7897 -4.6750 -4.6750 -4.6718 -4.6718 -4.0860 -4.0860 -4.0845 -4.0845 -3.4444 -3.4444 -3.4438 -3.4438 -1.5890 -1.5890 -1.5754 -1.5754 1.5254 1.5254 1.5668 1.5668 1.8014 1.8014 1.8224 1.8224 2.3924 2.3924 2.4226 2.4226 2.7863 2.7863 2.8938 2.8938 3.2268 3.2268 3.3580 3.3580 3.7729 3.7729 3.9316 3.9316 4.1180 4.1180 4.1988 4.1988 4.4291 4.4291 4.5419 4.5419 4.7970 4.7970 4.9876 4.9876 5.0657 5.0657 5.1593 5.1593 5.4039 5.4039 5.4702 5.4702 7.3432 7.3432 7.3829 7.3829 8.0011 8.0011 8.0426 8.0426 8.5297 8.5297 8.5578 8.5578 k = 0.2024 0.8101 0.3733 ( 14030 PWs) bands (ev): -5.8080 -5.8080 -5.8044 -5.8044 -4.7170 -4.7170 -4.7136 -4.7136 -4.0727 -4.0727 -4.0713 -4.0713 -3.4517 -3.4517 -3.4509 -3.4509 -1.5599 -1.5599 -1.5443 -1.5443 1.5456 1.5456 1.6014 1.6014 1.7944 1.7944 1.8034 1.8034 2.4014 2.4014 2.4306 2.4306 2.7979 2.7979 2.8829 2.8829 3.2470 3.2470 3.3712 3.3712 3.7741 3.7741 3.9403 3.9403 4.1446 4.1446 4.2194 4.2194 4.4714 4.4714 4.5737 4.5737 4.8039 4.8039 5.0051 5.0051 5.0670 5.0670 5.1568 5.1568 5.4279 5.4279 5.5039 5.5039 7.3477 7.3477 7.3872 7.3872 8.0079 8.0079 8.0446 8.0446 8.4886 8.4886 8.5187 8.5187 k = 0.1960 0.7847 0.3733 ( 14038 PWs) bands (ev): -5.8249 -5.8249 -5.8210 -5.8210 -4.7596 -4.7596 -4.7560 -4.7560 -4.0622 -4.0622 -4.0611 -4.0611 -3.4600 -3.4600 -3.4592 -3.4592 -1.5275 -1.5275 -1.5100 -1.5100 1.5639 1.5639 1.6384 1.6384 1.7843 1.7843 1.8012 1.8012 2.4072 2.4072 2.4369 2.4369 2.8120 2.8120 2.8737 2.8737 3.2705 3.2705 3.3896 3.3896 3.7677 3.7677 3.9432 3.9432 4.1733 4.1733 4.2509 4.2509 4.5154 4.5154 4.6108 4.6108 4.8113 4.8113 5.0208 5.0208 5.0735 5.0735 5.1544 5.1544 5.4528 5.4528 5.5376 5.5376 7.3519 7.3519 7.3913 7.3913 8.0163 8.0163 8.0476 8.0476 8.4478 8.4478 8.4805 8.4805 k = 0.1897 0.7594 0.3733 ( 14028 PWs) bands (ev): -5.8434 -5.8434 -5.8392 -5.8392 -4.8023 -4.8023 -4.7985 -4.7985 -4.0548 -4.0548 -4.0538 -4.0538 -3.4693 -3.4693 -3.4684 -3.4684 -1.4923 -1.4923 -1.4730 -1.4730 1.5787 1.5787 1.6737 1.6737 1.7777 1.7777 1.8152 1.8152 2.4093 2.4093 2.4406 2.4406 2.8277 2.8277 2.8667 2.8667 3.2980 3.2980 3.4132 3.4132 3.7587 3.7587 3.9418 3.9418 4.2039 4.2039 4.2876 4.2876 4.5590 4.5590 4.6544 4.6544 4.8196 4.8196 5.0330 5.0330 5.0869 5.0869 5.1543 5.1543 5.4778 5.4778 5.5707 5.5707 7.3554 7.3554 7.3947 7.3947 8.0261 8.0261 8.0517 8.0517 8.4082 8.4082 8.4443 8.4443 k = 0.1834 0.7341 0.3733 ( 14034 PWs) bands (ev): -5.8635 -5.8635 -5.8591 -5.8591 -4.8446 -4.8446 -4.8407 -4.8407 -4.0503 -4.0503 -4.0495 -4.0495 -3.4796 -3.4796 -3.4785 -3.4785 -1.4548 -1.4548 -1.4337 -1.4337 1.5897 1.5897 1.6976 1.6976 1.7885 1.7885 1.8412 1.8412 2.4079 2.4079 2.4415 2.4415 2.8438 2.8438 2.8623 2.8623 3.3296 3.3296 3.4417 3.4417 3.7511 3.7511 3.9390 3.9390 4.2342 4.2342 4.3248 4.3248 4.6016 4.6016 4.7034 4.7034 4.8300 4.8300 5.0428 5.0428 5.1049 5.1049 5.1593 5.1593 5.5021 5.5021 5.6027 5.6027 7.3579 7.3579 7.3971 7.3971 8.0363 8.0363 8.0566 8.0566 8.3711 8.3711 8.4116 8.4116 k = 0.1771 0.7088 0.3733 ( 14026 PWs) bands (ev): -5.8851 -5.8851 -5.8805 -5.8805 -4.8864 -4.8864 -4.8823 -4.8823 -4.0487 -4.0487 -4.0480 -4.0480 -3.4907 -3.4907 -3.4896 -3.4896 -1.4155 -1.4155 -1.3927 -1.3927 1.5984 1.5984 1.7056 1.7056 1.8207 1.8207 1.8776 1.8776 2.4033 2.4033 2.4403 2.4403 2.8547 2.8547 2.8645 2.8645 3.3658 3.3658 3.4748 3.4748 3.7477 3.7477 3.9374 3.9374 4.2623 4.2623 4.3596 4.3596 4.6436 4.6436 4.7528 4.7528 4.8462 4.8462 5.0521 5.0521 5.1235 5.1235 5.1735 5.1735 5.5253 5.5253 5.6332 5.6332 7.3589 7.3589 7.3982 7.3982 8.0456 8.0456 8.0615 8.0615 8.3379 8.3379 8.3835 8.3835 k = 0.1707 0.6835 0.3733 ( 14030 PWs) bands (ev): -5.9079 -5.9079 -5.9031 -5.9031 -4.9273 -4.9273 -4.9231 -4.9231 -4.0498 -4.0498 -4.0491 -4.0491 -3.5027 -3.5027 -3.5015 -3.5015 -1.3751 -1.3751 -1.3507 -1.3507 1.6069 1.6069 1.7074 1.7074 1.8632 1.8632 1.9224 1.9224 2.3960 2.3960 2.4384 2.4384 2.8548 2.8548 2.8775 2.8775 3.4064 3.4064 3.5118 3.5118 3.7505 3.7505 3.9388 3.9388 4.2874 4.2874 4.3904 4.3904 4.6847 4.6847 4.7945 4.7945 4.8749 4.8749 5.0618 5.0618 5.1428 5.1428 5.1975 5.1975 5.5471 5.5471 5.6620 5.6620 7.3583 7.3583 7.3980 7.3980 8.0523 8.0523 8.0651 8.0651 8.3107 8.3107 8.3617 8.3617 k = 0.1644 0.6582 0.3733 ( 14032 PWs) bands (ev): -5.9319 -5.9319 -5.9270 -5.9270 -4.9673 -4.9673 -4.9630 -4.9630 -4.0533 -4.0533 -4.0526 -4.0526 -3.5155 -3.5155 -3.5141 -3.5141 -1.3340 -1.3340 -1.3082 -1.3082 1.6170 1.6170 1.7099 1.7099 1.9072 1.9072 1.9728 1.9728 2.3870 2.3870 2.4380 2.4380 2.8538 2.8538 2.8902 2.8902 3.4514 3.4514 3.5518 3.5518 3.7611 3.7611 3.9444 3.9444 4.3093 4.3093 4.4165 4.4165 4.7226 4.7226 4.8265 4.8265 4.9177 4.9177 5.0721 5.0721 5.1674 5.1674 5.2285 5.2285 5.5673 5.5673 5.6889 5.6889 7.3560 7.3560 7.3963 7.3963 8.0544 8.0544 8.0652 8.0652 8.2920 8.2920 8.3479 8.3479 k = 0.1581 0.6329 0.3733 ( 14056 PWs) bands (ev): -5.9568 -5.9568 -5.9518 -5.9518 -5.0061 -5.0061 -5.0017 -5.0017 -4.0589 -4.0589 -4.0582 -4.0582 -3.5289 -3.5289 -3.5275 -3.5275 -1.2929 -1.2929 -1.2660 -1.2660 1.6303 1.6303 1.7157 1.7157 1.9480 1.9480 2.0257 2.0257 2.3782 2.3782 2.4419 2.4419 2.8529 2.8529 2.9007 2.9007 3.5000 3.5000 3.5937 3.5937 3.7805 3.7805 3.9548 3.9548 4.3285 4.3285 4.4382 4.4382 4.7535 4.7535 4.8583 4.8583 4.9641 4.9641 5.0843 5.0843 5.2013 5.2013 5.2637 5.2637 5.5860 5.5860 5.7139 5.7139 7.3519 7.3519 7.3930 7.3930 8.0503 8.0503 8.0599 8.0599 8.2837 8.2837 8.3432 8.3432 k = 0.1518 0.6075 0.3733 ( 14064 PWs) bands (ev): -5.9825 -5.9825 -5.9775 -5.9775 -5.0437 -5.0437 -5.0392 -5.0392 -4.0665 -4.0665 -4.0657 -4.0657 -3.5429 -3.5429 -3.5414 -3.5414 -1.2525 -1.2525 -1.2245 -1.2245 1.6477 1.6477 1.7259 1.7259 1.9826 1.9826 2.0762 2.0762 2.3733 2.3733 2.4526 2.4526 2.8522 2.8522 2.9091 2.9091 3.5514 3.5514 3.6363 3.6363 3.8091 3.8091 3.9703 3.9703 4.3455 4.3455 4.4569 4.4569 4.7763 4.7763 4.8956 4.8956 5.0045 5.0045 5.1017 5.1017 5.2450 5.2450 5.3020 5.3020 5.6031 5.6031 5.7370 5.7370 7.3461 7.3461 7.3880 7.3880 8.0391 8.0391 8.0499 8.0499 8.2859 8.2859 8.3475 8.3475 k = 0.1454 0.5822 0.3733 ( 14060 PWs) bands (ev): -6.0087 -6.0087 -6.0037 -6.0037 -5.0800 -5.0800 -5.0755 -5.0755 -4.0756 -4.0756 -4.0748 -4.0748 -3.5574 -3.5574 -3.5558 -3.5558 -1.2131 -1.2131 -1.1844 -1.1844 1.6697 1.6697 1.7407 1.7407 2.0087 2.0087 2.1170 2.1170 2.3788 2.3788 2.4719 2.4719 2.8520 2.8520 2.9164 2.9164 3.6045 3.6045 3.6790 3.6790 3.8461 3.8461 3.9909 3.9909 4.3613 4.3613 4.4741 4.4741 4.7939 4.7939 4.9366 4.9366 5.0338 5.0338 5.1276 5.1276 5.2966 5.2966 5.3433 5.3433 5.6190 5.6190 5.7584 5.7584 7.3385 7.3385 7.3814 7.3814 8.0218 8.0218 8.0366 8.0366 8.2969 8.2969 8.3596 8.3596 k = 0.1391 0.5569 0.3733 ( 14064 PWs) bands (ev): -6.0354 -6.0354 -6.0304 -6.0304 -5.1149 -5.1149 -5.1103 -5.1103 -4.0861 -4.0861 -4.0852 -4.0852 -3.5722 -3.5722 -3.5706 -3.5706 -1.1754 -1.1754 -1.1462 -1.1462 1.6965 1.6965 1.7601 1.7601 2.0252 2.0252 2.1408 2.1408 2.4012 2.4012 2.5004 2.5004 2.8531 2.8531 2.9241 2.9241 3.6578 3.6578 3.7217 3.7217 3.8895 3.8895 4.0164 4.0164 4.3770 4.3770 4.4920 4.4920 4.8092 4.8092 4.9784 4.9784 5.0534 5.0534 5.1608 5.1608 5.3519 5.3519 5.3885 5.3885 5.6343 5.6343 5.7784 5.7784 7.3291 7.3291 7.3730 7.3730 8.0011 8.0011 8.0211 8.0211 8.3141 8.3141 8.3774 8.3774 k = 0.1328 0.5316 0.3733 ( 14054 PWs) bands (ev): -6.0622 -6.0622 -6.0574 -6.0574 -5.1484 -5.1484 -5.1438 -5.1438 -4.0976 -4.0976 -4.0967 -4.0967 -3.5873 -3.5873 -3.5856 -3.5856 -1.1397 -1.1397 -1.1103 -1.1103 1.7279 1.7279 1.7838 1.7838 2.0326 2.0326 2.1458 2.1458 2.4414 2.4414 2.5365 2.5365 2.8568 2.8568 2.9342 2.9342 3.7099 3.7099 3.7647 3.7647 3.9362 3.9362 4.0464 4.0464 4.3939 4.3939 4.5128 4.5128 4.8239 4.8239 5.0188 5.0188 5.0684 5.0684 5.1972 5.1972 5.4039 5.4039 5.4401 5.4401 5.6500 5.6500 5.7973 5.7973 7.3178 7.3178 7.3627 7.3627 7.9792 7.9792 8.0044 8.0044 8.3355 8.3355 8.3989 8.3989 k = 0.1265 0.5063 0.3733 ( 14050 PWs) bands (ev): -6.0891 -6.0891 -6.0844 -6.0844 -5.1805 -5.1805 -5.1759 -5.1759 -4.1100 -4.1100 -4.1090 -4.1090 -3.6025 -3.6025 -3.6008 -3.6008 -1.1064 -1.1064 -1.0770 -1.0770 1.7633 1.7633 1.8111 1.8111 2.0329 2.0329 2.1378 2.1378 2.4923 2.4923 2.5771 2.5771 2.8653 2.8653 2.9493 2.9493 3.7598 3.7598 3.8078 3.8078 3.9825 3.9825 4.0805 4.0805 4.4139 4.4139 4.5390 4.5390 4.8386 4.8386 5.0558 5.0558 5.0837 5.0837 5.2334 5.2334 5.4486 5.4486 5.4981 5.4981 5.6679 5.6679 5.8156 5.8156 7.3047 7.3047 7.3504 7.3504 7.9576 7.9576 7.9873 7.9873 8.3597 8.3597 8.4226 8.4226 k = 0.1202 0.4810 0.3733 ( 14062 PWs) bands (ev): -6.1158 -6.1158 -6.1112 -6.1112 -5.2111 -5.2111 -5.2065 -5.2065 -4.1230 -4.1230 -4.1220 -4.1220 -3.6177 -3.6177 -3.6160 -3.6160 -1.0757 -1.0757 -1.0467 -1.0467 1.8008 1.8008 1.8411 1.8411 2.0290 2.0290 2.1236 2.1236 2.5455 2.5455 2.6184 2.6184 2.8815 2.8815 2.9722 2.9722 3.8067 3.8067 3.8503 3.8503 4.0251 4.0251 4.1178 4.1178 4.4391 4.4391 4.5721 4.5721 4.8537 4.8537 5.0831 5.0831 5.1072 5.1072 5.2676 5.2676 5.4864 5.4864 5.5570 5.5570 5.6907 5.6907 5.8339 5.8339 7.2896 7.2896 7.3360 7.3360 7.9366 7.9366 7.9703 7.9703 8.3855 8.3855 8.4476 8.4476 k = 0.1138 0.4557 0.3733 ( 14066 PWs) bands (ev): -6.1422 -6.1422 -6.1377 -6.1377 -5.2401 -5.2401 -5.2356 -5.2356 -4.1364 -4.1364 -4.1354 -4.1354 -3.6329 -3.6329 -3.6312 -3.6312 -1.0478 -1.0478 -1.0193 -1.0193 1.8364 1.8364 1.8729 1.8729 2.0242 2.0242 2.1088 2.1088 2.5944 2.5944 2.6569 2.6569 2.9093 2.9093 3.0051 3.0051 3.8495 3.8495 3.8919 3.8919 4.0616 4.0616 4.1577 4.1577 4.4714 4.4714 4.6132 4.6132 4.8694 4.8694 5.1002 5.1002 5.1401 5.1401 5.2986 5.2986 5.5168 5.5168 5.6128 5.6128 5.7213 5.7213 5.8528 5.8528 7.2724 7.2724 7.3194 7.3194 7.9165 7.9165 7.9535 7.9535 8.4124 8.4124 8.4733 8.4733 k = 0.1075 0.4303 0.3733 ( 14088 PWs) bands (ev): -6.1680 -6.1680 -6.1638 -6.1638 -5.2677 -5.2677 -5.2633 -5.2633 -4.1499 -4.1499 -4.1489 -4.1489 -3.6478 -3.6478 -3.6461 -3.6461 -1.0227 -1.0227 -0.9950 -0.9950 1.8631 1.8631 1.9052 1.9052 2.0227 2.0227 2.0989 2.0989 2.6355 2.6355 2.6906 2.6906 2.9514 2.9514 3.0489 3.0489 3.8856 3.8856 3.9337 3.9337 4.0912 4.0912 4.1993 4.1993 4.5115 4.5115 4.6616 4.6616 4.8861 4.8861 5.1158 5.1158 5.1744 5.1744 5.3256 5.3256 5.5392 5.5392 5.6636 5.6636 5.7614 5.7614 5.8727 5.8727 7.2531 7.2531 7.3005 7.3005 7.8966 7.8966 7.9367 7.9367 8.4398 8.4398 8.4992 8.4992 k = 0.1012 0.4050 0.3733 ( 14092 PWs) bands (ev): -6.1932 -6.1932 -6.1891 -6.1891 -5.2938 -5.2938 -5.2894 -5.2894 -4.1635 -4.1635 -4.1625 -4.1625 -3.6625 -3.6625 -3.6608 -3.6608 -1.0004 -1.0004 -0.9738 -0.9738 1.8761 1.8761 1.9298 1.9298 2.0313 2.0313 2.0999 2.0999 2.6692 2.6692 2.7201 2.7201 3.0073 3.0073 3.1027 3.1027 3.9132 3.9132 3.9766 3.9766 4.1150 4.1150 4.2421 4.2421 4.5588 4.5588 4.7149 4.7149 4.9049 4.9049 5.1319 5.1319 5.2080 5.2080 5.3487 5.3487 5.5545 5.5545 5.7100 5.7100 5.8088 5.8088 5.8938 5.8938 7.2318 7.2318 7.2793 7.2793 7.8764 7.8764 7.9193 7.9193 8.4675 8.4675 8.5255 8.5255 k = 0.0949 0.3797 0.3733 ( 14096 PWs) bands (ev): -6.2176 -6.2176 -6.2137 -6.2137 -5.3184 -5.3184 -5.3141 -5.3141 -4.1770 -4.1770 -4.1760 -4.1760 -3.6767 -3.6767 -3.6751 -3.6751 -0.9809 -0.9809 -0.9555 -0.9555 1.8762 1.8762 1.9352 1.9352 2.0564 2.0564 2.1144 2.1144 2.6987 2.6987 2.7481 2.7481 3.0739 3.0739 3.1643 3.1643 3.9326 3.9326 4.0187 4.0187 4.1358 4.1358 4.2861 4.2861 4.6113 4.6113 4.7686 4.7686 4.9278 4.9278 5.1487 5.1487 5.2405 5.2405 5.3683 5.3683 5.5647 5.5647 5.7539 5.7539 5.8594 5.8594 5.9165 5.9165 7.2084 7.2084 7.2559 7.2559 7.8550 7.8550 7.9006 7.9006 8.4950 8.4950 8.5522 8.5522 k = 0.0885 0.3544 0.3733 ( 14084 PWs) bands (ev): -6.2410 -6.2410 -6.2373 -6.2373 -5.3414 -5.3414 -5.3373 -5.3373 -4.1902 -4.1902 -4.1892 -4.1892 -3.6904 -3.6904 -3.6889 -3.6889 -0.9640 -0.9640 -0.9399 -0.9399 1.8676 1.8676 1.9246 1.9246 2.0920 2.0920 2.1385 2.1385 2.7280 2.7280 2.7776 2.7776 3.1472 3.1472 3.2313 3.2313 3.9457 3.9457 4.0556 4.0556 4.1583 4.1583 4.3305 4.3305 4.6663 4.6663 4.8167 4.8167 4.9583 4.9583 5.1653 5.1653 5.2719 5.2719 5.3863 5.3863 5.5723 5.5723 5.7965 5.7965 5.9092 5.9092 5.9415 5.9415 7.1830 7.1830 7.2303 7.2303 7.8316 7.8316 7.8799 7.8799 8.5220 8.5220 8.5792 8.5792 k = 0.0822 0.3291 0.3733 ( 14092 PWs) bands (ev): -6.2632 -6.2632 -6.2598 -6.2598 -5.3629 -5.3629 -5.3590 -5.3590 -4.2029 -4.2029 -4.2020 -4.2020 -3.7036 -3.7036 -3.7021 -3.7021 -0.9495 -0.9495 -0.9269 -0.9269 1.8542 1.8542 1.9066 1.9066 2.1287 2.1287 2.1663 2.1663 2.7607 2.7607 2.8111 2.8111 3.2244 3.2244 3.3014 3.3014 3.9542 3.9542 4.0827 4.0827 4.1877 4.1877 4.3747 4.3747 4.7212 4.7212 4.8542 4.8542 4.9983 4.9983 5.1800 5.1800 5.3018 5.3018 5.4058 5.4058 5.5795 5.5795 5.8379 5.8379 5.9499 5.9499 5.9753 5.9753 7.1557 7.1557 7.2026 7.2026 7.8055 7.8055 7.8564 7.8564 8.5479 8.5479 8.6062 8.6062 k = 0.0759 0.3038 0.3733 ( 14080 PWs) bands (ev): -6.2843 -6.2843 -6.2811 -6.2811 -5.3828 -5.3828 -5.3791 -5.3791 -4.2152 -4.2152 -4.2143 -4.2143 -3.7161 -3.7161 -3.7147 -3.7147 -0.9372 -0.9372 -0.9162 -0.9162 1.8387 1.8387 1.8860 1.8860 2.1616 2.1616 2.1936 2.1936 2.7991 2.7991 2.8499 2.8499 3.3033 3.3033 3.3730 3.3730 3.9600 3.9600 4.0996 4.0996 4.2245 4.2245 4.4177 4.4177 4.7724 4.7724 4.8829 4.8829 5.0439 5.0439 5.1905 5.1905 5.3297 5.3297 5.4303 5.4303 5.5886 5.5886 5.8777 5.8777 5.9773 5.9773 6.0214 6.0214 7.1267 7.1267 7.1730 7.1730 7.7765 7.7765 7.8297 7.8297 8.5717 8.5717 8.6321 8.6321 k = 0.0696 0.2785 0.3733 ( 14096 PWs) bands (ev): -6.3041 -6.3041 -6.3011 -6.3011 -5.4012 -5.4012 -5.3977 -5.3977 -4.2268 -4.2268 -4.2259 -4.2259 -3.7278 -3.7278 -3.7265 -3.7265 -0.9269 -0.9269 -0.9076 -0.9076 1.8224 1.8224 1.8647 1.8647 2.1887 2.1887 2.2174 2.2174 2.8438 2.8438 2.8945 2.8945 3.3826 3.3826 3.4448 3.4448 3.9643 3.9643 4.1104 4.1104 4.2642 4.2642 4.4587 4.4587 4.8151 4.8151 4.9097 4.9097 5.0874 5.0874 5.1957 5.1957 5.3560 5.3560 5.4615 5.4615 5.6023 5.6023 5.9151 5.9151 6.0014 6.0014 6.0704 6.0704 7.0960 7.0960 7.1415 7.1415 7.7446 7.7446 7.7996 7.7996 8.5917 8.5917 8.6547 8.6547 k = 0.0632 0.2531 0.3733 ( 14082 PWs) bands (ev): -6.3224 -6.3224 -6.3197 -6.3197 -5.4180 -5.4180 -5.4147 -5.4147 -4.2376 -4.2376 -4.2368 -4.2368 -3.7388 -3.7388 -3.7376 -3.7376 -0.9183 -0.9183 -0.9007 -0.9007 1.8062 1.8062 1.8437 1.8437 2.2102 2.2102 2.2366 2.2366 2.8941 2.8941 2.9444 2.9444 3.4613 3.4613 3.5157 3.5157 3.9685 3.9685 4.1190 4.1190 4.3023 4.3023 4.4969 4.4969 4.8433 4.8433 4.9414 4.9414 5.1233 5.1233 5.1959 5.1959 5.3823 5.3823 5.4970 5.4970 5.6236 5.6236 5.9479 5.9479 6.0269 6.0269 6.1195 6.1195 7.0639 7.0639 7.1081 7.1081 7.7103 7.7103 7.7664 7.7664 8.6052 8.6052 8.6692 8.6692 k = 0.0569 0.2278 0.3733 ( 14088 PWs) bands (ev): -6.3392 -6.3392 -6.3368 -6.3368 -5.4332 -5.4332 -5.4302 -5.4302 -4.2477 -4.2477 -4.2469 -4.2469 -3.7489 -3.7489 -3.7478 -3.7478 -0.9112 -0.9112 -0.8954 -0.8954 1.7907 1.7907 1.8238 1.8238 2.2264 2.2264 2.2507 2.2507 2.9481 2.9481 2.9983 2.9983 3.5387 3.5387 3.5849 3.5849 3.9735 3.9735 4.1280 4.1280 4.3357 4.3357 4.5319 4.5319 4.8565 4.8565 4.9763 4.9763 5.1507 5.1507 5.1939 5.1939 5.4090 5.4090 5.5322 5.5322 5.6543 5.6543 5.9732 5.9732 6.0575 6.0575 6.1686 6.1686 7.0304 7.0304 7.0730 7.0730 7.6744 7.6744 7.7307 7.7307 8.6093 8.6093 8.6687 8.6687 k = 0.0506 0.2025 0.3733 ( 14088 PWs) bands (ev): -6.3545 -6.3545 -6.3523 -6.3523 -5.4469 -5.4469 -5.4441 -5.4441 -4.2569 -4.2569 -4.2562 -4.2562 -3.7580 -3.7580 -3.7570 -3.7570 -0.9055 -0.9055 -0.8914 -0.8914 1.7763 1.7763 1.8051 1.8051 2.2385 2.2385 2.2603 2.2603 3.0034 3.0034 3.0541 3.0541 3.6143 3.6143 3.6516 3.6516 3.9798 3.9798 4.1392 4.1392 4.3620 4.3620 4.5629 4.5629 4.8585 4.8585 5.0046 5.0046 5.1694 5.1694 5.1989 5.1989 5.4338 5.4338 5.5654 5.5654 5.6928 5.6928 5.9899 5.9899 6.0951 6.0951 6.2179 6.2179 6.9958 6.9958 7.0364 7.0364 7.6379 7.6379 7.6935 7.6935 8.6020 8.6020 8.6530 8.6530 k = 0.0443 0.1772 0.3733 ( 14068 PWs) bands (ev): -6.3680 -6.3680 -6.3662 -6.3662 -5.4589 -5.4589 -5.4565 -5.4565 -4.2651 -4.2651 -4.2645 -4.2645 -3.7662 -3.7662 -3.7653 -3.7653 -0.9008 -0.9008 -0.8885 -0.8885 1.7633 1.7633 1.7881 1.7881 2.2471 2.2471 2.2664 2.2664 3.0577 3.0577 3.1093 3.1093 3.6866 3.6866 3.7162 3.7162 3.9874 3.9874 4.1545 4.1545 4.3799 4.3799 4.5890 4.5890 4.8523 4.8523 5.0165 5.0165 5.1789 5.1789 5.2229 5.2229 5.4541 5.4541 5.5967 5.5967 5.7345 5.7345 5.9992 5.9992 6.1395 6.1395 6.2671 6.2671 6.9603 6.9603 6.9985 6.9985 7.6021 7.6021 7.6557 7.6557 8.5843 8.5843 8.6285 8.6285 k = 0.0379 0.1519 0.3733 ( 14080 PWs) bands (ev): -6.3799 -6.3799 -6.3783 -6.3783 -5.4693 -5.4693 -5.4672 -5.4672 -4.2723 -4.2723 -4.2718 -4.2718 -3.7734 -3.7734 -3.7726 -3.7726 -0.8970 -0.8970 -0.8865 -0.8865 1.7519 1.7519 1.7728 1.7728 2.2533 2.2533 2.2698 2.2698 3.1090 3.1090 3.1607 3.1607 3.7521 3.7521 3.7812 3.7812 3.9956 3.9956 4.1756 4.1756 4.3889 4.3889 4.6082 4.6082 4.8404 4.8404 5.0098 5.0098 5.1901 5.1901 5.2590 5.2590 5.4702 5.4702 5.6250 5.6250 5.7749 5.7749 6.0027 6.0027 6.1894 6.1894 6.3156 6.3156 6.9243 6.9243 6.9598 6.9598 7.5684 7.5684 7.6187 7.6187 8.5598 8.5598 8.5997 8.5997 k = 0.0316 0.1266 0.3733 ( 14070 PWs) bands (ev): -6.3900 -6.3900 -6.3887 -6.3887 -5.4781 -5.4781 -5.4764 -5.4764 -4.2785 -4.2785 -4.2781 -4.2781 -3.7795 -3.7795 -3.7789 -3.7789 -0.8940 -0.8940 -0.8852 -0.8852 1.7422 1.7422 1.7595 1.7595 2.2576 2.2576 2.2713 2.2713 3.1559 3.1559 3.2059 3.2059 3.8071 3.8071 3.8494 3.8494 4.0032 4.0032 4.2032 4.2032 4.3892 4.3892 4.6177 4.6177 4.8262 4.8262 4.9895 4.9895 5.2074 5.2074 5.2972 5.2972 5.4848 5.4848 5.6477 5.6477 5.8118 5.8118 6.0017 6.0017 6.2431 6.2431 6.3626 6.3626 6.8882 6.8882 6.9211 6.9211 7.5381 7.5381 7.5837 7.5837 8.5326 8.5326 8.5686 8.5686 k = 0.0253 0.1013 0.3733 ( 14054 PWs) bands (ev): -6.3983 -6.3983 -6.3972 -6.3972 -5.4853 -5.4853 -5.4839 -5.4839 -4.2836 -4.2836 -4.2833 -4.2833 -3.7845 -3.7845 -3.7840 -3.7840 -0.8915 -0.8915 -0.8845 -0.8845 1.7345 1.7345 1.7481 1.7481 2.2607 2.2607 2.2716 2.2716 3.1971 3.1971 3.2426 3.2426 3.8528 3.8528 3.9179 3.9179 4.0100 4.0100 4.2358 4.2358 4.3827 4.3827 4.6140 4.6140 4.8151 4.8151 4.9617 4.9617 5.2295 5.2295 5.3287 5.3287 5.5024 5.5024 5.6621 5.6621 5.8448 5.8448 5.9967 5.9967 6.2986 6.2986 6.4062 6.4062 6.8529 6.8529 6.8834 6.8834 7.5126 7.5126 7.5519 7.5519 8.5063 8.5063 8.5374 8.5374 k = 0.0190 0.0759 0.3733 ( 14054 PWs) bands (ev): -6.4048 -6.4048 -6.4040 -6.4040 -5.4909 -5.4909 -5.4898 -5.4898 -4.2876 -4.2876 -4.2873 -4.2873 -3.7885 -3.7885 -3.7881 -3.7881 -0.8895 -0.8895 -0.8843 -0.8843 1.7287 1.7287 1.7389 1.7389 2.2629 2.2629 2.2710 2.2710 3.2319 3.2319 3.2696 3.2696 3.8912 3.8912 3.9749 3.9749 4.0241 4.0241 4.2648 4.2648 4.3763 4.3763 4.5951 4.5951 4.8116 4.8116 4.9310 4.9310 5.2546 5.2546 5.3470 5.3470 5.5272 5.5272 5.6666 5.6666 5.8742 5.8742 5.9883 5.9883 6.3532 6.3532 6.4436 6.4436 6.8202 6.8202 6.8480 6.8480 7.4930 7.4930 7.5243 7.5243 8.4837 8.4837 8.5086 8.5086 k = 0.0126 0.0506 0.3733 ( 14050 PWs) bands (ev): -6.4094 -6.4094 -6.4088 -6.4088 -5.4948 -5.4948 -5.4941 -5.4941 -4.2905 -4.2905 -4.2903 -4.2903 -3.7913 -3.7913 -3.7910 -3.7910 -0.8880 -0.8880 -0.8845 -0.8845 1.7250 1.7250 1.7317 1.7317 2.2647 2.2647 2.2701 2.2701 3.2595 3.2595 3.2864 3.2864 3.9233 3.9233 3.9900 3.9900 4.0735 4.0735 4.2686 4.2686 4.3893 4.3893 4.5625 4.5625 4.8168 4.8168 4.9005 4.9005 5.2806 5.2806 5.3506 5.3506 5.5583 5.5583 5.6607 5.6607 5.9005 5.9005 5.9767 5.9767 6.4034 6.4034 6.4707 6.4707 6.7934 6.7934 6.8165 6.8165 7.4802 7.4802 7.5020 7.5020 8.4672 8.4672 8.4845 8.4845 k = 0.0063 0.0253 0.3733 ( 14060 PWs) bands (ev): -6.4121 -6.4121 -6.4118 -6.4118 -5.4971 -5.4971 -5.4967 -5.4967 -4.2922 -4.2922 -4.2921 -4.2921 -3.7929 -3.7929 -3.7928 -3.7928 -0.8867 -0.8867 -0.8849 -0.8849 1.7234 1.7234 1.7268 1.7268 2.2662 2.2662 2.2689 2.2689 3.2792 3.2792 3.2933 3.2933 3.9494 3.9494 3.9838 3.9838 4.1351 4.1351 4.2398 4.2398 4.4270 4.4270 4.5206 4.5206 4.8296 4.8296 4.8725 4.8725 5.3052 5.3052 5.3426 5.3426 5.5912 5.5912 5.6452 5.6452 5.9239 5.9239 5.9620 5.9620 6.4451 6.4451 6.4819 6.4819 6.7778 6.7778 6.7917 6.7917 7.4746 7.4746 7.4859 7.4859 8.4584 8.4584 8.4673 8.4673 k = 0.0000 0.0000 0.3733 ( 14058 PWs) bands (ev): -6.4129 -6.4129 -6.4129 -6.4129 -5.4977 -5.4977 -5.4977 -5.4977 -4.2927 -4.2927 -4.2927 -4.2927 -3.7934 -3.7934 -3.7934 -3.7934 -0.8857 -0.8857 -0.8857 -0.8857 1.7240 1.7240 1.7240 1.7240 2.2676 2.2676 2.2676 2.2676 3.2907 3.2907 3.2907 3.2907 3.9697 3.9697 3.9697 3.9697 4.1925 4.1925 4.1925 4.1925 4.4738 4.4738 4.4738 4.4738 4.8485 4.8485 4.8485 4.8485 5.3266 5.3266 5.3266 5.3266 5.6212 5.6212 5.6212 5.6212 5.9444 5.9444 5.9444 5.9444 6.4730 6.4730 6.4730 6.4730 6.7773 6.7773 6.7773 6.7773 7.4766 7.4766 7.4766 7.4766 8.4584 8.4584 8.4584 8.4584 k = 0.0000 0.0000 0.3733 ( 14058 PWs) bands (ev): -6.4129 -6.4129 -6.4129 -6.4129 -5.4977 -5.4977 -5.4977 -5.4977 -4.2927 -4.2927 -4.2927 -4.2927 -3.7934 -3.7934 -3.7934 -3.7934 -0.8857 -0.8857 -0.8857 -0.8857 1.7240 1.7240 1.7240 1.7240 2.2676 2.2676 2.2676 2.2676 3.2907 3.2907 3.2907 3.2907 3.9697 3.9697 3.9697 3.9697 4.1925 4.1925 4.1925 4.1925 4.4738 4.4738 4.4738 4.4738 4.8485 4.8485 4.8485 4.8485 5.3266 5.3266 5.3266 5.3266 5.6212 5.6212 5.6212 5.6212 5.9444 5.9444 5.9444 5.9444 6.4730 6.4730 6.4730 6.4730 6.7773 6.7773 6.7773 6.7773 7.4766 7.4766 7.4766 7.4766 8.4584 8.4584 8.4584 8.4584 k = 0.0000 0.0000 0.3484 ( 14054 PWs) bands (ev): -6.4367 -6.4367 -6.3880 -6.3880 -5.5044 -5.5044 -5.4919 -5.4919 -4.3096 -4.3096 -4.2780 -4.2780 -3.8159 -3.8159 -3.7683 -3.7683 -0.9412 -0.9412 -0.8289 -0.8289 1.6547 1.6547 1.7952 1.7952 2.2002 2.2002 2.3360 2.3360 3.2469 3.2469 3.3313 3.3313 3.9658 3.9658 3.9740 3.9740 4.1797 4.1797 4.2051 4.2051 4.4699 4.4699 4.4755 4.4755 4.8321 4.8321 4.8634 4.8634 5.3195 5.3195 5.3340 5.3340 5.6003 5.6003 5.6406 5.6406 5.9294 5.9294 5.9591 5.9591 6.4674 6.4674 6.4791 6.4791 6.7747 6.7747 6.7880 6.7880 7.4443 7.4443 7.5106 7.5106 8.4209 8.4209 8.4898 8.4898 k = 0.0000 0.0000 0.3235 ( 14038 PWs) bands (ev): -6.4594 -6.4594 -6.3622 -6.3622 -5.5119 -5.5119 -5.4869 -5.4869 -4.3285 -4.3285 -4.2655 -4.2655 -3.8353 -3.8353 -3.7409 -3.7409 -0.9950 -0.9950 -0.7713 -0.7713 1.5876 1.5876 1.8677 1.8677 2.1347 2.1347 2.4048 2.4048 3.2003 3.2003 3.3684 3.3684 3.9623 3.9623 3.9786 3.9786 4.1671 4.1671 4.2174 4.2174 4.4637 4.4637 4.4757 4.4757 4.8147 4.8147 4.8757 4.8757 5.3140 5.3140 5.3410 5.3410 5.5784 5.5784 5.6584 5.6584 5.9143 5.9143 5.9732 5.9732 6.4624 6.4624 6.4854 6.4854 6.7798 6.7798 6.8064 6.8064 7.4145 7.4145 7.5458 7.5458 8.3765 8.3765 8.5165 8.5165 k = 0.0000 0.0000 0.2986 ( 14050 PWs) bands (ev): -6.4807 -6.4807 -6.3356 -6.3356 -5.5203 -5.5203 -5.4826 -5.4826 -4.3491 -4.3491 -4.2549 -4.2549 -3.8516 -3.8516 -3.7118 -3.7118 -1.0466 -1.0466 -0.7136 -0.7136 1.5233 1.5233 1.9401 1.9401 2.0726 2.0726 2.4729 2.4729 3.1513 3.1513 3.4020 3.4020 3.9592 3.9592 3.9835 3.9835 4.1548 4.1548 4.2288 4.2288 4.4549 4.4549 4.4749 4.4749 4.7960 4.7960 4.8845 4.8845 5.3108 5.3108 5.3475 5.3475 5.5564 5.5564 5.6747 5.6747 5.8994 5.8994 5.9867 5.9867 6.4580 6.4580 6.4915 6.4915 6.7922 6.7922 6.8315 6.8315 7.3875 7.3875 7.5817 7.5817 8.3254 8.3254 8.5396 8.5396 k = 0.0000 0.0000 0.2738 ( 14049 PWs) bands (ev): -6.5006 -6.5006 -6.3086 -6.3086 -5.5297 -5.5297 -5.4790 -5.4790 -4.3711 -4.3711 -4.2461 -4.2461 -3.8650 -3.8650 -3.6816 -3.6816 -1.0957 -1.0957 -0.6562 -0.6562 1.4621 1.4621 1.9925 1.9925 2.0339 2.0339 2.5397 2.5397 3.1009 3.1009 3.4323 3.4323 3.9563 3.9563 3.9884 3.9884 4.1432 4.1432 4.2387 4.2387 4.4440 4.4440 4.4740 4.4740 4.7755 4.7755 4.8892 4.8892 5.3097 5.3097 5.3543 5.3543 5.5356 5.5356 5.6898 5.6898 5.8850 5.8850 5.9995 5.9995 6.4540 6.4540 6.4972 6.4972 6.8104 6.8104 6.8623 6.8623 7.3639 7.3639 7.6175 7.6175 8.2691 8.2691 8.5601 8.5601 k = 0.0000 0.0000 0.2489 ( 14061 PWs) bands (ev): -6.5191 -6.5191 -6.2812 -6.2812 -5.5400 -5.5400 -5.4759 -5.4759 -4.3938 -4.3938 -4.2389 -4.2389 -3.8755 -3.8755 -3.6512 -3.6512 -1.1418 -1.1418 -0.5998 -0.5998 1.4044 1.4044 1.9483 1.9483 2.0949 2.0949 2.6041 2.6041 3.0498 3.0498 3.4592 3.4592 3.9537 3.9537 3.9931 3.9931 4.1324 4.1324 4.2466 4.2466 4.4315 4.4315 4.4737 4.4737 4.7523 4.7523 4.8904 4.8904 5.3094 5.3094 5.3619 5.3619 5.5172 5.5172 5.7039 5.7039 5.8717 5.8717 6.0113 6.0113 6.4503 6.4503 6.5024 6.5024 6.8329 6.8329 6.8974 6.8974 7.3439 7.3439 7.6524 7.6524 8.2101 8.2101 8.5775 8.5775 k = 0.0000 0.0000 0.2240 ( 14059 PWs) bands (ev): -6.5360 -6.5360 -6.2539 -6.2539 -5.5511 -5.5511 -5.4733 -5.4733 -4.4166 -4.4166 -4.2330 -4.2330 -3.8836 -3.8836 -3.6211 -3.6211 -1.1847 -1.1847 -0.5452 -0.5452 1.3506 1.3506 1.8960 1.8960 2.1670 2.1670 2.6653 2.6653 2.9994 2.9994 3.4829 3.4829 3.9513 3.9513 3.9969 3.9969 4.1228 4.1228 4.2516 4.2516 4.4185 4.4185 4.4744 4.4744 4.7263 4.7263 4.8887 4.8887 5.3091 5.3091 5.3694 5.3694 5.5031 5.5031 5.7170 5.7170 5.8606 5.8606 6.0220 6.0220 6.4467 6.4467 6.5070 6.5070 6.8580 6.8580 6.9351 6.9351 7.3275 7.3275 7.6855 7.6855 8.1513 8.1513 8.5887 8.5887 k = 0.0000 0.0000 0.1991 ( 14057 PWs) bands (ev): -6.5512 -6.5512 -6.2269 -6.2269 -5.5629 -5.5629 -5.4712 -5.4712 -4.4390 -4.4390 -4.2282 -4.2282 -3.8897 -3.8897 -3.5922 -3.5922 -1.2240 -1.2240 -0.4930 -0.4930 1.3012 1.3012 1.8471 1.8471 2.2382 2.2382 2.7222 2.7222 2.9509 2.9509 3.5034 3.5034 3.9490 3.9490 3.9992 3.9992 4.1149 4.1149 4.2526 4.2526 4.4065 4.4065 4.4765 4.4765 4.6982 4.6982 4.8851 4.8851 5.3086 5.3086 5.3738 5.3738 5.4955 5.4955 5.7285 5.7285 5.8526 5.8526 6.0317 6.0317 6.4434 6.4434 6.5110 6.5110 6.8841 6.8841 6.9738 6.9738 7.3143 7.3143 7.7160 7.7160 8.0961 8.0961 8.5844 8.5844 k = 0.0000 0.0000 0.1742 ( 14085 PWs) bands (ev): -6.5648 -6.5648 -6.2007 -6.2007 -5.5751 -5.5751 -5.4695 -5.4695 -4.4602 -4.4602 -4.2243 -4.2243 -3.8940 -3.8940 -3.5649 -3.5649 -1.2594 -1.2594 -0.4441 -0.4441 1.2565 1.2565 1.8026 1.8026 2.3066 2.3066 2.7731 2.7731 2.9065 2.9065 3.5207 3.5207 3.9470 3.9470 3.9992 3.9992 4.1092 4.1092 4.2490 4.2490 4.3971 4.3971 4.4799 4.4799 4.6696 4.6696 4.8800 4.8800 5.3085 5.3085 5.3730 5.3730 5.4945 5.4945 5.7379 5.7379 5.8491 5.8491 6.0401 6.0401 6.4404 6.4404 6.5144 6.5144 6.9099 6.9099 7.0118 7.0118 7.3034 7.3034 7.7426 7.7426 8.0477 8.0477 8.5637 8.5637 k = 0.0000 0.0000 0.1493 ( 14073 PWs) bands (ev): -6.5766 -6.5766 -6.1758 -6.1758 -5.5876 -5.5876 -5.4681 -5.4681 -4.4797 -4.4797 -4.2212 -4.2212 -3.8969 -3.8969 -3.5400 -3.5400 -1.2906 -1.2906 -0.3993 -0.3993 1.2170 1.2170 1.7631 1.7631 2.3707 2.3707 2.8120 2.8120 2.8730 2.8730 3.5346 3.5346 3.9451 3.9451 3.9963 3.9963 4.1060 4.1060 4.2408 4.2408 4.3913 4.3913 4.4843 4.4843 4.6421 4.6421 4.8736 4.8736 5.3088 5.3088 5.3679 5.3679 5.4978 5.4978 5.7445 5.7445 5.8508 5.8508 6.0472 6.0472 6.4378 6.4378 6.5173 6.5173 6.9347 6.9347 7.0477 7.0477 7.2934 7.2934 7.7645 7.7645 8.0090 8.0090 8.5363 8.5363 k = 0.0000 0.0000 0.1244 ( 14075 PWs) bands (ev): -6.5867 -6.5867 -6.1528 -6.1528 -5.5998 -5.5998 -5.4671 -5.4671 -4.4971 -4.4971 -4.2187 -4.2187 -3.8989 -3.8989 -3.5179 -3.5179 -1.3175 -1.3175 -0.3595 -0.3595 1.1829 1.1829 1.7288 1.7288 2.4286 2.4286 2.8102 2.8102 2.8797 2.8797 3.5450 3.5450 3.9435 3.9435 3.9906 3.9906 4.1051 4.1051 4.2294 4.2294 4.3894 4.3894 4.4888 4.4888 4.6174 4.6174 4.8664 4.8664 5.3093 5.3093 5.3616 5.3616 5.5017 5.5017 5.7487 5.7487 5.8570 5.8570 6.0531 6.0531 6.4358 6.4358 6.5198 6.5198 6.9581 6.9581 7.0798 7.0798 7.2827 7.2827 7.7811 7.7811 7.9820 7.9820 8.5070 8.5070 k = 0.0000 0.0000 0.0995 ( 14063 PWs) bands (ev): -6.5950 -6.5950 -6.1323 -6.1323 -5.6112 -5.6112 -5.4662 -5.4662 -4.5118 -4.5118 -4.2168 -4.2168 -3.9001 -3.9001 -3.4991 -3.4991 -1.3398 -1.3398 -0.3255 -0.3255 1.1546 1.1546 1.7002 1.7002 2.4783 2.4783 2.7859 2.7859 2.9094 2.9094 3.5518 3.5518 3.9424 3.9424 3.9827 3.9827 4.1059 4.1059 4.2168 4.2168 4.3908 4.3908 4.4919 4.4919 4.5972 4.5972 4.8587 4.8587 5.3091 5.3091 5.3570 5.3570 5.5038 5.5038 5.7514 5.7514 5.8659 5.8659 6.0578 6.0578 6.4345 6.4345 6.5217 6.5217 6.9801 6.9801 7.1069 7.1069 7.2705 7.2705 7.7930 7.7930 7.9664 7.9664 8.4783 8.4783 k = 0.0000 0.0000 0.0747 ( 14071 PWs) bands (ev): -6.6015 -6.6015 -6.1152 -6.1152 -5.6211 -5.6211 -5.4656 -5.4656 -4.5236 -4.5236 -4.2154 -4.2154 -3.9008 -3.9008 -3.4841 -3.4841 -1.3573 -1.3573 -0.2981 -0.2981 1.1323 1.1323 1.6776 1.6776 2.5175 2.5175 2.7654 2.7654 2.9363 2.9363 3.5554 3.5554 3.9420 3.9420 3.9741 3.9741 4.1075 4.1075 4.2053 4.2053 4.3946 4.3946 4.4924 4.4924 4.5828 4.5828 4.8514 4.8514 5.3074 5.3074 5.3556 5.3556 5.5037 5.5037 5.7533 5.7533 5.8752 5.8752 6.0614 6.0614 6.4339 6.4339 6.5232 6.5232 7.0002 7.0002 7.1279 7.1279 7.2569 7.2569 7.8017 7.8017 7.9597 7.9597 8.4522 8.4522 k = 0.0000 0.0000 0.0498 ( 14067 PWs) bands (ev): -6.6061 -6.6061 -6.1022 -6.1022 -5.6289 -5.6289 -5.4652 -5.4652 -4.5323 -4.5323 -4.2144 -4.2144 -3.9011 -3.9011 -3.4732 -3.4732 -1.3700 -1.3700 -0.2780 -0.2780 1.1162 1.1162 1.6612 1.6612 2.5448 2.5448 2.7522 2.7522 2.9568 2.9568 3.5566 3.5566 3.9424 3.9424 3.9660 3.9660 4.1091 4.1091 4.1963 4.1963 4.3993 4.3993 4.4900 4.4900 4.5745 4.5745 4.8453 4.8453 5.3049 5.3049 5.3567 5.3567 5.5021 5.5021 5.7547 5.7547 5.8831 5.8831 6.0640 6.0640 6.4337 6.4337 6.5243 6.5243 7.0175 7.0175 7.1420 7.1420 7.2439 7.2439 7.8084 7.8084 7.9581 7.9581 8.4311 8.4311 k = 0.0000 0.0000 0.0249 ( 14047 PWs) bands (ev): -6.6089 -6.6089 -6.0941 -6.0941 -5.6339 -5.6339 -5.4650 -5.4650 -4.5375 -4.5375 -4.2138 -4.2138 -3.9013 -3.9013 -3.4665 -3.4665 -1.3776 -1.3776 -0.2657 -0.2657 1.1066 1.1066 1.6512 1.6512 2.5601 2.5601 2.7459 2.7459 2.9695 2.9695 3.5566 3.5566 3.9436 3.9436 3.9596 3.9596 4.1101 4.1101 4.1907 4.1907 4.4034 4.4034 4.4865 4.4865 4.5709 4.5709 4.8412 4.8412 5.3027 5.3027 5.3585 5.3585 5.5003 5.5003 5.7557 5.7557 5.8883 5.8883 6.0656 6.0656 6.4337 6.4337 6.5249 6.5249 7.0299 7.0299 7.1493 7.1493 7.2345 7.2345 7.8129 7.8129 7.9584 7.9584 8.4171 8.4171 k = 0.0000 0.0000 0.0000 ( 14051 PWs) bands (ev): -6.6098 -6.6098 -6.0913 -6.0913 -5.6356 -5.6356 -5.4649 -5.4649 -4.5393 -4.5393 -4.2136 -4.2136 -3.9013 -3.9013 -3.4643 -3.4643 -1.3801 -1.3801 -0.2615 -0.2615 1.1033 1.1033 1.6479 1.6479 2.5649 2.5649 2.7441 2.7441 2.9738 2.9738 3.5564 3.5564 3.9445 3.9445 3.9570 3.9570 4.1105 4.1105 4.1888 4.1888 4.4050 4.4050 4.4849 4.4849 4.5700 4.5700 4.8398 4.8398 5.3019 5.3019 5.3593 5.3593 5.4996 5.4996 5.7560 5.7560 5.8901 5.8901 6.0661 6.0661 6.4338 6.4338 6.5252 6.5252 7.0345 7.0345 7.1513 7.1513 7.2312 7.2312 7.8146 7.8146 7.9587 7.9587 8.4122 8.4122 k = 0.0000 0.0000 0.0000 ( 14051 PWs) bands (ev): -6.6098 -6.6098 -6.0913 -6.0913 -5.6356 -5.6356 -5.4649 -5.4649 -4.5393 -4.5393 -4.2136 -4.2136 -3.9013 -3.9013 -3.4643 -3.4643 -1.3801 -1.3801 -0.2615 -0.2615 1.1033 1.1033 1.6479 1.6479 2.5649 2.5649 2.7441 2.7441 2.9738 2.9738 3.5564 3.5564 3.9445 3.9445 3.9570 3.9570 4.1105 4.1105 4.1888 4.1888 4.4050 4.4050 4.4849 4.4849 4.5700 4.5700 4.8398 4.8398 5.3019 5.3019 5.3593 5.3593 5.4996 5.4996 5.7560 5.7560 5.8901 5.8901 6.0661 6.0661 6.4338 6.4338 6.5252 6.5252 7.0345 7.0345 7.1513 7.1513 7.2312 7.2312 7.8146 7.8146 7.9587 7.9587 8.4122 8.4122 k =-0.0250 0.0062-0.0000 ( 14051 PWs) bands (ev): -6.6090 -6.6089 -6.0914 -6.0913 -5.6365 -5.6362 -5.4658 -5.4656 -4.5396 -4.5391 -4.2151 -4.2149 -3.9000 -3.8990 -3.4645 -3.4641 -1.3784 -1.3782 -0.2617 -0.2611 1.1045 1.1064 1.6479 1.6500 2.5448 2.5834 2.7139 2.7671 2.9675 2.9713 3.5497 3.5720 3.9279 3.9435 3.9476 3.9762 4.1046 4.1171 4.1608 4.2139 4.3867 4.4105 4.4686 4.4765 4.5763 4.6025 4.8417 4.8473 5.2809 5.3089 5.3394 5.3934 5.4939 5.5064 5.7261 5.7726 5.8689 5.9225 6.0556 6.0791 6.4263 6.4325 6.5259 6.5293 7.0231 7.0454 7.1433 7.1612 7.2290 7.2330 7.7835 7.8422 7.9395 7.9755 8.4095 8.4116 k =-0.0500 0.0125-0.0000 ( 14051 PWs) bands (ev): -6.6064 -6.6063 -6.0917 -6.0915 -5.6388 -5.6382 -5.4684 -5.4679 -4.5402 -4.5393 -4.2194 -4.2191 -3.8949 -3.8929 -3.4650 -3.4641 -1.3732 -1.3728 -0.2616 -0.2604 1.1099 1.1139 1.6499 1.6542 2.5231 2.6001 2.6775 2.7823 2.9522 2.9607 3.5529 3.5948 3.8951 3.9406 3.9468 3.9896 4.1011 4.1179 4.1348 4.2350 4.3626 4.3983 4.4492 4.4554 4.6122 4.6477 4.8541 4.8630 5.2450 5.3130 5.3362 5.4264 5.4912 5.5149 5.6863 5.7796 5.8613 5.9493 6.0583 6.0915 6.4118 6.4232 6.5300 6.5377 7.0119 7.0543 7.1386 7.1720 7.2266 7.2344 7.7500 7.8629 7.9212 7.9896 8.4034 8.4075 k =-0.0750 0.0187-0.0000 ( 14044 PWs) bands (ev): -6.6021 -6.6019 -6.0921 -6.0919 -5.6426 -5.6417 -5.4724 -5.4718 -4.5411 -4.5396 -4.2262 -4.2258 -3.8864 -3.8836 -3.4656 -3.4642 -1.3646 -1.3639 -0.2613 -0.2595 1.1196 1.1255 1.6540 1.6606 2.4996 2.6138 2.6370 2.7894 2.9287 2.9430 3.5657 3.6230 3.8563 3.9365 3.9454 3.9953 4.0938 4.1008 4.1307 4.2507 4.3405 4.3727 4.4315 4.4401 4.6547 4.6944 4.8771 4.8854 5.2056 5.3172 5.3391 5.4428 5.5003 5.5260 5.6450 5.7812 5.8629 5.9513 6.0875 6.1028 6.3933 6.4083 6.5353 6.5486 7.0014 7.0597 7.1383 7.1821 7.2249 7.2352 7.7146 7.8627 7.9182 8.0013 8.3940 8.4002 k =-0.1000 0.0250-0.0000 ( 14070 PWs) bands (ev): -6.5960 -6.5958 -6.0930 -6.0927 -5.6476 -5.6465 -5.4777 -5.4769 -4.5420 -4.5401 -4.2351 -4.2348 -3.8750 -3.8715 -3.4663 -3.4646 -1.3526 -1.3518 -0.2607 -0.2583 1.1332 1.1414 1.6599 1.6691 2.4744 2.5905 2.6267 2.7878 2.8987 2.9197 3.5868 3.6545 3.8132 3.9312 3.9437 3.9906 4.0666 4.1032 4.1310 4.2579 4.3243 4.3477 4.4147 4.4266 4.6970 4.7392 4.9089 4.9133 5.1676 5.3205 5.3436 5.4378 5.5224 5.5407 5.6103 5.7783 5.8699 5.9358 6.1133 6.1328 6.3735 6.3905 6.5409 6.5604 6.9917 7.0611 7.1424 7.1893 7.2258 7.2357 7.6781 7.8391 7.9338 8.0112 8.3815 8.3897 k =-0.1250 0.0312-0.0000 ( 14084 PWs) bands (ev): -6.5882 -6.5880 -6.0943 -6.0939 -5.6538 -5.6525 -5.4840 -5.4831 -4.5431 -4.5407 -4.2459 -4.2457 -3.8611 -3.8569 -3.4671 -3.4650 -1.3377 -1.3367 -0.2597 -0.2568 1.1508 1.1612 1.6677 1.6798 2.4475 2.5440 2.6320 2.7759 2.8662 2.8930 3.6132 3.6875 3.7678 3.9244 3.9417 3.9751 4.0455 4.1073 4.1321 4.2530 4.3135 4.3313 4.3989 4.4139 4.7374 4.7800 4.9451 4.9458 5.1334 5.3183 5.3479 5.4262 5.5348 5.5594 5.5960 5.7701 5.8802 5.9163 6.1234 6.1784 6.3562 6.3717 6.5465 6.5726 6.9827 7.0591 7.1490 7.1911 7.2312 7.2364 7.6413 7.8072 7.9538 8.0198 8.3660 8.3763 k =-0.1500 0.0375-0.0000 ( 14086 PWs) bands (ev): -6.5788 -6.5785 -6.0964 -6.0959 -5.6609 -5.6595 -5.4911 -5.4901 -4.5441 -4.5413 -4.2581 -4.2581 -3.8452 -3.8406 -3.4681 -3.4657 -1.3202 -1.3190 -0.2585 -0.2551 1.1720 1.1849 1.6772 1.6926 2.4189 2.4961 2.6299 2.7501 2.8368 2.8656 3.6406 3.7197 3.7220 3.9153 3.9397 3.9567 4.0274 4.1117 4.1361 4.2398 4.3049 4.3201 4.3856 4.4061 4.7755 4.8157 4.9794 4.9820 5.1054 5.3040 5.3513 5.4198 5.5224 5.5815 5.6127 5.7556 5.8921 5.8999 6.1329 6.2117 6.3499 6.3544 6.5522 6.5851 6.9744 7.0550 7.1554 7.1879 7.2382 7.2407 7.6052 7.7723 7.9742 8.0278 8.3475 8.3603 k =-0.1750 0.0437-0.0000 ( 14074 PWs) bands (ev): -6.5677 -6.5673 -6.0995 -6.0989 -5.6687 -5.6672 -5.4989 -5.4978 -4.5450 -4.5418 -4.2718 -4.2716 -3.8278 -3.8228 -3.4693 -3.4665 -1.3003 -1.2990 -0.2570 -0.2532 1.1967 1.2122 1.6882 1.7074 2.3892 2.4483 2.6176 2.7099 2.8131 2.8402 3.6627 3.6775 3.7493 3.9066 3.9377 3.9441 4.0090 4.1145 4.1441 4.2270 4.2948 4.3069 4.3765 4.4061 4.8109 4.8455 5.0080 5.0150 5.0898 5.2767 5.3534 5.4203 5.5032 5.6035 5.6416 5.7382 5.8895 5.9044 6.1411 6.2204 6.3410 6.3650 6.5586 6.5979 6.9662 7.0495 7.1587 7.1816 7.2423 7.2520 7.5709 7.7362 7.9946 8.0356 8.3263 8.3420 k =-0.2000 0.0500-0.0000 ( 14064 PWs) bands (ev): -6.5551 -6.5546 -6.1040 -6.1033 -5.6767 -5.6752 -5.5071 -5.5060 -4.5456 -4.5421 -4.2865 -4.2860 -3.8094 -3.8041 -3.4706 -3.4675 -1.2785 -1.2771 -0.2552 -0.2511 1.2246 1.2428 1.7006 1.7239 2.3588 2.4013 2.5939 2.6601 2.7918 2.8179 3.6359 3.6717 3.7744 3.9056 3.9358 3.9390 3.9909 4.1148 4.1553 4.2184 4.2817 4.2932 4.3721 4.4129 4.8422 4.8684 5.0122 5.0502 5.0958 5.2429 5.3544 5.4171 5.4904 5.6145 5.6741 5.7307 5.8850 5.9161 6.1461 6.2080 6.3346 6.3967 6.5665 6.6111 6.9581 7.0428 7.1572 7.1734 7.2496 7.2639 7.5395 7.7003 8.0148 8.0434 8.3023 8.3219 k =-0.2250 0.0562-0.0000 ( 14076 PWs) bands (ev): -6.5409 -6.5403 -6.1100 -6.1092 -5.6845 -5.6830 -5.5156 -5.5146 -4.5458 -4.5420 -4.3020 -4.3011 -3.7904 -3.7850 -3.4721 -3.4687 -1.2554 -1.2540 -0.2532 -0.2488 1.2553 1.2764 1.7138 1.7417 2.3283 2.3561 2.5599 2.6055 2.7700 2.7977 3.5977 3.6632 3.7941 3.9127 3.9336 3.9447 3.9752 4.1136 4.1693 4.2105 4.2668 4.2873 4.3713 4.4237 4.8663 4.8836 5.0042 5.0831 5.1124 5.2095 5.3547 5.3990 5.4919 5.6033 5.7082 5.7475 5.8845 5.9266 6.1467 6.1865 6.3371 6.4320 6.5772 6.6249 6.9495 7.0348 7.1506 7.1639 7.2599 7.2759 7.5119 7.6656 8.0351 8.0515 8.2761 8.3006 k =-0.2500 0.0625-0.0000 ( 14076 PWs) bands (ev): -6.5252 -6.5246 -6.1179 -6.1170 -5.6916 -5.6903 -5.5244 -5.5234 -4.5453 -4.5413 -4.3180 -4.3167 -3.7713 -3.7657 -3.4738 -3.4702 -1.2315 -1.2300 -0.2509 -0.2463 1.2886 1.3127 1.7276 1.7603 2.2984 2.3135 2.5187 2.5491 2.7462 2.7772 3.5627 3.6396 3.8089 3.9171 3.9313 3.9612 3.9708 4.1131 4.1857 4.1986 4.2519 4.2947 4.3724 4.4372 4.8783 4.8894 5.0005 5.1092 5.1235 5.1842 5.3550 5.3686 5.5032 5.5793 5.7427 5.7826 5.8864 5.9354 6.1433 6.1623 6.3484 6.4634 6.5920 6.6394 6.9402 7.0249 7.1403 7.1535 7.2723 7.2878 7.4888 7.6329 8.0553 8.0594 8.2481 8.2789 k =-0.2750 0.0687-0.0000 ( 14086 PWs) bands (ev): -6.5081 -6.5075 -6.1279 -6.1269 -5.6977 -5.6965 -5.5333 -5.5324 -4.5442 -4.5400 -4.3343 -4.3327 -3.7523 -3.7468 -3.4757 -3.4719 -1.2073 -1.2057 -0.2484 -0.2438 1.3241 1.3513 1.7411 1.7788 2.2697 2.2744 2.4735 2.4932 2.7201 2.7543 3.5298 3.6058 3.8212 3.9198 3.9294 3.9551 4.0045 4.1134 4.1850 4.2045 4.2393 4.3126 4.3742 4.4533 4.8748 4.8838 5.0067 5.1177 5.1222 5.1792 5.3327 5.3564 5.5179 5.5561 5.7762 5.8246 5.8899 5.9421 6.1384 6.1387 6.3666 6.4879 6.6116 6.6545 6.9300 7.0123 7.1282 7.1425 7.2858 7.2995 7.4705 7.6028 8.0665 8.0748 8.2195 8.2580 k =-0.3000 0.0749-0.0000 ( 14078 PWs) bands (ev): -6.4897 -6.4890 -6.1401 -6.1390 -5.7024 -5.7013 -5.5424 -5.5415 -4.5422 -4.5378 -4.3509 -4.3489 -3.7340 -3.7285 -3.4777 -3.4738 -1.1834 -1.1819 -0.2458 -0.2412 1.3614 1.3917 1.7535 1.7959 2.2397 2.2428 2.4272 2.4395 2.6923 2.7280 3.4974 3.5658 3.8341 3.9235 3.9285 3.9519 4.0421 4.1127 4.1747 4.2249 4.2318 4.3352 4.3762 4.4731 4.8592 4.8660 5.0181 5.1073 5.1120 5.1892 5.2982 5.3593 5.5332 5.5399 5.8074 5.8665 5.8953 5.9460 6.1167 6.1357 6.3889 6.5058 6.6346 6.6698 6.9189 6.9965 7.1160 7.1314 7.2996 7.3111 7.4568 7.5759 8.0715 8.0922 8.1922 8.2396 k =-0.3250 0.0812-0.0000 ( 14076 PWs) bands (ev): -6.4701 -6.4693 -6.1546 -6.1535 -5.7056 -5.7046 -5.5514 -5.5507 -4.5392 -4.5348 -4.3673 -4.3650 -3.7165 -3.7112 -3.4798 -3.4760 -1.1604 -1.1589 -0.2431 -0.2388 1.4003 1.4335 1.7637 1.8101 2.2102 2.2180 2.3820 2.3902 2.6635 2.6987 3.4647 3.5226 3.8504 3.9278 3.9289 3.9526 4.0780 4.1088 4.1706 4.2264 4.2514 4.3579 4.3786 4.4978 4.8365 4.8372 5.0214 5.0877 5.1069 5.1866 5.2786 5.3633 5.5325 5.5478 5.8351 5.8904 5.9159 5.9466 6.0994 6.1364 6.4132 6.5188 6.6585 6.6850 6.9070 6.9777 7.1051 7.1206 7.3132 7.3224 7.4474 7.5522 8.0728 8.1027 8.1719 8.2256 k =-0.3500 0.0874-0.0000 ( 14074 PWs) bands (ev): -6.4493 -6.4485 -6.1713 -6.1701 -5.7071 -5.7063 -5.5603 -5.5596 -4.5352 -4.5307 -4.3836 -4.3810 -3.7003 -3.6953 -3.4821 -3.4783 -1.1389 -1.1376 -0.2405 -0.2364 1.4402 1.4762 1.7702 1.8194 2.1864 2.1951 2.3406 2.3473 2.6346 2.6674 3.4317 3.4787 3.8708 3.9307 3.9318 3.9560 4.1031 4.1094 4.1722 4.2306 4.2769 4.3774 4.3828 4.5283 4.8012 4.8095 4.9966 5.0844 5.1043 5.1592 5.2826 5.3672 5.5330 5.5610 5.8586 5.8954 5.9443 5.9472 6.0899 6.1415 6.4381 6.5288 6.6810 6.6994 6.8948 6.9567 7.0962 7.1105 7.3262 7.3333 7.4416 7.5316 8.0690 8.0968 8.1684 8.2177 k =-0.3750 0.0937-0.0000 ( 14070 PWs) bands (ev): -6.4277 -6.4268 -6.1899 -6.1887 -5.7073 -5.7066 -5.5688 -5.5683 -4.5301 -4.5257 -4.3994 -4.3965 -3.6856 -3.6810 -3.4843 -3.4808 -1.1195 -1.1184 -0.2379 -0.2343 1.4809 1.5193 1.7716 1.8220 2.1680 2.1738 2.3054 2.3131 2.6067 2.6356 3.3995 3.4364 3.8936 3.9344 3.9352 3.9599 4.0993 4.1345 4.1765 4.2429 4.2986 4.3925 4.3932 4.5635 4.7621 4.7792 4.9507 5.0932 5.0940 5.1294 5.2969 5.3701 5.5390 5.5723 5.8773 5.8975 5.9402 5.9677 6.0923 6.1498 6.4622 6.5368 6.7006 6.7125 6.8831 6.9349 7.0893 7.1015 7.3382 7.3436 7.4391 7.5140 8.0603 8.0779 8.1790 8.2161 k =-0.4000 0.0999-0.0000 ( 14066 PWs) bands (ev): -6.4053 -6.4044 -6.2101 -6.2089 -5.7063 -5.7057 -5.5767 -5.5763 -4.5241 -4.5198 -4.4144 -4.4114 -3.6728 -3.6688 -3.4864 -3.4833 -1.1028 -1.1018 -0.2356 -0.2326 1.5219 1.5624 1.7667 1.8166 2.1533 2.1540 2.2793 2.2891 2.5810 2.6048 3.3699 3.3978 3.9142 3.9386 3.9407 3.9623 4.1016 4.1532 4.1815 4.2617 4.3108 4.4032 4.4152 4.6008 4.7240 4.7462 4.9001 5.0550 5.1053 5.1235 5.3125 5.3714 5.5484 5.5811 5.8908 5.8983 5.9368 5.9744 6.1069 6.1593 6.4848 6.5431 6.7165 6.7234 6.8729 6.9141 7.0840 7.0937 7.3488 7.3529 7.4391 7.4991 8.0484 8.0569 8.1934 8.2189 k =-0.4250 0.1062-0.0000 ( 14066 PWs) bands (ev): -6.3824 -6.3815 -6.2315 -6.2303 -5.7046 -5.7041 -5.5836 -5.5833 -4.5173 -4.5132 -4.4282 -4.4252 -3.6621 -3.6590 -3.4882 -3.4856 -1.0892 -1.0884 -0.2336 -0.2312 1.5627 1.6047 1.7546 1.8030 2.1365 2.1400 2.2641 2.2747 2.5588 2.5770 3.3448 3.3649 3.9277 3.9421 3.9497 3.9625 4.1137 4.1662 4.1862 4.2748 4.3213 4.4096 4.4485 4.6346 4.6912 4.7105 4.8556 5.0073 5.1151 5.1258 5.3269 5.3710 5.5591 5.5870 5.8979 5.8981 5.9368 5.9727 6.1270 6.1679 6.5049 6.5475 6.7282 6.7318 6.8650 6.8957 7.0803 7.0873 7.3577 7.3607 7.4414 7.4863 8.0360 8.0386 8.2071 8.2237 k =-0.4500 0.1124-0.0000 ( 14048 PWs) bands (ev): -6.3597 -6.3588 -6.2532 -6.2521 -5.7027 -5.7024 -5.5891 -5.5888 -4.5101 -4.5067 -4.4401 -4.4374 -3.6540 -3.6518 -3.4895 -3.4877 -1.0791 -1.0786 -0.2319 -0.2303 1.6025 1.6456 1.7353 1.7820 2.1230 2.1278 2.2587 2.2675 2.5419 2.5540 3.3263 3.3392 3.9357 3.9454 3.9568 3.9610 4.1361 4.1747 4.1905 4.2660 4.3454 4.4115 4.4880 4.6508 4.6677 4.6765 4.8305 4.9585 5.1227 5.1286 5.3394 5.3686 5.5695 5.5897 5.8974 5.8994 5.9411 5.9675 6.1463 6.1736 6.5217 6.5495 6.7360 6.7375 6.8605 6.8806 7.0779 7.0825 7.3645 7.3665 7.4454 7.4753 8.0250 8.0251 8.2184 8.2283 k =-0.4750 0.1187-0.0000 ( 14046 PWs) bands (ev): -6.3388 -6.3379 -6.2735 -6.2726 -5.7013 -5.7011 -5.5926 -5.5925 -4.5037 -4.5016 -4.4485 -4.4467 -3.6488 -3.6476 -3.4902 -3.4893 -1.0729 -1.0726 -0.2307 -0.2299 1.6406 1.6829 1.7110 1.7548 2.1151 2.1183 2.2592 2.2640 2.5318 2.5379 3.3157 3.3220 3.9416 3.9473 3.9593 3.9594 4.1630 4.1792 4.1965 4.2428 4.3731 4.4073 4.5307 4.6200 4.6565 4.6660 4.8371 4.9112 5.1277 5.1303 5.3498 5.3643 5.5786 5.5891 5.8970 5.8984 5.9476 5.9612 6.1614 6.1750 6.5347 6.5484 6.7403 6.7408 6.8596 6.8696 7.0769 7.0791 7.3690 7.3700 7.4509 7.4659 8.0169 8.0175 8.2264 8.2310 k =-0.5000 0.1249-0.0000 ( 14034 PWs) bands (ev): -6.3272 -6.3272 -6.2840 -6.2840 -5.7007 -5.7007 -5.5938 -5.5938 -4.5003 -4.5003 -4.4511 -4.4511 -3.6466 -3.6466 -3.4901 -3.4901 -1.0707 -1.0707 -0.2301 -0.2301 1.6754 1.6754 1.7233 1.7233 2.1137 2.1137 2.2615 2.2615 2.5303 2.5303 3.3141 3.3141 3.9458 3.9458 3.9592 3.9592 4.1783 4.1783 4.2149 4.2149 4.3948 4.3948 4.5754 4.5754 4.6579 4.6579 4.8684 4.8684 5.1302 5.1302 5.3581 5.3581 5.5853 5.5853 5.8973 5.8973 5.9545 5.9545 6.1711 6.1711 6.5436 6.5436 6.7417 6.7417 6.8626 6.8626 7.0773 7.0773 7.3708 7.3708 7.4578 7.4578 8.0145 8.0145 8.2306 8.2306 k =-0.5000 0.1249-0.0000 ( 14034 PWs) bands (ev): -6.3272 -6.3272 -6.2840 -6.2840 -5.7007 -5.7007 -5.5938 -5.5938 -4.5003 -4.5003 -4.4511 -4.4511 -3.6466 -3.6466 -3.4901 -3.4901 -1.0707 -1.0707 -0.2301 -0.2301 1.6754 1.6754 1.7233 1.7233 2.1137 2.1137 2.2615 2.2615 2.5303 2.5303 3.3141 3.3141 3.9458 3.9458 3.9592 3.9592 4.1783 4.1783 4.2149 4.2149 4.3948 4.3948 4.5754 4.5754 4.6579 4.6579 4.8684 4.8684 5.1302 5.1302 5.3581 5.3581 5.5853 5.5853 5.8973 5.8973 5.9545 5.9545 6.1711 6.1711 6.5436 6.5436 6.7417 6.7417 6.8626 6.8626 7.0773 7.0773 7.3708 7.3708 7.4578 7.4578 8.0145 8.0145 8.2306 8.2306 k =-0.4938 0.1496-0.0000 ( 14044 PWs) bands (ev): -6.3266 -6.3264 -6.2831 -6.2830 -5.7000 -5.6999 -5.5927 -5.5926 -4.4997 -4.4996 -4.4505 -4.4504 -3.6465 -3.6462 -3.4897 -3.4896 -1.0714 -1.0709 -0.2313 -0.2304 1.6749 1.6764 1.7231 1.7244 2.1145 2.1149 2.2600 2.2645 2.5310 2.5317 3.3110 3.3164 3.9338 3.9466 3.9494 3.9535 4.1609 4.1657 4.1823 4.2536 4.3485 4.4389 4.5763 4.5774 4.6479 4.6784 4.8666 4.8722 5.1188 5.1382 5.3379 5.3716 5.5630 5.6012 5.8811 5.8938 5.9350 5.9614 6.1368 6.2032 6.5237 6.5466 6.7252 6.7471 6.8632 6.8711 7.0774 7.0889 7.3658 7.3917 7.4527 7.4746 8.0192 8.0210 8.2225 8.2396 k =-0.4877 0.1743-0.0000 ( 14048 PWs) bands (ev): -6.3247 -6.3243 -6.2803 -6.2801 -5.6977 -5.6974 -5.5894 -5.5893 -4.4980 -4.4976 -4.4485 -4.4483 -3.6458 -3.6453 -3.4882 -3.4881 -1.0730 -1.0721 -0.2342 -0.2324 1.6750 1.6777 1.7240 1.7269 2.1175 2.1183 2.2599 2.2689 2.5337 2.5351 3.3070 3.3181 3.9078 3.9228 3.9356 3.9385 4.1130 4.1359 4.1687 4.2462 4.3360 4.4757 4.5780 4.5831 4.6486 4.7055 4.8669 4.8778 5.1055 5.1419 5.3116 5.3766 5.5365 5.6095 5.8442 5.8756 5.9104 5.9447 6.1078 6.2261 6.4890 6.5307 6.7024 6.7418 6.8714 6.8904 7.0907 7.1088 7.3772 7.4246 7.4592 7.5007 8.0352 8.0386 8.2155 8.2494 k =-0.4815 0.1990-0.0000 ( 14062 PWs) bands (ev): -6.3214 -6.3209 -6.2756 -6.2753 -5.6939 -5.6935 -5.5839 -5.5838 -4.4950 -4.4945 -4.4452 -4.4449 -3.6446 -3.6439 -3.4858 -3.4856 -1.0755 -1.0741 -0.2387 -0.2361 1.6755 1.6790 1.7260 1.7311 2.1227 2.1238 2.2613 2.2748 2.5385 2.5406 3.3018 3.3189 3.8663 3.8812 3.9096 3.9211 4.0583 4.1076 4.1390 4.1880 4.3631 4.5060 4.5790 4.5906 4.6556 4.7342 4.8692 4.8848 5.0917 5.1410 5.2796 5.3695 5.5107 5.6098 5.7934 5.8462 5.8795 5.9040 6.0835 6.2351 6.4429 6.4972 6.6798 6.7284 6.8882 6.9200 7.1151 7.1347 7.4028 7.4582 7.4812 7.5315 8.0627 8.0673 8.2098 8.2600 k =-0.4753 0.2237-0.0000 ( 14054 PWs) bands (ev): -6.3168 -6.3161 -6.2691 -6.2687 -5.6884 -5.6880 -5.5761 -5.5760 -4.4908 -4.4902 -4.4406 -4.4402 -3.6429 -3.6419 -3.4824 -3.4822 -1.0790 -1.0772 -0.2450 -0.2416 1.6761 1.6796 1.7293 1.7373 2.1299 2.1314 2.2639 2.2822 2.5451 2.5480 3.2952 3.3186 3.8118 3.8270 3.8767 3.8948 4.0016 4.0772 4.0987 4.1179 4.3920 4.5300 4.5777 4.5973 4.6633 4.7605 4.8730 4.8928 5.0788 5.1354 5.2430 5.3458 5.4907 5.6016 5.7362 5.8085 5.8404 5.8490 6.0547 6.2269 6.3905 6.4528 6.6591 6.7087 6.9143 6.9585 7.1481 7.1661 7.4392 7.4785 7.5244 7.5613 8.1018 8.1061 8.2054 8.2716 k =-0.4692 0.2484-0.0000 ( 14066 PWs) bands (ev): -6.3109 -6.3100 -6.2606 -6.2602 -5.6815 -5.6809 -5.5662 -5.5661 -4.4855 -4.4847 -4.4346 -4.4341 -3.6407 -3.6395 -3.4780 -3.4778 -1.0835 -1.0813 -0.2532 -0.2489 1.6762 1.6792 1.7344 1.7459 2.1391 2.1411 2.2679 2.2910 2.5537 2.5574 3.2864 3.3169 3.7488 3.7638 3.8373 3.8586 3.9440 4.0393 4.0499 4.0531 4.4151 4.5437 4.5728 4.6018 4.6693 4.7813 4.8770 4.9011 5.0660 5.1257 5.2049 5.3062 5.4766 5.5829 5.6791 5.7643 5.7896 5.7929 6.0139 6.1996 6.3371 6.4070 6.6377 6.6838 6.9486 7.0036 7.1877 7.2029 7.4828 7.4929 7.5750 7.5855 8.1513 8.1520 8.2023 8.2852 k =-0.4630 0.2731-0.0000 ( 14068 PWs) bands (ev): -6.3038 -6.3027 -6.2504 -6.2499 -5.6729 -5.6722 -5.5541 -5.5539 -4.4790 -4.4781 -4.4273 -4.4268 -3.6381 -3.6367 -3.4728 -3.4725 -1.0892 -1.0865 -0.2633 -0.2582 1.6754 1.6775 1.7415 1.7570 2.1504 2.1528 2.2731 2.3012 2.5639 2.5684 3.2747 3.3130 3.6814 3.6955 3.7915 3.8101 3.8885 3.9678 4.0056 4.0128 4.4299 4.5402 4.5633 4.6030 4.6764 4.7938 4.8799 4.9090 5.0472 5.1126 5.1729 5.2572 5.4626 5.5500 5.6292 5.7146 5.7345 5.7380 5.9589 6.1551 6.2862 6.3653 6.6132 6.6540 6.9896 7.0533 7.2322 7.2449 7.5020 7.5302 7.6024 7.6279 8.1974 8.1990 8.2112 8.3037 k =-0.4568 0.2978-0.0000 ( 14060 PWs) bands (ev): -6.2954 -6.2941 -6.2385 -6.2378 -5.6628 -5.6620 -5.5398 -5.5396 -4.4715 -4.4704 -4.4188 -4.4181 -3.6351 -3.6334 -3.4666 -3.4663 -1.0961 -1.0930 -0.2756 -0.2697 1.6732 1.6744 1.7507 1.7705 2.1636 2.1666 2.2794 2.3127 2.5756 2.5811 3.2588 3.3058 3.6132 3.6256 3.7398 3.7489 3.8375 3.8944 3.9576 3.9769 4.4344 4.5160 4.5487 4.5991 4.6871 4.7950 4.8805 4.9159 5.0130 5.0972 5.1567 5.2054 5.4424 5.5038 5.5885 5.6633 5.6766 5.6873 5.8918 6.0994 6.2386 6.3274 6.5844 6.6195 7.0355 7.1055 7.2800 7.2910 7.5053 7.5754 7.6158 7.6813 8.1960 8.2363 8.2718 8.3340 k =-0.4507 0.3224-0.0000 ( 14046 PWs) bands (ev): -6.2858 -6.2844 -6.2248 -6.2240 -5.6512 -5.6503 -5.5233 -5.5231 -4.4629 -4.4617 -4.4090 -4.4082 -3.6317 -3.6298 -3.4596 -3.4592 -1.1042 -1.1007 -0.2901 -0.2836 1.6695 1.6698 1.7623 1.7863 2.1787 2.1824 2.2867 2.3254 2.5885 2.5951 3.2371 3.2932 3.5474 3.5579 3.6794 3.6827 3.7892 3.8233 3.9099 3.9397 4.4261 4.4741 4.5299 4.5874 4.6986 4.7816 4.8786 4.9202 4.9646 5.0807 5.1553 5.1570 5.4124 5.4535 5.5503 5.6100 5.6150 5.6485 5.8172 6.0398 6.1931 6.2906 6.5508 6.5803 7.0844 7.1584 7.3292 7.3397 7.5037 7.5966 7.6470 7.7343 8.1926 8.2571 8.3338 8.3787 k =-0.4445 0.3471-0.0000 ( 14054 PWs) bands (ev): -6.2750 -6.2734 -6.2095 -6.2086 -5.6380 -5.6370 -5.5047 -5.5044 -4.4534 -4.4520 -4.3980 -4.3971 -3.6280 -3.6259 -3.4517 -3.4514 -1.1138 -1.1099 -0.3072 -0.2999 1.6636 1.6640 1.7760 1.8043 2.1957 2.2001 2.2950 2.3393 2.6023 2.6102 3.2082 3.2723 3.4869 3.4967 3.6063 3.6213 3.7410 3.7554 3.8628 3.9016 4.4033 4.4192 4.5075 4.5656 4.7044 4.7515 4.8734 4.9141 4.9195 5.0645 5.1162 5.1601 5.3750 5.4067 5.5071 5.5416 5.5682 5.6173 5.7418 5.9814 6.1482 6.2531 6.5123 6.5367 7.1346 7.2107 7.3764 7.3885 7.5001 7.5966 7.6949 7.7861 8.1881 8.2669 8.3923 8.4291 k =-0.4383 0.3718-0.0000 ( 14054 PWs) bands (ev): -6.2631 -6.2614 -6.1926 -6.1916 -5.6232 -5.6221 -5.4839 -5.4836 -4.4429 -4.4414 -4.3858 -4.3848 -3.6241 -3.6218 -3.4431 -3.4427 -1.1249 -1.1207 -0.3269 -0.3190 1.6557 1.6566 1.7917 1.8243 2.2143 2.2196 2.3040 2.3541 2.6165 2.6260 3.1713 3.2399 3.4332 3.4456 3.5329 3.5571 3.6908 3.6921 3.8171 3.8634 4.3553 4.3667 4.4809 4.5324 4.6935 4.7050 4.8570 4.8843 4.9095 5.0508 5.0849 5.1632 5.3357 5.3675 5.4465 5.4838 5.5209 5.5841 5.6772 5.9270 6.1030 6.2139 6.4693 6.4891 7.1846 7.2610 7.4138 7.4334 7.5023 7.5936 7.7447 7.8360 8.1826 8.2713 8.4446 8.4771 k =-0.4321 0.3965-0.0000 ( 14056 PWs) bands (ev): -6.2502 -6.2483 -6.1742 -6.1731 -5.6068 -5.6057 -5.4609 -5.4607 -4.4317 -4.4301 -4.3724 -4.3713 -3.6199 -3.6175 -3.4337 -3.4332 -1.1377 -1.1331 -0.3495 -0.3411 1.6460 1.6473 1.8094 1.8462 2.2346 2.2409 2.3136 2.3697 2.6303 2.6418 3.1276 3.1955 3.3856 3.4052 3.4612 3.4918 3.6295 3.6423 3.7738 3.8259 4.2852 4.3189 4.4483 4.4872 4.6452 4.6548 4.8411 4.8767 4.8857 5.0403 5.0641 5.1587 5.2988 5.3374 5.3698 5.4388 5.4713 5.5360 5.6379 5.8773 6.0571 6.1727 6.4224 6.4379 7.2327 7.3085 7.4281 7.4676 7.5239 7.5970 7.7936 7.8836 8.1769 8.2733 8.4892 8.5189 k =-0.4260 0.4212-0.0000 ( 14032 PWs) bands (ev): -6.2363 -6.2343 -6.1545 -6.1533 -5.5889 -5.5877 -5.4359 -5.4357 -4.4197 -4.4180 -4.3579 -4.3567 -3.6157 -3.6131 -3.4236 -3.4231 -1.1522 -1.1473 -0.3752 -0.3662 1.6345 1.6361 1.8288 1.8698 2.2564 2.2638 2.3237 2.3857 2.6428 2.6570 3.0803 3.1433 3.3416 3.3714 3.3925 3.4263 3.5716 3.5923 3.7341 3.7904 4.2113 4.2633 4.4081 4.4308 4.5765 4.5941 4.8398 4.8467 4.8732 5.0303 5.0549 5.1412 5.2629 5.2858 5.3192 5.4003 5.4179 5.4836 5.6171 5.8318 6.0104 6.1298 6.3723 6.3836 7.2768 7.3520 7.4244 7.4836 7.5613 7.6151 7.8409 7.9288 8.1720 8.2747 8.5257 8.5532 k =-0.4198 0.4459-0.0000 ( 14018 PWs) bands (ev): -6.2214 -6.2193 -6.1334 -6.1322 -5.5693 -5.5682 -5.4088 -5.4086 -4.4071 -4.4053 -4.3423 -4.3410 -3.6115 -3.6087 -3.4129 -3.4124 -1.1686 -1.1634 -0.4041 -0.3946 1.6211 1.6230 1.8498 1.8950 2.2794 2.2883 2.3341 2.4019 2.6526 2.6704 3.0337 3.0883 3.2982 3.3264 3.3394 3.3611 3.5179 3.5432 3.6994 3.7577 4.1355 4.2026 4.3596 4.3651 4.5029 4.5232 4.7952 4.8442 4.8700 5.0204 5.0534 5.1086 5.2028 5.2217 5.3071 5.3661 5.3693 5.4400 5.6015 5.7891 5.9631 6.0855 6.3197 6.3268 7.3124 7.3893 7.4194 7.4855 7.6015 7.6457 7.8866 7.9716 8.1690 8.2765 8.5547 8.5805 k =-0.4136 0.4706-0.0000 ( 14010 PWs) bands (ev): -6.2057 -6.2035 -6.1113 -6.1099 -5.5482 -5.5470 -5.3796 -5.3794 -4.3940 -4.3922 -4.3257 -4.3243 -3.6074 -3.6044 -3.4017 -3.4011 -1.1869 -1.1815 -0.4363 -0.4265 1.6061 1.6081 1.8723 1.9216 2.3035 2.3141 2.3446 2.4178 2.6575 2.6805 2.9918 3.0351 3.2530 3.2645 3.2959 3.3038 3.4695 3.4964 3.6705 3.7287 4.0596 4.1391 4.2923 4.3034 4.4269 4.4488 4.7352 4.8472 4.8650 5.0112 5.0534 5.0635 5.1223 5.1691 5.2996 5.3262 5.3464 5.4054 5.5857 5.7477 5.9158 6.0400 6.2655 6.2680 7.3311 7.4150 7.4265 7.4874 7.6394 7.6798 7.9307 8.0120 8.1690 8.2799 8.5773 8.6020 k =-0.4075 0.4953-0.0000 ( 14032 PWs) bands (ev): -6.1893 -6.1869 -6.0881 -6.0866 -5.5254 -5.5242 -5.3484 -5.3482 -4.3806 -4.3787 -4.3082 -4.3067 -3.6034 -3.6003 -3.3899 -3.3893 -1.2073 -1.2016 -0.4720 -0.4619 1.5894 1.5916 1.8961 1.9495 2.3280 2.3410 2.3553 2.4329 2.6555 2.6854 2.9584 2.9869 3.2045 3.2046 3.2308 3.2647 3.4275 3.4535 3.6478 3.7038 3.9850 4.0746 4.2148 4.2410 4.3504 4.3741 4.6695 4.8403 4.8550 5.0016 5.0127 5.0460 5.0517 5.1133 5.2927 5.2985 5.3301 5.3780 5.5676 5.7062 5.8689 5.9938 6.2078 6.2107 7.3305 7.4215 7.4500 7.5025 7.6731 7.7117 7.9734 8.0502 8.1729 8.2855 8.5946 8.6191 k =-0.4013 0.5200-0.0000 ( 14044 PWs) bands (ev): -6.1721 -6.1697 -6.0640 -6.0624 -5.5010 -5.4998 -5.3152 -5.3151 -4.3670 -4.3650 -4.2898 -4.2882 -3.5997 -3.5966 -3.3777 -3.3771 -1.2296 -1.2238 -0.5112 -0.5008 1.5714 1.5738 1.9211 1.9783 2.3515 2.3670 2.3686 2.4464 2.6447 2.6826 2.9358 2.9462 3.1452 3.1513 3.1669 3.2236 3.3927 3.4157 3.6306 3.6828 3.9129 4.0104 4.1351 4.1748 4.2743 4.3006 4.6002 4.8041 4.8418 4.9666 4.9865 5.0014 5.0092 5.0855 5.2766 5.2841 5.3183 5.3573 5.5463 5.6637 5.8229 5.9473 6.1469 6.1562 7.3210 7.4149 7.4807 7.5274 7.7019 7.7389 8.0150 8.0863 8.1811 8.2935 8.6081 8.6335 k =-0.3951 0.5447-0.0000 ( 14040 PWs) bands (ev): -6.1544 -6.1519 -6.0393 -6.0376 -5.4750 -5.4738 -5.2801 -5.2799 -4.3533 -4.3513 -4.2705 -4.2688 -3.5964 -3.5932 -3.3652 -3.3645 -1.2540 -1.2480 -0.5537 -0.5433 1.5524 1.5550 1.9471 2.0076 2.3680 2.3851 2.3964 2.4576 2.6257 2.6702 2.9143 2.9233 3.0842 3.0919 3.1077 3.1838 3.3657 3.3840 3.6174 3.6651 3.8445 3.9472 4.0555 4.1074 4.1994 4.2295 4.5284 4.7372 4.8166 4.9297 4.9333 4.9795 4.9829 5.0814 5.2558 5.2722 5.3091 5.3424 5.5211 5.6198 5.7785 5.9007 6.0857 6.1028 7.3098 7.4047 7.5122 7.5543 7.7257 7.7605 8.0558 8.1206 8.1933 8.3042 8.6189 8.6464 k =-0.3890 0.5694-0.0000 ( 14050 PWs) bands (ev): -6.1361 -6.1335 -6.0139 -6.0121 -5.4472 -5.4461 -5.2431 -5.2429 -4.3398 -4.3378 -4.2505 -4.2488 -3.5937 -3.5904 -3.3524 -3.3517 -1.2803 -1.2742 -0.5997 -0.5892 1.5328 1.5356 1.9739 2.0371 2.3773 2.4086 2.4227 2.4658 2.6013 2.6484 2.8904 2.9156 3.0209 3.0329 3.0515 3.1477 3.3467 3.3592 3.6062 3.6496 3.7808 3.8853 3.9786 4.0417 4.1263 4.1616 4.4548 4.6536 4.7741 4.8640 4.9064 4.9656 4.9745 5.0815 5.2344 5.2563 5.3010 5.3321 5.4920 5.5745 5.7360 5.8541 6.0248 6.0513 7.2997 7.3946 7.5423 7.5803 7.7449 7.7767 8.0959 8.1528 8.2091 8.3175 8.6280 8.6586 k =-0.3828 0.5941-0.0000 ( 14046 PWs) bands (ev): -6.1175 -6.1148 -5.9882 -5.9863 -5.4178 -5.4167 -5.2042 -5.2041 -4.3266 -4.3246 -4.2299 -4.2280 -3.5916 -3.5883 -3.3394 -3.3387 -1.3085 -1.3022 -0.6488 -0.6383 1.5130 1.5161 2.0012 2.0660 2.3832 2.4324 2.4417 2.4727 2.5756 2.6195 2.8712 2.8994 2.9570 2.9902 2.9962 3.1163 3.3351 3.3421 3.5940 3.6347 3.7225 3.8248 3.9073 3.9804 4.0560 4.0977 4.3802 4.5631 4.7211 4.7955 4.8924 4.9450 4.9752 5.0817 5.2123 5.2359 5.2926 5.3248 5.4591 5.5287 5.6959 5.8077 5.9648 6.0023 7.2920 7.3861 7.5702 7.6048 7.7601 7.7884 8.1355 8.1831 8.2273 8.3333 8.6360 8.6706 k =-0.3766 0.6187-0.0000 ( 14056 PWs) bands (ev): -6.0985 -6.0958 -5.9624 -5.9604 -5.3866 -5.3856 -5.1636 -5.1635 -4.3139 -4.3119 -4.2087 -4.2068 -3.5903 -3.5869 -3.3264 -3.3256 -1.3383 -1.3320 -0.7009 -0.6905 1.4935 1.4971 2.0286 2.0933 2.3856 2.4404 2.4546 2.4837 2.5555 2.5868 2.8502 2.8612 2.8983 2.9430 2.9782 3.0896 3.3296 3.3322 3.5774 3.6192 3.6707 3.7654 3.8454 3.9260 3.9901 4.0385 4.3053 4.4700 4.6650 4.7302 4.8813 4.9199 4.9767 5.0810 5.1894 5.2110 5.2823 5.3193 5.4227 5.4842 5.6583 5.7614 5.9060 5.9563 7.2873 7.3798 7.5956 7.6275 7.7722 7.7966 8.1744 8.2111 8.2472 8.3516 8.6436 8.6825 k =-0.3705 0.6434-0.0000 ( 14064 PWs) bands (ev): -6.0793 -6.0766 -5.9365 -5.9344 -5.3537 -5.3527 -5.1212 -5.1211 -4.3020 -4.3000 -4.1871 -4.1852 -3.5899 -3.5865 -3.3134 -3.3126 -1.3695 -1.3632 -0.7556 -0.7454 1.4747 1.4788 2.0558 2.1171 2.3832 2.4204 2.4741 2.4820 2.5533 2.5535 2.8123 2.8153 2.8620 2.8934 2.9845 3.0667 3.3279 3.3281 3.5527 3.6018 3.6264 3.7076 3.7964 3.8790 3.9308 3.9852 4.2309 4.3764 4.6095 4.6690 4.8697 4.8897 4.9767 5.0790 5.1658 5.1820 5.2686 5.3143 5.3841 5.4436 5.6229 5.7151 5.8492 5.9136 7.2857 7.3759 7.6186 7.6484 7.7819 7.8024 8.2124 8.2366 8.2682 8.3722 8.6506 8.6939 k =-0.3643 0.6681-0.0000 ( 14062 PWs) bands (ev): -6.0600 -6.0573 -5.9108 -5.9086 -5.3191 -5.3182 -5.0772 -5.0772 -4.2911 -4.2890 -4.1652 -4.1632 -3.5905 -3.5872 -3.3005 -3.2997 -1.4019 -1.3955 -0.8126 -0.8027 1.4569 1.4618 2.0817 2.1347 2.3749 2.3886 2.4566 2.4904 2.5201 2.5707 2.7647 2.7754 2.8454 2.8497 2.9972 3.0464 3.3262 3.3277 3.5197 3.5826 3.5906 3.6526 3.7617 3.8368 3.8829 3.9388 4.1578 4.2839 4.5566 4.6127 4.8546 4.8555 4.9737 5.0752 5.1411 5.1495 5.2499 5.3082 5.3454 5.4099 5.5888 5.6686 5.7954 5.8742 7.2873 7.3744 7.6392 7.6677 7.7903 7.8069 8.2486 8.2598 8.2904 8.3949 8.6572 8.7043 k =-0.3581 0.6928-0.0000 ( 14028 PWs) bands (ev): -6.0408 -6.0380 -5.8854 -5.8832 -5.2828 -5.2819 -5.0317 -5.0317 -4.2814 -4.2794 -4.1432 -4.1412 -3.5922 -3.5890 -3.2878 -3.2870 -1.4350 -1.4287 -0.8715 -0.8620 1.4406 1.4465 2.1048 2.1415 2.3504 2.3617 2.4153 2.4853 2.5046 2.5938 2.7262 2.7453 2.8134 2.8349 3.0124 3.0276 3.3227 3.3244 3.4833 3.5630 3.5642 3.6025 3.7379 3.7956 3.8504 3.9010 4.0873 4.1935 4.5074 4.5619 4.8148 4.8369 4.9668 5.0695 5.1147 5.1147 5.2264 5.2925 5.3161 5.3844 5.5546 5.6223 5.7457 5.8378 7.2918 7.3749 7.6574 7.6851 7.7979 7.8110 8.2808 8.2814 8.3151 8.4195 8.6630 8.7134 k =-0.3520 0.7175-0.0000 ( 14058 PWs) bands (ev): -6.0217 -6.0189 -5.8606 -5.8584 -5.2448 -5.2440 -4.9847 -4.9847 -4.2732 -4.2712 -4.1213 -4.1192 -3.5952 -3.5921 -3.2755 -3.2746 -1.4685 -1.4623 -0.9319 -0.9227 1.4259 1.4331 2.1216 2.1331 2.3110 2.3445 2.3637 2.4516 2.5163 2.6165 2.7012 2.7234 2.7861 2.8281 3.0092 3.0281 3.3127 3.3141 3.4501 3.5440 3.5491 3.5612 3.7192 3.7578 3.8302 3.8732 4.0209 4.1066 4.4628 4.5170 4.7707 4.8117 4.9555 5.0608 5.0787 5.0863 5.2007 5.2602 5.3048 5.3662 5.5185 5.5763 5.7019 5.8043 7.2988 7.3774 7.6731 7.7007 7.8056 7.8152 8.3001 8.3089 8.3442 8.4454 8.6679 8.7204 k =-0.3458 0.7422-0.0000 ( 14066 PWs) bands (ev): -6.0028 -6.0001 -5.8365 -5.8343 -5.2052 -5.2044 -4.9364 -4.9363 -4.2667 -4.2648 -4.0996 -4.0975 -3.5995 -3.5965 -3.2636 -3.2627 -1.5020 -1.4959 -0.9932 -0.9844 1.4131 1.4218 2.1079 2.1247 2.2754 2.3096 2.3165 2.4289 2.5274 2.6356 2.6868 2.7068 2.7682 2.8244 2.9907 3.0428 3.2946 3.2950 3.4243 3.5147 3.5426 3.5458 3.7011 3.7278 3.8156 3.8560 3.9615 4.0247 4.4236 4.4784 4.7230 4.7782 4.9405 5.0424 5.0432 5.0620 5.1756 5.2275 5.2961 5.3529 5.4796 5.5311 5.6651 5.7731 7.3078 7.3813 7.6864 7.7143 7.8139 7.8201 8.3180 8.3318 8.3768 8.4722 8.6716 8.7251 k =-0.3396 0.7669-0.0000 ( 14058 PWs) bands (ev): -5.9843 -5.9817 -5.8133 -5.8111 -5.1640 -5.1633 -4.8869 -4.8868 -4.2623 -4.2604 -4.0784 -4.0764 -3.6051 -3.6022 -3.2522 -3.2513 -1.5349 -1.5289 -1.0550 -1.0467 1.4021 1.4128 2.0694 2.1053 2.2294 2.2713 2.2805 2.4253 2.5373 2.6457 2.6776 2.6963 2.7592 2.8231 2.9727 3.0542 3.2701 3.2719 3.4066 3.4836 3.5374 3.5516 3.6819 3.7081 3.7995 3.8478 3.9147 3.9503 4.3901 4.4461 4.6724 4.7355 4.9231 5.0085 5.0086 5.0480 5.1530 5.1984 5.2853 5.3424 5.4382 5.4873 5.6356 5.7439 7.3184 7.3862 7.6973 7.7260 7.8234 7.8260 8.3352 8.3524 8.4109 8.4994 8.6742 8.7275 k =-0.3335 0.7916-0.0000 ( 14062 PWs) bands (ev): -5.9663 -5.9638 -5.7911 -5.7889 -5.1214 -5.1207 -4.8363 -4.8362 -4.2601 -4.2583 -4.0581 -4.0561 -3.6120 -3.6093 -3.2414 -3.2405 -1.5668 -1.5609 -1.1167 -1.1089 1.3931 1.4061 2.0226 2.0660 2.1683 2.2158 2.2817 2.4334 2.5441 2.6407 2.6705 2.6950 2.7582 2.8225 2.9570 3.0584 3.2466 3.2492 3.3962 3.4583 3.5351 3.5609 3.6621 3.6979 3.7762 3.8444 3.8876 3.8882 4.3629 4.4199 4.6197 4.6845 4.9045 4.9695 4.9753 5.0352 5.1333 5.1724 5.2704 5.3330 5.3969 5.4457 5.6124 5.7161 7.3298 7.3918 7.7055 7.7357 7.8329 7.8346 8.3521 8.3723 8.4451 8.5265 8.6759 8.7278 k =-0.3273 0.8163-0.0000 ( 14062 PWs) bands (ev): -5.9490 -5.9465 -5.7700 -5.7679 -5.0774 -5.0768 -4.7848 -4.7847 -4.2604 -4.2586 -4.0391 -4.0371 -3.6202 -3.6177 -3.2314 -3.2305 -1.5971 -1.5915 -1.1779 -1.1706 1.3859 1.4017 1.9715 2.0165 2.1055 2.1571 2.2917 2.4451 2.5442 2.6246 2.6662 2.6967 2.7650 2.8194 2.9475 3.0506 3.2295 3.2323 3.3926 3.4401 3.5327 3.5663 3.6439 3.6880 3.7546 3.8259 3.8604 3.8797 4.3421 4.3990 4.5658 4.6274 4.8855 4.9298 4.9430 5.0210 5.1160 5.1484 5.2492 5.3238 5.3598 5.4069 5.5940 5.6895 7.3417 7.3977 7.7111 7.7433 7.8409 7.8476 8.3689 8.3922 8.4789 8.5533 8.6771 8.7267 k =-0.3211 0.8410-0.0000 ( 14078 PWs) bands (ev): -5.9324 -5.9300 -5.7502 -5.7481 -5.0323 -5.0317 -4.7325 -4.7324 -4.2634 -4.2617 -4.0217 -4.0199 -3.6293 -3.6271 -3.2222 -3.2213 -1.6254 -1.6200 -1.2380 -1.2313 1.3805 1.3996 1.9189 1.9636 2.0443 2.0990 2.3015 2.4550 2.5341 2.6037 2.6678 2.6959 2.7779 2.8101 2.9485 3.0295 3.2135 3.2302 3.3947 3.4303 3.5301 3.5607 3.6293 3.6628 3.7553 3.7997 3.8626 3.8834 4.3272 4.3815 4.5130 4.5666 4.8665 4.8913 4.9119 5.0045 5.1007 5.1250 5.2210 5.3138 5.3300 5.3717 5.5791 5.6636 7.3535 7.4036 7.7136 7.7485 7.8502 7.8631 8.3862 8.4129 8.5120 8.5796 8.6783 8.7250 k =-0.3149 0.8657-0.0000 ( 14066 PWs) bands (ev): -5.9166 -5.9144 -5.7317 -5.7297 -4.9862 -4.9856 -4.6798 -4.6796 -4.2694 -4.2677 -4.0067 -4.0050 -3.6392 -3.6371 -3.2138 -3.2130 -1.6512 -1.6461 -1.2965 -1.2904 1.3767 1.3995 1.8664 1.9104 1.9860 2.0433 2.3063 2.4571 2.5166 2.5810 2.6758 2.6922 2.7944 2.7944 2.9608 2.9999 3.2009 3.2369 3.3999 3.4297 3.5283 3.5455 3.6175 3.6286 3.7743 3.7932 3.8681 3.8937 4.3174 4.3624 4.4660 4.5050 4.8477 4.8556 4.8821 4.9848 5.0869 5.1012 5.1884 5.3016 5.3072 5.3413 5.5665 5.6383 7.3650 7.4093 7.7127 7.7511 7.8609 7.8811 8.4041 8.4347 8.5441 8.6049 8.6794 8.7236 k =-0.3088 0.8904-0.0000 ( 14046 PWs) bands (ev): -5.9019 -5.8998 -5.7146 -5.7128 -4.9393 -4.9387 -4.6266 -4.6265 -4.2783 -4.2767 -3.9948 -3.9932 -3.6491 -3.6474 -3.2065 -3.2056 -1.6741 -1.6692 -1.3530 -1.3475 1.3742 1.4012 1.8155 1.8586 1.9316 1.9914 2.3028 2.4409 2.5036 2.5591 2.6853 2.6859 2.7771 2.8128 2.9680 2.9818 3.1910 3.2478 3.4038 3.4372 3.5288 3.5292 3.5959 3.6086 3.8017 3.8040 3.8725 3.9077 4.3108 4.3323 4.4343 4.4458 4.8231 4.8297 4.8541 4.9612 5.0748 5.0770 5.1563 5.2845 5.2887 5.3180 5.5557 5.6134 7.3759 7.4149 7.7082 7.7503 7.8734 7.9020 8.4229 8.4578 8.5749 8.6290 8.6801 8.7231 k =-0.3026 0.9151-0.0000 ( 14058 PWs) bands (ev): -5.8883 -5.8864 -5.6991 -5.6974 -4.8918 -4.8912 -4.5735 -4.5734 -4.2903 -4.2888 -3.9869 -3.9855 -3.6586 -3.6571 -3.2001 -3.1993 -1.6937 -1.6891 -1.4071 -1.4021 1.3728 1.4044 1.7670 1.8093 1.8819 1.9442 2.2887 2.4056 2.4989 2.5402 2.6743 2.6888 2.7675 2.8316 2.9394 3.0074 3.1839 3.2608 3.4033 3.4483 3.5172 3.5325 3.5711 3.6078 3.8250 3.8335 3.8737 3.9232 4.2883 4.3023 4.3950 4.4216 4.7939 4.8131 4.8286 4.9333 5.0534 5.0644 5.1273 5.2620 5.2725 5.3019 5.5460 5.5888 7.3862 7.4204 7.6996 7.7458 7.8878 7.9256 8.4427 8.4826 8.6041 8.6513 8.6779 8.7241 k =-0.2964 0.9397-0.0000 ( 14052 PWs) bands (ev): -5.8760 -5.8742 -5.6851 -5.6836 -4.8440 -4.8434 -4.5206 -4.5205 -4.3054 -4.3039 -3.9840 -3.9828 -3.6666 -3.6655 -3.1948 -3.1941 -1.7096 -1.7054 -1.4582 -1.4539 1.3724 1.4087 1.7215 1.7632 1.8378 1.9024 2.2635 2.3604 2.4955 2.5254 2.6577 2.6765 2.7739 2.8474 2.9203 3.0335 3.1807 3.2760 3.4003 3.4540 3.5074 3.5373 3.5650 3.6205 3.8497 3.8678 3.8711 3.9373 4.2393 4.2809 4.3644 4.4203 4.7674 4.7984 4.8067 4.9025 5.0317 5.0561 5.1016 5.2372 5.2576 5.2893 5.5372 5.5643 7.3962 7.4259 7.6870 7.7371 7.9044 7.9519 8.4634 8.5088 8.6307 8.6649 8.6701 8.7268 k =-0.2903 0.9644-0.0000 ( 14042 PWs) bands (ev): -5.8650 -5.8634 -5.6727 -5.6714 -4.7961 -4.7955 -4.4686 -4.4686 -4.3232 -4.3217 -3.9871 -3.9861 -3.6726 -3.6718 -3.1906 -3.1899 -1.7216 -1.7177 -1.5061 -1.5024 1.3726 1.4138 1.6795 1.7209 1.7998 1.8665 2.2286 2.3105 2.4902 2.5147 2.6347 2.6540 2.7912 2.8522 2.9201 3.0544 3.1854 3.2940 3.3993 3.4471 3.4977 3.5411 3.5849 3.6459 3.8533 3.8850 3.9030 3.9461 4.1946 4.2446 4.3567 4.4247 4.7421 4.7862 4.7895 4.8721 5.0124 5.0499 5.0786 5.2122 5.2440 5.2779 5.5289 5.5401 7.4058 7.4316 7.6703 7.7240 7.9231 7.9804 8.4845 8.5361 8.6294 8.6592 8.6794 8.7310 k =-0.2841 0.9891-0.0000 ( 14034 PWs) bands (ev): -5.8555 -5.8541 -5.6620 -5.6609 -4.7486 -4.7479 -4.4193 -4.4192 -4.3423 -4.3407 -3.9968 -3.9961 -3.6759 -3.6754 -3.1874 -3.1868 -1.7294 -1.7260 -1.5503 -1.5472 1.3735 1.4191 1.6415 1.6827 1.7687 1.8368 2.1863 2.2579 2.4824 2.5073 2.6056 2.6285 2.8125 2.8457 2.9389 3.0645 3.2024 3.3152 3.4033 3.4315 3.4892 3.5505 3.6182 3.6793 3.8350 3.9144 3.9287 3.9527 4.1629 4.2063 4.3593 4.4318 4.7167 4.7770 4.7780 4.8456 4.9954 5.0459 5.0572 5.1877 5.2318 5.2669 5.5164 5.5213 7.4154 7.4377 7.6497 7.7066 7.9437 8.0108 8.5043 8.5585 8.5945 8.6638 8.6795 8.7295 k =-0.2779 1.0138-0.0000 ( 14038 PWs) bands (ev): -5.8477 -5.8465 -5.6529 -5.6520 -4.7016 -4.7009 -4.3884 -4.3883 -4.3467 -4.3454 -4.0133 -4.0128 -3.6765 -3.6763 -3.1852 -3.1847 -1.7329 -1.7299 -1.5905 -1.5881 1.3750 1.4242 1.6076 1.6489 1.7449 1.8135 2.1392 2.2039 2.4719 2.5027 2.5716 2.6035 2.8345 2.8366 2.9666 3.0643 3.2309 3.3395 3.4126 3.4138 3.4838 3.5653 3.6557 3.7145 3.8108 3.9143 3.9451 3.9838 4.1495 4.1730 4.3652 4.4403 4.6904 4.7693 4.7742 4.8256 4.9802 5.0369 5.0441 5.1639 5.2217 5.2559 5.4934 5.5141 7.4252 7.4444 7.6256 7.6852 7.9660 8.0426 8.5178 8.5343 8.6036 8.6375 8.6966 8.7342 k =-0.2718 1.0385-0.0000 ( 14026 PWs) bands (ev): -5.8416 -5.8406 -5.6456 -5.6449 -4.6554 -4.6547 -4.4050 -4.4042 -4.3079 -4.3073 -4.0364 -4.0360 -3.6748 -3.6747 -3.1841 -3.1837 -1.7320 -1.7295 -1.6265 -1.6248 1.3772 1.4289 1.5780 1.6196 1.7286 1.7965 2.0892 2.1494 2.4587 2.5007 2.5345 2.5815 2.8283 2.8555 2.9978 3.0583 3.2655 3.3648 3.3982 3.4261 3.4829 3.5848 3.6897 3.7340 3.7988 3.8861 3.9754 4.0200 4.1467 4.1517 4.3722 4.4493 4.6640 4.7644 4.7769 4.8125 4.9667 5.0177 5.0445 5.1416 5.2145 5.2447 5.4715 5.5074 7.4351 7.4517 7.5985 7.6602 7.9898 8.0752 8.4906 8.5139 8.6271 8.6320 8.7075 8.7362 k =-0.2656 1.0632-0.0000 ( 14008 PWs) bands (ev): -5.8373 -5.8365 -5.6399 -5.6395 -4.6105 -4.6098 -4.4334 -4.4325 -4.2615 -4.2612 -4.0653 -4.0650 -3.6713 -3.6712 -3.1839 -3.1836 -1.7266 -1.7247 -1.6581 -1.6569 1.3805 1.4333 1.5527 1.5948 1.7198 1.7853 2.0382 2.0951 2.4422 2.4947 2.5022 2.5643 2.8213 2.8745 3.0302 3.0500 3.3010 3.3733 3.4032 3.4419 3.4869 3.6080 3.7060 3.7162 3.8226 3.8690 4.0042 4.0544 4.1290 4.1634 4.3799 4.4585 4.6390 4.7618 4.7848 4.8050 4.9545 5.0000 5.0469 5.1218 5.2108 5.2333 5.4512 5.5014 7.4452 7.4597 7.5691 7.6321 8.0147 8.1082 8.4464 8.4891 8.6390 8.6581 8.7064 8.7260 k =-0.2656 1.0632-0.0000 ( 14008 PWs) bands (ev): -5.8373 -5.8365 -5.6399 -5.6395 -4.6105 -4.6098 -4.4334 -4.4325 -4.2615 -4.2612 -4.0653 -4.0650 -3.6713 -3.6712 -3.1839 -3.1836 -1.7266 -1.7247 -1.6581 -1.6569 1.3805 1.4333 1.5527 1.5948 1.7198 1.7853 2.0382 2.0951 2.4422 2.4947 2.5022 2.5643 2.8213 2.8745 3.0302 3.0500 3.3010 3.3733 3.4032 3.4419 3.4869 3.6080 3.7060 3.7162 3.8226 3.8690 4.0042 4.0544 4.1290 4.1634 4.3799 4.4585 4.6390 4.7618 4.7848 4.8050 4.9545 5.0000 5.0469 5.1218 5.2108 5.2333 5.4512 5.5014 7.4452 7.4597 7.5691 7.6321 8.0147 8.1082 8.4464 8.4891 8.6390 8.6581 8.7064 8.7260 k =-0.2656 1.0632 0.0249 ( 14012 PWs) bands (ev): -5.8368 -5.8360 -5.6405 -5.6401 -4.6101 -4.6094 -4.4340 -4.4330 -4.2610 -4.2606 -4.0659 -4.0656 -3.6699 -3.6699 -3.1853 -3.1849 -1.7261 -1.7242 -1.6580 -1.6568 1.3813 1.4340 1.5526 1.5943 1.7204 1.7858 2.0374 2.0940 2.4443 2.4954 2.5050 2.5663 2.8185 2.8728 3.0219 3.0345 3.3076 3.3719 3.4085 3.4407 3.4839 3.5897 3.7249 3.7280 3.8284 3.8695 4.0045 4.0576 4.1253 4.1597 4.3797 4.4565 4.6380 4.7593 4.7878 4.8064 4.9585 4.9990 5.0434 5.1285 5.2128 5.2329 5.4504 5.5010 7.4433 7.4577 7.5661 7.6287 8.0109 8.1025 8.4464 8.4892 8.6420 8.6602 8.7067 8.7261 k =-0.2656 1.0632 0.0498 ( 14012 PWs) bands (ev): -5.8354 -5.8346 -5.6424 -5.6420 -4.6089 -4.6082 -4.4357 -4.4348 -4.2595 -4.2591 -4.0676 -4.0674 -3.6658 -3.6657 -3.1892 -3.1889 -1.7248 -1.7229 -1.6577 -1.6565 1.3836 1.4362 1.5521 1.5928 1.7223 1.7872 2.0354 2.0909 2.4501 2.4981 2.5121 2.5719 2.8100 2.8677 2.9958 2.9996 3.3189 3.3685 3.4209 3.4303 3.4865 3.5565 3.7461 3.7724 3.8465 3.8711 4.0051 4.0667 4.1151 4.1493 4.3790 4.4507 4.6362 4.7544 4.7945 4.8103 4.9687 4.9966 5.0365 5.1446 5.2190 5.2320 5.4482 5.4997 7.4375 7.4518 7.5575 7.6188 8.0000 8.0868 8.4457 8.4881 8.6504 8.6655 8.7073 8.7264 k =-0.2656 1.0632 0.0747 ( 14022 PWs) bands (ev): -5.8331 -5.8323 -5.6455 -5.6451 -4.6069 -4.6062 -4.4385 -4.4376 -4.2569 -4.2566 -4.0705 -4.0703 -3.6590 -3.6589 -3.1958 -3.1954 -1.7226 -1.7206 -1.6573 -1.6561 1.3873 1.4396 1.5511 1.5902 1.7257 1.7898 2.0328 2.0865 2.4590 2.5027 2.5217 2.5798 2.7965 2.8594 2.9466 2.9695 3.3228 3.3634 3.4079 3.4316 3.5047 3.5275 3.7715 3.8227 3.8739 3.8780 4.0050 4.0797 4.1007 4.1359 4.3778 4.4411 4.6357 4.7496 4.8022 4.8161 4.9777 4.9976 5.0301 5.1630 5.2295 5.2324 5.4446 5.4974 7.4279 7.4420 7.5442 7.6038 7.9841 8.0646 8.4426 8.4832 8.6616 8.6723 8.7077 8.7263 k =-0.2656 1.0632 0.0995 ( 14011 PWs) bands (ev): -5.8298 -5.8290 -5.6498 -5.6493 -4.6041 -4.6034 -4.4424 -4.4416 -4.2535 -4.2531 -4.0745 -4.0742 -3.6496 -3.6495 -3.2049 -3.2045 -1.7196 -1.7176 -1.6568 -1.6556 1.3924 1.4441 1.5497 1.5864 1.7307 1.7938 2.0305 2.0819 2.4695 2.5081 2.5314 2.5872 2.7790 2.8481 2.8968 2.9378 3.3163 3.3559 3.3817 3.4292 3.5136 3.5308 3.7969 3.8713 3.8789 3.9194 4.0033 4.0863 4.0870 4.1318 4.3762 4.4286 4.6387 4.7467 4.8100 4.8235 4.9738 5.0102 5.0259 5.1748 5.2397 5.2442 5.4396 5.4940 7.4147 7.4286 7.5276 7.5851 7.9660 8.0396 8.4352 8.4724 8.6726 8.6788 8.7076 8.7257 k =-0.2656 1.0632 0.1244 ( 14010 PWs) bands (ev): -5.8257 -5.8249 -5.6551 -5.6547 -4.6005 -4.5998 -4.4473 -4.4465 -4.2490 -4.2487 -4.0795 -4.0793 -3.6377 -3.6375 -3.2163 -3.2160 -1.7159 -1.7139 -1.6562 -1.6550 1.3985 1.4493 1.5476 1.5812 1.7379 1.7995 2.0296 2.0779 2.4799 2.5106 2.5403 2.5896 2.7594 2.8332 2.8560 2.9101 3.3019 3.3447 3.3564 3.4124 3.5161 3.5576 3.8201 3.8781 3.9186 3.9583 4.0054 4.0781 4.0801 4.1505 4.3744 4.4151 4.6465 4.7468 4.8180 4.8323 4.9628 5.0235 5.0254 5.1732 5.2582 5.2628 5.4333 5.4890 7.3987 7.4122 7.5093 7.5643 7.9482 8.0153 8.4219 8.4544 8.6814 8.6841 8.7070 8.7243 k =-0.2656 1.0632 0.1493 ( 14012 PWs) bands (ev): -5.8207 -5.8199 -5.6615 -5.6610 -4.5961 -4.5955 -4.4531 -4.4523 -4.2437 -4.2434 -4.0855 -4.0853 -3.6235 -3.6233 -3.2301 -3.2297 -1.7116 -1.7096 -1.6557 -1.6544 1.4054 1.4550 1.5449 1.5746 1.7475 1.8072 2.0306 2.0752 2.4877 2.5042 2.5493 2.5818 2.7400 2.8118 2.8361 2.8913 3.2825 3.3268 3.3337 3.3938 3.5247 3.5815 3.8364 3.8756 3.9492 3.9673 4.0304 4.0786 4.0855 4.1806 4.3734 4.4042 4.6590 4.7507 4.8268 4.8422 4.9477 5.0218 5.0385 5.1613 5.2830 5.2839 5.4255 5.4823 7.3806 7.3939 7.4904 7.5426 7.9329 7.9942 8.4018 8.4286 8.6875 8.6880 8.7059 8.7223 k =-0.2656 1.0632 0.1742 ( 14004 PWs) bands (ev): -5.8149 -5.8141 -5.6688 -5.6683 -4.5910 -4.5905 -4.4597 -4.4590 -4.2376 -4.2372 -4.0923 -4.0922 -3.6071 -3.6069 -3.2460 -3.2456 -1.7068 -1.7048 -1.6554 -1.6540 1.4129 1.4607 1.5414 1.5668 1.7599 1.8174 2.0340 2.0740 2.4856 2.4883 2.5586 2.5633 2.7218 2.7939 2.8326 2.8847 3.2605 3.3009 3.3140 3.3804 3.5337 3.6018 3.8387 3.8659 3.9593 3.9629 4.0524 4.0949 4.1209 4.2131 4.3750 4.4012 4.6759 4.7583 4.8370 4.8525 4.9293 5.0199 5.0491 5.1436 5.3053 5.3080 5.4168 5.4737 7.3620 7.3752 7.4721 7.5209 7.9217 7.9777 8.3745 8.3954 8.6909 8.6916 8.7048 8.7199 k =-0.2656 1.0632 0.1991 ( 13995 PWs) bands (ev): -5.8083 -5.8076 -5.6769 -5.6764 -4.5851 -4.5847 -4.4670 -4.4664 -4.2307 -4.2304 -4.1000 -4.0999 -3.5888 -3.5885 -3.2639 -3.2635 -1.7016 -1.6997 -1.6552 -1.6539 1.4208 1.4663 1.5373 1.5578 1.7754 1.8303 2.0395 2.0740 2.4571 2.4751 2.5421 2.5643 2.7071 2.7843 2.8403 2.8910 3.2372 3.2694 3.2978 3.3716 3.5420 3.6184 3.8258 3.8483 3.9577 3.9592 4.0677 4.1182 4.1708 4.2445 4.3821 4.4122 4.6961 4.7686 4.8489 4.8616 4.9090 5.0171 5.0583 5.1228 5.3243 5.3286 5.4081 5.4633 7.3446 7.3576 7.4551 7.4999 7.9153 7.9667 8.3405 8.3553 8.6930 8.6943 8.7036 8.7174 k =-0.2656 1.0632 0.2240 ( 13997 PWs) bands (ev): -5.8010 -5.8003 -5.6856 -5.6851 -4.5786 -4.5783 -4.4750 -4.4744 -4.2231 -4.2228 -4.1083 -4.1082 -3.5687 -3.5684 -3.2835 -3.2831 -1.6963 -1.6944 -1.6554 -1.6540 1.4289 1.4714 1.5326 1.5479 1.7944 1.8462 2.0464 2.0742 2.4238 2.4474 2.5235 2.5606 2.7011 2.7830 2.8548 2.9070 3.2142 3.2352 3.2851 3.3647 3.5496 3.6313 3.8038 3.8250 3.9542 3.9548 4.0817 4.1322 4.2215 4.2780 4.3976 4.4382 4.7181 4.7793 4.8616 4.8621 4.8938 5.0138 5.0679 5.1016 5.3386 5.3407 5.4017 5.4514 7.3303 7.3429 7.4395 7.4796 7.9140 7.9613 8.3009 8.3098 8.6947 8.6962 8.7026 8.7149 k =-0.2656 1.0632 0.2489 ( 13987 PWs) bands (ev): -5.7930 -5.7923 -5.6950 -5.6944 -4.5715 -4.5713 -4.4834 -4.4828 -4.2148 -4.2146 -4.1173 -4.1172 -3.5471 -3.5468 -3.3047 -3.3042 -1.6909 -1.6890 -1.6560 -1.6545 1.4371 1.4761 1.5275 1.5375 1.8168 1.8651 2.0529 2.0728 2.3907 2.4155 2.5033 2.5442 2.7076 2.7905 2.8706 2.9283 3.1930 3.2005 3.2757 3.3579 3.5567 3.6399 3.7796 3.7998 3.9489 3.9515 4.0913 4.1315 4.2702 4.3177 4.4224 4.4727 4.7396 4.7874 4.8438 4.8718 4.8956 5.0111 5.0790 5.0837 5.3414 5.3465 5.3999 5.4382 7.3206 7.3325 7.4254 7.4601 7.9180 7.9614 8.2575 8.2606 8.6962 8.6975 8.7019 8.7126 k =-0.2656 1.0632 0.2738 ( 13974 PWs) bands (ev): -5.7845 -5.7838 -5.7048 -5.7042 -4.5639 -4.5637 -4.4922 -4.4917 -4.2061 -4.2058 -4.1267 -4.1267 -3.5243 -3.5239 -3.3272 -3.3267 -1.6856 -1.6837 -1.6570 -1.6555 1.4453 1.4802 1.5222 1.5271 1.8424 1.8867 2.0568 2.0674 2.3625 2.3883 2.4788 2.5184 2.7242 2.8053 2.8835 2.9500 3.1679 3.1752 3.2698 3.3494 3.5638 3.6428 3.7580 3.7761 3.9432 3.9498 4.0944 4.1209 4.3173 4.3616 4.4538 4.5079 4.7574 4.7903 4.8189 4.8746 4.9058 5.0106 5.0736 5.0918 5.3343 5.3481 5.3996 5.4239 7.3166 7.3271 7.4122 7.4412 7.9273 7.9670 8.2097 8.2123 8.6975 8.6984 8.7013 8.7104 k =-0.2656 1.0632 0.2986 ( 13974 PWs) bands (ev): -5.7754 -5.7747 -5.7148 -5.7142 -4.5557 -4.5557 -4.5013 -4.5009 -4.1968 -4.1965 -4.1365 -4.1365 -3.5004 -3.5000 -3.3507 -3.3503 -1.6805 -1.6787 -1.6585 -1.6570 1.4536 1.4836 1.5169 1.5170 1.8708 1.9106 2.0550 2.0556 2.3436 2.3709 2.4517 2.4884 2.7468 2.8234 2.8919 2.9667 3.1409 3.1615 3.2679 3.3385 3.5715 3.6389 3.7422 3.7564 3.9392 3.9487 4.0920 4.1068 4.3631 4.4048 4.4867 4.5367 4.7663 4.7866 4.7986 4.8666 4.9209 5.0106 5.0752 5.1048 5.3257 5.3453 5.3970 5.4088 7.3186 7.3268 7.3998 7.4225 7.9420 7.9778 8.1594 8.1675 8.6988 8.6990 8.7010 8.7084 k =-0.2656 1.0632 0.3235 ( 13972 PWs) bands (ev): -5.7658 -5.7651 -5.7251 -5.7245 -4.5472 -4.5471 -4.5106 -4.5102 -4.1871 -4.1869 -4.1466 -4.1465 -3.4758 -3.4754 -3.3751 -3.3747 -1.6758 -1.6741 -1.6605 -1.6590 1.4620 1.4856 1.5084 1.5119 1.9011 1.9353 2.0374 2.0455 2.3368 2.3644 2.4253 2.4580 2.7719 2.8366 2.9000 2.9715 3.1250 3.1507 3.2711 3.3249 3.5802 3.6290 3.7328 3.7419 3.9380 3.9474 4.0870 4.0938 4.4061 4.4416 4.5160 4.5536 4.7609 4.7767 4.7944 4.8506 4.9404 5.0066 5.0875 5.1150 5.3204 5.3402 5.3912 5.3939 7.3257 7.3308 7.3882 7.4044 7.9620 7.9935 8.1124 8.1252 8.6994 8.6997 8.7012 8.7066 k =-0.2656 1.0632 0.3484 ( 13984 PWs) bands (ev): -5.7560 -5.7553 -5.7355 -5.7348 -4.5384 -4.5382 -4.5198 -4.5196 -4.1772 -4.1770 -4.1567 -4.1566 -3.4507 -3.4503 -3.4001 -3.3996 -1.6716 -1.6702 -1.6629 -1.6615 1.4704 1.4843 1.5037 1.5075 1.9315 1.9562 2.0173 2.0294 2.3417 2.3630 2.4072 2.4306 2.7971 2.8350 2.9165 2.9609 3.1231 3.1406 3.2799 3.3092 3.5905 3.6159 3.7287 3.7328 3.9394 3.9453 4.0825 4.0847 4.4424 4.4644 4.5379 4.5570 4.7538 4.7642 4.8015 4.8318 4.9618 4.9969 5.1031 5.1190 5.3208 5.3340 5.3829 5.3842 7.3352 7.3370 7.3789 7.3879 7.9870 8.0115 8.0727 8.0879 8.6997 8.6999 8.7021 8.7050 k =-0.2656 1.0632 0.3733 ( 13990 PWs) bands (ev): -5.7461 -5.7461 -5.7448 -5.7448 -4.5304 -4.5304 -4.5278 -4.5278 -4.1681 -4.1681 -4.1658 -4.1658 -3.4254 -3.4254 -3.4249 -3.4249 -1.6688 -1.6688 -1.6637 -1.6637 1.4783 1.4783 1.5042 1.5042 1.9560 1.9560 2.0135 2.0135 2.3539 2.3539 2.4104 2.4104 2.8195 2.8195 2.9397 2.9397 3.1304 3.1304 3.2934 3.2934 3.6026 3.6026 3.7287 3.7287 3.9423 3.9423 4.0811 4.0811 4.4647 4.4647 4.5510 4.5510 4.7550 4.7550 4.8145 4.8145 4.9816 4.9816 5.1149 5.1149 5.3266 5.3266 5.3799 5.3799 7.3406 7.3406 7.3773 7.3773 8.0123 8.0123 8.0615 8.0615 8.6999 8.6999 8.7035 8.7035 k =-0.2656 1.0632 0.3733 ( 13990 PWs) bands (ev): -5.7461 -5.7461 -5.7448 -5.7448 -4.5304 -4.5304 -4.5278 -4.5278 -4.1681 -4.1681 -4.1658 -4.1658 -3.4254 -3.4254 -3.4249 -3.4249 -1.6688 -1.6688 -1.6637 -1.6637 1.4783 1.4783 1.5042 1.5042 1.9560 1.9560 2.0135 2.0135 2.3539 2.3539 2.4104 2.4104 2.8195 2.8195 2.9397 2.9397 3.1304 3.1304 3.2934 3.2934 3.6026 3.6026 3.7287 3.7287 3.9423 3.9423 4.0811 4.0811 4.4647 4.4647 4.5510 4.5510 4.7550 4.7550 4.8145 4.8145 4.9816 4.9816 5.1149 5.1149 5.3266 5.3266 5.3799 5.3799 7.3406 7.3406 7.3773 7.3773 8.0123 8.0123 8.0615 8.0615 8.6999 8.6999 8.7035 8.7035 k =-0.2718 1.0385 0.3733 ( 13990 PWs) bands (ev): -5.7510 -5.7510 -5.7491 -5.7491 -4.5632 -4.5632 -4.5603 -4.5603 -4.1517 -4.1517 -4.1496 -4.1496 -3.4279 -3.4279 -3.4274 -3.4274 -1.6573 -1.6573 -1.6502 -1.6502 1.4969 1.4969 1.5254 1.5254 1.9658 1.9658 2.0240 2.0240 2.3678 2.3678 2.4269 2.4269 2.8352 2.8352 2.9314 2.9314 3.1236 3.1236 3.2719 3.2719 3.6167 3.6167 3.7222 3.7222 3.9233 3.9233 4.0563 4.0563 4.4844 4.4844 4.5776 4.5776 4.7465 4.7465 4.7996 4.7996 4.9667 4.9667 5.1150 5.1150 5.3365 5.3365 5.3956 5.3956 7.3455 7.3455 7.3816 7.3816 8.0217 8.0217 8.0696 8.0696 8.6859 8.6859 8.6891 8.6891 k =-0.2779 1.0138 0.3733 ( 14006 PWs) bands (ev): -5.7575 -5.7575 -5.7551 -5.7551 -4.6020 -4.6020 -4.5989 -4.5989 -4.1339 -4.1339 -4.1320 -4.1320 -3.4311 -3.4311 -3.4306 -3.4306 -1.6416 -1.6416 -1.6326 -1.6326 1.5199 1.5199 1.5513 1.5513 1.9739 1.9739 2.0333 2.0333 2.3841 2.3841 2.4459 2.4459 2.8496 2.8496 2.9239 2.9239 3.1189 3.1189 3.2508 3.2508 3.6330 3.6330 3.7172 3.7172 3.9127 3.9127 4.0341 4.0341 4.4949 4.4949 4.6003 4.6003 4.7342 4.7342 4.7959 4.7959 4.9572 4.9572 5.1165 5.1165 5.3501 5.3501 5.4138 5.4138 7.3509 7.3509 7.3863 7.3863 8.0331 8.0331 8.0797 8.0797 8.6671 8.6671 8.6726 8.6726 k =-0.2841 0.9891 0.3733 ( 13994 PWs) bands (ev): -5.7657 -5.7657 -5.7628 -5.7628 -4.6449 -4.6449 -4.6416 -4.6416 -4.1162 -4.1162 -4.1147 -4.1147 -3.4350 -3.4350 -3.4345 -3.4345 -1.6220 -1.6220 -1.6110 -1.6110 1.5467 1.5467 1.5812 1.5812 1.9813 1.9813 2.0425 2.0425 2.4014 2.4014 2.4661 2.4661 2.8585 2.8585 2.9228 2.9228 3.1166 3.1166 3.2322 3.2322 3.6462 3.6462 3.7139 3.7139 3.9121 3.9121 4.0170 4.0170 4.4939 4.4939 4.6148 4.6148 4.7230 4.7230 4.8048 4.8048 4.9531 4.9531 5.1195 5.1195 5.3672 5.3672 5.4348 5.4348 7.3566 7.3566 7.3913 7.3913 8.0465 8.0465 8.0920 8.0920 8.6454 8.6454 8.6533 8.6533 k =-0.2903 0.9644 0.3733 ( 13986 PWs) bands (ev): -5.7754 -5.7754 -5.7721 -5.7721 -4.6907 -4.6907 -4.6872 -4.6872 -4.0999 -4.0999 -4.0986 -4.0986 -3.4395 -3.4395 -3.4391 -3.4391 -1.5987 -1.5987 -1.5857 -1.5857 1.5765 1.5765 1.6144 1.6144 1.9890 1.9890 2.0528 2.0528 2.4180 2.4180 2.4862 2.4862 2.8592 2.8592 2.9319 2.9319 3.1168 3.1168 3.2177 3.2177 3.6500 3.6500 3.7154 3.7154 3.9210 3.9210 4.0077 4.0077 4.4826 4.4826 4.6131 4.6131 4.7242 4.7242 4.8220 4.8220 4.9540 4.9540 5.1245 5.1245 5.3874 5.3874 5.4587 5.4587 7.3623 7.3623 7.3964 7.3964 8.0621 8.0621 8.1064 8.1064 8.6213 8.6213 8.6314 8.6314 k =-0.2964 0.9397 0.3733 ( 13990 PWs) bands (ev): -5.7866 -5.7866 -5.7829 -5.7829 -4.7384 -4.7384 -4.7347 -4.7347 -4.0857 -4.0857 -4.0846 -4.0846 -3.4447 -3.4447 -3.4443 -3.4443 -1.5718 -1.5718 -1.5569 -1.5569 1.6083 1.6083 1.6496 1.6496 1.9983 1.9983 2.0658 2.0658 2.4321 2.4321 2.5051 2.5051 2.8560 2.8560 2.9481 2.9481 3.1199 3.1199 3.2084 3.2084 3.6437 3.6437 3.7211 3.7211 3.9372 3.9372 4.0084 4.0084 4.4644 4.4644 4.5953 4.5953 4.7394 4.7394 4.8431 4.8431 4.9595 4.9595 5.1320 5.1320 5.4106 5.4106 5.4856 5.4856 7.3680 7.3680 7.4014 7.4014 8.0795 8.0795 8.1230 8.1230 8.5952 8.5952 8.6073 8.6073 k =-0.3026 0.9151 0.3733 ( 13998 PWs) bands (ev): -5.7992 -5.7992 -5.7951 -5.7951 -4.7874 -4.7874 -4.7836 -4.7836 -4.0739 -4.0739 -4.0729 -4.0729 -3.4505 -3.4505 -3.4501 -3.4501 -1.5415 -1.5415 -1.5248 -1.5248 1.6409 1.6409 1.6856 1.6856 2.0105 2.0105 2.0828 2.0828 2.4424 2.4424 2.5217 2.5217 2.8538 2.8538 2.9665 2.9665 3.1266 3.1266 3.2051 3.2051 3.6327 3.6327 3.7261 3.7261 3.9578 3.9578 4.0208 4.0208 4.4427 4.4427 4.5701 4.5701 4.7604 4.7604 4.8651 4.8651 4.9699 4.9699 5.1424 5.1424 5.4365 5.4365 5.5154 5.5154 7.3734 7.3734 7.4063 7.4063 8.0988 8.0988 8.1415 8.1415 8.5677 8.5677 8.5813 8.5813 k =-0.3088 0.8904 0.3733 ( 13994 PWs) bands (ev): -5.8131 -5.8131 -5.8086 -5.8086 -4.8372 -4.8372 -4.8332 -4.8332 -4.0648 -4.0648 -4.0640 -4.0640 -3.4569 -3.4569 -3.4565 -3.4565 -1.5082 -1.5082 -1.4897 -1.4897 1.6729 1.6729 1.7202 1.7202 2.0275 2.0275 2.1053 2.1053 2.4482 2.4482 2.5354 2.5354 2.8546 2.8546 2.9845 2.9845 3.1381 3.1381 3.2083 3.2083 3.6210 3.6210 3.7279 3.7279 3.9800 3.9800 4.0447 4.0447 4.4204 4.4204 4.5435 4.5435 4.7811 4.7811 4.8859 4.8859 4.9857 4.9857 5.1566 5.1566 5.4649 5.4649 5.5481 5.5481 7.3783 7.3783 7.4110 7.4110 8.1193 8.1193 8.1617 8.1617 8.5390 8.5390 8.5538 8.5538 k =-0.3149 0.8657 0.3733 ( 14002 PWs) bands (ev): -5.8281 -5.8281 -5.8233 -5.8233 -4.8872 -4.8872 -4.8832 -4.8832 -4.0585 -4.0585 -4.0577 -4.0577 -3.4639 -3.4639 -3.4634 -3.4634 -1.4723 -1.4723 -1.4520 -1.4520 1.7031 1.7031 1.7514 1.7514 2.0511 2.0511 2.1344 2.1344 2.4498 2.4498 2.5458 2.5458 2.8577 2.8577 3.0014 3.0014 3.1550 3.1550 3.2184 3.2184 3.6109 3.6109 3.7269 3.7269 4.0025 4.0025 4.0777 4.0777 4.3995 4.3995 4.5184 4.5184 4.7988 4.7988 4.9041 4.9041 5.0078 5.0078 5.1749 5.1749 5.4956 5.4956 5.5832 5.5832 7.3828 7.3828 7.4154 7.4154 8.1407 8.1407 8.1829 8.1829 8.5099 8.5099 8.5255 8.5255 k =-0.3211 0.8410 0.3733 ( 13994 PWs) bands (ev): -5.8442 -5.8442 -5.8392 -5.8392 -4.9372 -4.9372 -4.9331 -4.9331 -4.0550 -4.0550 -4.0540 -4.0540 -3.4716 -3.4716 -3.4709 -3.4709 -1.4340 -1.4340 -1.4121 -1.4121 1.7305 1.7305 1.7776 1.7776 2.0824 2.0824 2.1706 2.1706 2.4484 2.4484 2.5535 2.5535 2.8612 2.8612 3.0169 3.0169 3.1772 3.1772 3.2359 3.2359 3.6031 3.6031 3.7241 3.7241 4.0246 4.0246 4.1165 4.1165 4.3820 4.3820 4.4970 4.4970 4.8123 4.8123 4.9192 4.9192 5.0365 5.0365 5.1978 5.1978 5.5283 5.5283 5.6203 5.6203 7.3867 7.3867 7.4197 7.4197 8.1621 8.1621 8.2046 8.2046 8.4808 8.4808 8.4971 8.4971 k =-0.3273 0.8163 0.3733 ( 14002 PWs) bands (ev): -5.8613 -5.8613 -5.8560 -5.8560 -4.9868 -4.9868 -4.9827 -4.9827 -4.0540 -4.0540 -4.0530 -4.0530 -3.4799 -3.4799 -3.4790 -3.4790 -1.3939 -1.3939 -1.3704 -1.3704 1.7545 1.7545 1.7979 1.7979 2.1212 2.1212 2.2134 2.2134 2.4459 2.4459 2.5594 2.5594 2.8634 2.8634 3.0313 3.0313 3.2044 3.2044 3.2611 3.2611 3.5982 3.5982 3.7204 3.7204 4.0459 4.0459 4.1580 4.1580 4.3695 4.3695 4.4810 4.4810 4.8214 4.8214 4.9313 4.9313 5.0717 5.0717 5.2254 5.2254 5.5625 5.5625 5.6591 5.6591 7.3901 7.3901 7.4238 7.4238 8.1823 8.1823 8.2257 8.2257 8.4526 8.4526 8.4694 8.4694 k =-0.3335 0.7916 0.3733 ( 14018 PWs) bands (ev): -5.8792 -5.8792 -5.8737 -5.8737 -5.0359 -5.0359 -5.0318 -5.0318 -4.0554 -4.0554 -4.0542 -4.0542 -3.4887 -3.4887 -3.4876 -3.4876 -1.3523 -1.3523 -1.3274 -1.3274 1.7751 1.7751 1.8128 1.8128 2.1655 2.1655 2.2609 2.2609 2.4456 2.4456 2.5651 2.5651 2.8633 2.8633 3.0441 3.0441 3.2364 3.2364 3.2933 3.2933 3.5959 3.5959 3.7163 3.7163 4.0663 4.0663 4.1991 4.1991 4.3638 4.3638 4.4725 4.4725 4.8268 4.8268 4.9407 4.9407 5.1127 5.1127 5.2573 5.2573 5.5979 5.5979 5.6989 5.6989 7.3931 7.3931 7.4279 7.4279 8.1995 8.1995 8.2448 8.2448 8.4266 8.4266 8.4443 8.4443 k =-0.3396 0.7669 0.3733 ( 14022 PWs) bands (ev): -5.8979 -5.8979 -5.8922 -5.8922 -5.0841 -5.0841 -5.0800 -5.0800 -4.0590 -4.0590 -4.0577 -4.0577 -3.4981 -3.4981 -3.4968 -3.4968 -1.3097 -1.3097 -1.2835 -1.2835 1.7924 1.7924 1.8236 1.8236 2.2115 2.2115 2.3088 2.3088 2.4524 2.4524 2.5730 2.5730 2.8615 2.8615 3.0550 3.0550 3.2732 3.2732 3.3309 3.3309 3.5960 3.5960 3.7122 3.7122 4.0858 4.0858 4.2364 4.2364 4.3668 4.3668 4.4733 4.4733 4.8294 4.8294 4.9483 4.9483 5.1585 5.1585 5.2933 5.2933 5.6340 5.6340 5.7394 5.7394 7.3958 7.3958 7.4320 7.4320 8.2109 8.2109 8.2595 8.2595 8.4043 8.4043 8.4248 8.4248 k =-0.3458 0.7422 0.3733 ( 14014 PWs) bands (ev): -5.9171 -5.9171 -5.9113 -5.9113 -5.1313 -5.1313 -5.1272 -5.1272 -4.0645 -4.0645 -4.0631 -4.0631 -3.5080 -3.5080 -3.5066 -3.5066 -1.2667 -1.2667 -1.2393 -1.2393 1.8067 1.8067 1.8315 1.8315 2.2538 2.2538 2.3495 2.3495 2.4748 2.4748 2.5863 2.5863 2.8590 2.8590 3.0643 3.0643 3.3139 3.3139 3.3715 3.3715 3.5980 3.5980 3.7085 3.7085 4.1053 4.1053 4.2667 4.2667 4.3797 4.3797 4.4856 4.4856 4.8299 4.8299 4.9547 4.9547 5.2084 5.2084 5.3328 5.3328 5.6704 5.6704 5.7800 5.7800 7.3984 7.3984 7.4364 7.4364 8.2127 8.2127 8.2663 8.2663 8.3884 8.3884 8.4148 8.4148 k =-0.3520 0.7175 0.3733 ( 14014 PWs) bands (ev): -5.9368 -5.9368 -5.9310 -5.9310 -5.1773 -5.1773 -5.1733 -5.1733 -4.0717 -4.0717 -4.0702 -4.0702 -3.5184 -3.5184 -3.5168 -3.5168 -1.2236 -1.2236 -1.1953 -1.1953 1.8177 1.8177 1.8382 1.8382 2.2861 2.2861 2.3782 2.3782 2.5170 2.5170 2.6098 2.6098 2.8574 2.8574 3.0730 3.0730 3.3566 3.3566 3.4126 3.4126 3.6022 3.6022 3.7064 3.7064 4.1260 4.1260 4.2897 4.2897 4.4015 4.4015 4.5099 4.5099 4.8293 4.8293 4.9607 4.9607 5.2616 5.2616 5.3750 5.3750 5.7068 5.7068 5.8203 5.8203 7.4009 7.4009 7.4410 7.4410 8.2027 8.2027 8.2613 8.2613 8.3828 8.3828 8.4160 8.4160 k =-0.3581 0.6928 0.3733 ( 14026 PWs) bands (ev): -5.9569 -5.9569 -5.9511 -5.9511 -5.2221 -5.2221 -5.2182 -5.2182 -4.0803 -4.0803 -4.0787 -4.0787 -3.5292 -3.5292 -3.5275 -3.5275 -1.1809 -1.1809 -1.1518 -1.1518 1.8251 1.8251 1.8448 1.8448 2.3052 2.3052 2.3988 2.3988 2.5714 2.5714 2.6480 2.6480 2.8586 2.8586 3.0827 3.0827 3.3982 3.3982 3.4510 3.4510 3.6099 3.6099 3.7077 3.7077 4.1491 4.1491 4.3091 4.3091 4.4286 4.4286 4.5448 4.5448 4.8284 4.8284 4.9671 4.9671 5.3176 5.3176 5.4194 5.4194 5.7429 5.7429 5.8599 5.8599 7.4036 7.4036 7.4461 7.4461 8.1822 8.1822 8.2445 8.2445 8.3883 8.3883 8.4260 8.4260 k =-0.3643 0.6681 0.3733 ( 14038 PWs) bands (ev): -5.9772 -5.9772 -5.9714 -5.9714 -5.2654 -5.2654 -5.2615 -5.2615 -4.0902 -4.0902 -4.0885 -4.0885 -3.5403 -3.5403 -3.5385 -3.5385 -1.1391 -1.1391 -1.1094 -1.1094 1.8288 1.8288 1.8518 1.8518 2.3145 2.3145 2.4135 2.4135 2.6283 2.6283 2.7017 2.7017 2.8649 2.8649 3.0951 3.0951 3.4343 3.4343 3.4831 3.4831 3.6236 3.6236 3.7154 3.7154 4.1758 4.1758 4.3293 4.3293 4.4583 4.4583 4.5869 4.5869 4.8284 4.8284 4.9746 4.9746 5.3755 5.3755 5.4651 5.4651 5.7784 5.7784 5.8987 5.8987 7.4066 7.4066 7.4518 7.4518 8.1545 8.1545 8.2199 8.2199 8.4008 8.4008 8.4411 8.4411 k =-0.3705 0.6434 0.3733 ( 14042 PWs) bands (ev): -5.9977 -5.9977 -5.9919 -5.9919 -5.3071 -5.3071 -5.3034 -5.3034 -4.1010 -4.1010 -4.0992 -4.0992 -3.5518 -3.5518 -3.5499 -3.5499 -1.0985 -1.0985 -1.0685 -1.0685 1.8298 1.8298 1.8581 1.8581 2.3190 2.3190 2.4229 2.4229 2.6831 2.6831 2.7651 2.7651 2.8798 2.8798 3.1124 3.1124 3.4597 3.4597 3.5063 3.5063 3.6467 3.6467 3.7325 3.7325 4.2067 4.2067 4.3531 4.3531 4.4895 4.4895 4.6322 4.6322 4.8306 4.8306 4.9841 4.9841 5.4347 5.4347 5.5114 5.5114 5.8133 5.8133 5.9362 5.9362 7.4100 7.4100 7.4581 7.4581 8.1219 8.1219 8.1910 8.1910 8.4167 8.4167 8.4589 8.4589 k =-0.3766 0.6187 0.3733 ( 14042 PWs) bands (ev): -6.0182 -6.0182 -6.0125 -6.0125 -5.3472 -5.3472 -5.3437 -5.3437 -4.1125 -4.1125 -4.1107 -4.1107 -3.5634 -3.5634 -3.5614 -3.5614 -1.0596 -1.0596 -1.0294 -1.0294 1.8289 1.8289 1.8629 1.8629 2.3218 2.3218 2.4283 2.4283 2.7329 2.7329 2.8284 2.8284 2.9094 2.9094 3.1363 3.1363 3.4718 3.4718 3.5217 3.5217 3.6790 3.6790 3.7604 3.7604 4.2415 4.2415 4.3826 4.3826 4.5210 4.5210 4.6769 4.6769 4.8375 4.8375 4.9966 4.9966 5.4944 5.4944 5.5574 5.5574 5.8476 5.8476 5.9723 5.9723 7.4139 7.4139 7.4652 7.4652 8.0860 8.0860 8.1597 8.1597 8.4339 8.4339 8.4779 8.4779 k =-0.3828 0.5941 0.3733 ( 14030 PWs) bands (ev): -6.0385 -6.0385 -6.0329 -6.0329 -5.3857 -5.3857 -5.3822 -5.3822 -4.1245 -4.1245 -4.1227 -4.1227 -3.5751 -3.5751 -3.5731 -3.5731 -1.0225 -1.0225 -0.9924 -0.9924 1.8264 1.8264 1.8655 1.8655 2.3245 2.3245 2.4312 2.4312 2.7761 2.7761 2.8818 2.8818 2.9601 2.9601 3.1685 3.1685 3.4728 3.4728 3.5315 3.5315 3.7177 3.7177 3.7975 3.7975 4.2791 4.2791 4.4190 4.4190 4.5513 4.5513 4.7175 4.7175 4.8525 4.8525 5.0130 5.0130 5.5537 5.5537 5.6024 5.6024 5.8814 5.8814 6.0068 6.0068 7.4183 7.4183 7.4731 7.4731 8.0478 8.0478 8.1268 8.1268 8.4514 8.4514 8.4975 8.4975 k =-0.3890 0.5694 0.3733 ( 14010 PWs) bands (ev): -6.0586 -6.0586 -6.0532 -6.0532 -5.4223 -5.4223 -5.4190 -5.4190 -4.1369 -4.1369 -4.1351 -4.1351 -3.5869 -3.5869 -3.5849 -3.5849 -0.9875 -0.9875 -0.9578 -0.9578 1.8225 1.8225 1.8657 1.8657 2.3274 2.3274 2.4323 2.4323 2.8137 2.8137 2.9265 2.9265 3.0259 3.0259 3.2093 3.2093 3.4679 3.4679 3.5382 3.5382 3.7598 3.7598 3.8408 3.8408 4.3180 4.3180 4.4628 4.4628 4.5790 4.5790 4.7515 4.7515 4.8786 4.8786 5.0343 5.0343 5.6114 5.6114 5.6457 5.6457 5.9152 5.9152 6.0396 6.0396 7.4231 7.4231 7.4817 7.4817 8.0076 8.0076 8.0929 8.0929 8.4683 8.4683 8.5174 8.5174 k =-0.3951 0.5447 0.3733 ( 14034 PWs) bands (ev): -6.0783 -6.0783 -6.0731 -6.0731 -5.4571 -5.4571 -5.4540 -5.4540 -4.1495 -4.1495 -4.1477 -4.1477 -3.5986 -3.5986 -3.5966 -3.5966 -0.9549 -0.9549 -0.9257 -0.9257 1.8174 1.8174 1.8633 1.8633 2.3307 2.3307 2.4321 2.4321 2.8494 2.8494 2.9684 2.9684 3.0949 3.0949 3.2576 3.2576 3.4616 3.4616 3.5444 3.5444 3.8038 3.8038 3.8872 3.8872 4.3566 4.3566 4.5133 4.5133 4.6028 4.6028 4.7807 4.7807 4.9156 4.9156 5.0614 5.0614 5.6650 5.6650 5.6882 5.6882 5.9491 5.9491 6.0704 6.0704 7.4282 7.4282 7.4909 7.4909 7.9660 7.9660 8.0582 8.0582 8.4842 8.4842 8.5375 8.5375 k =-0.4013 0.5200 0.3733 ( 14026 PWs) bands (ev): -6.0976 -6.0976 -6.0926 -6.0926 -5.4900 -5.4900 -5.4871 -5.4871 -4.1621 -4.1621 -4.1603 -4.1603 -3.6101 -3.6101 -3.6081 -3.6081 -0.9247 -0.9247 -0.8963 -0.8963 1.8111 1.8111 1.8585 1.8585 2.3341 2.3341 2.4308 2.4308 2.8862 2.8862 3.0090 3.0090 3.1600 3.1600 3.3107 3.3107 3.4585 3.4585 3.5528 3.5528 3.8488 3.8488 3.9345 3.9345 4.3935 4.3935 4.5669 4.5669 4.6241 4.6241 4.8105 4.8105 4.9597 4.9597 5.0947 5.0947 5.7086 5.7086 5.7339 5.7339 5.9836 5.9836 6.0993 6.0993 7.4332 7.4332 7.5004 7.5004 7.9233 7.9233 8.0230 8.0230 8.4982 8.4982 8.5575 8.5575 k =-0.4075 0.4953 0.3733 ( 14034 PWs) bands (ev): -6.1163 -6.1163 -6.1115 -6.1115 -5.5211 -5.5211 -5.5183 -5.5183 -4.1745 -4.1745 -4.1728 -4.1728 -3.6214 -3.6214 -3.6194 -3.6194 -0.8969 -0.8969 -0.8695 -0.8695 1.8039 1.8039 1.8514 1.8514 2.3372 2.3372 2.4284 2.4284 2.9251 2.9251 3.0491 3.0491 3.2158 3.2158 3.3650 3.3650 3.4641 3.4641 3.5659 3.5659 3.8943 3.8943 3.9813 3.9813 4.4275 4.4275 4.6074 4.6074 4.6571 4.6571 4.8456 4.8456 5.0076 5.0076 5.1345 5.1345 5.7414 5.7414 5.7822 5.7822 6.0188 6.0188 6.1260 6.1260 7.4378 7.4378 7.5097 7.5097 7.8802 7.8802 7.9878 7.9878 8.5095 8.5095 8.5774 8.5774 k =-0.4136 0.4706 0.3733 ( 14052 PWs) bands (ev): -6.1343 -6.1343 -6.1298 -6.1298 -5.5502 -5.5502 -5.5476 -5.5476 -4.1867 -4.1867 -4.1851 -4.1851 -3.6323 -3.6323 -3.6304 -3.6304 -0.8717 -0.8717 -0.8455 -0.8455 1.7959 1.7959 1.8425 1.8425 2.3397 2.3397 2.4250 2.4250 2.9652 2.9652 3.0888 3.0888 3.2574 3.2574 3.4167 3.4167 3.4859 3.4859 3.5856 3.5856 3.9398 3.9398 4.0264 4.0264 4.4574 4.4574 4.6215 4.6215 4.7144 4.7144 4.8885 4.8885 5.0576 5.0576 5.1805 5.1805 5.7671 5.7671 5.8281 5.8281 6.0548 6.0548 6.1505 6.1505 7.4412 7.4412 7.5179 7.5179 7.8375 7.8375 7.9531 7.9531 8.5170 8.5170 8.5965 8.5965 k =-0.4198 0.4459 0.3733 ( 14040 PWs) bands (ev): -6.1516 -6.1516 -6.1473 -6.1473 -5.5773 -5.5773 -5.5749 -5.5749 -4.1985 -4.1985 -4.1970 -4.1970 -3.6428 -3.6428 -3.6410 -3.6410 -0.8489 -0.8489 -0.8241 -0.8241 1.7874 1.7874 1.8322 1.8322 2.3416 2.3416 2.4207 2.4207 3.0042 3.0042 3.1275 3.1275 3.2846 3.2846 3.4646 3.4646 3.5260 3.5260 3.6132 3.6132 3.9845 3.9845 4.0692 4.0692 4.4823 4.4823 4.6253 4.6253 4.7792 4.7792 4.9401 4.9401 5.1086 5.1086 5.2324 5.2324 5.7867 5.7867 5.8697 5.8697 6.0910 6.0910 6.1727 6.1727 7.4426 7.4426 7.5235 7.5235 7.7969 7.7969 7.9195 7.9195 8.5197 8.5197 8.6139 8.6139 k =-0.4260 0.4212 0.3733 ( 14058 PWs) bands (ev): -6.1679 -6.1679 -6.1640 -6.1640 -5.6024 -5.6024 -5.6002 -5.6002 -4.2098 -4.2098 -4.2084 -4.2084 -3.6528 -3.6528 -3.6511 -3.6511 -0.8285 -0.8285 -0.8051 -0.8051 1.7785 1.7785 1.8210 1.8210 2.3428 2.3428 2.4154 2.4154 3.0387 3.0387 3.1622 3.1622 3.3065 3.3065 3.5122 3.5122 3.5776 3.5776 3.6483 3.6483 4.0272 4.0272 4.1090 4.1090 4.5015 4.5015 4.6255 4.6255 4.8455 4.8455 5.0001 5.0001 5.1601 5.1601 5.2894 5.2894 5.8010 5.8010 5.9064 5.9064 6.1266 6.1266 6.1924 6.1924 7.4411 7.4411 7.5240 7.5240 7.7608 7.7608 7.8878 7.8878 8.5163 8.5163 8.6281 8.6281 k =-0.4321 0.3965 0.3733 ( 14070 PWs) bands (ev): -6.1833 -6.1833 -6.1796 -6.1796 -5.6256 -5.6256 -5.6235 -5.6235 -4.2206 -4.2206 -4.2192 -4.2192 -3.6623 -3.6623 -3.6607 -3.6607 -0.8104 -0.8104 -0.7886 -0.7886 1.7696 1.7696 1.8092 1.8092 2.3434 2.3434 2.4095 2.4095 3.0665 3.0665 3.1861 3.1861 3.3375 3.3375 3.5617 3.5617 3.6338 3.6338 3.6889 3.6889 4.0667 4.0667 4.1454 4.1454 4.5147 4.5147 4.6238 4.6238 4.9123 4.9123 5.0666 5.0666 5.2121 5.2121 5.3505 5.3505 5.8104 5.8104 5.9379 5.9379 6.1601 6.1601 6.2100 6.2100 7.4355 7.4355 7.5166 7.5166 7.7322 7.7322 7.8588 7.8588 8.5059 8.5059 8.6363 8.6363 k =-0.4383 0.3718 0.3733 ( 14066 PWs) bands (ev): -6.1976 -6.1976 -6.1943 -6.1943 -5.6467 -5.6467 -5.6449 -5.6449 -4.2306 -4.2306 -4.2293 -4.2293 -3.6712 -3.6712 -3.6697 -3.6697 -0.7943 -0.7943 -0.7744 -0.7744 1.7608 1.7608 1.7972 1.7972 2.3434 2.3434 2.4031 2.4031 3.0867 3.0867 3.1954 3.1954 3.3851 3.3851 3.6129 3.6129 3.6920 3.6920 3.7331 3.7331 4.1015 4.1015 4.1782 4.1782 4.5220 4.5220 4.6212 4.6212 4.9798 4.9798 5.1367 5.1367 5.2646 5.2646 5.4141 5.4141 5.8154 5.8154 5.9650 5.9650 6.1888 6.1888 6.2270 6.2270 7.4246 7.4246 7.4990 7.4990 7.7134 7.7134 7.8333 7.8333 8.4883 8.4883 8.6340 8.6340 k =-0.4445 0.3471 0.3733 ( 14046 PWs) bands (ev): -6.2108 -6.2108 -6.2078 -6.2078 -5.6659 -5.6659 -5.6642 -5.6642 -4.2399 -4.2399 -4.2388 -4.2388 -3.6794 -3.6794 -3.6780 -3.6780 -0.7803 -0.7803 -0.7622 -0.7622 1.7524 1.7524 1.7853 1.7853 2.3431 2.3431 2.3964 2.3964 3.1006 3.1006 3.1944 3.1944 3.4460 3.4460 3.6642 3.6642 3.7509 3.7509 3.7801 3.7801 4.1309 4.1309 4.2071 4.2071 4.5237 4.5237 4.6178 4.6178 5.0479 5.0479 5.2073 5.2073 5.3175 5.3175 5.4784 5.4784 5.8169 5.8169 5.9885 5.9885 6.2079 6.2079 6.2470 6.2470 7.4073 7.4073 7.4725 7.4725 7.7037 7.7037 7.8118 7.8118 8.4637 8.4637 8.6164 8.6164 k =-0.4507 0.3224 0.3733 ( 14046 PWs) bands (ev): -6.2228 -6.2228 -6.2201 -6.2201 -5.6830 -5.6830 -5.6815 -5.6815 -4.2484 -4.2484 -4.2474 -4.2474 -3.6868 -3.6868 -3.6855 -3.6855 -0.7682 -0.7682 -0.7519 -0.7519 1.7445 1.7445 1.7738 1.7738 2.3425 2.3425 2.3896 2.3896 3.1094 3.1094 3.1883 3.1883 3.5139 3.5139 3.7137 3.7137 3.8070 3.8070 3.8323 3.8323 4.1543 4.1543 4.2321 4.2321 4.5204 4.5204 4.6134 4.6134 5.1164 5.1164 5.2754 5.2754 5.3704 5.3704 5.5411 5.5411 5.8160 5.8160 6.0103 6.0103 6.2160 6.2160 6.2700 6.2700 7.3831 7.3831 7.4408 7.4408 7.6996 7.6996 7.7940 7.7940 8.4337 8.4337 8.5827 8.5827 k =-0.4568 0.2978 0.3733 ( 14048 PWs) bands (ev): -6.2335 -6.2335 -6.2311 -6.2311 -5.6981 -5.6981 -5.6968 -5.6968 -4.2560 -4.2560 -4.2551 -4.2551 -3.6935 -3.6935 -3.6924 -3.6924 -0.7577 -0.7577 -0.7434 -0.7434 1.7374 1.7374 1.7630 1.7630 2.3419 2.3419 2.3828 2.3828 3.1149 3.1149 3.1800 3.1800 3.5844 3.5844 3.7598 3.7598 3.8560 3.8560 3.8930 3.8930 4.1721 4.1721 4.2531 4.2531 4.5127 4.5127 4.6073 4.6073 5.1840 5.1840 5.3382 5.3382 5.4223 5.4223 5.5989 5.5989 5.8152 5.8152 6.0325 6.0325 6.2162 6.2162 6.2924 6.2924 7.3529 7.3529 7.4076 7.4076 7.6977 7.6977 7.7794 7.7794 8.4005 8.4005 8.5369 8.5369 k =-0.4630 0.2731 0.3733 ( 14056 PWs) bands (ev): -6.2429 -6.2429 -6.2409 -6.2409 -5.7112 -5.7112 -5.7101 -5.7101 -4.2627 -4.2627 -4.2619 -4.2619 -3.6993 -3.6993 -3.6984 -3.6984 -0.7489 -0.7489 -0.7365 -0.7365 1.7311 1.7311 1.7531 1.7531 2.3414 2.3414 2.3762 2.3762 3.1181 3.1181 3.1710 3.1710 3.6538 3.6538 3.8013 3.8013 3.9006 3.9006 3.9576 3.9576 4.1851 4.1851 4.2704 4.2704 4.5014 4.5014 4.5990 4.5990 5.2494 5.2494 5.3940 5.3940 5.4708 5.4708 5.6465 5.6465 5.8192 5.8192 6.0573 6.0573 6.2101 6.2101 6.3118 6.3118 7.3192 7.3192 7.3746 7.3746 7.6957 7.6957 7.7668 7.7668 8.3668 8.3668 8.4852 8.4852 k =-0.4692 0.2484 0.3733 ( 14068 PWs) bands (ev): -6.2509 -6.2509 -6.2492 -6.2492 -5.7222 -5.7222 -5.7213 -5.7213 -4.2685 -4.2685 -4.2678 -4.2678 -3.7043 -3.7043 -3.7035 -3.7035 -0.7414 -0.7414 -0.7311 -0.7311 1.7259 1.7259 1.7441 1.7441 2.3412 2.3412 2.3700 2.3700 3.1201 3.1201 3.1622 3.1622 3.7190 3.7190 3.8376 3.8376 3.9430 3.9430 4.0205 4.0205 4.1946 4.1946 4.2850 4.2850 4.4872 4.4872 4.5875 4.5875 5.3107 5.3107 5.4418 5.4418 5.5128 5.5128 5.6765 5.6765 5.8355 5.8355 6.0863 6.0863 6.1988 6.1988 6.3267 6.3267 7.2856 7.2856 7.3420 7.3420 7.6927 7.6927 7.7548 7.7548 8.3354 8.3354 8.4333 8.4333 k =-0.4753 0.2237 0.3733 ( 14064 PWs) bands (ev): -6.2575 -6.2575 -6.2561 -6.2561 -5.7312 -5.7312 -5.7305 -5.7305 -4.2732 -4.2732 -4.2727 -4.2727 -3.7084 -3.7084 -3.7078 -3.7078 -0.7353 -0.7353 -0.7270 -0.7270 1.7218 1.7218 1.7363 1.7363 2.3414 2.3414 2.3643 2.3643 3.1216 3.1216 3.1540 3.1540 3.7771 3.7771 3.8678 3.8678 3.9838 3.9838 4.0762 4.0762 4.2031 4.2031 4.2980 4.2980 4.4714 4.4714 4.5722 4.5722 5.3661 5.3661 5.4808 5.4808 5.5461 5.5461 5.6867 5.6867 5.8674 5.8674 6.1175 6.1175 6.1849 6.1849 6.3360 6.3360 7.2555 7.2555 7.3103 7.3103 7.6892 7.6892 7.7425 7.7425 8.3086 8.3086 8.3855 8.3855 k =-0.4815 0.1990 0.3733 ( 14068 PWs) bands (ev): -6.2626 -6.2626 -6.2615 -6.2615 -5.7382 -5.7382 -5.7377 -5.7377 -4.2769 -4.2769 -4.2765 -4.2765 -3.7116 -3.7116 -3.7111 -3.7111 -0.7304 -0.7304 -0.7242 -0.7242 1.7188 1.7188 1.7298 1.7298 2.3420 2.3420 2.3591 2.3591 3.1231 3.1231 3.1467 3.1467 3.8259 3.8259 3.8910 3.8910 4.0226 4.0226 4.1161 4.1161 4.2164 4.2164 4.3099 4.3099 4.4567 4.4567 4.5527 4.5527 5.4138 5.4138 5.5092 5.5092 5.5716 5.5716 5.6837 5.6837 5.9092 5.9092 6.1329 6.1329 6.1856 6.1856 6.3382 6.3382 7.2319 7.2319 7.2804 7.2804 7.6863 7.6863 7.7294 7.7294 8.2883 8.2883 8.3448 8.3448 k =-0.4877 0.1743 0.3733 ( 14076 PWs) bands (ev): -6.2662 -6.2662 -6.2655 -6.2655 -5.7432 -5.7432 -5.7428 -5.7428 -4.2795 -4.2795 -4.2792 -4.2792 -3.7139 -3.7139 -3.7136 -3.7136 -0.7267 -0.7267 -0.7225 -0.7225 1.7172 1.7172 1.7245 1.7245 2.3432 2.3432 2.3546 2.3546 3.1249 3.1249 3.1403 3.1403 3.8639 3.8639 3.9060 3.9060 4.0582 4.0582 4.1322 4.1322 4.2402 4.2402 4.3175 4.3175 4.4488 4.4488 4.5291 4.5291 5.4529 5.4529 5.5227 5.5227 5.5944 5.5944 5.6740 5.6740 5.9545 5.9545 6.1134 6.1134 6.2174 6.2174 6.3316 6.3316 7.2169 7.2169 7.2536 7.2536 7.6856 7.6856 7.7161 7.7161 8.2757 8.2757 8.3127 8.3127 k =-0.4938 0.1496 0.3733 ( 14068 PWs) bands (ev): -6.2683 -6.2683 -6.2680 -6.2680 -5.7461 -5.7461 -5.7460 -5.7460 -4.2811 -4.2811 -4.2809 -4.2809 -3.7152 -3.7152 -3.7151 -3.7151 -0.7241 -0.7241 -0.7220 -0.7220 1.7170 1.7170 1.7206 1.7206 2.3450 2.3450 2.3507 2.3507 3.1274 3.1274 3.1350 3.1350 3.8908 3.8908 3.9114 3.9114 4.0889 4.0889 4.1285 4.1285 4.2693 4.2693 4.3134 4.3134 4.4552 4.4552 4.5024 4.5024 5.4836 5.4836 5.5204 5.5204 5.6180 5.6180 5.6595 5.6595 5.9996 5.9996 6.0809 6.0809 6.2553 6.2553 6.3152 6.3152 7.2120 7.2120 7.2319 7.2319 7.6880 7.6880 7.7039 7.7039 8.2715 8.2715 8.2897 8.2897 k =-0.5000 0.1249 0.3733 ( 14060 PWs) bands (ev): -6.2689 -6.2689 -6.2689 -6.2689 -5.7471 -5.7471 -5.7471 -5.7471 -4.2815 -4.2815 -4.2815 -4.2815 -3.7156 -3.7156 -3.7156 -3.7156 -0.7225 -0.7225 -0.7225 -0.7225 1.7181 1.7181 1.7181 1.7181 2.3475 2.3475 2.3475 2.3475 3.1307 3.1307 3.1307 3.1307 3.9065 3.9065 3.9065 3.9065 4.1129 4.1129 4.1129 4.1129 4.2957 4.2957 4.2957 4.2957 4.4757 4.4757 4.4757 4.4757 5.5063 5.5063 5.5063 5.5063 5.6406 5.6406 5.6406 5.6406 6.0422 6.0422 6.0422 6.0422 6.2892 6.2892 6.2892 6.2892 7.2174 7.2174 7.2174 7.2174 7.6942 7.6942 7.6942 7.6942 8.2761 8.2761 8.2761 8.2761 k =-0.5000 0.1249 0.3733 ( 14060 PWs) bands (ev): -6.2689 -6.2689 -6.2689 -6.2689 -5.7471 -5.7471 -5.7471 -5.7471 -4.2815 -4.2815 -4.2815 -4.2815 -3.7156 -3.7156 -3.7156 -3.7156 -0.7225 -0.7225 -0.7225 -0.7225 1.7181 1.7181 1.7181 1.7181 2.3475 2.3475 2.3475 2.3475 3.1307 3.1307 3.1307 3.1307 3.9065 3.9065 3.9065 3.9065 4.1129 4.1129 4.1129 4.1129 4.2957 4.2957 4.2957 4.2957 4.4757 4.4757 4.4757 4.4757 5.5063 5.5063 5.5063 5.5063 5.6406 5.6406 5.6406 5.6406 6.0422 6.0422 6.0422 6.0422 6.2892 6.2892 6.2892 6.2892 7.2174 7.2174 7.2174 7.2174 7.6942 7.6942 7.6942 7.6942 8.2761 8.2761 8.2761 8.2761 k =-0.5000 0.1249 0.3484 ( 14072 PWs) bands (ev): -6.2722 -6.2722 -6.2665 -6.2665 -5.7518 -5.7518 -5.7402 -5.7402 -4.2879 -4.2879 -4.2801 -4.2801 -3.7232 -3.7232 -3.7040 -3.7040 -0.7627 -0.7627 -0.6810 -0.6810 1.7073 1.7073 1.7308 1.7308 2.3273 2.3273 2.3596 2.3596 3.0744 3.0744 3.1886 3.1886 3.9000 3.9000 3.9128 3.9128 4.1011 4.1011 4.1192 4.1192 4.2797 4.2797 4.3172 4.3172 4.4573 4.4573 4.5048 4.5048 5.4724 5.4724 5.5241 5.5241 5.6229 5.6229 5.6688 5.6688 6.0310 6.0310 6.0569 6.0569 6.2680 6.2680 6.3140 6.3140 7.2043 7.2043 7.2291 7.2291 7.6665 7.6665 7.7169 7.7169 8.2221 8.2221 8.3251 8.3251 k =-0.5000 0.1249 0.3235 ( 14062 PWs) bands (ev): -6.2763 -6.2763 -6.2650 -6.2650 -5.7544 -5.7544 -5.7313 -5.7313 -4.2988 -4.2988 -4.2838 -4.2838 -3.7267 -3.7267 -3.6888 -3.6888 -0.8013 -0.8013 -0.6384 -0.6384 1.6983 1.6983 1.7454 1.7454 2.2989 2.2989 2.3643 2.3643 3.0213 3.0213 3.2452 3.2452 3.8943 3.8943 3.9184 3.9184 4.0866 4.0866 4.1193 4.1193 4.2711 4.2711 4.3407 4.3407 4.4506 4.4506 4.5435 4.5435 5.4263 5.4263 5.5278 5.5278 5.6143 5.6143 5.7033 5.7033 6.0231 6.0231 6.0739 6.0739 6.2526 6.2526 6.3411 6.3411 7.1894 7.1894 7.2395 7.2395 7.6353 7.6353 7.7332 7.7332 8.1650 8.1650 8.3682 8.3682 k =-0.5000 0.1249 0.2986 ( 14066 PWs) bands (ev): -6.2810 -6.2810 -6.2644 -6.2644 -5.7548 -5.7548 -5.7207 -5.7207 -4.3135 -4.3135 -4.2920 -4.2920 -3.7261 -3.7261 -3.6707 -3.6707 -0.8380 -0.8380 -0.5951 -0.5951 1.6912 1.6912 1.7616 1.7616 2.2627 2.2627 2.3629 2.3629 2.9716 2.9716 3.2968 3.2968 3.8912 3.8912 3.9237 3.9237 4.0718 4.0718 4.1167 4.1167 4.2676 4.2676 4.3630 4.3630 4.4567 4.4567 4.5896 4.5896 5.3735 5.3735 5.5224 5.5224 5.6107 5.6107 5.7387 5.7387 6.0175 6.0175 6.0905 6.0905 6.2470 6.2470 6.3696 6.3696 7.1722 7.1722 7.2484 7.2484 7.6019 7.6019 7.7415 7.7415 8.1074 8.1074 8.4045 8.4045 k =-0.5000 0.1249 0.2738 ( 14056 PWs) bands (ev): -6.2862 -6.2862 -6.2648 -6.2648 -5.7532 -5.7532 -5.7085 -5.7085 -4.3312 -4.3312 -4.3043 -4.3043 -3.7222 -3.7222 -3.6506 -3.6506 -0.8727 -0.8727 -0.5515 -0.5515 1.6856 1.6856 1.7790 1.7790 2.2206 2.2206 2.3568 2.3568 2.9250 2.9250 3.3394 3.3394 3.8921 3.8921 3.9293 3.9293 4.0590 4.0590 4.1165 4.1165 4.2656 4.2656 4.3816 4.3816 4.4755 4.4755 4.6404 4.6404 5.3176 5.3176 5.5119 5.5119 5.6087 5.6087 5.7719 5.7719 6.0128 6.0128 6.1028 6.1028 6.2553 6.2553 6.3991 6.3991 7.1522 7.1522 7.2555 7.2555 7.5681 7.5681 7.7395 7.7395 8.0533 8.0533 8.4337 8.4337 k =-0.5000 0.1249 0.2489 ( 14048 PWs) bands (ev): -6.2917 -6.2917 -6.2659 -6.2659 -5.7498 -5.7498 -5.6953 -5.6953 -4.3511 -4.3511 -4.3197 -4.3197 -3.7156 -3.7156 -3.6293 -3.6293 -0.9051 -0.9051 -0.5081 -0.5081 1.6816 1.6816 1.7968 1.7968 2.1750 2.1750 2.3473 2.3473 2.8804 2.8804 3.3695 3.3695 3.8969 3.8969 3.9362 3.9362 4.0515 4.0515 4.1219 4.1219 4.2633 4.2633 4.3971 4.3971 4.5041 4.5041 4.6934 4.6934 5.2613 5.2613 5.4984 5.4984 5.6069 5.6069 5.8016 5.8016 6.0074 6.0074 6.1097 6.1097 6.2785 6.2785 6.4293 6.4293 7.1287 7.1287 7.2603 7.2603 7.5353 7.5353 7.7242 7.7242 8.0079 8.0079 8.4556 8.4556 k =-0.5000 0.1249 0.2240 ( 14040 PWs) bands (ev): -6.2972 -6.2972 -6.2677 -6.2677 -5.7450 -5.7450 -5.6812 -5.6812 -4.3722 -4.3722 -4.3371 -4.3371 -3.7071 -3.7071 -3.6077 -3.6077 -0.9351 -0.9351 -0.4653 -0.4653 1.6789 1.6789 1.8136 1.8136 2.1293 2.1293 2.3359 2.3359 2.8366 2.8366 3.3858 3.3858 3.9033 3.9033 3.9444 3.9444 4.0525 4.0525 4.1345 4.1345 4.2613 4.2613 4.4112 4.4112 4.5374 4.5374 4.7457 4.7457 5.2068 5.2068 5.4832 5.4832 5.6046 5.6046 5.8276 5.8276 6.0000 6.0000 6.1142 6.1142 6.3128 6.3128 6.4602 6.4602 7.1013 7.1013 7.2620 7.2620 7.5048 7.5048 7.6944 7.6944 7.9756 7.9756 8.4697 8.4697 k =-0.5000 0.1249 0.1991 ( 14052 PWs) bands (ev): -6.3026 -6.3026 -6.2699 -6.2699 -5.7392 -5.7392 -5.6669 -5.6669 -4.3938 -4.3938 -4.3557 -4.3557 -3.6976 -3.6976 -3.5864 -3.5864 -0.9625 -0.9625 -0.4238 -0.4238 1.6772 1.6772 1.8267 1.8267 2.0882 2.0882 2.3234 2.3234 2.7930 2.7930 3.3896 3.3896 3.9096 3.9096 3.9513 3.9513 4.0631 4.0631 4.1537 4.1537 4.2619 4.2619 4.4255 4.4255 4.5717 4.5717 4.7943 4.7943 5.1568 5.1568 5.4669 5.4669 5.6019 5.6019 5.8500 5.8500 5.9904 5.9904 6.1193 6.1193 6.3526 6.3526 6.4923 6.4923 7.0702 7.0702 7.2595 7.2595 7.4774 7.4774 7.6528 7.6528 7.9570 7.9570 8.4743 8.4743 k =-0.5000 0.1249 0.1742 ( 14052 PWs) bands (ev): -6.3078 -6.3078 -6.2724 -6.2724 -5.7326 -5.7326 -5.6526 -5.6526 -4.4150 -4.4150 -4.3743 -4.3743 -3.6877 -3.6877 -3.5661 -3.5661 -0.9871 -0.9871 -0.3843 -0.3843 1.6763 1.6763 1.8318 1.8318 2.0579 2.0579 2.3109 2.3109 2.7491 2.7491 3.3842 3.3842 3.9159 3.9159 3.9554 3.9554 4.0807 4.0807 4.1748 4.1748 4.2698 4.2698 4.4413 4.4413 4.6039 4.6039 4.8351 4.8351 5.1153 5.1153 5.4498 5.4498 5.5990 5.5990 5.8690 5.8690 5.9792 5.9792 6.1260 6.1260 6.3934 6.3934 6.5261 6.5261 7.0359 7.0359 7.2513 7.2513 7.4531 7.4531 7.6063 7.6063 7.9497 7.9497 8.4631 8.4631 k =-0.5000 0.1249 0.1493 ( 14062 PWs) bands (ev): -6.3126 -6.3126 -6.2749 -6.2749 -5.7258 -5.7258 -5.6390 -5.6390 -4.4351 -4.4351 -4.3923 -4.3923 -3.6781 -3.6781 -3.5474 -3.5474 -1.0088 -1.0088 -0.3475 -0.3475 1.6761 1.6761 1.8245 1.8245 2.0438 2.0438 2.2989 2.2989 2.7054 2.7054 3.3729 3.3729 3.9221 3.9221 3.9574 3.9574 4.1016 4.1016 4.1893 4.1893 4.2897 4.2897 4.4600 4.4600 4.6315 4.6315 4.8627 4.8627 5.0881 5.0881 5.4322 5.4322 5.5959 5.5959 5.8846 5.8846 5.9678 5.9678 6.1342 6.1342 6.4318 6.4318 6.5624 6.5624 6.9997 6.9997 7.2359 7.2359 7.4317 7.4317 7.5620 7.5620 7.9506 7.9506 8.4290 8.4290 k =-0.5000 0.1249 0.1244 ( 14064 PWs) bands (ev): -6.3168 -6.3168 -6.2774 -6.2774 -5.7191 -5.7191 -5.6264 -5.6264 -4.4535 -4.4535 -4.4089 -4.4089 -3.6692 -3.6692 -3.5308 -3.5308 -1.0274 -1.0274 -0.3143 -0.3143 1.6761 1.6761 1.8057 1.8057 2.0464 2.0464 2.2881 2.2881 2.6627 2.6627 3.3590 3.3590 3.9283 3.9283 3.9583 3.9583 4.1237 4.1237 4.1950 4.1950 4.3182 4.3182 4.4827 4.4827 4.6520 4.6520 4.8734 4.8734 5.0801 5.0801 5.4146 5.4146 5.5930 5.5930 5.8962 5.8962 5.9580 5.9580 6.1430 6.1430 6.4653 6.4653 6.6011 6.6011 6.9635 6.9635 7.2121 7.2121 7.4131 7.4131 7.5251 7.5251 7.9575 7.9575 8.3836 8.3836 k =-0.5000 0.1249 0.0995 ( 14052 PWs) bands (ev): -6.3205 -6.3205 -6.2796 -6.2796 -5.7130 -5.7130 -5.6153 -5.6153 -4.4695 -4.4695 -4.4233 -4.4233 -3.6614 -3.6614 -3.5166 -3.5166 -1.0428 -1.0428 -0.2855 -0.2855 1.6763 1.6763 1.7813 1.7813 2.0601 2.0601 2.2788 2.2788 2.6222 2.6222 3.3449 3.3449 3.9341 3.9341 3.9587 3.9587 4.1453 4.1453 4.1965 4.1965 4.3458 4.3458 4.5092 4.5092 4.6634 4.6634 4.8718 4.8718 5.0883 5.0883 5.3976 5.3976 5.5904 5.5904 5.9027 5.9027 5.9516 5.9516 6.1517 6.1517 6.4929 6.4929 6.6410 6.6410 6.9296 6.9296 7.1809 7.1809 7.3977 7.3977 7.4976 7.4976 7.9689 7.9689 8.3380 8.3380 k =-0.5000 0.1249 0.0747 ( 14046 PWs) bands (ev): -6.3234 -6.3234 -6.2815 -6.2815 -5.7079 -5.7079 -5.6062 -5.6062 -4.4826 -4.4826 -4.4351 -4.4351 -3.6551 -3.6551 -3.5052 -3.5052 -1.0550 -1.0550 -0.2619 -0.2619 1.6763 1.6763 1.7577 1.7577 2.0784 2.0784 2.2714 2.2714 2.5860 2.5860 3.3323 3.3323 3.9390 3.9390 3.9589 3.9589 4.1636 4.1636 4.1983 4.1983 4.3676 4.3676 4.5364 4.5364 4.6655 4.6655 4.8679 4.8679 5.1032 5.1032 5.3821 5.3821 5.5883 5.5883 5.9036 5.9036 5.9501 5.9501 6.1595 6.1595 6.5146 6.5146 6.6793 6.6793 6.9004 6.9004 7.1456 7.1456 7.3858 7.3858 7.4787 7.4787 7.9832 7.9832 8.2967 8.2967 k =-0.5000 0.1249 0.0498 ( 14040 PWs) bands (ev): -6.3255 -6.3255 -6.2829 -6.2829 -5.7040 -5.7040 -5.5994 -5.5994 -4.4923 -4.4923 -4.4439 -4.4439 -3.6504 -3.6504 -3.4969 -3.4969 -1.0637 -1.0637 -0.2445 -0.2445 1.6761 1.6761 1.7389 1.7389 2.0961 2.0961 2.2659 2.2659 2.5567 2.5567 3.3224 3.3224 3.9427 3.9427 3.9590 3.9590 4.1742 4.1742 4.2041 4.2041 4.3827 4.3827 4.5586 4.5586 4.6622 4.6622 4.8668 4.8668 5.1173 5.1173 5.3694 5.3694 5.5867 5.5867 5.9011 5.9011 5.9517 5.9517 6.1657 6.1657 6.5304 6.5304 6.7120 6.7120 6.8787 6.8787 7.1120 7.1120 7.3774 7.3774 7.4666 7.4666 7.9980 7.9980 8.2625 8.2625 k =-0.5000 0.1249 0.0249 ( 14036 PWs) bands (ev): -6.3268 -6.3268 -6.2837 -6.2837 -5.7015 -5.7015 -5.5952 -5.5952 -4.4982 -4.4982 -4.4493 -4.4493 -3.6476 -3.6476 -3.4918 -3.4918 -1.0689 -1.0689 -0.2337 -0.2337 1.6756 1.6756 1.7272 1.7272 2.1089 2.1089 2.2626 2.2626 2.5372 2.5372 3.3162 3.3162 3.9451 3.9451 3.9591 3.9591 4.1777 4.1777 4.2116 4.2116 4.3918 4.3918 4.5716 4.5716 4.6589 4.6589 4.8678 4.8678 5.1269 5.1269 5.3610 5.3610 5.5857 5.5857 5.8984 5.8984 5.9537 5.9537 6.1697 6.1697 6.5403 6.5403 6.7340 6.7340 6.8662 6.8662 7.0868 7.0868 7.3725 7.3725 7.4599 7.4599 8.0098 8.0098 8.2391 8.2391 k =-0.5000 0.1249-0.0000 ( 14034 PWs) bands (ev): -6.3272 -6.3272 -6.2840 -6.2840 -5.7007 -5.7007 -5.5938 -5.5938 -4.5003 -4.5003 -4.4511 -4.4511 -3.6466 -3.6466 -3.4901 -3.4901 -1.0707 -1.0707 -0.2301 -0.2301 1.6754 1.6754 1.7233 1.7233 2.1137 2.1137 2.2615 2.2615 2.5303 2.5303 3.3141 3.3141 3.9458 3.9458 3.9592 3.9592 4.1783 4.1783 4.2149 4.2149 4.3948 4.3948 4.5754 4.5754 4.6579 4.6579 4.8684 4.8684 5.1302 5.1302 5.3581 5.3581 5.5853 5.5853 5.8973 5.8973 5.9545 5.9545 6.1711 6.1711 6.5436 6.5436 6.7417 6.7417 6.8626 6.8626 7.0773 7.0773 7.3708 7.3708 7.4578 7.4578 8.0145 8.0145 8.2306 8.2306 k = 0.0000 0.0000 0.3733 ( 14058 PWs) bands (ev): -6.4129 -6.4129 -6.4129 -6.4129 -5.4977 -5.4977 -5.4977 -5.4977 -4.2927 -4.2927 -4.2927 -4.2927 -3.7934 -3.7934 -3.7934 -3.7934 -0.8857 -0.8857 -0.8857 -0.8857 1.7240 1.7240 1.7240 1.7240 2.2676 2.2676 2.2676 2.2676 3.2907 3.2907 3.2907 3.2907 3.9697 3.9697 3.9697 3.9697 4.1925 4.1925 4.1925 4.1925 4.4738 4.4738 4.4738 4.4738 4.8485 4.8485 4.8485 4.8485 5.3266 5.3266 5.3266 5.3266 5.6212 5.6212 5.6212 5.6212 5.9444 5.9444 5.9444 5.9444 6.4730 6.4730 6.4730 6.4730 6.7773 6.7773 6.7773 6.7773 7.4766 7.4766 7.4766 7.4766 8.4584 8.4584 8.4584 8.4584 k =-0.0250 0.0062 0.3733 ( 14048 PWs) bands (ev): -6.4122 -6.4122 -6.4122 -6.4122 -5.4992 -5.4992 -5.4990 -5.4990 -4.2929 -4.2929 -4.2925 -4.2925 -3.7930 -3.7930 -3.7927 -3.7927 -0.8849 -0.8849 -0.8849 -0.8849 1.7246 1.7246 1.7261 1.7261 2.2667 2.2667 2.2676 2.2676 3.2841 3.2841 3.2907 3.2907 3.9683 3.9683 3.9712 3.9712 4.1881 4.1881 4.1979 4.1979 4.4662 4.4662 4.4827 4.4827 4.8461 4.8461 4.8501 4.8501 5.3107 5.3107 5.3372 5.3372 5.6166 5.6166 5.6254 5.6254 5.9335 5.9335 5.9560 5.9560 6.4696 6.4696 6.4727 6.4727 6.7819 6.7819 6.7824 6.7824 7.4760 7.4760 7.4785 7.4785 8.4579 8.4579 8.4585 8.4585 k =-0.0500 0.0125 0.3733 ( 14050 PWs) bands (ev): -6.4102 -6.4102 -6.4102 -6.4102 -5.5033 -5.5033 -5.5031 -5.5031 -4.2930 -4.2930 -4.2923 -4.2923 -3.7913 -3.7913 -3.7907 -3.7907 -0.8825 -0.8825 -0.8824 -0.8824 1.7277 1.7277 1.7306 1.7306 2.2650 2.2650 2.2668 2.2668 3.2715 3.2715 3.2840 3.2840 3.9670 3.9670 3.9726 3.9726 4.1851 4.1851 4.2040 4.2040 4.4602 4.4602 4.4922 4.4922 4.8436 4.8436 4.8505 4.8505 5.2898 5.2898 5.3424 5.3424 5.6121 5.6121 5.6286 5.6286 5.9242 5.9242 5.9676 5.9676 6.4629 6.4629 6.4687 6.4687 6.7957 6.7957 6.7965 6.7965 7.4767 7.4767 7.4817 7.4817 8.4571 8.4571 8.4581 8.4581 k =-0.0750 0.0187 0.3733 ( 14068 PWs) bands (ev): -6.4069 -6.4069 -6.4069 -6.4069 -5.5101 -5.5101 -5.5097 -5.5097 -4.2931 -4.2931 -4.2921 -4.2921 -3.7884 -3.7884 -3.7876 -3.7876 -0.8785 -0.8785 -0.8784 -0.8784 1.7331 1.7331 1.7375 1.7375 2.2624 2.2624 2.2653 2.2653 3.2540 3.2540 3.2714 3.2714 3.9658 3.9658 3.9737 3.9737 4.1836 4.1836 4.2102 4.2102 4.4553 4.4553 4.5011 4.5011 4.8415 4.8415 4.8493 4.8493 5.2646 5.2646 5.3425 5.3425 5.6084 5.6084 5.6307 5.6307 5.9176 5.9176 5.9789 5.9789 6.4536 6.4536 6.4619 6.4619 6.8172 6.8172 6.8182 6.8182 7.4790 7.4790 7.4860 7.4860 8.4559 8.4559 8.4569 8.4569 k =-0.1000 0.0250 0.3733 ( 14066 PWs) bands (ev): -6.4023 -6.4023 -6.4022 -6.4022 -5.5193 -5.5193 -5.5189 -5.5189 -4.2931 -4.2931 -4.2919 -4.2919 -3.7846 -3.7846 -3.7836 -3.7836 -0.8729 -0.8729 -0.8728 -0.8728 1.7402 1.7402 1.7462 1.7462 2.2592 2.2592 2.2634 2.2634 3.2330 3.2330 3.2540 3.2540 3.9645 3.9645 3.9742 3.9742 4.1833 4.1833 4.2159 4.2159 4.4510 4.4510 4.5077 4.5077 4.8400 4.8400 4.8457 4.8457 5.2366 5.2366 5.3382 5.3382 5.6059 5.6059 5.6320 5.6320 5.9145 5.9145 5.9900 5.9900 6.4426 6.4426 6.4531 6.4531 6.8448 6.8448 6.8459 6.8459 7.4827 7.4827 7.4914 7.4914 8.4539 8.4539 8.4545 8.4545 k =-0.1250 0.0312 0.3733 ( 14074 PWs) bands (ev): -6.3965 -6.3965 -6.3964 -6.3964 -5.5309 -5.5309 -5.5304 -5.5304 -4.2930 -4.2930 -4.2915 -4.2915 -3.7798 -3.7798 -3.7786 -3.7786 -0.8659 -0.8659 -0.8658 -0.8658 1.7487 1.7487 1.7561 1.7561 2.2556 2.2556 2.2614 2.2614 3.2100 3.2100 3.2332 3.2332 3.9630 3.9630 3.9740 3.9740 4.1838 4.1838 4.2208 4.2208 4.4468 4.4468 4.5106 4.5106 4.8383 4.8383 4.8389 4.8389 5.2086 5.2086 5.3308 5.3308 5.6050 5.6050 5.6330 5.6330 5.9152 5.9152 6.0009 6.0009 6.4306 6.4306 6.4430 6.4430 6.8766 6.8766 6.8778 6.8778 7.4879 7.4879 7.4978 7.4978 8.4505 8.4505 8.4508 8.4508 k =-0.1500 0.0375 0.3733 ( 14066 PWs) bands (ev): -6.3895 -6.3895 -6.3893 -6.3893 -5.5445 -5.5445 -5.5439 -5.5439 -4.2928 -4.2928 -4.2911 -4.2911 -3.7744 -3.7744 -3.7731 -3.7731 -0.8574 -0.8574 -0.8573 -0.8573 1.7575 1.7575 1.7665 1.7665 2.2521 2.2521 2.2597 2.2597 3.1867 3.1867 3.2106 3.2106 3.9611 3.9611 3.9729 3.9729 4.1846 4.1846 4.2246 4.2246 4.4420 4.4420 4.5086 4.5086 4.8274 4.8274 4.8337 4.8337 5.1848 5.1848 5.3228 5.3228 5.6056 5.6056 5.6345 5.6345 5.9191 5.9191 6.0114 6.0114 6.4180 6.4180 6.4321 6.4321 6.9112 6.9112 6.9126 6.9126 7.4947 7.4947 7.5052 7.5052 8.4444 8.4444 8.4461 8.4461 k =-0.1750 0.0437 0.3733 ( 14090 PWs) bands (ev): -6.3814 -6.3814 -6.3812 -6.3812 -5.5599 -5.5599 -5.5593 -5.5593 -4.2924 -4.2924 -4.2906 -4.2906 -3.7686 -3.7686 -3.7671 -3.7671 -0.8477 -0.8477 -0.8476 -0.8476 1.7660 1.7660 1.7764 1.7764 2.2491 2.2491 2.2587 2.2587 3.1643 3.1643 3.1878 3.1878 3.9589 3.9589 3.9709 3.9709 4.1852 4.1852 4.2271 4.2271 4.4362 4.4362 4.5015 4.5015 4.8098 4.8098 4.8220 4.8220 5.1704 5.1704 5.3169 5.3169 5.6077 5.6077 5.6370 5.6370 5.9254 5.9254 6.0214 6.0214 6.4051 6.4051 6.4206 6.4206 6.9472 6.9472 6.9490 6.9490 7.5032 7.5032 7.5135 7.5135 8.4361 8.4361 8.4396 8.4396 k =-0.2000 0.0500 0.3733 ( 14086 PWs) bands (ev): -6.3723 -6.3723 -6.3722 -6.3722 -5.5769 -5.5769 -5.5762 -5.5762 -4.2919 -4.2919 -4.2900 -4.2900 -3.7624 -3.7624 -3.7609 -3.7609 -0.8369 -0.8369 -0.8367 -0.8367 1.7731 1.7731 1.7848 1.7848 2.2475 2.2475 2.2592 2.2592 3.1441 3.1441 3.1661 3.1661 3.9562 3.9562 3.9682 3.9682 4.1850 4.1850 4.2282 4.2282 4.4293 4.4293 4.4898 4.4898 4.7848 4.7848 4.7997 4.7997 5.1692 5.1692 5.3160 5.3160 5.6111 5.6111 5.6405 5.6405 5.9333 5.9333 6.0307 6.0307 6.3920 6.3920 6.4089 6.4089 6.9833 6.9833 6.9859 6.9859 7.5135 7.5135 7.5230 7.5230 8.4256 8.4256 8.4309 8.4309 k =-0.2250 0.0562 0.3733 ( 14076 PWs) bands (ev): -6.3624 -6.3624 -6.3622 -6.3622 -5.5949 -5.5949 -5.5943 -5.5943 -4.2911 -4.2911 -4.2892 -4.2892 -3.7562 -3.7562 -3.7546 -3.7546 -0.8251 -0.8251 -0.8249 -0.8249 1.7780 1.7780 1.7906 1.7906 2.2480 2.2480 2.2616 2.2616 3.1270 3.1270 3.1467 3.1467 3.9531 3.9531 3.9648 3.9648 4.1838 4.1838 4.2276 4.2276 4.4211 4.4211 4.4744 4.4744 4.7526 4.7526 4.7663 4.7663 5.1820 5.1820 5.3214 5.3214 5.6154 5.6154 5.6448 5.6448 5.9420 5.9420 6.0391 6.0391 6.3789 6.3789 6.3970 6.3970 7.0187 7.0187 7.0224 7.0224 7.5258 7.5258 7.5337 7.5337 8.4128 8.4128 8.4201 8.4201 k =-0.2500 0.0625 0.3733 ( 14078 PWs) bands (ev): -6.3518 -6.3518 -6.3516 -6.3516 -5.6138 -5.6138 -5.6131 -5.6131 -4.2903 -4.2903 -4.2883 -4.2883 -3.7500 -3.7500 -3.7485 -3.7485 -0.8127 -0.8127 -0.8125 -0.8125 1.7799 1.7799 1.7930 1.7930 2.2512 2.2512 2.2665 2.2665 3.1137 3.1137 3.1304 3.1304 3.9495 3.9495 3.9607 3.9607 4.1813 4.1813 4.2252 4.2252 4.4118 4.4118 4.4562 4.4562 4.7142 4.7142 4.7250 4.7250 5.2061 5.2061 5.3334 5.3334 5.6203 5.6203 5.6494 5.6494 5.9509 5.9509 6.0463 6.0463 6.3659 6.3659 6.3851 6.3851 7.0524 7.0524 7.0574 7.0574 7.5400 7.5400 7.5459 7.5459 8.3983 8.3983 8.4073 8.4073 k =-0.2750 0.0687 0.3733 ( 14076 PWs) bands (ev): -6.3407 -6.3407 -6.3405 -6.3405 -5.6331 -5.6331 -5.6324 -5.6324 -4.2893 -4.2893 -4.2874 -4.2874 -3.7441 -3.7441 -3.7426 -3.7426 -0.7998 -0.7998 -0.7996 -0.7996 1.7785 1.7785 1.7916 1.7916 2.2574 2.2574 2.2738 2.2738 3.1044 3.1044 3.1178 3.1178 3.9455 3.9455 3.9562 3.9562 4.1772 4.1772 4.2207 4.2207 4.4013 4.4013 4.4359 4.4359 4.6721 4.6721 4.6799 4.6799 5.2377 5.2377 5.3511 5.3511 5.6253 5.6253 5.6539 5.6539 5.9597 5.9597 6.0523 6.0523 6.3532 6.3532 6.3731 6.3731 7.0837 7.0837 7.0902 7.0902 7.5563 7.5563 7.5598 7.5598 8.3824 8.3824 8.3926 8.3926 k =-0.3000 0.0749 0.3733 ( 14066 PWs) bands (ev): -6.3294 -6.3294 -6.3292 -6.3292 -5.6523 -5.6523 -5.6516 -5.6516 -4.2882 -4.2882 -4.2864 -4.2864 -3.7385 -3.7385 -3.7371 -3.7371 -0.7868 -0.7868 -0.7866 -0.7866 1.7739 1.7739 1.7865 1.7865 2.2665 2.2665 2.2834 2.2834 3.0994 3.0994 3.1093 3.1093 3.9410 3.9410 3.9512 3.9512 4.1714 4.1714 4.2138 4.2138 4.3896 4.3896 4.4140 4.4140 4.6292 4.6292 4.6352 4.6352 5.2737 5.2737 5.3729 5.3729 5.6301 5.6301 5.6577 5.6577 5.9685 5.9685 6.0570 6.0570 6.3408 6.3408 6.3612 6.3612 7.1120 7.1120 7.1199 7.1199 7.5746 7.5746 7.5755 7.5755 8.3657 8.3657 8.3767 8.3767 k =-0.3250 0.0812 0.3733 ( 14050 PWs) bands (ev): -6.3181 -6.3181 -6.3179 -6.3179 -5.6710 -5.6710 -5.6704 -5.6704 -4.2871 -4.2871 -4.2854 -4.2854 -3.7335 -3.7335 -3.7321 -3.7321 -0.7741 -0.7741 -0.7739 -0.7739 1.7666 1.7666 1.7781 1.7781 2.2780 2.2780 2.2947 2.2947 3.0983 3.0983 3.1049 3.1049 3.9360 3.9360 3.9457 3.9457 4.1639 4.1639 4.2042 4.2042 4.3765 4.3765 4.3912 4.3912 4.5885 4.5885 4.5943 4.5943 5.3117 5.3117 5.3973 5.3973 5.6344 5.6344 5.6603 5.6603 5.9773 5.9773 6.0603 6.0603 6.3290 6.3290 6.3495 6.3495 7.1369 7.1369 7.1459 7.1459 7.5929 7.5929 7.5943 7.5943 8.3487 8.3487 8.3599 8.3599 k =-0.3500 0.0874 0.3733 ( 14062 PWs) bands (ev): -6.3071 -6.3071 -6.3069 -6.3069 -5.6888 -5.6888 -5.6882 -5.6882 -4.2859 -4.2859 -4.2844 -4.2844 -3.7289 -3.7289 -3.7277 -3.7277 -0.7621 -0.7621 -0.7618 -0.7618 1.7574 1.7574 1.7676 1.7676 2.2910 2.2910 2.3068 2.3068 3.1006 3.1006 3.1043 3.1043 3.9307 3.9307 3.9397 3.9397 4.1548 4.1548 4.1917 4.1917 4.3619 4.3619 4.3684 4.3684 4.5530 4.5530 4.5595 4.5595 5.3498 5.3498 5.4224 5.4224 5.6377 5.6377 5.6613 5.6613 5.9862 5.9862 6.0623 6.0623 6.3180 6.3180 6.3380 6.3380 7.1582 7.1582 7.1678 7.1678 7.6117 7.6117 7.6150 7.6150 8.3320 8.3320 8.3429 8.3429 k =-0.3750 0.0937 0.3733 ( 14068 PWs) bands (ev): -6.2967 -6.2967 -6.2966 -6.2966 -5.7050 -5.7050 -5.7045 -5.7045 -4.2848 -4.2848 -4.2836 -4.2836 -3.7250 -3.7250 -3.7240 -3.7240 -0.7510 -0.7510 -0.7508 -0.7508 1.7474 1.7474 1.7561 1.7561 2.3044 2.3044 2.3187 2.3187 3.1057 3.1057 3.1070 3.1070 3.9250 3.9250 3.9333 3.9333 4.1445 4.1445 4.1767 4.1767 4.3461 4.3461 4.3468 4.3468 4.5244 4.5244 4.5316 4.5316 5.3865 5.3865 5.4469 5.4469 5.6399 5.6399 5.6605 5.6605 5.9954 5.9954 6.0629 6.0629 6.3081 6.3081 6.3269 6.3269 7.1759 7.1759 7.1854 7.1854 7.6312 7.6312 7.6355 7.6355 8.3163 8.3163 8.3264 8.3264 k =-0.4000 0.0999 0.3733 ( 14064 PWs) bands (ev): -6.2875 -6.2875 -6.2874 -6.2874 -5.7193 -5.7193 -5.7189 -5.7189 -4.2838 -4.2838 -4.2828 -4.2828 -3.7218 -3.7218 -3.7209 -3.7209 -0.7413 -0.7413 -0.7411 -0.7411 1.7377 1.7377 1.7446 1.7446 2.3172 2.3172 2.3294 2.3294 3.1121 3.1121 3.1124 3.1124 3.9192 3.9192 3.9266 3.9266 4.1338 4.1338 4.1600 4.1600 4.3281 4.3281 4.3304 4.3304 4.5034 4.5034 4.5105 4.5105 5.4207 5.4207 5.4693 5.4693 5.6409 5.6409 5.6577 5.6577 6.0049 6.0049 6.0620 6.0620 6.2998 6.2998 6.3165 6.3165 7.1901 7.1901 7.1989 7.1989 7.6501 7.6501 7.6548 7.6548 8.3022 8.3022 8.3110 8.3110 k =-0.4250 0.1062 0.3733 ( 14060 PWs) bands (ev): -6.2797 -6.2797 -6.2796 -6.2796 -5.7311 -5.7311 -5.7307 -5.7307 -4.2830 -4.2830 -4.2822 -4.2822 -3.7192 -3.7192 -3.7185 -3.7185 -0.7333 -0.7333 -0.7332 -0.7332 1.7291 1.7291 1.7343 1.7343 2.3286 2.3286 2.3382 2.3382 3.1183 3.1183 3.1195 3.1195 3.9137 3.9137 3.9199 3.9199 4.1239 4.1239 4.1435 4.1435 4.3134 4.3134 4.3163 4.3163 4.4892 4.4892 4.4953 4.4953 5.4511 5.4511 5.4881 5.4881 5.6409 5.6409 5.6534 5.6534 6.0146 6.0146 6.0595 6.0595 6.2934 6.2934 6.3071 6.3071 7.2012 7.2012 7.2085 7.2085 7.6672 7.6672 7.6715 7.6715 8.2905 8.2905 8.2975 8.2975 k =-0.4500 0.1124 0.3733 ( 14068 PWs) bands (ev): -6.2739 -6.2739 -6.2738 -6.2738 -5.7399 -5.7399 -5.7396 -5.7396 -4.2823 -4.2823 -4.2817 -4.2817 -3.7173 -3.7173 -3.7168 -3.7168 -0.7274 -0.7274 -0.7273 -0.7273 1.7226 1.7226 1.7261 1.7261 2.3378 2.3378 2.3444 2.3444 3.1243 3.1243 3.1256 3.1256 3.9093 3.9093 3.9137 3.9137 4.1162 4.1162 4.1291 4.1291 4.3031 4.3031 4.3054 4.3054 4.4805 4.4805 4.4849 4.4849 5.4765 5.4765 5.5016 5.5016 5.6401 5.6401 5.6482 5.6482 6.0243 6.0243 6.0554 6.0554 6.2893 6.2893 6.2992 6.2992 7.2093 7.2093 7.2145 7.2145 7.6811 7.6811 7.6843 7.6843 8.2819 8.2819 8.2868 8.2868 k =-0.4750 0.1187 0.3733 ( 14062 PWs) bands (ev): -6.2702 -6.2702 -6.2701 -6.2701 -5.7453 -5.7453 -5.7452 -5.7452 -4.2818 -4.2818 -4.2815 -4.2815 -3.7161 -3.7161 -3.7159 -3.7159 -0.7238 -0.7238 -0.7237 -0.7237 1.7188 1.7188 1.7206 1.7206 2.3442 2.3442 2.3476 2.3476 3.1288 3.1288 3.1296 3.1296 3.9066 3.9066 3.9090 3.9090 4.1122 4.1122 4.1186 4.1186 4.2972 4.2972 4.2984 4.2984 4.4762 4.4762 4.4785 4.4785 5.4954 5.4954 5.5082 5.5082 5.6397 5.6397 5.6435 5.6435 6.0337 6.0337 6.0496 6.0496 6.2879 6.2879 6.2931 6.2931 7.2147 7.2147 7.2174 7.2174 7.6904 7.6904 7.6921 7.6921 8.2769 8.2769 8.2794 8.2794 k =-0.5000 0.1249 0.3733 ( 14060 PWs) bands (ev): -6.2689 -6.2689 -6.2689 -6.2689 -5.7471 -5.7471 -5.7471 -5.7471 -4.2815 -4.2815 -4.2815 -4.2815 -3.7156 -3.7156 -3.7156 -3.7156 -0.7225 -0.7225 -0.7225 -0.7225 1.7181 1.7181 1.7181 1.7181 2.3475 2.3475 2.3475 2.3475 3.1307 3.1307 3.1307 3.1307 3.9065 3.9065 3.9065 3.9065 4.1129 4.1129 4.1129 4.1129 4.2957 4.2957 4.2957 4.2957 4.4757 4.4757 4.4757 4.4757 5.5063 5.5063 5.5063 5.5063 5.6406 5.6406 5.6406 5.6406 6.0422 6.0422 6.0422 6.0422 6.2892 6.2892 6.2892 6.2892 7.2174 7.2174 7.2174 7.2174 7.6942 7.6942 7.6942 7.6942 8.2761 8.2761 8.2761 8.2761 Writing output data file ZrGeTe4.save init_run : 2.49s CPU 13.00s WALL ( 1 calls) electrons : 2531.03s CPU 2550.58s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.54s CPU 1.70s WALL ( 1 calls) Called by electrons: c_bands : 2531.00s CPU 2550.37s WALL ( 1 calls) v_of_rho : 0.22s CPU 1.06s WALL ( 1 calls) v_h : 0.06s CPU 0.07s WALL ( 1 calls) v_xc : 0.15s CPU 0.64s WALL ( 1 calls) newd : 0.18s CPU 0.34s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.20s CPU 0.36s WALL ( 294 calls) cegterg : 2327.82s CPU 2343.36s WALL ( 856 calls) Called by sum_band: Called by *egterg: h_psi : 1191.07s CPU 1203.03s WALL ( 15121 calls) s_psi : 65.00s CPU 64.99s WALL ( 15121 calls) g_psi : 3.42s CPU 3.54s WALL ( 13971 calls) cdiaghg : 702.01s CPU 699.19s WALL ( 14265 calls) cegterg:over : 209.60s CPU 206.48s WALL ( 13971 calls) cegterg:upda : 95.45s CPU 99.26s WALL ( 13971 calls) cegterg:last : 66.84s CPU 67.58s WALL ( 2098 calls) Called by h_psi: h_psi:vloc : 985.12s CPU 993.74s WALL ( 15121 calls) h_psi:vnl : 202.66s CPU 205.05s WALL ( 15121 calls) add_vuspsi : 73.87s CPU 79.32s WALL ( 15121 calls) General routines calbec : 128.72s CPU 125.60s WALL ( 15121 calls) fft : 0.34s CPU 1.40s WALL ( 15 calls) fftw : 923.40s CPU 932.33s WALL ( 1933856 calls) davcio : 0.05s CPU 4.84s WALL ( 588 calls) Parallel routines fft_scatter : 482.97s CPU 483.21s WALL ( 1933871 calls) PWSCF : 44m25.60s CPU 50m 9.29s WALL This run was terminated on: 8:56:18 11Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=