Program PWSCF v.5.1.1 starts on 23Jul2015 at 13: 6: 4 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: ./Rb2Te.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized 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 45 24 7 2187 854 131 Max 46 25 8 2194 880 137 Sum 2205 1177 349 105131 41765 6445 bravais-lattice index = 14 lattice parameter (alat) = 11.0944 a.u. unit-cell volume = 1493.8220 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 35.0000 Ry charge density cutoff = 259.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.094366 celldm(2)= 1.000000 celldm(3)= 1.266759 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.504230 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.504230 0.863569 0.000000 ) a(3) = ( 0.000000 0.000000 1.266759 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.583890 -0.000000 ) b(2) = ( 0.000000 1.157984 -0.000000 ) b(3) = ( 0.000000 0.000000 0.789416 ) PseudoPot. # 1 for Te read from file: /home/autes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Rb read from file: /home/autes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Te 6.00 127.60000 Te( 1.00) Rb 9.00 85.46780 Rb( 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 ) ( 0.6333797 ) 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= 308 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0092332 0.0160831 -0.0000000), wk = 0.0032468 k( 3) = ( 0.0184664 0.0321662 -0.0000000), wk = 0.0032468 k( 4) = ( 0.0276997 0.0482494 -0.0000000), wk = 0.0032468 k( 5) = ( 0.0369329 0.0643325 -0.0000000), wk = 0.0032468 k( 6) = ( 0.0461661 0.0804156 -0.0000000), wk = 0.0032468 k( 7) = ( 0.0553993 0.0964987 -0.0000000), wk = 0.0032468 k( 8) = ( 0.0646326 0.1125818 -0.0000000), wk = 0.0032468 k( 9) = ( 0.0738658 0.1286649 -0.0000000), wk = 0.0032468 k( 10) = ( 0.0830990 0.1447481 -0.0000000), wk = 0.0032468 k( 11) = ( 0.0923322 0.1608312 -0.0000000), wk = 0.0032468 k( 12) = ( 0.1015655 0.1769143 -0.0000000), wk = 0.0032468 k( 13) = ( 0.1107987 0.1929974 -0.0000000), wk = 0.0032468 k( 14) = ( 0.1200319 0.2090805 -0.0000000), wk = 0.0032468 k( 15) = ( 0.1292651 0.2251636 -0.0000000), wk = 0.0032468 k( 16) = ( 0.1384983 0.2412467 -0.0000000), wk = 0.0032468 k( 17) = ( 0.1477316 0.2573299 -0.0000000), wk = 0.0032468 k( 18) = ( 0.1569648 0.2734130 -0.0000000), wk = 0.0032468 k( 19) = ( 0.1661980 0.2894961 -0.0000000), wk = 0.0032468 k( 20) = ( 0.1754312 0.3055792 -0.0000000), wk = 0.0032468 k( 21) = ( 0.1846645 0.3216623 -0.0000000), wk = 0.0032468 k( 22) = ( 0.1938977 0.3377455 -0.0000000), wk = 0.0032468 k( 23) = ( 0.2031309 0.3538286 -0.0000000), wk = 0.0032468 k( 24) = ( 0.2123641 0.3699117 -0.0000000), wk = 0.0032468 k( 25) = ( 0.2215973 0.3859948 -0.0000000), wk = 0.0032468 k( 26) = ( 0.2308306 0.4020779 -0.0000000), wk = 0.0032468 k( 27) = ( 0.2400638 0.4181610 -0.0000000), wk = 0.0032468 k( 28) = ( 0.2492970 0.4342442 -0.0000000), wk = 0.0032468 k( 29) = ( 0.2585302 0.4503273 -0.0000000), wk = 0.0032468 k( 30) = ( 0.2677635 0.4664104 -0.0000000), wk = 0.0032468 k( 31) = ( 0.2769967 0.4824935 -0.0000000), wk = 0.0032468 k( 32) = ( 0.2862299 0.4985766 -0.0000000), wk = 0.0032468 k( 33) = ( 0.2954631 0.5146597 -0.0000000), wk = 0.0032468 k( 34) = ( 0.3046963 0.5307429 -0.0000000), wk = 0.0032468 k( 35) = ( 0.3139296 0.5468260 -0.0000000), wk = 0.0032468 k( 36) = ( 0.3231628 0.5629091 -0.0000000), wk = 0.0032468 k( 37) = ( 0.3323960 0.5789922 -0.0000000), wk = 0.0032468 k( 38) = ( 0.3323960 0.5789922 -0.0000000), wk = 0.0032468 k( 39) = ( 0.3139296 0.5789922 -0.0000000), wk = 0.0032468 k( 40) = ( 0.2954631 0.5789922 -0.0000000), wk = 0.0032468 k( 41) = ( 0.2769967 0.5789922 -0.0000000), wk = 0.0032468 k( 42) = ( 0.2585302 0.5789922 -0.0000000), wk = 0.0032468 k( 43) = ( 0.2400638 0.5789922 -0.0000000), wk = 0.0032468 k( 44) = ( 0.2215973 0.5789922 -0.0000000), wk = 0.0032468 k( 45) = ( 0.2031309 0.5789922 -0.0000000), wk = 0.0032468 k( 46) = ( 0.1846645 0.5789922 -0.0000000), wk = 0.0032468 k( 47) = ( 0.1661980 0.5789922 -0.0000000), wk = 0.0032468 k( 48) = ( 0.1477316 0.5789922 -0.0000000), wk = 0.0032468 k( 49) = ( 0.1292651 0.5789922 -0.0000000), wk = 0.0032468 k( 50) = ( 0.1107987 0.5789922 -0.0000000), wk = 0.0032468 k( 51) = ( 0.0923322 0.5789922 -0.0000000), wk = 0.0032468 k( 52) = ( 0.0738658 0.5789922 -0.0000000), wk = 0.0032468 k( 53) = ( 0.0553993 0.5789922 -0.0000000), wk = 0.0032468 k( 54) = ( 0.0369329 0.5789922 -0.0000000), wk = 0.0032468 k( 55) = ( 0.0184664 0.5789922 -0.0000000), wk = 0.0032468 k( 56) = ( 0.0000000 0.5789922 -0.0000000), wk = 0.0032468 k( 57) = ( 0.0000000 0.5789922 -0.0000000), wk = 0.0032468 k( 58) = ( 0.0000000 0.5789922 0.0179413), wk = 0.0032468 k( 59) = ( 0.0000000 0.5789922 0.0358825), wk = 0.0032468 k( 60) = ( 0.0000000 0.5789922 0.0538238), wk = 0.0032468 k( 61) = ( 0.0000000 0.5789922 0.0717651), wk = 0.0032468 k( 62) = ( 0.0000000 0.5789922 0.0897063), wk = 0.0032468 k( 63) = ( 0.0000000 0.5789922 0.1076476), wk = 0.0032468 k( 64) = ( 0.0000000 0.5789922 0.1255889), wk = 0.0032468 k( 65) = ( 0.0000000 0.5789922 0.1435302), wk = 0.0032468 k( 66) = ( 0.0000000 0.5789922 0.1614714), wk = 0.0032468 k( 67) = ( 0.0000000 0.5789922 0.1794127), wk = 0.0032468 k( 68) = ( 0.0000000 0.5789922 0.1973540), wk = 0.0032468 k( 69) = ( 0.0000000 0.5789922 0.2152952), wk = 0.0032468 k( 70) = ( 0.0000000 0.5789922 0.2332365), wk = 0.0032468 k( 71) = ( 0.0000000 0.5789922 0.2511778), wk = 0.0032468 k( 72) = ( 0.0000000 0.5789922 0.2691190), wk = 0.0032468 k( 73) = ( 0.0000000 0.5789922 0.2870603), wk = 0.0032468 k( 74) = ( 0.0000000 0.5789922 0.3050016), wk = 0.0032468 k( 75) = ( 0.0000000 0.5789922 0.3229429), wk = 0.0032468 k( 76) = ( 0.0000000 0.5789922 0.3408841), wk = 0.0032468 k( 77) = ( 0.0000000 0.5789922 0.3588254), wk = 0.0032468 k( 78) = ( 0.0000000 0.5789922 0.3767667), wk = 0.0032468 k( 79) = ( 0.0000000 0.5789922 0.3947079), wk = 0.0032468 k( 80) = ( 0.0000000 0.5789922 0.3947079), wk = 0.0032468 k( 81) = ( 0.0184664 0.5789922 0.3947079), wk = 0.0032468 k( 82) = ( 0.0369329 0.5789922 0.3947079), wk = 0.0032468 k( 83) = ( 0.0553993 0.5789922 0.3947079), wk = 0.0032468 k( 84) = ( 0.0738658 0.5789922 0.3947079), wk = 0.0032468 k( 85) = ( 0.0923322 0.5789922 0.3947079), wk = 0.0032468 k( 86) = ( 0.1107987 0.5789922 0.3947079), wk = 0.0032468 k( 87) = ( 0.1292651 0.5789922 0.3947079), wk = 0.0032468 k( 88) = ( 0.1477316 0.5789922 0.3947079), wk = 0.0032468 k( 89) = ( 0.1661980 0.5789922 0.3947079), wk = 0.0032468 k( 90) = ( 0.1846645 0.5789922 0.3947079), wk = 0.0032468 k( 91) = ( 0.2031309 0.5789922 0.3947079), wk = 0.0032468 k( 92) = ( 0.2215973 0.5789922 0.3947079), wk = 0.0032468 k( 93) = ( 0.2400638 0.5789922 0.3947079), wk = 0.0032468 k( 94) = ( 0.2585302 0.5789922 0.3947079), wk = 0.0032468 k( 95) = ( 0.2769967 0.5789922 0.3947079), wk = 0.0032468 k( 96) = ( 0.2954631 0.5789922 0.3947079), wk = 0.0032468 k( 97) = ( 0.3139296 0.5789922 0.3947079), wk = 0.0032468 k( 98) = ( 0.3323960 0.5789922 0.3947079), wk = 0.0032468 k( 99) = ( 0.3323960 0.5789922 0.3947079), wk = 0.0032468 k( 100) = ( 0.3231628 0.5629091 0.3947079), wk = 0.0032468 k( 101) = ( 0.3139296 0.5468260 0.3947079), wk = 0.0032468 k( 102) = ( 0.3046963 0.5307429 0.3947079), wk = 0.0032468 k( 103) = ( 0.2954631 0.5146597 0.3947079), wk = 0.0032468 k( 104) = ( 0.2862299 0.4985766 0.3947079), wk = 0.0032468 k( 105) = ( 0.2769967 0.4824935 0.3947079), wk = 0.0032468 k( 106) = ( 0.2677635 0.4664104 0.3947079), wk = 0.0032468 k( 107) = ( 0.2585302 0.4503273 0.3947079), wk = 0.0032468 k( 108) = ( 0.2492970 0.4342442 0.3947079), wk = 0.0032468 k( 109) = ( 0.2400638 0.4181610 0.3947079), wk = 0.0032468 k( 110) = ( 0.2308306 0.4020779 0.3947079), wk = 0.0032468 k( 111) = ( 0.2215973 0.3859948 0.3947079), wk = 0.0032468 k( 112) = ( 0.2123641 0.3699117 0.3947079), wk = 0.0032468 k( 113) = ( 0.2031309 0.3538286 0.3947079), wk = 0.0032468 k( 114) = ( 0.1938977 0.3377455 0.3947079), wk = 0.0032468 k( 115) = ( 0.1846645 0.3216623 0.3947079), wk = 0.0032468 k( 116) = ( 0.1754312 0.3055792 0.3947079), wk = 0.0032468 k( 117) = ( 0.1661980 0.2894961 0.3947079), wk = 0.0032468 k( 118) = ( 0.1569648 0.2734130 0.3947079), wk = 0.0032468 k( 119) = ( 0.1477316 0.2573299 0.3947079), wk = 0.0032468 k( 120) = ( 0.1384983 0.2412467 0.3947079), wk = 0.0032468 k( 121) = ( 0.1292651 0.2251636 0.3947079), wk = 0.0032468 k( 122) = ( 0.1200319 0.2090805 0.3947079), wk = 0.0032468 k( 123) = ( 0.1107987 0.1929974 0.3947079), wk = 0.0032468 k( 124) = ( 0.1015655 0.1769143 0.3947079), wk = 0.0032468 k( 125) = ( 0.0923322 0.1608312 0.3947079), wk = 0.0032468 k( 126) = ( 0.0830990 0.1447481 0.3947079), wk = 0.0032468 k( 127) = ( 0.0738658 0.1286649 0.3947079), wk = 0.0032468 k( 128) = ( 0.0646326 0.1125818 0.3947079), wk = 0.0032468 k( 129) = ( 0.0553993 0.0964987 0.3947079), wk = 0.0032468 k( 130) = ( 0.0461661 0.0804156 0.3947079), wk = 0.0032468 k( 131) = ( 0.0369329 0.0643325 0.3947079), wk = 0.0032468 k( 132) = ( 0.0276997 0.0482494 0.3947079), wk = 0.0032468 k( 133) = ( 0.0184664 0.0321662 0.3947079), wk = 0.0032468 k( 134) = ( 0.0092332 0.0160831 0.3947079), wk = 0.0032468 k( 135) = ( 0.0000000 0.0000000 0.3947079), wk = 0.0032468 k( 136) = ( 0.0000000 0.0000000 0.3947079), wk = 0.0032468 k( 137) = ( 0.0000000 0.0000000 0.3767667), wk = 0.0032468 k( 138) = ( 0.0000000 0.0000000 0.3588254), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.3408841), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.3229429), wk = 0.0032468 k( 141) = ( 0.0000000 0.0000000 0.3050016), wk = 0.0032468 k( 142) = ( 0.0000000 0.0000000 0.2870603), wk = 0.0032468 k( 143) = ( 0.0000000 0.0000000 0.2691190), wk = 0.0032468 k( 144) = ( 0.0000000 0.0000000 0.2511778), wk = 0.0032468 k( 145) = ( 0.0000000 0.0000000 0.2332365), wk = 0.0032468 k( 146) = ( 0.0000000 0.0000000 0.2152952), wk = 0.0032468 k( 147) = ( 0.0000000 0.0000000 0.1973540), wk = 0.0032468 k( 148) = ( 0.0000000 0.0000000 0.1794127), wk = 0.0032468 k( 149) = ( 0.0000000 0.0000000 0.1614714), wk = 0.0032468 k( 150) = ( 0.0000000 0.0000000 0.1435302), wk = 0.0032468 k( 151) = ( 0.0000000 0.0000000 0.1255889), wk = 0.0032468 k( 152) = ( 0.0000000 0.0000000 0.1076476), wk = 0.0032468 k( 153) = ( 0.0000000 0.0000000 0.0897063), wk = 0.0032468 k( 154) = ( 0.0000000 0.0000000 0.0717651), wk = 0.0032468 k( 155) = ( 0.0000000 0.0000000 0.0538238), wk = 0.0032468 k( 156) = ( 0.0000000 0.0000000 0.0358825), wk = 0.0032468 k( 157) = ( 0.0000000 0.0000000 0.0179413), wk = 0.0032468 k( 158) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 160) = ( -0.0161290 0.0092596 0.0000000), wk = 0.0032468 k( 161) = ( -0.0322581 0.0185192 0.0000000), wk = 0.0032468 k( 162) = ( -0.0483871 0.0277787 0.0000000), wk = 0.0032468 k( 163) = ( -0.0645161 0.0370383 0.0000000), wk = 0.0032468 k( 164) = ( -0.0806452 0.0462979 0.0000000), wk = 0.0032468 k( 165) = ( -0.0967742 0.0555575 0.0000000), wk = 0.0032468 k( 166) = ( -0.1129032 0.0648171 0.0000000), wk = 0.0032468 k( 167) = ( -0.1290323 0.0740767 0.0000000), wk = 0.0032468 k( 168) = ( -0.1451613 0.0833362 0.0000000), wk = 0.0032468 k( 169) = ( -0.1612903 0.0925958 0.0000000), wk = 0.0032468 k( 170) = ( -0.1774194 0.1018554 0.0000000), wk = 0.0032468 k( 171) = ( -0.1935484 0.1111150 0.0000000), wk = 0.0032468 k( 172) = ( -0.2096774 0.1203746 0.0000000), wk = 0.0032468 k( 173) = ( -0.2258064 0.1296341 0.0000000), wk = 0.0032468 k( 174) = ( -0.2419355 0.1388937 0.0000000), wk = 0.0032468 k( 175) = ( -0.2580645 0.1481533 0.0000000), wk = 0.0032468 k( 176) = ( -0.2741936 0.1574129 0.0000000), wk = 0.0032468 k( 177) = ( -0.2903226 0.1666725 0.0000000), wk = 0.0032468 k( 178) = ( -0.3064516 0.1759321 0.0000000), wk = 0.0032468 k( 179) = ( -0.3225807 0.1851916 0.0000000), wk = 0.0032468 k( 180) = ( -0.3387097 0.1944512 0.0000000), wk = 0.0032468 k( 181) = ( -0.3548387 0.2037108 0.0000000), wk = 0.0032468 k( 182) = ( -0.3709677 0.2129704 0.0000000), wk = 0.0032468 k( 183) = ( -0.3870968 0.2222300 0.0000000), wk = 0.0032468 k( 184) = ( -0.4032258 0.2314895 0.0000000), wk = 0.0032468 k( 185) = ( -0.4193548 0.2407491 0.0000000), wk = 0.0032468 k( 186) = ( -0.4354839 0.2500087 0.0000000), wk = 0.0032468 k( 187) = ( -0.4516129 0.2592683 0.0000000), wk = 0.0032468 k( 188) = ( -0.4677419 0.2685279 0.0000000), wk = 0.0032468 k( 189) = ( -0.4838710 0.2777875 0.0000000), wk = 0.0032468 k( 190) = ( -0.5000000 0.2870470 0.0000000), wk = 0.0032468 k( 191) = ( -0.5000000 0.2870470 0.0000000), wk = 0.0032468 k( 192) = ( -0.4911787 0.3024126 -0.0000000), wk = 0.0032468 k( 193) = ( -0.4823575 0.3177781 -0.0000000), wk = 0.0032468 k( 194) = ( -0.4735362 0.3331436 -0.0000000), wk = 0.0032468 k( 195) = ( -0.4647150 0.3485092 -0.0000000), wk = 0.0032468 k( 196) = ( -0.4558937 0.3638747 -0.0000000), wk = 0.0032468 k( 197) = ( -0.4470724 0.3792403 -0.0000000), wk = 0.0032468 k( 198) = ( -0.4382512 0.3946058 -0.0000000), wk = 0.0032468 k( 199) = ( -0.4294299 0.4099713 -0.0000000), wk = 0.0032468 k( 200) = ( -0.4206086 0.4253369 -0.0000000), wk = 0.0032468 k( 201) = ( -0.4117874 0.4407024 -0.0000000), wk = 0.0032468 k( 202) = ( -0.4029661 0.4560679 -0.0000000), wk = 0.0032468 k( 203) = ( -0.3941448 0.4714335 -0.0000000), wk = 0.0032468 k( 204) = ( -0.3853236 0.4867990 -0.0000000), wk = 0.0032468 k( 205) = ( -0.3765023 0.5021645 -0.0000000), wk = 0.0032468 k( 206) = ( -0.3676811 0.5175301 -0.0000000), wk = 0.0032468 k( 207) = ( -0.3588598 0.5328956 -0.0000000), wk = 0.0032468 k( 208) = ( -0.3500385 0.5482611 -0.0000000), wk = 0.0032468 k( 209) = ( -0.3412173 0.5636267 -0.0000000), wk = 0.0032468 k( 210) = ( -0.3323960 0.5789922 -0.0000000), wk = 0.0032468 k( 211) = ( -0.3323960 0.5789922 -0.0000000), wk = 0.0032468 k( 212) = ( -0.3323960 0.5789922 0.0179413), wk = 0.0032468 k( 213) = ( -0.3323960 0.5789922 0.0358825), wk = 0.0032468 k( 214) = ( -0.3323960 0.5789922 0.0538238), wk = 0.0032468 k( 215) = ( -0.3323960 0.5789922 0.0717651), wk = 0.0032468 k( 216) = ( -0.3323960 0.5789922 0.0897063), wk = 0.0032468 k( 217) = ( -0.3323960 0.5789922 0.1076476), wk = 0.0032468 k( 218) = ( -0.3323960 0.5789922 0.1255889), wk = 0.0032468 k( 219) = ( -0.3323960 0.5789922 0.1435302), wk = 0.0032468 k( 220) = ( -0.3323960 0.5789922 0.1614714), wk = 0.0032468 k( 221) = ( -0.3323960 0.5789922 0.1794127), wk = 0.0032468 k( 222) = ( -0.3323960 0.5789922 0.1973540), wk = 0.0032468 k( 223) = ( -0.3323960 0.5789922 0.2152952), wk = 0.0032468 k( 224) = ( -0.3323960 0.5789922 0.2332365), wk = 0.0032468 k( 225) = ( -0.3323960 0.5789922 0.2511778), wk = 0.0032468 k( 226) = ( -0.3323960 0.5789922 0.2691190), wk = 0.0032468 k( 227) = ( -0.3323960 0.5789922 0.2870603), wk = 0.0032468 k( 228) = ( -0.3323960 0.5789922 0.3050016), wk = 0.0032468 k( 229) = ( -0.3323960 0.5789922 0.3229429), wk = 0.0032468 k( 230) = ( -0.3323960 0.5789922 0.3408841), wk = 0.0032468 k( 231) = ( -0.3323960 0.5789922 0.3588254), wk = 0.0032468 k( 232) = ( -0.3323960 0.5789922 0.3767667), wk = 0.0032468 k( 233) = ( -0.3323960 0.5789922 0.3947079), wk = 0.0032468 k( 234) = ( -0.3323960 0.5789922 0.3947079), wk = 0.0032468 k( 235) = ( -0.3412173 0.5636267 0.3947079), wk = 0.0032468 k( 236) = ( -0.3500385 0.5482611 0.3947079), wk = 0.0032468 k( 237) = ( -0.3588598 0.5328956 0.3947079), wk = 0.0032468 k( 238) = ( -0.3676811 0.5175301 0.3947079), wk = 0.0032468 k( 239) = ( -0.3765023 0.5021645 0.3947079), wk = 0.0032468 k( 240) = ( -0.3853236 0.4867990 0.3947079), wk = 0.0032468 k( 241) = ( -0.3941448 0.4714335 0.3947079), wk = 0.0032468 k( 242) = ( -0.4029661 0.4560679 0.3947079), wk = 0.0032468 k( 243) = ( -0.4117874 0.4407024 0.3947079), wk = 0.0032468 k( 244) = ( -0.4206086 0.4253369 0.3947079), wk = 0.0032468 k( 245) = ( -0.4294299 0.4099713 0.3947079), wk = 0.0032468 k( 246) = ( -0.4382512 0.3946058 0.3947079), wk = 0.0032468 k( 247) = ( -0.4470724 0.3792403 0.3947079), wk = 0.0032468 k( 248) = ( -0.4558937 0.3638747 0.3947079), wk = 0.0032468 k( 249) = ( -0.4647150 0.3485092 0.3947079), wk = 0.0032468 k( 250) = ( -0.4735362 0.3331436 0.3947079), wk = 0.0032468 k( 251) = ( -0.4823575 0.3177781 0.3947079), wk = 0.0032468 k( 252) = ( -0.4911787 0.3024126 0.3947079), wk = 0.0032468 k( 253) = ( -0.5000000 0.2870470 0.3947079), wk = 0.0032468 k( 254) = ( -0.5000000 0.2870470 0.3947079), wk = 0.0032468 k( 255) = ( -0.5000000 0.2870470 0.3767667), wk = 0.0032468 k( 256) = ( -0.5000000 0.2870470 0.3588254), wk = 0.0032468 k( 257) = ( -0.5000000 0.2870470 0.3408841), wk = 0.0032468 k( 258) = ( -0.5000000 0.2870470 0.3229429), wk = 0.0032468 k( 259) = ( -0.5000000 0.2870470 0.3050016), wk = 0.0032468 k( 260) = ( -0.5000000 0.2870470 0.2870603), wk = 0.0032468 k( 261) = ( -0.5000000 0.2870470 0.2691190), wk = 0.0032468 k( 262) = ( -0.5000000 0.2870470 0.2511778), wk = 0.0032468 k( 263) = ( -0.5000000 0.2870470 0.2332365), wk = 0.0032468 k( 264) = ( -0.5000000 0.2870470 0.2152952), wk = 0.0032468 k( 265) = ( -0.5000000 0.2870470 0.1973540), wk = 0.0032468 k( 266) = ( -0.5000000 0.2870470 0.1794127), wk = 0.0032468 k( 267) = ( -0.5000000 0.2870470 0.1614714), wk = 0.0032468 k( 268) = ( -0.5000000 0.2870470 0.1435302), wk = 0.0032468 k( 269) = ( -0.5000000 0.2870470 0.1255889), wk = 0.0032468 k( 270) = ( -0.5000000 0.2870470 0.1076476), wk = 0.0032468 k( 271) = ( -0.5000000 0.2870470 0.0897063), wk = 0.0032468 k( 272) = ( -0.5000000 0.2870470 0.0717651), wk = 0.0032468 k( 273) = ( -0.5000000 0.2870470 0.0538238), wk = 0.0032468 k( 274) = ( -0.5000000 0.2870470 0.0358825), wk = 0.0032468 k( 275) = ( -0.5000000 0.2870470 0.0179413), wk = 0.0032468 k( 276) = ( -0.5000000 0.2870470 0.0000000), wk = 0.0032468 k( 277) = ( 0.0000000 0.0000000 0.3947079), wk = 0.0032468 k( 278) = ( -0.0161290 0.0092596 0.3947079), wk = 0.0032468 k( 279) = ( -0.0322581 0.0185192 0.3947079), wk = 0.0032468 k( 280) = ( -0.0483871 0.0277787 0.3947079), wk = 0.0032468 k( 281) = ( -0.0645161 0.0370383 0.3947079), wk = 0.0032468 k( 282) = ( -0.0806452 0.0462979 0.3947079), wk = 0.0032468 k( 283) = ( -0.0967742 0.0555575 0.3947079), wk = 0.0032468 k( 284) = ( -0.1129032 0.0648171 0.3947079), wk = 0.0032468 k( 285) = ( -0.1290323 0.0740767 0.3947079), wk = 0.0032468 k( 286) = ( -0.1451613 0.0833362 0.3947079), wk = 0.0032468 k( 287) = ( -0.1612903 0.0925958 0.3947079), wk = 0.0032468 k( 288) = ( -0.1774194 0.1018554 0.3947079), wk = 0.0032468 k( 289) = ( -0.1935484 0.1111150 0.3947079), wk = 0.0032468 k( 290) = ( -0.2096774 0.1203746 0.3947079), wk = 0.0032468 k( 291) = ( -0.2258064 0.1296341 0.3947079), wk = 0.0032468 k( 292) = ( -0.2419355 0.1388937 0.3947079), wk = 0.0032468 k( 293) = ( -0.2580645 0.1481533 0.3947079), wk = 0.0032468 k( 294) = ( -0.2741936 0.1574129 0.3947079), wk = 0.0032468 k( 295) = ( -0.2903226 0.1666725 0.3947079), wk = 0.0032468 k( 296) = ( -0.3064516 0.1759321 0.3947079), wk = 0.0032468 k( 297) = ( -0.3225807 0.1851916 0.3947079), wk = 0.0032468 k( 298) = ( -0.3387097 0.1944512 0.3947079), wk = 0.0032468 k( 299) = ( -0.3548387 0.2037108 0.3947079), wk = 0.0032468 k( 300) = ( -0.3709677 0.2129704 0.3947079), wk = 0.0032468 k( 301) = ( -0.3870968 0.2222300 0.3947079), wk = 0.0032468 k( 302) = ( -0.4032258 0.2314895 0.3947079), wk = 0.0032468 k( 303) = ( -0.4193548 0.2407491 0.3947079), wk = 0.0032468 k( 304) = ( -0.4354839 0.2500087 0.3947079), wk = 0.0032468 k( 305) = ( -0.4516129 0.2592683 0.3947079), wk = 0.0032468 k( 306) = ( -0.4677419 0.2685279 0.3947079), wk = 0.0032468 k( 307) = ( -0.4838710 0.2777875 0.3947079), wk = 0.0032468 k( 308) = ( -0.5000000 0.2870470 0.3947079), wk = 0.0032468 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0092332 0.0092332 0.0000000), wk = 0.0032468 k( 3) = ( 0.0184664 0.0184664 0.0000000), wk = 0.0032468 k( 4) = ( 0.0276997 0.0276997 0.0000000), wk = 0.0032468 k( 5) = ( 0.0369329 0.0369329 -0.0000000), wk = 0.0032468 k( 6) = ( 0.0461661 0.0461661 0.0000000), wk = 0.0032468 k( 7) = ( 0.0553993 0.0553993 0.0000000), wk = 0.0032468 k( 8) = ( 0.0646326 0.0646326 0.0000000), wk = 0.0032468 k( 9) = ( 0.0738658 0.0738658 -0.0000000), wk = 0.0032468 k( 10) = ( 0.0830990 0.0830990 0.0000000), wk = 0.0032468 k( 11) = ( 0.0923322 0.0923322 0.0000000), wk = 0.0032468 k( 12) = ( 0.1015655 0.1015655 0.0000000), wk = 0.0032468 k( 13) = ( 0.1107987 0.1107987 0.0000000), wk = 0.0032468 k( 14) = ( 0.1200319 0.1200319 0.0000000), wk = 0.0032468 k( 15) = ( 0.1292651 0.1292651 0.0000000), wk = 0.0032468 k( 16) = ( 0.1384983 0.1384983 -0.0000000), wk = 0.0032468 k( 17) = ( 0.1477316 0.1477316 -0.0000000), wk = 0.0032468 k( 18) = ( 0.1569648 0.1569648 0.0000000), wk = 0.0032468 k( 19) = ( 0.1661980 0.1661980 0.0000000), wk = 0.0032468 k( 20) = ( 0.1754312 0.1754312 0.0000000), wk = 0.0032468 k( 21) = ( 0.1846645 0.1846645 0.0000000), wk = 0.0032468 k( 22) = ( 0.1938977 0.1938977 0.0000000), wk = 0.0032468 k( 23) = ( 0.2031309 0.2031309 0.0000000), wk = 0.0032468 k( 24) = ( 0.2123641 0.2123641 0.0000000), wk = 0.0032468 k( 25) = ( 0.2215973 0.2215973 0.0000000), wk = 0.0032468 k( 26) = ( 0.2308306 0.2308306 0.0000000), wk = 0.0032468 k( 27) = ( 0.2400638 0.2400638 0.0000000), wk = 0.0032468 k( 28) = ( 0.2492970 0.2492970 0.0000000), wk = 0.0032468 k( 29) = ( 0.2585302 0.2585302 0.0000000), wk = 0.0032468 k( 30) = ( 0.2677635 0.2677635 -0.0000000), wk = 0.0032468 k( 31) = ( 0.2769967 0.2769967 0.0000000), wk = 0.0032468 k( 32) = ( 0.2862299 0.2862299 0.0000000), wk = 0.0032468 k( 33) = ( 0.2954631 0.2954631 0.0000000), wk = 0.0032468 k( 34) = ( 0.3046963 0.3046963 -0.0000000), wk = 0.0032468 k( 35) = ( 0.3139296 0.3139296 0.0000000), wk = 0.0032468 k( 36) = ( 0.3231628 0.3231628 0.0000000), wk = 0.0032468 k( 37) = ( 0.3323960 0.3323960 0.0000000), wk = 0.0032468 k( 38) = ( 0.3323960 0.3323960 0.0000000), wk = 0.0032468 k( 39) = ( 0.3139296 0.3417073 0.0000000), wk = 0.0032468 k( 40) = ( 0.2954631 0.3510187 0.0000000), wk = 0.0032468 k( 41) = ( 0.2769967 0.3603300 0.0000000), wk = 0.0032468 k( 42) = ( 0.2585302 0.3696413 0.0000000), wk = 0.0032468 k( 43) = ( 0.2400638 0.3789527 0.0000000), wk = 0.0032468 k( 44) = ( 0.2215973 0.3882640 0.0000000), wk = 0.0032468 k( 45) = ( 0.2031309 0.3975753 0.0000000), wk = 0.0032468 k( 46) = ( 0.1846645 0.4068867 0.0000000), wk = 0.0032468 k( 47) = ( 0.1661980 0.4161980 0.0000000), wk = 0.0032468 k( 48) = ( 0.1477316 0.4255093 0.0000000), wk = 0.0032468 k( 49) = ( 0.1292651 0.4348207 0.0000000), wk = 0.0032468 k( 50) = ( 0.1107987 0.4441320 0.0000000), wk = 0.0032468 k( 51) = ( 0.0923322 0.4534433 0.0000000), wk = 0.0032468 k( 52) = ( 0.0738658 0.4627547 -0.0000000), wk = 0.0032468 k( 53) = ( 0.0553993 0.4720660 0.0000000), wk = 0.0032468 k( 54) = ( 0.0369329 0.4813773 0.0000000), wk = 0.0032468 k( 55) = ( 0.0184664 0.4906887 0.0000000), wk = 0.0032468 k( 56) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032468 k( 57) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0032468 k( 58) = ( 0.0000000 0.5000000 0.0227273), wk = 0.0032468 k( 59) = ( 0.0000000 0.5000000 0.0454545), wk = 0.0032468 k( 60) = ( 0.0000000 0.5000000 0.0681818), wk = 0.0032468 k( 61) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0032468 k( 62) = ( 0.0000000 0.5000000 0.1136364), wk = 0.0032468 k( 63) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0032468 k( 64) = ( 0.0000000 0.5000000 0.1590909), wk = 0.0032468 k( 65) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0032468 k( 66) = ( 0.0000000 0.5000000 0.2045454), wk = 0.0032468 k( 67) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0032468 k( 68) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0032468 k( 69) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0032468 k( 70) = ( 0.0000000 0.5000000 0.2954545), wk = 0.0032468 k( 71) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0032468 k( 72) = ( 0.0000000 0.5000000 0.3409091), wk = 0.0032468 k( 73) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0032468 k( 74) = ( 0.0000000 0.5000000 0.3863636), wk = 0.0032468 k( 75) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0032468 k( 76) = ( 0.0000000 0.5000000 0.4318182), wk = 0.0032468 k( 77) = ( 0.0000000 0.5000000 0.4545455), wk = 0.0032468 k( 78) = ( 0.0000000 0.5000000 0.4772727), wk = 0.0032468 k( 79) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032468 k( 80) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0032468 k( 81) = ( 0.0184664 0.4906887 0.5000000), wk = 0.0032468 k( 82) = ( 0.0369329 0.4813773 0.5000000), wk = 0.0032468 k( 83) = ( 0.0553993 0.4720660 0.5000000), wk = 0.0032468 k( 84) = ( 0.0738658 0.4627547 0.5000000), wk = 0.0032468 k( 85) = ( 0.0923322 0.4534433 0.5000000), wk = 0.0032468 k( 86) = ( 0.1107987 0.4441320 0.5000000), wk = 0.0032468 k( 87) = ( 0.1292651 0.4348207 0.5000000), wk = 0.0032468 k( 88) = ( 0.1477316 0.4255093 0.5000000), wk = 0.0032468 k( 89) = ( 0.1661980 0.4161980 0.5000000), wk = 0.0032468 k( 90) = ( 0.1846645 0.4068867 0.5000000), wk = 0.0032468 k( 91) = ( 0.2031309 0.3975753 0.5000000), wk = 0.0032468 k( 92) = ( 0.2215973 0.3882640 0.5000000), wk = 0.0032468 k( 93) = ( 0.2400638 0.3789527 0.5000000), wk = 0.0032468 k( 94) = ( 0.2585302 0.3696413 0.5000000), wk = 0.0032468 k( 95) = ( 0.2769967 0.3603300 0.5000000), wk = 0.0032468 k( 96) = ( 0.2954631 0.3510187 0.5000000), wk = 0.0032468 k( 97) = ( 0.3139296 0.3417073 0.5000000), wk = 0.0032468 k( 98) = ( 0.3323960 0.3323960 0.5000000), wk = 0.0032468 k( 99) = ( 0.3323960 0.3323960 0.5000000), wk = 0.0032468 k( 100) = ( 0.3231628 0.3231628 0.5000000), wk = 0.0032468 k( 101) = ( 0.3139296 0.3139296 0.5000000), wk = 0.0032468 k( 102) = ( 0.3046963 0.3046963 0.5000000), wk = 0.0032468 k( 103) = ( 0.2954631 0.2954631 0.5000000), wk = 0.0032468 k( 104) = ( 0.2862299 0.2862299 0.5000000), wk = 0.0032468 k( 105) = ( 0.2769967 0.2769967 0.5000000), wk = 0.0032468 k( 106) = ( 0.2677635 0.2677635 0.5000000), wk = 0.0032468 k( 107) = ( 0.2585302 0.2585302 0.5000000), wk = 0.0032468 k( 108) = ( 0.2492970 0.2492970 0.5000000), wk = 0.0032468 k( 109) = ( 0.2400638 0.2400638 0.5000000), wk = 0.0032468 k( 110) = ( 0.2308306 0.2308306 0.5000000), wk = 0.0032468 k( 111) = ( 0.2215973 0.2215973 0.5000000), wk = 0.0032468 k( 112) = ( 0.2123641 0.2123641 0.5000000), wk = 0.0032468 k( 113) = ( 0.2031309 0.2031309 0.5000000), wk = 0.0032468 k( 114) = ( 0.1938977 0.1938977 0.5000000), wk = 0.0032468 k( 115) = ( 0.1846645 0.1846645 0.5000000), wk = 0.0032468 k( 116) = ( 0.1754312 0.1754312 0.5000000), wk = 0.0032468 k( 117) = ( 0.1661980 0.1661980 0.5000000), wk = 0.0032468 k( 118) = ( 0.1569648 0.1569648 0.5000000), wk = 0.0032468 k( 119) = ( 0.1477316 0.1477316 0.5000000), wk = 0.0032468 k( 120) = ( 0.1384983 0.1384983 0.5000000), wk = 0.0032468 k( 121) = ( 0.1292651 0.1292651 0.5000000), wk = 0.0032468 k( 122) = ( 0.1200319 0.1200319 0.5000000), wk = 0.0032468 k( 123) = ( 0.1107987 0.1107987 0.5000000), wk = 0.0032468 k( 124) = ( 0.1015655 0.1015655 0.5000000), wk = 0.0032468 k( 125) = ( 0.0923322 0.0923322 0.5000000), wk = 0.0032468 k( 126) = ( 0.0830990 0.0830990 0.5000000), wk = 0.0032468 k( 127) = ( 0.0738658 0.0738658 0.5000000), wk = 0.0032468 k( 128) = ( 0.0646326 0.0646326 0.5000000), wk = 0.0032468 k( 129) = ( 0.0553993 0.0553993 0.5000000), wk = 0.0032468 k( 130) = ( 0.0461661 0.0461661 0.5000000), wk = 0.0032468 k( 131) = ( 0.0369329 0.0369329 0.5000000), wk = 0.0032468 k( 132) = ( 0.0276997 0.0276997 0.5000000), wk = 0.0032468 k( 133) = ( 0.0184664 0.0184664 0.5000000), wk = 0.0032468 k( 134) = ( 0.0092332 0.0092332 0.5000000), wk = 0.0032468 k( 135) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032468 k( 136) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032468 k( 137) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0032468 k( 138) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0032468 k( 141) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0032468 k( 142) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0032468 k( 143) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0032468 k( 144) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0032468 k( 145) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0032468 k( 146) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0032468 k( 147) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0032468 k( 148) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0032468 k( 149) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0032468 k( 150) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0032468 k( 151) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0032468 k( 152) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0032468 k( 153) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0032468 k( 154) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0032468 k( 155) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0032468 k( 156) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0032468 k( 157) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0032468 k( 158) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 160) = ( -0.0161290 0.0161290 0.0000000), wk = 0.0032468 k( 161) = ( -0.0322581 0.0322581 0.0000000), wk = 0.0032468 k( 162) = ( -0.0483871 0.0483871 0.0000000), wk = 0.0032468 k( 163) = ( -0.0645161 0.0645161 -0.0000000), wk = 0.0032468 k( 164) = ( -0.0806452 0.0806452 -0.0000000), wk = 0.0032468 k( 165) = ( -0.0967742 0.0967742 0.0000000), wk = 0.0032468 k( 166) = ( -0.1129032 0.1129032 -0.0000000), wk = 0.0032468 k( 167) = ( -0.1290323 0.1290323 -0.0000000), wk = 0.0032468 k( 168) = ( -0.1451613 0.1451613 0.0000000), wk = 0.0032468 k( 169) = ( -0.1612903 0.1612903 -0.0000000), wk = 0.0032468 k( 170) = ( -0.1774194 0.1774193 -0.0000000), wk = 0.0032468 k( 171) = ( -0.1935484 0.1935484 -0.0000000), wk = 0.0032468 k( 172) = ( -0.2096774 0.2096774 -0.0000000), wk = 0.0032468 k( 173) = ( -0.2258064 0.2258064 0.0000000), wk = 0.0032468 k( 174) = ( -0.2419355 0.2419355 -0.0000000), wk = 0.0032468 k( 175) = ( -0.2580645 0.2580645 -0.0000000), wk = 0.0032468 k( 176) = ( -0.2741936 0.2741936 -0.0000000), wk = 0.0032468 k( 177) = ( -0.2903226 0.2903226 0.0000000), wk = 0.0032468 k( 178) = ( -0.3064516 0.3064516 -0.0000000), wk = 0.0032468 k( 179) = ( -0.3225807 0.3225807 -0.0000000), wk = 0.0032468 k( 180) = ( -0.3387097 0.3387097 -0.0000000), wk = 0.0032468 k( 181) = ( -0.3548387 0.3548387 0.0000000), wk = 0.0032468 k( 182) = ( -0.3709677 0.3709677 -0.0000000), wk = 0.0032468 k( 183) = ( -0.3870968 0.3870968 -0.0000000), wk = 0.0032468 k( 184) = ( -0.4032258 0.4032258 -0.0000000), wk = 0.0032468 k( 185) = ( -0.4193548 0.4193548 -0.0000000), wk = 0.0032468 k( 186) = ( -0.4354839 0.4354839 -0.0000000), wk = 0.0032468 k( 187) = ( -0.4516129 0.4516129 0.0000000), wk = 0.0032468 k( 188) = ( -0.4677419 0.4677419 -0.0000000), wk = 0.0032468 k( 189) = ( -0.4838710 0.4838710 -0.0000000), wk = 0.0032468 k( 190) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0032468 k( 191) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0032468 k( 192) = ( -0.4911787 0.5088213 -0.0000000), wk = 0.0032468 k( 193) = ( -0.4823575 0.5176425 -0.0000000), wk = 0.0032468 k( 194) = ( -0.4735362 0.5264638 -0.0000000), wk = 0.0032468 k( 195) = ( -0.4647150 0.5352851 0.0000000), wk = 0.0032468 k( 196) = ( -0.4558937 0.5441063 -0.0000000), wk = 0.0032468 k( 197) = ( -0.4470724 0.5529276 0.0000000), wk = 0.0032468 k( 198) = ( -0.4382512 0.5617488 -0.0000000), wk = 0.0032468 k( 199) = ( -0.4294299 0.5705701 -0.0000000), wk = 0.0032468 k( 200) = ( -0.4206086 0.5793914 -0.0000000), wk = 0.0032468 k( 201) = ( -0.4117874 0.5882126 -0.0000000), wk = 0.0032468 k( 202) = ( -0.4029661 0.5970339 -0.0000000), wk = 0.0032468 k( 203) = ( -0.3941448 0.6058552 0.0000000), wk = 0.0032468 k( 204) = ( -0.3853236 0.6146764 0.0000000), wk = 0.0032468 k( 205) = ( -0.3765023 0.6234977 0.0000000), wk = 0.0032468 k( 206) = ( -0.3676811 0.6323190 0.0000000), wk = 0.0032468 k( 207) = ( -0.3588598 0.6411402 -0.0000000), wk = 0.0032468 k( 208) = ( -0.3500385 0.6499615 0.0000000), wk = 0.0032468 k( 209) = ( -0.3412173 0.6587827 0.0000000), wk = 0.0032468 k( 210) = ( -0.3323960 0.6676040 -0.0000000), wk = 0.0032468 k( 211) = ( -0.3323960 0.6676040 -0.0000000), wk = 0.0032468 k( 212) = ( -0.3323960 0.6676040 0.0227273), wk = 0.0032468 k( 213) = ( -0.3323960 0.6676040 0.0454545), wk = 0.0032468 k( 214) = ( -0.3323960 0.6676040 0.0681818), wk = 0.0032468 k( 215) = ( -0.3323960 0.6676040 0.0909091), wk = 0.0032468 k( 216) = ( -0.3323960 0.6676040 0.1136364), wk = 0.0032468 k( 217) = ( -0.3323960 0.6676040 0.1363636), wk = 0.0032468 k( 218) = ( -0.3323960 0.6676040 0.1590909), wk = 0.0032468 k( 219) = ( -0.3323960 0.6676040 0.1818182), wk = 0.0032468 k( 220) = ( -0.3323960 0.6676040 0.2045455), wk = 0.0032468 k( 221) = ( -0.3323960 0.6676040 0.2272727), wk = 0.0032468 k( 222) = ( -0.3323960 0.6676040 0.2500000), wk = 0.0032468 k( 223) = ( -0.3323960 0.6676040 0.2727273), wk = 0.0032468 k( 224) = ( -0.3323960 0.6676040 0.2954546), wk = 0.0032468 k( 225) = ( -0.3323960 0.6676040 0.3181818), wk = 0.0032468 k( 226) = ( -0.3323960 0.6676040 0.3409091), wk = 0.0032468 k( 227) = ( -0.3323960 0.6676040 0.3636364), wk = 0.0032468 k( 228) = ( -0.3323960 0.6676040 0.3863636), wk = 0.0032468 k( 229) = ( -0.3323960 0.6676040 0.4090909), wk = 0.0032468 k( 230) = ( -0.3323960 0.6676040 0.4318182), wk = 0.0032468 k( 231) = ( -0.3323960 0.6676040 0.4545455), wk = 0.0032468 k( 232) = ( -0.3323960 0.6676040 0.4772727), wk = 0.0032468 k( 233) = ( -0.3323960 0.6676040 0.5000000), wk = 0.0032468 k( 234) = ( -0.3323960 0.6676040 0.5000000), wk = 0.0032468 k( 235) = ( -0.3412173 0.6587827 0.5000000), wk = 0.0032468 k( 236) = ( -0.3500385 0.6499615 0.5000000), wk = 0.0032468 k( 237) = ( -0.3588598 0.6411402 0.5000000), wk = 0.0032468 k( 238) = ( -0.3676811 0.6323190 0.5000000), wk = 0.0032468 k( 239) = ( -0.3765023 0.6234977 0.5000000), wk = 0.0032468 k( 240) = ( -0.3853236 0.6146764 0.5000000), wk = 0.0032468 k( 241) = ( -0.3941448 0.6058552 0.5000000), wk = 0.0032468 k( 242) = ( -0.4029661 0.5970339 0.5000000), wk = 0.0032468 k( 243) = ( -0.4117874 0.5882126 0.5000000), wk = 0.0032468 k( 244) = ( -0.4206086 0.5793914 0.5000000), wk = 0.0032468 k( 245) = ( -0.4294299 0.5705701 0.5000000), wk = 0.0032468 k( 246) = ( -0.4382512 0.5617488 0.5000000), wk = 0.0032468 k( 247) = ( -0.4470724 0.5529276 0.5000000), wk = 0.0032468 k( 248) = ( -0.4558937 0.5441063 0.5000000), wk = 0.0032468 k( 249) = ( -0.4647150 0.5352851 0.5000000), wk = 0.0032468 k( 250) = ( -0.4735362 0.5264638 0.5000000), wk = 0.0032468 k( 251) = ( -0.4823575 0.5176425 0.5000000), wk = 0.0032468 k( 252) = ( -0.4911787 0.5088213 0.5000000), wk = 0.0032468 k( 253) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 254) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 255) = ( -0.5000000 0.5000000 0.4772727), wk = 0.0032468 k( 256) = ( -0.5000000 0.5000000 0.4545455), wk = 0.0032468 k( 257) = ( -0.5000000 0.5000000 0.4318182), wk = 0.0032468 k( 258) = ( -0.5000000 0.5000000 0.4090909), wk = 0.0032468 k( 259) = ( -0.5000000 0.5000000 0.3863636), wk = 0.0032468 k( 260) = ( -0.5000000 0.5000000 0.3636364), wk = 0.0032468 k( 261) = ( -0.5000000 0.5000000 0.3409091), wk = 0.0032468 k( 262) = ( -0.5000000 0.5000000 0.3181818), wk = 0.0032468 k( 263) = ( -0.5000000 0.5000000 0.2954545), wk = 0.0032468 k( 264) = ( -0.5000000 0.5000000 0.2727273), wk = 0.0032468 k( 265) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0032468 k( 266) = ( -0.5000000 0.5000000 0.2272727), wk = 0.0032468 k( 267) = ( -0.5000000 0.5000000 0.2045454), wk = 0.0032468 k( 268) = ( -0.5000000 0.5000000 0.1818182), wk = 0.0032468 k( 269) = ( -0.5000000 0.5000000 0.1590909), wk = 0.0032468 k( 270) = ( -0.5000000 0.5000000 0.1363636), wk = 0.0032468 k( 271) = ( -0.5000000 0.5000000 0.1136364), wk = 0.0032468 k( 272) = ( -0.5000000 0.5000000 0.0909091), wk = 0.0032468 k( 273) = ( -0.5000000 0.5000000 0.0681818), wk = 0.0032468 k( 274) = ( -0.5000000 0.5000000 0.0454546), wk = 0.0032468 k( 275) = ( -0.5000000 0.5000000 0.0227273), wk = 0.0032468 k( 276) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0032468 k( 277) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032468 k( 278) = ( -0.0161290 0.0161290 0.5000000), wk = 0.0032468 k( 279) = ( -0.0322581 0.0322581 0.5000000), wk = 0.0032468 k( 280) = ( -0.0483871 0.0483871 0.5000000), wk = 0.0032468 k( 281) = ( -0.0645161 0.0645161 0.5000000), wk = 0.0032468 k( 282) = ( -0.0806452 0.0806452 0.5000000), wk = 0.0032468 k( 283) = ( -0.0967742 0.0967742 0.5000000), wk = 0.0032468 k( 284) = ( -0.1129032 0.1129032 0.5000000), wk = 0.0032468 k( 285) = ( -0.1290323 0.1290323 0.5000000), wk = 0.0032468 k( 286) = ( -0.1451613 0.1451613 0.5000000), wk = 0.0032468 k( 287) = ( -0.1612903 0.1612903 0.5000000), wk = 0.0032468 k( 288) = ( -0.1774194 0.1774193 0.5000000), wk = 0.0032468 k( 289) = ( -0.1935484 0.1935484 0.5000000), wk = 0.0032468 k( 290) = ( -0.2096774 0.2096774 0.5000000), wk = 0.0032468 k( 291) = ( -0.2258064 0.2258064 0.5000000), wk = 0.0032468 k( 292) = ( -0.2419355 0.2419355 0.5000000), wk = 0.0032468 k( 293) = ( -0.2580645 0.2580645 0.5000000), wk = 0.0032468 k( 294) = ( -0.2741936 0.2741936 0.5000000), wk = 0.0032468 k( 295) = ( -0.2903226 0.2903226 0.5000000), wk = 0.0032468 k( 296) = ( -0.3064516 0.3064516 0.5000000), wk = 0.0032468 k( 297) = ( -0.3225807 0.3225807 0.5000000), wk = 0.0032468 k( 298) = ( -0.3387097 0.3387097 0.5000000), wk = 0.0032468 k( 299) = ( -0.3548387 0.3548387 0.5000000), wk = 0.0032468 k( 300) = ( -0.3709677 0.3709677 0.5000000), wk = 0.0032468 k( 301) = ( -0.3870968 0.3870968 0.5000000), wk = 0.0032468 k( 302) = ( -0.4032258 0.4032258 0.5000000), wk = 0.0032468 k( 303) = ( -0.4193548 0.4193548 0.5000000), wk = 0.0032468 k( 304) = ( -0.4354839 0.4354839 0.5000000), wk = 0.0032468 k( 305) = ( -0.4516129 0.4516129 0.5000000), wk = 0.0032468 k( 306) = ( -0.4677419 0.4677419 0.5000000), wk = 0.0032468 k( 307) = ( -0.4838710 0.4838710 0.5000000), wk = 0.0032468 k( 308) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0032468 Dense grid: 105131 G-vectors FFT dimensions: ( 60, 60, 72) Smooth grid: 41765 G-vectors FFT dimensions: ( 45, 45, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.21 Mb ( 238, 58) NL pseudopotentials 0.37 Mb ( 119, 204) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2190) G-vector shells 0.01 Mb ( 1068) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.84 Mb ( 238, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.36 Mb ( 204, 2, 58) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./Rb2Te.save/charge-density.dat Starting wfc are 80 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 44.4 secs Computing kpt #: 2 total cpu time spent up to now is 47.8 secs Computing kpt #: 3 total cpu time spent up to now is 50.5 secs Computing kpt #: 4 total cpu time spent up to now is 53.1 secs Computing kpt #: 5 total cpu time spent up to now is 55.9 secs Computing kpt #: 6 total cpu time spent up to now is 58.8 secs Computing kpt #: 7 total cpu time spent up to now is 61.8 secs Computing kpt #: 8 total cpu time spent up to now is 64.5 secs Computing kpt #: 9 total cpu time spent up to now is 67.4 secs Computing kpt #: 10 total cpu time spent up to now is 70.2 secs Computing kpt #: 11 total cpu time spent up to now is 73.3 secs Computing kpt #: 12 total cpu time spent up to now is 76.5 secs Computing kpt #: 13 total cpu time spent up to now is 79.2 secs Computing kpt #: 14 total cpu time spent up to now is 82.2 secs Computing kpt #: 15 total cpu time spent up to now is 85.5 secs Computing kpt #: 16 total cpu time spent up to now is 89.3 secs Computing kpt #: 17 total cpu time spent up to now is 92.8 secs Computing kpt #: 18 total cpu time spent up to now is 96.3 secs Computing kpt #: 19 total cpu time spent up to now is 100.5 secs Computing kpt #: 20 total cpu time spent up to now is 105.7 secs Computing kpt #: 21 total cpu time spent up to now is 109.2 secs Computing kpt #: 22 total cpu time spent up to now is 112.7 secs Computing kpt #: 23 total cpu time spent up to now is 115.9 secs Computing kpt #: 24 total cpu time spent up to now is 119.1 secs Computing kpt #: 25 total cpu time spent up to now is 122.5 secs Computing kpt #: 26 total cpu time spent up to now is 125.7 secs Computing kpt #: 27 total cpu time spent up to now is 129.0 secs Computing kpt #: 28 total cpu time spent up to now is 132.6 secs Computing kpt #: 29 total cpu time spent up to now is 135.6 secs Computing kpt #: 30 total cpu time spent up to now is 139.0 secs Computing kpt #: 31 total cpu time spent up to now is 142.7 secs Computing kpt #: 32 total cpu time spent up to now is 146.1 secs Computing kpt #: 33 total cpu time spent up to now is 149.8 secs Computing kpt #: 34 total cpu time spent up to now is 154.1 secs Computing kpt #: 35 total cpu time spent up to now is 158.6 secs Computing kpt #: 36 total cpu time spent up to now is 162.8 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 169.0 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 175.5 secs Computing kpt #: 39 total cpu time spent up to now is 181.4 secs Computing kpt #: 40 total cpu time spent up to now is 186.0 secs Computing kpt #: 41 total cpu time spent up to now is 189.9 secs Computing kpt #: 42 total cpu time spent up to now is 194.2 secs Computing kpt #: 43 total cpu time spent up to now is 197.7 secs Computing kpt #: 44 total cpu time spent up to now is 200.9 secs Computing kpt #: 45 total cpu time spent up to now is 204.0 secs Computing kpt #: 46 total cpu time spent up to now is 207.3 secs Computing kpt #: 47 total cpu time spent up to now is 210.4 secs Computing kpt #: 48 total cpu time spent up to now is 213.6 secs Computing kpt #: 49 total cpu time spent up to now is 218.0 secs Computing kpt #: 50 total cpu time spent up to now is 221.3 secs Computing kpt #: 51 total cpu time spent up to now is 224.2 secs Computing kpt #: 52 total cpu time spent up to now is 227.9 secs Computing kpt #: 53 total cpu time spent up to now is 231.4 secs Computing kpt #: 54 total cpu time spent up to now is 235.5 secs Computing kpt #: 55 total cpu time spent up to now is 239.1 secs Computing kpt #: 56 total cpu time spent up to now is 242.8 secs Computing kpt #: 57 total cpu time spent up to now is 246.5 secs Computing kpt #: 58 total cpu time spent up to now is 250.1 secs Computing kpt #: 59 total cpu time spent up to now is 254.4 secs Computing kpt #: 60 total cpu time spent up to now is 258.4 secs Computing kpt #: 61 total cpu time spent up to now is 261.9 secs Computing kpt #: 62 total cpu time spent up to now is 265.2 secs Computing kpt #: 63 total cpu time spent up to now is 269.6 secs Computing kpt #: 64 total cpu time spent up to now is 273.4 secs Computing kpt #: 65 total cpu time spent up to now is 277.0 secs Computing kpt #: 66 total cpu time spent up to now is 280.6 secs Computing kpt #: 67 total cpu time spent up to now is 284.4 secs Computing kpt #: 68 total cpu time spent up to now is 288.8 secs Computing kpt #: 69 total cpu time spent up to now is 293.2 secs Computing kpt #: 70 total cpu time spent up to now is 297.6 secs Computing kpt #: 71 total cpu time spent up to now is 302.0 secs Computing kpt #: 72 total cpu time spent up to now is 306.4 secs Computing kpt #: 73 total cpu time spent up to now is 310.0 secs Computing kpt #: 74 total cpu time spent up to now is 313.6 secs Computing kpt #: 75 total cpu time spent up to now is 316.8 secs Computing kpt #: 76 total cpu time spent up to now is 320.5 secs Computing kpt #: 77 total cpu time spent up to now is 324.5 secs Computing kpt #: 78 total cpu time spent up to now is 328.9 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 335.1 secs Computing kpt #: 80 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 341.9 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 349.3 secs Computing kpt #: 82 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 355.8 secs Computing kpt #: 83 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 362.1 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 368.3 secs Computing kpt #: 85 total cpu time spent up to now is 374.4 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 380.6 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 386.7 secs Computing kpt #: 88 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 392.5 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 398.6 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 404.6 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 410.6 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 416.7 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 422.9 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 429.3 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 435.4 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 442.0 secs Computing kpt #: 97 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 448.2 secs Computing kpt #: 98 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 454.5 secs Computing kpt #: 99 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 460.4 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 467.2 secs Computing kpt #: 101 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 473.5 secs Computing kpt #: 102 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 479.9 secs Computing kpt #: 103 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 487.0 secs Computing kpt #: 104 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 493.1 secs Computing kpt #: 105 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 499.3 secs Computing kpt #: 106 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 505.1 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 510.8 secs Computing kpt #: 108 total cpu time spent up to now is 516.3 secs Computing kpt #: 109 total cpu time spent up to now is 521.6 secs Computing kpt #: 110 total cpu time spent up to now is 527.5 secs Computing kpt #: 111 total cpu time spent up to now is 532.3 secs Computing kpt #: 112 total cpu time spent up to now is 537.2 secs Computing kpt #: 113 total cpu time spent up to now is 541.1 secs Computing kpt #: 114 total cpu time spent up to now is 546.0 secs Computing kpt #: 115 total cpu time spent up to now is 550.3 secs Computing kpt #: 116 total cpu time spent up to now is 554.4 secs Computing kpt #: 117 total cpu time spent up to now is 559.4 secs Computing kpt #: 118 total cpu time spent up to now is 563.5 secs Computing kpt #: 119 total cpu time spent up to now is 567.0 secs Computing kpt #: 120 total cpu time spent up to now is 571.3 secs Computing kpt #: 121 total cpu time spent up to now is 575.7 secs Computing kpt #: 122 total cpu time spent up to now is 579.2 secs Computing kpt #: 123 total cpu time spent up to now is 582.6 secs Computing kpt #: 124 total cpu time spent up to now is 587.3 secs Computing kpt #: 125 total cpu time spent up to now is 591.3 secs Computing kpt #: 126 total cpu time spent up to now is 596.1 secs Computing kpt #: 127 total cpu time spent up to now is 599.6 secs Computing kpt #: 128 total cpu time spent up to now is 602.4 secs Computing kpt #: 129 total cpu time spent up to now is 605.9 secs Computing kpt #: 130 total cpu time spent up to now is 609.8 secs Computing kpt #: 131 total cpu time spent up to now is 613.2 secs Computing kpt #: 132 total cpu time spent up to now is 616.7 secs Computing kpt #: 133 total cpu time spent up to now is 619.4 secs Computing kpt #: 134 total cpu time spent up to now is 622.9 secs Computing kpt #: 135 total cpu time spent up to now is 626.2 secs Computing kpt #: 136 total cpu time spent up to now is 628.9 secs Computing kpt #: 137 total cpu time spent up to now is 631.7 secs Computing kpt #: 138 total cpu time spent up to now is 635.1 secs Computing kpt #: 139 total cpu time spent up to now is 638.6 secs Computing kpt #: 140 total cpu time spent up to now is 641.9 secs Computing kpt #: 141 total cpu time spent up to now is 645.1 secs Computing kpt #: 142 total cpu time spent up to now is 648.7 secs Computing kpt #: 143 total cpu time spent up to now is 652.0 secs Computing kpt #: 144 total cpu time spent up to now is 654.9 secs Computing kpt #: 145 total cpu time spent up to now is 658.0 secs Computing kpt #: 146 total cpu time spent up to now is 661.4 secs Computing kpt #: 147 total cpu time spent up to now is 664.4 secs Computing kpt #: 148 total cpu time spent up to now is 667.6 secs Computing kpt #: 149 total cpu time spent up to now is 671.1 secs Computing kpt #: 150 total cpu time spent up to now is 674.1 secs Computing kpt #: 151 total cpu time spent up to now is 676.9 secs Computing kpt #: 152 total cpu time spent up to now is 680.3 secs Computing kpt #: 153 total cpu time spent up to now is 683.2 secs Computing kpt #: 154 total cpu time spent up to now is 686.0 secs Computing kpt #: 155 total cpu time spent up to now is 689.4 secs Computing kpt #: 156 total cpu time spent up to now is 692.4 secs Computing kpt #: 157 total cpu time spent up to now is 695.2 secs Computing kpt #: 158 total cpu time spent up to now is 697.9 secs Computing kpt #: 159 total cpu time spent up to now is 700.8 secs Computing kpt #: 160 total cpu time spent up to now is 703.7 secs Computing kpt #: 161 total cpu time spent up to now is 706.3 secs Computing kpt #: 162 total cpu time spent up to now is 709.0 secs Computing kpt #: 163 total cpu time spent up to now is 711.8 secs Computing kpt #: 164 total cpu time spent up to now is 714.4 secs Computing kpt #: 165 total cpu time spent up to now is 717.3 secs Computing kpt #: 166 total cpu time spent up to now is 720.0 secs Computing kpt #: 167 total cpu time spent up to now is 722.8 secs Computing kpt #: 168 total cpu time spent up to now is 726.1 secs Computing kpt #: 169 total cpu time spent up to now is 728.9 secs Computing kpt #: 170 total cpu time spent up to now is 731.6 secs Computing kpt #: 171 total cpu time spent up to now is 734.5 secs Computing kpt #: 172 total cpu time spent up to now is 737.4 secs Computing kpt #: 173 total cpu time spent up to now is 740.4 secs Computing kpt #: 174 total cpu time spent up to now is 743.2 secs Computing kpt #: 175 total cpu time spent up to now is 746.1 secs Computing kpt #: 176 total cpu time spent up to now is 749.3 secs Computing kpt #: 177 total cpu time spent up to now is 752.2 secs Computing kpt #: 178 total cpu time spent up to now is 755.3 secs Computing kpt #: 179 total cpu time spent up to now is 758.1 secs Computing kpt #: 180 total cpu time spent up to now is 761.1 secs Computing kpt #: 181 total cpu time spent up to now is 763.9 secs Computing kpt #: 182 total cpu time spent up to now is 767.4 secs Computing kpt #: 183 total cpu time spent up to now is 770.8 secs Computing kpt #: 184 total cpu time spent up to now is 774.2 secs Computing kpt #: 185 total cpu time spent up to now is 777.8 secs Computing kpt #: 186 total cpu time spent up to now is 781.3 secs Computing kpt #: 187 total cpu time spent up to now is 784.6 secs Computing kpt #: 188 total cpu time spent up to now is 787.7 secs Computing kpt #: 189 total cpu time spent up to now is 791.2 secs Computing kpt #: 190 total cpu time spent up to now is 794.6 secs Computing kpt #: 191 total cpu time spent up to now is 798.1 secs Computing kpt #: 192 total cpu time spent up to now is 802.2 secs Computing kpt #: 193 total cpu time spent up to now is 805.8 secs Computing kpt #: 194 total cpu time spent up to now is 810.2 secs Computing kpt #: 195 total cpu time spent up to now is 813.8 secs Computing kpt #: 196 total cpu time spent up to now is 817.7 secs Computing kpt #: 197 total cpu time spent up to now is 821.3 secs Computing kpt #: 198 total cpu time spent up to now is 824.5 secs Computing kpt #: 199 total cpu time spent up to now is 827.3 secs Computing kpt #: 200 total cpu time spent up to now is 830.6 secs Computing kpt #: 201 total cpu time spent up to now is 833.6 secs Computing kpt #: 202 total cpu time spent up to now is 836.7 secs Computing kpt #: 203 total cpu time spent up to now is 840.2 secs Computing kpt #: 204 total cpu time spent up to now is 843.5 secs Computing kpt #: 205 total cpu time spent up to now is 846.8 secs Computing kpt #: 206 total cpu time spent up to now is 850.1 secs Computing kpt #: 207 total cpu time spent up to now is 854.0 secs Computing kpt #: 208 total cpu time spent up to now is 857.8 secs Computing kpt #: 209 total cpu time spent up to now is 862.2 secs Computing kpt #: 210 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 868.2 secs Computing kpt #: 211 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 874.2 secs Computing kpt #: 212 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 880.2 secs Computing kpt #: 213 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 886.3 secs Computing kpt #: 214 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 892.4 secs Computing kpt #: 215 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 898.5 secs Computing kpt #: 216 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 905.1 secs Computing kpt #: 217 total cpu time spent up to now is 909.3 secs Computing kpt #: 218 total cpu time spent up to now is 913.1 secs Computing kpt #: 219 total cpu time spent up to now is 917.8 secs Computing kpt #: 220 total cpu time spent up to now is 921.6 secs Computing kpt #: 221 total cpu time spent up to now is 925.1 secs Computing kpt #: 222 total cpu time spent up to now is 928.6 secs Computing kpt #: 223 total cpu time spent up to now is 932.1 secs Computing kpt #: 224 total cpu time spent up to now is 935.3 secs Computing kpt #: 225 total cpu time spent up to now is 938.7 secs Computing kpt #: 226 total cpu time spent up to now is 941.9 secs Computing kpt #: 227 total cpu time spent up to now is 944.9 secs Computing kpt #: 228 total cpu time spent up to now is 948.5 secs Computing kpt #: 229 total cpu time spent up to now is 952.8 secs Computing kpt #: 230 total cpu time spent up to now is 957.6 secs Computing kpt #: 231 total cpu time spent up to now is 963.4 secs Computing kpt #: 232 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 970.0 secs Computing kpt #: 233 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 976.0 secs Computing kpt #: 234 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 982.3 secs Computing kpt #: 235 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 988.4 secs Computing kpt #: 236 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 994.4 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1000.7 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1006.8 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1012.8 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1019.0 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1025.2 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1031.2 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1037.4 secs Computing kpt #: 244 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1043.5 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1049.6 secs Computing kpt #: 246 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1055.6 secs Computing kpt #: 247 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1061.7 secs Computing kpt #: 248 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1067.6 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1073.7 secs Computing kpt #: 250 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1079.5 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1085.6 secs Computing kpt #: 252 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1091.8 secs Computing kpt #: 253 total cpu time spent up to now is 1095.3 secs Computing kpt #: 254 total cpu time spent up to now is 1099.0 secs Computing kpt #: 255 total cpu time spent up to now is 1103.0 secs Computing kpt #: 256 total cpu time spent up to now is 1107.0 secs Computing kpt #: 257 total cpu time spent up to now is 1110.5 secs Computing kpt #: 258 total cpu time spent up to now is 1114.2 secs Computing kpt #: 259 total cpu time spent up to now is 1117.5 secs Computing kpt #: 260 total cpu time spent up to now is 1121.2 secs Computing kpt #: 261 total cpu time spent up to now is 1125.4 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1131.6 secs Computing kpt #: 263 total cpu time spent up to now is 1137.3 secs Computing kpt #: 264 total cpu time spent up to now is 1142.5 secs Computing kpt #: 265 total cpu time spent up to now is 1146.7 secs Computing kpt #: 266 total cpu time spent up to now is 1150.2 secs Computing kpt #: 267 total cpu time spent up to now is 1153.8 secs Computing kpt #: 268 total cpu time spent up to now is 1158.1 secs Computing kpt #: 269 total cpu time spent up to now is 1161.8 secs Computing kpt #: 270 total cpu time spent up to now is 1165.2 secs Computing kpt #: 271 total cpu time spent up to now is 1168.9 secs Computing kpt #: 272 total cpu time spent up to now is 1172.1 secs Computing kpt #: 273 total cpu time spent up to now is 1175.8 secs Computing kpt #: 274 total cpu time spent up to now is 1179.2 secs Computing kpt #: 275 total cpu time spent up to now is 1182.6 secs Computing kpt #: 276 total cpu time spent up to now is 1186.0 secs Computing kpt #: 277 total cpu time spent up to now is 1189.1 secs Computing kpt #: 278 total cpu time spent up to now is 1192.6 secs Computing kpt #: 279 total cpu time spent up to now is 1196.5 secs Computing kpt #: 280 total cpu time spent up to now is 1200.0 secs Computing kpt #: 281 total cpu time spent up to now is 1203.6 secs Computing kpt #: 282 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1209.1 secs Computing kpt #: 283 total cpu time spent up to now is 1212.4 secs Computing kpt #: 284 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1218.5 secs Computing kpt #: 285 total cpu time spent up to now is 1222.1 secs Computing kpt #: 286 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1227.7 secs Computing kpt #: 287 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1233.5 secs Computing kpt #: 288 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1239.6 secs Computing kpt #: 289 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1245.6 secs Computing kpt #: 290 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1251.1 secs Computing kpt #: 291 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1256.9 secs Computing kpt #: 292 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1262.7 secs Computing kpt #: 293 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1268.7 secs Computing kpt #: 294 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1274.5 secs Computing kpt #: 295 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1280.5 secs Computing kpt #: 296 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1286.7 secs Computing kpt #: 297 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1292.6 secs Computing kpt #: 298 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1298.7 secs Computing kpt #: 299 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1304.6 secs Computing kpt #: 300 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1310.6 secs Computing kpt #: 301 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1316.6 secs Computing kpt #: 302 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1322.4 secs Computing kpt #: 303 total cpu time spent up to now is 1326.5 secs Computing kpt #: 304 total cpu time spent up to now is 1330.7 secs Computing kpt #: 305 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1337.0 secs Computing kpt #: 306 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1343.2 secs Computing kpt #: 307 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1349.4 secs Computing kpt #: 308 total cpu time spent up to now is 1352.9 secs ethr = 2.08E-11, avg # of iterations = 65.2 total cpu time spent up to now is 1353.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5247 PWs) bands (ev): -22.0646 -22.0646 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9554 -6.9554 -6.7439 -6.7439 -6.1119 -6.1119 -6.0245 -6.0245 -5.9684 -5.9684 -5.9280 -5.9280 -5.7824 -5.7824 -5.7176 -5.7176 -5.1936 -5.1936 -5.1666 -5.1666 -5.0645 -5.0645 -5.0172 -5.0172 -3.9601 -3.9601 -3.6840 -3.6840 3.7698 3.7698 4.2607 4.2607 4.3385 4.3385 4.3482 4.3482 4.9326 4.9326 5.4665 5.4665 7.1742 7.1742 8.6141 8.6141 8.6228 8.6228 8.6997 8.6997 9.2181 9.2181 k = 0.0092 0.0161-0.0000 ( 5247 PWs) bands (ev): -22.0646 -22.0646 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9558 -6.9551 -6.7439 -6.7438 -6.1180 -6.1076 -6.0320 -6.0188 -5.9701 -5.9636 -5.9286 -5.9279 -5.7839 -5.7811 -5.7185 -5.7168 -5.1942 -5.1930 -5.1665 -5.1664 -5.0653 -5.0653 -5.0179 -5.0172 -3.9585 -3.9582 -3.6839 -3.6832 3.7699 3.7712 4.2610 4.2621 4.3344 4.3420 4.3439 4.3515 4.9303 4.9303 5.4642 5.4649 7.1811 7.1815 8.6152 8.6153 8.6262 8.6270 8.7006 8.7010 9.2125 9.2132 k = 0.0185 0.0322-0.0000 ( 5241 PWs) bands (ev): -22.0645 -22.0645 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9564 -6.9549 -6.7440 -6.7438 -6.1253 -6.1053 -6.0397 -6.0159 -5.9680 -5.9568 -5.9299 -5.9284 -5.7853 -5.7797 -5.7196 -5.7162 -5.1947 -5.1925 -5.1659 -5.1657 -5.0679 -5.0677 -5.0191 -5.0178 -3.9535 -3.9529 -3.6830 -3.6817 3.7714 3.7740 4.2629 4.2652 4.3290 4.3374 4.3464 4.3547 4.9233 4.9233 5.4582 5.4596 7.2019 7.2025 8.6187 8.6189 8.6373 8.6389 8.7039 8.7047 9.1899 9.1912 k = 0.0277 0.0482-0.0000 ( 5241 PWs) bands (ev): -22.0645 -22.0645 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9570 -6.9548 -6.7440 -6.7438 -6.1338 -6.1058 -6.0465 -6.0160 -5.9625 -5.9487 -5.9318 -5.9293 -5.7867 -5.7784 -5.7208 -5.7158 -5.1953 -5.1921 -5.1649 -5.1646 -5.0723 -5.0718 -5.0207 -5.0190 -3.9452 -3.9443 -3.6812 -3.6793 3.7744 3.7782 4.2665 4.2698 4.3214 4.3287 4.3513 4.3584 4.9122 4.9124 5.4488 5.4508 7.2359 7.2368 8.6243 8.6247 8.6555 8.6580 8.7098 8.7111 9.1462 9.1476 k = 0.0369 0.0643-0.0000 ( 5227 PWs) bands (ev): -22.0644 -22.0644 -21.9989 -21.9989 -21.1899 -21.1899 -21.1887 -21.1887 -6.9578 -6.9549 -6.7441 -6.7439 -6.1430 -6.1093 -6.0515 -6.0179 -5.9552 -5.9403 -5.9336 -5.9301 -5.7881 -5.7771 -5.7221 -5.7154 -5.1960 -5.1917 -5.1636 -5.1631 -5.0784 -5.0774 -5.0225 -5.0205 -3.9338 -3.9326 -3.6786 -3.6761 3.7788 3.7838 4.2718 4.2761 4.3111 4.3173 4.3572 4.3632 4.8979 4.8982 5.4363 5.4387 7.2820 7.2831 8.6320 8.6325 8.6789 8.6824 8.7200 8.7220 9.0924 9.0934 k = 0.0462 0.0804-0.0000 ( 5225 PWs) bands (ev): -22.0643 -22.0643 -21.9989 -21.9989 -21.1900 -21.1900 -21.1887 -21.1887 -6.9587 -6.9551 -6.7443 -6.7439 -6.1529 -6.1158 -6.0545 -6.0208 -5.9486 -5.9387 -5.9298 -5.9285 -5.7894 -5.7758 -5.7234 -5.7153 -5.1966 -5.1915 -5.1619 -5.1612 -5.0862 -5.0846 -5.0243 -5.0223 -3.9195 -3.9181 -3.6753 -3.6721 3.7846 3.7908 4.2786 4.2836 4.2979 4.3029 4.3643 4.3693 4.8812 4.8816 5.4210 5.4238 7.3389 7.3403 8.6416 8.6421 8.7024 8.7057 8.7404 8.7420 9.0362 9.0370 k = 0.0554 0.0965-0.0000 ( 5229 PWs) bands (ev): -22.0642 -22.0642 -21.9989 -21.9989 -21.1900 -21.1900 -21.1887 -21.1887 -6.9597 -6.9555 -6.7444 -6.7440 -6.1632 -6.1246 -6.0562 -6.0243 -5.9454 -5.9420 -5.9261 -5.9188 -5.7905 -5.7744 -5.7248 -5.7152 -5.1974 -5.1914 -5.1599 -5.1590 -5.0953 -5.0929 -5.0262 -5.0242 -3.9028 -3.9011 -3.6711 -3.6674 3.7918 3.7990 4.2797 4.2845 4.2878 4.2943 4.3725 4.3767 4.8631 4.8637 5.4035 5.4064 7.4052 7.4068 8.6528 8.6533 8.7201 8.7219 8.7766 8.7768 8.9815 8.9819 k = 0.0646 0.1126-0.0000 ( 5225 PWs) bands (ev): -22.0641 -22.0641 -21.9989 -21.9989 -21.1901 -21.1901 -21.1887 -21.1887 -6.9607 -6.9559 -6.7447 -6.7441 -6.1738 -6.1348 -6.0572 -6.0282 -5.9460 -5.9459 -5.9189 -5.9088 -5.7913 -5.7729 -5.7263 -5.7153 -5.1981 -5.1914 -5.1579 -5.1566 -5.1053 -5.1020 -5.0281 -5.0262 -3.8839 -3.8820 -3.6662 -3.6619 3.8002 3.8084 4.2598 4.2642 4.2971 4.3048 4.3819 4.3853 4.8445 4.8454 5.3840 5.3871 7.4792 7.4811 8.6652 8.6657 8.7344 8.7351 8.8228 8.8241 8.9301 8.9302 k = 0.0739 0.1287-0.0000 ( 5225 PWs) bands (ev): -22.0640 -22.0640 -21.9989 -21.9989 -21.1902 -21.1902 -21.1887 -21.1887 -6.9618 -6.9565 -6.7449 -6.7442 -6.1845 -6.1459 -6.0580 -6.0326 -5.9501 -5.9481 -5.9107 -5.8989 -5.7918 -5.7713 -5.7277 -5.7156 -5.1990 -5.1916 -5.1562 -5.1546 -5.1155 -5.1114 -5.0301 -5.0283 -3.8632 -3.8611 -3.6606 -3.6558 3.8098 3.8188 4.2364 4.2402 4.3085 4.3170 4.3924 4.3952 4.8262 4.8273 5.3631 5.3661 7.5593 7.5616 8.6782 8.6785 8.7483 8.7484 8.8737 8.8763 8.8858 8.8870 k = 0.0831 0.1447-0.0000 ( 5229 PWs) bands (ev): -22.0638 -22.0638 -21.9989 -21.9989 -21.1903 -21.1903 -21.1888 -21.1888 -6.9630 -6.9572 -6.7452 -6.7444 -6.1952 -6.1574 -6.0592 -6.0375 -5.9544 -5.9507 -5.9025 -5.8895 -5.7916 -5.7695 -5.7291 -5.7159 -5.2000 -5.1919 -5.1558 -5.1537 -5.1245 -5.1197 -5.0321 -5.0305 -3.8411 -3.8388 -3.6543 -3.6491 3.8205 3.8302 4.2102 4.2136 4.3213 4.3305 4.4038 4.4061 4.8088 4.8101 5.3410 5.3440 7.6438 7.6464 8.6910 8.6911 8.7621 8.7629 8.8405 8.8416 8.9394 8.9413 k = 0.0923 0.1608-0.0000 ( 5229 PWs) bands (ev): -22.0637 -22.0637 -21.9988 -21.9988 -21.1904 -21.1904 -21.1888 -21.1888 -6.9642 -6.9579 -6.7456 -6.7446 -6.2058 -6.1691 -6.0610 -6.0431 -5.9585 -5.9532 -5.8948 -5.8809 -5.7907 -5.7673 -5.7305 -5.7163 -5.2012 -5.1923 -5.1586 -5.1557 -5.1301 -5.1251 -5.0343 -5.0327 -3.8180 -3.8155 -3.6474 -3.6417 3.8321 3.8424 4.1816 4.1846 4.3353 4.3452 4.4161 4.4180 4.7927 4.7940 5.3180 5.3209 7.7308 7.7339 8.7014 8.7026 8.7766 8.7782 8.8055 8.8080 9.0065 9.0084 k = 0.1016 0.1769-0.0000 ( 5231 PWs) bands (ev): -22.0635 -22.0635 -21.9988 -21.9988 -21.1905 -21.1905 -21.1888 -21.1888 -6.9654 -6.9588 -6.7461 -6.7449 -6.2161 -6.1808 -6.0636 -6.0496 -5.9622 -5.9554 -5.8879 -5.8734 -5.7888 -5.7649 -5.7317 -5.7168 -5.2028 -5.1929 -5.1655 -5.1615 -5.1311 -5.1262 -5.0366 -5.0350 -3.7941 -3.7915 -3.6399 -3.6339 3.8445 3.8553 4.1514 4.1540 4.3505 4.3610 4.4290 4.4305 4.7780 4.7794 5.2946 5.2972 7.8184 7.8221 8.7071 8.7103 8.7781 8.7839 8.7933 8.7946 9.0791 9.0805 k = 0.1108 0.1930-0.0000 ( 5235 PWs) bands (ev): -22.0633 -22.0633 -21.9988 -21.9988 -21.1905 -21.1905 -21.1889 -21.1889 -6.9666 -6.9598 -6.7466 -6.7452 -6.2262 -6.1923 -6.0673 -6.0569 -5.9653 -5.9570 -5.8819 -5.8672 -5.7858 -5.7623 -5.7327 -5.7173 -5.2052 -5.1941 -5.1742 -5.1696 -5.1292 -5.1243 -5.0390 -5.0375 -3.7698 -3.7671 -3.6319 -3.6256 3.8575 3.8685 4.1202 4.1226 4.3666 4.3776 4.4424 4.4434 4.7649 4.7664 5.2709 5.2733 7.9044 7.9089 8.7046 8.7100 8.7642 8.7722 8.8100 8.8124 9.1565 9.1567 k = 0.1200 0.2091-0.0000 ( 5227 PWs) bands (ev): -22.0631 -22.0631 -21.9988 -21.9988 -21.1906 -21.1906 -21.1889 -21.1889 -6.9678 -6.9607 -6.7472 -6.7455 -6.2360 -6.2036 -6.0722 -6.0651 -5.9676 -5.9580 -5.8770 -5.8625 -5.7815 -5.7596 -5.7334 -5.7179 -5.2091 -5.1964 -5.1821 -5.1775 -5.1259 -5.1209 -5.0416 -5.0401 -3.7455 -3.7426 -3.6235 -3.6169 3.8708 3.8819 4.0890 4.0910 4.3833 4.3948 4.4559 4.4565 4.7535 4.7550 5.2473 5.2494 7.9863 7.9916 8.6959 8.7019 8.7612 8.7701 8.8291 8.8323 9.2359 9.2380 k = 0.1293 0.2252-0.0000 ( 5225 PWs) bands (ev): -22.0629 -22.0629 -21.9988 -21.9988 -21.1907 -21.1907 -21.1889 -21.1889 -6.9689 -6.9618 -6.7480 -6.7460 -6.2453 -6.2146 -6.0782 -6.0742 -5.9690 -5.9582 -5.8731 -5.8592 -5.7762 -5.7569 -5.7335 -5.7185 -5.2153 -5.2013 -5.1877 -5.1828 -5.1220 -5.1169 -5.0443 -5.0427 -3.7213 -3.7184 -3.6146 -3.6078 3.8841 3.8950 4.0584 4.0603 4.4005 4.4123 4.4693 4.4694 4.7439 4.7454 5.2240 5.2258 8.0614 8.0677 8.6864 8.6925 8.7616 8.7710 8.8511 8.8552 9.3155 9.3231 k = 0.1385 0.2412-0.0000 ( 5229 PWs) bands (ev): -22.0627 -22.0627 -21.9987 -21.9987 -21.1908 -21.1908 -21.1890 -21.1890 -6.9700 -6.9628 -6.7488 -6.7465 -6.2542 -6.2253 -6.0853 -6.0840 -5.9695 -5.9578 -5.8701 -5.8571 -5.7700 -5.7548 -5.7327 -5.7190 -5.2236 -5.2088 -5.1908 -5.1852 -5.1179 -5.1125 -5.0471 -5.0454 -3.6977 -3.6946 -3.6053 -3.5983 3.8966 3.9069 4.0297 4.0316 4.4175 4.4297 4.4818 4.4825 4.7364 4.7379 5.2012 5.2026 8.1268 8.1339 8.6790 8.6854 8.7607 8.7708 8.8776 8.8823 9.3879 9.4097 k = 0.1477 0.2573-0.0000 ( 5237 PWs) bands (ev): -22.0625 -22.0625 -21.9987 -21.9987 -21.1909 -21.1909 -21.1891 -21.1891 -6.9711 -6.9639 -6.7497 -6.7471 -6.2626 -6.2356 -6.0943 -6.0934 -5.9692 -5.9567 -5.8681 -5.8561 -5.7633 -5.7536 -5.7309 -5.7195 -5.2329 -5.2173 -5.1922 -5.1860 -5.1136 -5.1081 -5.0499 -5.0482 -3.6749 -3.6716 -3.5956 -3.5886 3.9070 3.9162 4.0046 4.0068 4.4338 4.4460 4.4937 4.4952 4.7311 4.7329 5.1793 5.1803 8.1797 8.1876 8.6736 8.6807 8.7573 8.7685 8.9098 8.9151 9.4414 9.4606 k = 0.1570 0.2734-0.0000 ( 5229 PWs) bands (ev): -22.0623 -22.0623 -21.9987 -21.9987 -21.1910 -21.1910 -21.1891 -21.1891 -6.9720 -6.9650 -6.7507 -6.7478 -6.2705 -6.2454 -6.1052 -6.1023 -5.9681 -5.9551 -5.8669 -5.8558 -5.7566 -5.7533 -5.7279 -5.7196 -5.2423 -5.2257 -5.1927 -5.1860 -5.1095 -5.1037 -5.0529 -5.0509 -3.6532 -3.6496 -3.5855 -3.5786 3.9124 3.9192 3.9861 3.9898 4.4483 4.4602 4.5055 4.5078 4.7284 4.7305 5.1585 5.1591 8.2182 8.2266 8.6673 8.6751 8.7536 8.7660 8.9488 8.9542 9.4844 9.4976 k = 0.1662 0.2895-0.0000 ( 5229 PWs) bands (ev): -22.0621 -22.0621 -21.9987 -21.9987 -21.1911 -21.1911 -21.1892 -21.1892 -6.9729 -6.9660 -6.7519 -6.7485 -6.2779 -6.2547 -6.1163 -6.1118 -5.9663 -5.9528 -5.8664 -5.8560 -5.7538 -5.7504 -5.7242 -5.7193 -5.2513 -5.2337 -5.1926 -5.1856 -5.1054 -5.0995 -5.0558 -5.0536 -3.6329 -3.6289 -3.5750 -3.5683 3.9084 3.9120 3.9788 3.9845 4.4600 4.4707 4.5181 4.5207 4.7282 4.7310 5.1391 5.1393 8.2418 8.2502 8.6551 8.6626 8.7550 8.7673 8.9945 8.9997 9.5260 9.5368 k = 0.1754 0.3056-0.0000 ( 5235 PWs) bands (ev): -22.0619 -22.0619 -21.9987 -21.9987 -21.1912 -21.1912 -21.1892 -21.1892 -6.9737 -6.9670 -6.7531 -6.7494 -6.2848 -6.2636 -6.1276 -6.1217 -5.9639 -5.9501 -5.8664 -5.8566 -5.7549 -5.7452 -5.7201 -5.7180 -5.2597 -5.2410 -5.1921 -5.1849 -5.1016 -5.0956 -5.0587 -5.0562 -3.6142 -3.6098 -3.5639 -3.5576 3.8961 3.8975 3.9818 3.9883 4.4679 4.4763 4.5321 4.5344 4.7307 4.7343 5.1212 5.1216 8.2513 8.2595 8.6330 8.6389 8.7656 8.7766 9.0457 9.0504 9.5682 9.5777 k = 0.1847 0.3217-0.0000 ( 5241 PWs) bands (ev): -22.0617 -22.0617 -21.9986 -21.9986 -21.1912 -21.1912 -21.1893 -21.1893 -6.9743 -6.9680 -6.7544 -6.7503 -6.2911 -6.2719 -6.1388 -6.1319 -5.9611 -5.9469 -5.8670 -5.8574 -5.7564 -5.7416 -5.7158 -5.7155 -5.2674 -5.2475 -5.1914 -5.1841 -5.0980 -5.0919 -5.0616 -5.0586 -3.5976 -3.5925 -3.5521 -3.5464 3.8808 3.8810 3.9895 3.9957 4.4718 4.4774 4.5473 4.5490 4.7353 4.7398 5.1052 5.1061 8.2488 8.2565 8.6003 8.6046 8.7849 8.7946 9.1006 9.1045 9.6103 9.6192 k = 0.1939 0.3377-0.0000 ( 5239 PWs) bands (ev): -22.0615 -22.0615 -21.9986 -21.9986 -21.1913 -21.1913 -21.1894 -21.1894 -6.9749 -6.9689 -6.7558 -6.7513 -6.2969 -6.2797 -6.1500 -6.1422 -5.9579 -5.9433 -5.8678 -5.8583 -5.7581 -5.7397 -5.7117 -5.7116 -5.2744 -5.2532 -5.1904 -5.1831 -5.0948 -5.0887 -5.0643 -5.0609 -3.5832 -3.5773 -3.5398 -3.5347 3.8655 3.8661 3.9985 4.0039 4.4721 4.4748 4.5629 4.5639 4.7415 4.7467 5.0919 5.0932 8.2368 8.2439 8.5592 8.5622 8.8110 8.8198 9.1571 9.1601 9.6515 9.6599 k = 0.2031 0.3538-0.0000 ( 5242 PWs) bands (ev): -22.0614 -22.0614 -21.9986 -21.9986 -21.1913 -21.1913 -21.1895 -21.1895 -6.9753 -6.9697 -6.7573 -6.7523 -6.3021 -6.2869 -6.1609 -6.1524 -5.9544 -5.9394 -5.8690 -5.8593 -5.7601 -5.7392 -5.7077 -5.7070 -5.2805 -5.2581 -5.1892 -5.1820 -5.0919 -5.0859 -5.0670 -5.0628 -3.5707 -3.5641 -3.5270 -3.5226 3.8522 3.8533 4.0072 4.0114 4.4696 4.4696 4.5781 4.5785 4.7486 4.7542 5.0816 5.0833 8.2180 8.2244 8.5119 8.5140 8.8425 8.8508 9.2134 9.2156 9.6904 9.6984 k = 0.2124 0.3699-0.0000 ( 5238 PWs) bands (ev): -22.0612 -22.0612 -21.9986 -21.9986 -21.1914 -21.1914 -21.1895 -21.1895 -6.9756 -6.9704 -6.7588 -6.7534 -6.3068 -6.2936 -6.1714 -6.1624 -5.9506 -5.9352 -5.8703 -5.8602 -5.7621 -5.7396 -5.7041 -5.7020 -5.2857 -5.2622 -5.1878 -5.1808 -5.0895 -5.0835 -5.0694 -5.0645 -3.5601 -3.5529 -3.5142 -3.5105 3.8414 3.8432 4.0150 4.0178 4.4625 4.4650 4.5924 4.5925 4.7557 4.7613 5.0747 5.0766 8.1947 8.2005 8.4605 8.4621 8.8780 8.8861 9.2680 9.2694 9.7259 9.7335 k = 0.2216 0.3860-0.0000 ( 5238 PWs) bands (ev): -22.0610 -22.0610 -21.9986 -21.9986 -21.1914 -21.1914 -21.1896 -21.1896 -6.9758 -6.9710 -6.7603 -6.7546 -6.3110 -6.2996 -6.1815 -6.1722 -5.9466 -5.9307 -5.8718 -5.8611 -5.7642 -5.7406 -5.7009 -5.6971 -5.2902 -5.2654 -5.1863 -5.1796 -5.0875 -5.0817 -5.0717 -5.0658 -3.5510 -3.5432 -3.5018 -3.4986 3.8335 3.8358 4.0213 4.0229 4.4542 4.4588 4.6051 4.6058 4.7622 4.7672 5.0716 5.0735 8.1691 8.1742 8.4070 8.4081 8.9167 8.9248 9.3194 9.3202 9.7574 9.7646 k = 0.2308 0.4021-0.0000 ( 5250 PWs) bands (ev): -22.0609 -22.0609 -21.9986 -21.9986 -21.1914 -21.1914 -21.1897 -21.1897 -6.9759 -6.9716 -6.7619 -6.7557 -6.3147 -6.3051 -6.1910 -6.1817 -5.9425 -5.9262 -5.8733 -5.8618 -5.7664 -5.7418 -5.6983 -5.6924 -5.2938 -5.2680 -5.1847 -5.1785 -5.0860 -5.0804 -5.0737 -5.0668 -3.5430 -3.5349 -3.4901 -3.4873 3.8285 3.8313 4.0262 4.0265 4.4450 4.4513 4.6164 4.6177 4.7678 4.7714 5.0723 5.0738 8.1429 8.1474 8.3528 8.3536 8.9575 8.9657 9.3665 9.3669 9.7850 9.7918 k = 0.2401 0.4182-0.0000 ( 5250 PWs) bands (ev): -22.0608 -22.0608 -21.9986 -21.9986 -21.1914 -21.1914 -21.1898 -21.1898 -6.9759 -6.9721 -6.7634 -6.7569 -6.3179 -6.3099 -6.1999 -6.1908 -5.9383 -5.9215 -5.8748 -5.8625 -5.7685 -5.7433 -5.6961 -5.6883 -5.2966 -5.2699 -5.1830 -5.1773 -5.0849 -5.0795 -5.0755 -5.0675 -3.5361 -3.5276 -3.4793 -3.4769 3.8261 3.8296 4.0287 4.0296 4.4351 4.4428 4.6261 4.6281 4.7721 4.7738 5.0765 5.0775 8.1174 8.1213 8.2993 8.2999 8.9996 9.0079 9.4074 9.4077 9.8099 9.8160 k = 0.2493 0.4342-0.0000 ( 5254 PWs) bands (ev): -22.0606 -22.0606 -21.9986 -21.9986 -21.1914 -21.1914 -21.1899 -21.1899 -6.9758 -6.9725 -6.7649 -6.7581 -6.3206 -6.3140 -6.2082 -6.1994 -5.9342 -5.9169 -5.8762 -5.8630 -5.7705 -5.7448 -5.6944 -5.6846 -5.2988 -5.2713 -5.1812 -5.1761 -5.0845 -5.0790 -5.0769 -5.0680 -3.5300 -3.5214 -3.4696 -3.4675 3.8263 3.8304 4.0297 4.0316 4.4247 4.4333 4.6341 4.6369 4.7746 4.7755 5.0838 5.0838 8.0937 8.0971 8.2477 8.2481 9.0419 9.0505 9.4405 9.4408 9.8338 9.8392 k = 0.2585 0.4503-0.0000 ( 5242 PWs) bands (ev): -22.0605 -22.0605 -21.9985 -21.9985 -21.1914 -21.1914 -21.1900 -21.1900 -6.9756 -6.9728 -6.7662 -6.7592 -6.3228 -6.3175 -6.2156 -6.2076 -5.9300 -5.9123 -5.8775 -5.8635 -5.7724 -5.7464 -5.6932 -5.6814 -5.3002 -5.2722 -5.1794 -5.1749 -5.0847 -5.0787 -5.0780 -5.0683 -3.5248 -3.5160 -3.4610 -3.4592 3.8288 3.8336 4.0298 4.0324 4.4138 4.4228 4.6406 4.6439 4.7742 4.7779 5.0923 5.0932 8.0726 8.0755 8.1990 8.1994 9.0837 9.0925 9.4638 9.4644 9.8592 9.8637 k = 0.2678 0.4664-0.0000 ( 5238 PWs) bands (ev): -22.0604 -22.0604 -21.9985 -21.9985 -21.1913 -21.1913 -21.1901 -21.1901 -6.9753 -6.9730 -6.7675 -6.7603 -6.3246 -6.3203 -6.2224 -6.2152 -5.9260 -5.9080 -5.8785 -5.8638 -5.7742 -5.7479 -5.6925 -5.6788 -5.3010 -5.2728 -5.1775 -5.1738 -5.0856 -5.0786 -5.0785 -5.0687 -3.5204 -3.5114 -3.4536 -3.4520 3.8333 3.8389 4.0294 4.0322 4.4024 4.4113 4.6455 4.6493 4.7732 4.7799 5.1021 5.1040 8.0546 8.0570 8.1541 8.1544 9.1242 9.1332 9.4761 9.4771 9.8881 9.8917 k = 0.2770 0.4825-0.0000 ( 5242 PWs) bands (ev): -22.0604 -22.0604 -21.9985 -21.9985 -21.1913 -21.1913 -21.1902 -21.1902 -6.9750 -6.9731 -6.7687 -6.7613 -6.3261 -6.3225 -6.2282 -6.2222 -5.9222 -5.9042 -5.8792 -5.8641 -5.7759 -5.7494 -5.6923 -5.6767 -5.3013 -5.2731 -5.1756 -5.1726 -5.0869 -5.0789 -5.0784 -5.0691 -3.5167 -3.5075 -3.4472 -3.4460 3.8392 3.8456 4.0287 4.0315 4.3907 4.3990 4.6490 4.6531 4.7720 4.7815 5.1124 5.1153 8.0400 8.0419 8.1137 8.1140 9.1627 9.1718 9.4774 9.4788 9.9213 9.9243 k = 0.2862 0.4986-0.0000 ( 5238 PWs) bands (ev): -22.0603 -22.0603 -21.9985 -21.9985 -21.1912 -21.1912 -21.1903 -21.1903 -6.9747 -6.9732 -6.7697 -6.7622 -6.3271 -6.3240 -6.2332 -6.2286 -5.9185 -5.9009 -5.8794 -5.8643 -5.7773 -5.7508 -5.6923 -5.6751 -5.3012 -5.2733 -5.1738 -5.1715 -5.0886 -5.0791 -5.0784 -5.0695 -3.5138 -3.5043 -3.4420 -3.4410 3.8460 3.8534 4.0280 4.0304 4.3789 4.3863 4.6515 4.6553 4.7710 4.7830 5.1224 5.1264 8.0288 8.0301 8.0784 8.0790 9.1986 9.2079 9.4691 9.4707 9.9587 9.9612 k = 0.2955 0.5147-0.0000 ( 5238 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1912 -21.1912 -21.1904 -21.1904 -6.9744 -6.9733 -6.7706 -6.7630 -6.3279 -6.3250 -6.2372 -6.2343 -5.9151 -5.8984 -5.8791 -5.8647 -5.7785 -5.7520 -5.6927 -5.6739 -5.3007 -5.2735 -5.1720 -5.1704 -5.0904 -5.0793 -5.0784 -5.0700 -3.5114 -3.5018 -3.4378 -3.4371 3.8532 3.8616 4.0276 4.0293 4.3675 4.3735 4.6531 4.6562 4.7703 4.7844 5.1315 5.1365 8.0208 8.0213 8.0488 8.0498 9.2315 9.2409 9.4533 9.4551 9.9990 10.0011 k = 0.3047 0.5307-0.0000 ( 5212 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1910 -21.1910 -21.1905 -21.1905 -6.9741 -6.9734 -6.7712 -6.7636 -6.3285 -6.3253 -6.2402 -6.2392 -5.9119 -5.8967 -5.8782 -5.8652 -5.7795 -5.7531 -5.6931 -5.6731 -5.2999 -5.2738 -5.1704 -5.1693 -5.0922 -5.0793 -5.0784 -5.0703 -3.5097 -3.4999 -3.4345 -3.4342 3.8600 3.8695 4.0277 4.0283 4.3572 4.3615 4.6540 4.6561 4.7699 4.7856 5.1391 5.1450 8.0144 8.0156 8.0254 8.0280 9.2613 9.2708 9.4328 9.4345 10.0405 10.0425 k = 0.3139 0.5468-0.0000 ( 5198 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1909 -21.1909 -21.1906 -21.1906 -6.9738 -6.9734 -6.7716 -6.7641 -6.3288 -6.3252 -6.2433 -6.2421 -5.9089 -5.8958 -5.8771 -5.8660 -5.7803 -5.7540 -5.6937 -5.6725 -5.2989 -5.2743 -5.1690 -5.1684 -5.0939 -5.0794 -5.0783 -5.0706 -3.5085 -3.4985 -3.4323 -3.4322 3.8658 3.8763 4.0274 4.0281 4.3488 4.3512 4.6546 4.6554 4.7696 4.7866 5.1447 5.1516 8.0053 8.0078 8.0135 8.0171 9.2873 9.2970 9.4105 9.4118 10.0815 10.0836 k = 0.3232 0.5629-0.0000 ( 5194 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1908 -21.1908 -21.1907 -21.1907 -6.9736 -6.9735 -6.7719 -6.7644 -6.3291 -6.3248 -6.2464 -6.2430 -5.9062 -5.8955 -5.8759 -5.8672 -5.7809 -5.7546 -5.6941 -5.6722 -5.2978 -5.2750 -5.1680 -5.1676 -5.0953 -5.0795 -5.0781 -5.0709 -3.5078 -3.4976 -3.4312 -3.4307 3.8700 3.8813 4.0266 4.0286 4.3433 4.3435 4.6543 4.6551 4.7694 4.7872 5.1480 5.1557 7.9969 7.9976 8.0123 8.0142 9.3081 9.3183 9.3903 9.3909 10.1202 10.1227 k = 0.3324 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1908 -21.1908 -21.1907 -21.1907 -6.9736 -6.9735 -6.7719 -6.7646 -6.3294 -6.3242 -6.2485 -6.2427 -5.9038 -5.8956 -5.8751 -5.8689 -5.7812 -5.7551 -5.6944 -5.6720 -5.2967 -5.2761 -5.1676 -5.1672 -5.0963 -5.0796 -5.0777 -5.0712 -3.5075 -3.4971 -3.4309 -3.4301 3.8720 3.8838 4.0259 4.0290 4.3396 4.3415 4.6531 4.6556 4.7690 4.7874 5.1488 5.1573 7.9941 7.9942 8.0122 8.0133 9.3190 9.3291 9.3793 9.3795 10.1539 10.1580 k = 0.3324 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1908 -21.1908 -21.1907 -21.1907 -6.9736 -6.9735 -6.7719 -6.7646 -6.3294 -6.3242 -6.2485 -6.2427 -5.9038 -5.8956 -5.8751 -5.8689 -5.7812 -5.7551 -5.6944 -5.6720 -5.2967 -5.2761 -5.1676 -5.1672 -5.0963 -5.0796 -5.0777 -5.0712 -3.5075 -3.4971 -3.4309 -3.4301 3.8720 3.8838 4.0259 4.0290 4.3396 4.3415 4.6531 4.6556 4.7690 4.7874 5.1488 5.1573 7.9941 7.9942 8.0122 8.0133 9.3190 9.3291 9.3793 9.3795 10.1539 10.1580 k = 0.3139 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1909 -21.1909 -21.1907 -21.1907 -6.9737 -6.9735 -6.7718 -6.7645 -6.3293 -6.3245 -6.2472 -6.2424 -5.9055 -5.8952 -5.8759 -5.8680 -5.7809 -5.7548 -5.6942 -5.6720 -5.2974 -5.2756 -5.1685 -5.1670 -5.0956 -5.0797 -5.0779 -5.0709 -3.5077 -3.4974 -3.4313 -3.4305 3.8702 3.8816 4.0263 4.0290 4.3421 4.3443 4.6537 4.6556 4.7690 4.7871 5.1477 5.1558 7.9968 7.9979 8.0118 8.0136 9.3122 9.3219 9.3871 9.3877 10.1225 10.1268 k = 0.2955 0.5790-0.0000 ( 5216 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1910 -21.1910 -21.1906 -21.1906 -6.9738 -6.9735 -6.7716 -6.7642 -6.3295 -6.3249 -6.2447 -6.2408 -5.9083 -5.8946 -5.8778 -5.8673 -5.7802 -5.7544 -5.6937 -5.6720 -5.2983 -5.2753 -5.1702 -5.1670 -5.0942 -5.0802 -5.0780 -5.0699 -3.5082 -3.4981 -3.4323 -3.4316 3.8650 3.8757 4.0272 4.0296 4.3483 4.3524 4.6542 4.6566 4.7686 4.7865 5.1437 5.1515 8.0045 8.0081 8.0110 8.0150 9.3025 9.3115 9.4015 9.4024 10.0818 10.0864 k = 0.2770 0.5790-0.0000 ( 5219 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1911 -21.1911 -21.1905 -21.1905 -6.9741 -6.9736 -6.7711 -6.7638 -6.3299 -6.3254 -6.2410 -6.2375 -5.9121 -5.8945 -5.8802 -5.8667 -5.7792 -5.7537 -5.6928 -5.6719 -5.2995 -5.2754 -5.1724 -5.1676 -5.0923 -5.0810 -5.0779 -5.0683 -3.5089 -3.4989 -3.4340 -3.4331 3.8563 3.8659 4.0291 4.0315 4.3584 4.3648 4.6550 4.6585 4.7677 4.7853 5.1368 5.1444 8.0063 8.0070 8.0265 8.0274 9.2960 9.3046 9.4172 9.4183 10.0385 10.0435 k = 0.2585 0.5790-0.0000 ( 5214 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1912 -21.1912 -21.1903 -21.1903 -6.9743 -6.9737 -6.7704 -6.7632 -6.3305 -6.3261 -6.2362 -6.2326 -5.9167 -5.8959 -5.8823 -5.8663 -5.7779 -5.7529 -5.6915 -5.6715 -5.3009 -5.2759 -5.1749 -5.1685 -5.0903 -5.0820 -5.0774 -5.0661 -3.5098 -3.5000 -3.4361 -3.4350 3.8443 3.8526 4.0323 4.0350 4.3719 4.3805 4.6564 4.6612 4.7664 4.7839 5.1271 5.1345 8.0005 8.0021 8.0503 8.0518 9.2952 9.3038 9.4330 9.4341 9.9948 10.0002 k = 0.2401 0.5790-0.0000 ( 5213 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1913 -21.1913 -21.1902 -21.1902 -6.9747 -6.9739 -6.7696 -6.7625 -6.3313 -6.3269 -6.2303 -6.2263 -5.9225 -5.9000 -5.8829 -5.8659 -5.7763 -5.7519 -5.6898 -5.6710 -5.3026 -5.2769 -5.1776 -5.1699 -5.0887 -5.0832 -5.0761 -5.0633 -3.5108 -3.5011 -3.4387 -3.4374 3.8294 3.8364 4.0372 4.0404 4.3877 4.3986 4.6586 4.6648 4.7649 4.7822 5.1148 5.1220 7.9915 7.9938 8.0811 8.0835 9.3012 9.3101 9.4482 9.4493 9.9517 9.9577 k = 0.2216 0.5790-0.0000 ( 5212 PWs) bands (ev): -22.0603 -22.0603 -21.9985 -21.9985 -21.1914 -21.1914 -21.1901 -21.1901 -6.9750 -6.9742 -6.7686 -6.7618 -6.3323 -6.3279 -6.2232 -6.2187 -5.9293 -5.9066 -5.8822 -5.8655 -5.7744 -5.7508 -5.6878 -5.6703 -5.3045 -5.2784 -5.1802 -5.1715 -5.0881 -5.0846 -5.0735 -5.0600 -3.5118 -3.5024 -3.4416 -3.4400 3.8124 3.8181 4.0438 4.0475 4.4050 4.4181 4.6617 4.6692 4.7633 4.7807 5.1002 5.1071 7.9794 7.9822 8.1188 8.1219 9.3143 9.3238 9.4629 9.4637 9.9097 9.9165 k = 0.2031 0.5790-0.0000 ( 5204 PWs) bands (ev): -22.0603 -22.0603 -21.9985 -21.9985 -21.1914 -21.1914 -21.1900 -21.1900 -6.9754 -6.9746 -6.7675 -6.7609 -6.3333 -6.3290 -6.2150 -6.2100 -5.9372 -5.9150 -5.8808 -5.8650 -5.7723 -5.7496 -5.6855 -5.6695 -5.3065 -5.2805 -5.1827 -5.1733 -5.0885 -5.0861 -5.0699 -5.0564 -3.5127 -3.5036 -3.4448 -3.4429 3.7939 3.7986 4.0520 4.0561 4.4228 4.4378 4.6656 4.6744 4.7620 4.7796 5.0834 5.0902 7.9644 7.9675 8.1629 8.1667 9.3342 9.3449 9.4767 9.4774 9.8692 9.8770 k = 0.1847 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0603 -22.0603 -21.9985 -21.9985 -21.1915 -21.1915 -21.1899 -21.1899 -6.9758 -6.9750 -6.7663 -6.7601 -6.3343 -6.3302 -6.2058 -6.2002 -5.9461 -5.9249 -5.8790 -5.8645 -5.7699 -5.7484 -5.6830 -5.6685 -5.3087 -5.2831 -5.1849 -5.1752 -5.0895 -5.0878 -5.0655 -5.0526 -3.5136 -3.5049 -3.4480 -3.4459 3.7749 3.7787 4.0614 4.0659 4.4403 4.4568 4.6703 4.6802 4.7614 4.7793 5.0650 5.0715 7.9470 7.9503 8.2132 8.2176 9.3602 9.3725 9.4897 9.4904 9.8304 9.8396 k = 0.1662 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0604 -22.0604 -21.9985 -21.9985 -21.1916 -21.1916 -21.1898 -21.1898 -6.9763 -6.9754 -6.7650 -6.7592 -6.3353 -6.3315 -6.1956 -6.1895 -5.9561 -5.9359 -5.8771 -5.8639 -5.7674 -5.7472 -5.6804 -5.6675 -5.3108 -5.2863 -5.1867 -5.1770 -5.0909 -5.0895 -5.0609 -5.0489 -3.5144 -3.5061 -3.4513 -3.4490 3.7560 3.7591 4.0719 4.0765 4.4568 4.4745 4.6754 4.6862 4.7619 4.7801 5.0453 5.0515 7.9277 7.9311 8.2693 8.2744 9.3906 9.4056 9.5015 9.5032 9.7932 9.8042 k = 0.1477 0.5790-0.0000 ( 5207 PWs) bands (ev): -22.0604 -22.0604 -21.9985 -21.9985 -21.1917 -21.1917 -21.1897 -21.1897 -6.9767 -6.9758 -6.7637 -6.7584 -6.3362 -6.3328 -6.1845 -6.1779 -5.9670 -5.9480 -5.8751 -5.8634 -5.7647 -5.7461 -5.6779 -5.6665 -5.3129 -5.2898 -5.1881 -5.1788 -5.0925 -5.0913 -5.0561 -5.0452 -3.5151 -3.5072 -3.4546 -3.4522 3.7377 3.7403 4.0830 4.0876 4.4719 4.4902 4.6806 4.6921 4.7641 4.7823 5.0249 5.0306 7.9074 7.9108 8.3309 8.3367 9.4228 9.4420 9.5127 9.5167 9.7570 9.7710 k = 0.1293 0.5790-0.0000 ( 5205 PWs) bands (ev): -22.0605 -22.0605 -21.9985 -21.9985 -21.1917 -21.1917 -21.1896 -21.1896 -6.9771 -6.9763 -6.7624 -6.7577 -6.3371 -6.3340 -6.1727 -6.1656 -5.9787 -5.9609 -5.8731 -5.8628 -5.7620 -5.7451 -5.6754 -5.6656 -5.3148 -5.2936 -5.1891 -5.1804 -5.0942 -5.0932 -5.0515 -5.0417 -3.5155 -3.5083 -3.4577 -3.4552 3.7207 3.7227 4.0944 4.0988 4.4854 4.5035 4.6856 4.6972 4.7684 4.7861 5.0042 5.0095 7.8870 7.8903 8.3975 8.4039 9.4519 9.4780 9.5242 9.5330 9.7204 9.7393 k = 0.1108 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0605 -22.0605 -21.9985 -21.9985 -21.1918 -21.1918 -21.1895 -21.1895 -6.9774 -6.9767 -6.7612 -6.7570 -6.3378 -6.3351 -6.1603 -6.1527 -5.9912 -5.9744 -5.8712 -5.8623 -5.7592 -5.7443 -5.6730 -5.6647 -5.3165 -5.2975 -5.1897 -5.1819 -5.0958 -5.0949 -5.0471 -5.0386 -3.5158 -3.5092 -3.4606 -3.4582 3.7052 3.7069 4.1055 4.1097 4.4971 4.5144 4.6901 4.7012 4.7746 4.7911 4.9840 4.9888 7.8673 7.8703 8.4685 8.4755 9.4698 9.5033 9.5403 9.5564 9.6796 9.7071 k = 0.0923 0.5790-0.0000 ( 5204 PWs) bands (ev): -22.0605 -22.0605 -21.9985 -21.9985 -21.1918 -21.1918 -21.1895 -21.1895 -6.9778 -6.9771 -6.7600 -6.7564 -6.3385 -6.3362 -6.1472 -6.1391 -6.0043 -5.9886 -5.8693 -5.8619 -5.7565 -5.7437 -5.6708 -5.6640 -5.3179 -5.3015 -5.1899 -5.1833 -5.0973 -5.0966 -5.0431 -5.0359 -3.5159 -3.5101 -3.4632 -3.4609 3.6916 3.6929 4.1161 4.1198 4.5071 4.5229 4.6942 4.7043 4.7823 4.7968 4.9648 4.9690 7.8491 7.8518 8.5432 8.5507 9.4661 9.5048 9.5600 9.5874 9.6304 9.6724 k = 0.0739 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0606 -22.0606 -21.9985 -21.9985 -21.1919 -21.1919 -21.1894 -21.1894 -6.9780 -6.9775 -6.7589 -6.7560 -6.3389 -6.3371 -6.1337 -6.1251 -6.0178 -6.0032 -5.8676 -5.8617 -5.7539 -5.7434 -5.6688 -5.6634 -5.3188 -5.3053 -5.1899 -5.1845 -5.0987 -5.0980 -5.0396 -5.0338 -3.5158 -3.5109 -3.4653 -3.4633 3.6802 3.6812 4.1256 4.1288 4.5156 4.5291 4.6979 4.7065 4.7906 4.8026 4.9474 4.9509 7.8332 7.8355 8.6203 8.6283 9.4297 9.4673 9.5688 9.5882 9.6238 9.6570 k = 0.0554 0.5790-0.0000 ( 5200 PWs) bands (ev): -22.0606 -22.0606 -21.9985 -21.9985 -21.1919 -21.1919 -21.1894 -21.1894 -6.9782 -6.9778 -6.7579 -6.7557 -6.3393 -6.3379 -6.1199 -6.1107 -6.0317 -6.0180 -5.8661 -5.8616 -5.7515 -5.7435 -5.6671 -5.6631 -5.3191 -5.3088 -5.1897 -5.1855 -5.0997 -5.0993 -5.0366 -5.0322 -3.5155 -3.5117 -3.4670 -3.4654 3.6711 3.6719 4.1336 4.1361 4.5225 4.5332 4.7013 4.7081 4.7986 4.8077 4.9327 4.9355 7.8202 7.8220 8.6978 8.7061 9.3646 9.3924 9.5718 9.5781 9.6478 9.6613 k = 0.0369 0.5790-0.0000 ( 5211 PWs) bands (ev): -22.0606 -22.0606 -21.9985 -21.9985 -21.1919 -21.1919 -21.1893 -21.1893 -6.9784 -6.9781 -6.7571 -6.7557 -6.3395 -6.3385 -6.1058 -6.0963 -6.0456 -6.0330 -5.8647 -5.8618 -5.7494 -5.7439 -5.6657 -5.6630 -5.3189 -5.3119 -5.1893 -5.1865 -5.1005 -5.1002 -5.0342 -5.0313 -3.5151 -3.5125 -3.4682 -3.4670 3.6646 3.6651 4.1398 4.1415 4.5279 4.5354 4.7044 4.7090 4.8053 4.8115 4.9215 4.9234 7.8107 7.8119 8.7717 8.7795 9.2919 9.3109 9.5762 9.5785 9.6440 9.6524 k = 0.0185 0.5790-0.0000 ( 5216 PWs) bands (ev): -22.0606 -22.0606 -21.9985 -21.9985 -21.1919 -21.1919 -21.1893 -21.1893 -6.9784 -6.9783 -6.7565 -6.7558 -6.3395 -6.3390 -6.0919 -6.0826 -6.0586 -6.0479 -5.8637 -5.8622 -5.7475 -5.7447 -5.6645 -5.6632 -5.3181 -5.3146 -5.1887 -5.1873 -5.1010 -5.1009 -5.0325 -5.0310 -3.5145 -3.5132 -3.4687 -3.4681 3.6607 3.6609 4.1438 4.1447 4.5320 4.5358 4.7068 4.7092 4.8103 4.8134 4.9145 4.9155 7.8049 7.8056 8.8324 8.8380 9.2323 9.2429 9.5807 9.5812 9.6359 9.6399 k = 0.0000 0.5790-0.0000 ( 5220 PWs) bands (ev): -22.0606 -22.0606 -21.9985 -21.9985 -21.1920 -21.1920 -21.1893 -21.1893 -6.9784 -6.9784 -6.7560 -6.7560 -6.3393 -6.3393 -6.0797 -6.0797 -6.0608 -6.0608 -5.8628 -5.8628 -5.7459 -5.7459 -5.6637 -5.6637 -5.3167 -5.3167 -5.1881 -5.1881 -5.1011 -5.1011 -5.0314 -5.0314 -3.5139 -3.5139 -3.4687 -3.4687 3.6594 3.6594 4.1455 4.1455 4.5347 4.5347 4.7085 4.7085 4.8130 4.8130 4.9125 4.9125 7.8032 7.8032 8.8602 8.8602 9.2110 9.2110 9.5827 9.5827 9.6340 9.6340 k = 0.0000 0.5790-0.0000 ( 5220 PWs) bands (ev): -22.0606 -22.0606 -21.9985 -21.9985 -21.1920 -21.1920 -21.1893 -21.1893 -6.9784 -6.9784 -6.7560 -6.7560 -6.3393 -6.3393 -6.0797 -6.0797 -6.0608 -6.0608 -5.8628 -5.8628 -5.7459 -5.7459 -5.6637 -5.6637 -5.3167 -5.3167 -5.1881 -5.1881 -5.1011 -5.1011 -5.0314 -5.0314 -3.5139 -3.5139 -3.4687 -3.4687 3.6594 3.6594 4.1455 4.1455 4.5347 4.5347 4.7085 4.7085 4.8130 4.8130 4.9125 4.9125 7.8032 7.8032 8.8602 8.8602 9.2110 9.2110 9.5827 9.5827 9.6340 9.6340 k = 0.0000 0.5790 0.0179 ( 5218 PWs) bands (ev): -22.0605 -22.0605 -21.9986 -21.9986 -21.1920 -21.1920 -21.1893 -21.1893 -6.9780 -6.9778 -6.7565 -6.7557 -6.3394 -6.3391 -6.0817 -6.0785 -6.0613 -6.0609 -5.8640 -5.8608 -5.7478 -5.7452 -5.6644 -5.6634 -5.3166 -5.3165 -5.1885 -5.1884 -5.1009 -5.1007 -5.0316 -5.0312 -3.5135 -3.5134 -3.4685 -3.4683 3.6592 3.6593 4.1423 4.1443 4.5322 4.5354 4.7064 4.7075 4.8128 4.8130 4.9140 4.9141 7.8059 7.8062 8.8574 8.8577 9.2122 9.2125 9.5843 9.5851 9.6421 9.6425 k = 0.0000 0.5790 0.0359 ( 5218 PWs) bands (ev): -22.0603 -22.0603 -21.9988 -21.9988 -21.1919 -21.1919 -21.1893 -21.1893 -6.9765 -6.9761 -6.7571 -6.7555 -6.3394 -6.3387 -6.0844 -6.0781 -6.0622 -6.0615 -5.8643 -5.8580 -5.7508 -5.7456 -5.6652 -5.6634 -5.3163 -5.3160 -5.1898 -5.1896 -5.1002 -5.0998 -5.0320 -5.0312 -3.5123 -3.5120 -3.4676 -3.4673 3.6588 3.6590 4.1349 4.1387 4.5283 4.5345 4.7015 4.7037 4.8126 4.8127 4.9184 4.9185 7.8143 7.8149 8.8500 8.8506 9.2161 9.2166 9.5905 9.5920 9.6653 9.6661 k = 0.0000 0.5790 0.0538 ( 5220 PWs) bands (ev): -22.0599 -22.0599 -21.9992 -21.9992 -21.1919 -21.1919 -21.1894 -21.1894 -6.9740 -6.9734 -6.7578 -6.7554 -6.3392 -6.3382 -6.0882 -6.0789 -6.0630 -6.0621 -5.8637 -5.8548 -5.7548 -5.7471 -5.6664 -5.6636 -5.3157 -5.3153 -5.1918 -5.1915 -5.0989 -5.0983 -5.0325 -5.0313 -3.5103 -3.5098 -3.4661 -3.4657 3.6580 3.6584 4.1234 4.1289 4.5233 4.5320 4.6944 4.6977 4.8122 4.8124 4.9249 4.9252 7.8283 7.8292 8.8395 8.8403 9.2228 9.2235 9.6016 9.6037 9.6980 9.6989 k = 0.0000 0.5790 0.0718 ( 5214 PWs) bands (ev): -22.0594 -22.0594 -21.9998 -21.9998 -21.1919 -21.1919 -21.1894 -21.1894 -6.9705 -6.9696 -6.7586 -6.7555 -6.3389 -6.3375 -6.0931 -6.0814 -6.0637 -6.0621 -5.8623 -5.8513 -5.7596 -5.7498 -5.6678 -5.6641 -5.3149 -5.3143 -5.1945 -5.1941 -5.0972 -5.0963 -5.0331 -5.0315 -3.5074 -3.5068 -3.4640 -3.4635 3.6570 3.6574 4.1080 4.1149 4.5174 4.5283 4.6857 4.6901 4.8117 4.8123 4.9326 4.9330 7.8478 7.8489 8.8277 8.8287 9.2323 9.2331 9.6177 9.6201 9.7264 9.7277 k = 0.0000 0.5790 0.0897 ( 5212 PWs) bands (ev): -22.0587 -22.0587 -22.0005 -22.0005 -21.1919 -21.1919 -21.1894 -21.1894 -6.9660 -6.9650 -6.7595 -6.7557 -6.3384 -6.3366 -6.0991 -6.0860 -6.0639 -6.0613 -5.8604 -5.8479 -5.7649 -5.7533 -5.6695 -5.6648 -5.3138 -5.3130 -5.1977 -5.1972 -5.0952 -5.0941 -5.0338 -5.0319 -3.5038 -3.5031 -3.4614 -3.4608 3.6556 3.6562 4.0891 4.0971 4.5112 4.5235 4.6761 4.6813 4.8112 4.8123 4.9405 4.9410 7.8725 7.8739 8.8165 8.8177 9.2446 9.2455 9.6384 9.6412 9.7486 9.7520 k = 0.0000 0.5790 0.1076 ( 5214 PWs) bands (ev): -22.0578 -22.0578 -22.0013 -22.0013 -21.1918 -21.1918 -21.1894 -21.1894 -6.9607 -6.9594 -6.7606 -6.7561 -6.3377 -6.3356 -6.1062 -6.0922 -6.0636 -6.0596 -5.8582 -5.8451 -5.7702 -5.7575 -5.6715 -5.6658 -5.3126 -5.3116 -5.2013 -5.2009 -5.0929 -5.0915 -5.0346 -5.0323 -3.4996 -3.4987 -3.4584 -3.4577 3.6540 3.6547 4.0672 4.0758 4.5050 4.5182 4.6661 4.6720 4.8108 4.8125 4.9479 4.9485 7.9023 7.9039 8.8074 8.8087 9.2599 9.2608 9.6637 9.6667 9.7727 9.7776 k = 0.0000 0.5790 0.1256 ( 5220 PWs) bands (ev): -22.0569 -22.0569 -22.0024 -22.0024 -21.1918 -21.1918 -21.1895 -21.1895 -6.9544 -6.9529 -6.7619 -6.7567 -6.3367 -6.3343 -6.1141 -6.0999 -6.0629 -6.0572 -5.8560 -5.8437 -5.7748 -5.7622 -5.6737 -5.6672 -5.3111 -5.3099 -5.2053 -5.2049 -5.0905 -5.0888 -5.0355 -5.0329 -3.4947 -3.4937 -3.4550 -3.4541 3.6520 3.6530 4.0425 4.0516 4.4992 4.5128 4.6561 4.6622 4.8108 4.8129 4.9543 4.9549 7.9369 7.9387 8.8014 8.8028 9.2781 9.2790 9.6933 9.6963 9.8002 9.8063 k = 0.0000 0.5790 0.1435 ( 5214 PWs) bands (ev): -22.0557 -22.0557 -22.0035 -22.0035 -21.1917 -21.1917 -21.1895 -21.1895 -6.9474 -6.9456 -6.7634 -6.7576 -6.3355 -6.3327 -6.1227 -6.1086 -6.0617 -6.0544 -5.8542 -5.8443 -5.7781 -5.7670 -5.6762 -5.6687 -5.3095 -5.3081 -5.2095 -5.2092 -5.0879 -5.0860 -5.0364 -5.0335 -3.4893 -3.4881 -3.4512 -3.4502 3.6498 3.6510 4.0157 4.0249 4.4940 4.5075 4.6461 4.6523 4.8111 4.8136 4.9593 4.9598 7.9759 7.9780 8.7990 8.8006 9.2994 9.3002 9.7267 9.7295 9.8313 9.8386 k = 0.0000 0.5790 0.1615 ( 5218 PWs) bands (ev): -22.0545 -22.0545 -22.0048 -22.0048 -21.1917 -21.1917 -21.1896 -21.1896 -6.9397 -6.9377 -6.7650 -6.7587 -6.3340 -6.3308 -6.1319 -6.1182 -6.0600 -6.0510 -5.8534 -5.8477 -5.7793 -5.7713 -5.6789 -5.6706 -5.3077 -5.3060 -5.2139 -5.2137 -5.0853 -5.0831 -5.0375 -5.0343 -3.4835 -3.4822 -3.4472 -3.4462 3.6474 3.6488 3.9873 3.9965 4.4897 4.5027 4.6363 4.6424 4.8118 4.8146 4.9625 4.9629 8.0191 8.0213 8.8006 8.8023 9.3236 9.3243 9.7637 9.7658 9.8657 9.8744 k = 0.0000 0.5790 0.1794 ( 5210 PWs) bands (ev): -22.0531 -22.0531 -22.0062 -22.0062 -21.1916 -21.1916 -21.1896 -21.1896 -6.9314 -6.9290 -6.7669 -6.7602 -6.3320 -6.3286 -6.1416 -6.1285 -6.0579 -6.0471 -5.8540 -5.8537 -5.7784 -5.7746 -5.6819 -5.6727 -5.3057 -5.3039 -5.2184 -5.2183 -5.0827 -5.0802 -5.0386 -5.0351 -3.4774 -3.4760 -3.4431 -3.4420 3.6449 3.6465 3.9578 3.9668 4.4864 4.4987 4.6267 4.6325 4.8130 4.8160 4.9639 4.9642 8.0661 8.0685 8.8061 8.8078 9.3508 9.3514 9.8035 9.8044 9.9028 9.9129 k = 0.0000 0.5790 0.1974 ( 5208 PWs) bands (ev): -22.0516 -22.0516 -22.0077 -22.0077 -21.1915 -21.1915 -21.1897 -21.1897 -6.9225 -6.9199 -6.7691 -6.7619 -6.3297 -6.3260 -6.1516 -6.1394 -6.0553 -6.0427 -5.8621 -5.8566 -5.7765 -5.7756 -5.6851 -5.6751 -5.3036 -5.3015 -5.2230 -5.2230 -5.0801 -5.0774 -5.0397 -5.0360 -3.4711 -3.4696 -3.4390 -3.4377 3.6423 3.6442 3.9277 3.9365 4.4841 4.4955 4.6174 4.6228 4.8148 4.8179 4.9635 4.9635 8.1165 8.1190 8.8149 8.8167 9.3810 9.3814 9.8428 9.8440 9.9387 9.9495 k = 0.0000 0.5790 0.2153 ( 5208 PWs) bands (ev): -22.0500 -22.0500 -22.0093 -22.0093 -21.1915 -21.1915 -21.1898 -21.1898 -6.9133 -6.9103 -6.7716 -6.7641 -6.3269 -6.3229 -6.1619 -6.1508 -6.0521 -6.0378 -5.8721 -5.8613 -5.7767 -5.7716 -5.6885 -5.6777 -5.3013 -5.2991 -5.2278 -5.2276 -5.0775 -5.0746 -5.0409 -5.0371 -3.4647 -3.4631 -3.4350 -3.4336 3.6400 3.6421 3.8977 3.9060 4.4830 4.4935 4.6083 4.6132 4.8172 4.8203 4.9610 4.9613 8.1699 8.1725 8.8263 8.8281 9.4142 9.4143 9.8731 9.8775 9.9545 9.9564 k = 0.0000 0.5790 0.2332 ( 5210 PWs) bands (ev): -22.0483 -22.0483 -22.0111 -22.0111 -21.1914 -21.1914 -21.1898 -21.1898 -6.9037 -6.9004 -6.7744 -6.7666 -6.3236 -6.3194 -6.1723 -6.1624 -6.0485 -6.0324 -5.8833 -5.8680 -5.7754 -5.7668 -5.6922 -5.6806 -5.2990 -5.2966 -5.2326 -5.2321 -5.0750 -5.0719 -5.0422 -5.0381 -3.4583 -3.4566 -3.4311 -3.4297 3.6380 3.6403 3.8680 3.8760 4.4831 4.4926 4.5995 4.6038 4.8202 4.8233 4.9569 4.9574 8.2260 8.2286 8.8393 8.8410 9.4500 9.4501 9.8746 9.8791 9.9677 9.9713 k = 0.0000 0.5790 0.2512 ( 5208 PWs) bands (ev): -22.0465 -22.0465 -22.0129 -22.0129 -21.1913 -21.1913 -21.1899 -21.1899 -6.8939 -6.8903 -6.7776 -6.7697 -6.3197 -6.3154 -6.1829 -6.1742 -6.0442 -6.0265 -5.8951 -5.8762 -5.7726 -5.7616 -5.6960 -5.6838 -5.2964 -5.2939 -5.2373 -5.2366 -5.0726 -5.0692 -5.0435 -5.0393 -3.4521 -3.4503 -3.4275 -3.4260 3.6365 3.6391 3.8392 3.8468 4.4843 4.4928 4.5908 4.5946 4.8238 4.8270 4.9512 4.9520 8.2841 8.2867 8.8523 8.8540 9.4883 9.4887 9.8495 9.8527 9.9931 10.0054 k = 0.0000 0.5790 0.2691 ( 5210 PWs) bands (ev): -22.0446 -22.0446 -22.0148 -22.0148 -21.1912 -21.1912 -21.1900 -21.1900 -6.8841 -6.8800 -6.7812 -6.7732 -6.3152 -6.3109 -6.1935 -6.1861 -6.0394 -6.0201 -5.9073 -5.8857 -5.7689 -5.7560 -5.7001 -5.6872 -5.2938 -5.2911 -5.2420 -5.2411 -5.0702 -5.0667 -5.0449 -5.0406 -3.4461 -3.4443 -3.4243 -3.4227 3.6358 3.6387 3.8116 3.8188 4.4866 4.4941 4.5823 4.5855 4.8282 4.8314 4.9442 4.9453 8.3439 8.3465 8.8637 8.8651 9.5292 9.5297 9.8175 9.8203 10.0070 10.0262 k = 0.0000 0.5790 0.2871 ( 5208 PWs) bands (ev): -22.0426 -22.0426 -22.0168 -22.0168 -21.1912 -21.1912 -21.1901 -21.1901 -6.8742 -6.8698 -6.7853 -6.7772 -6.3100 -6.3058 -6.2041 -6.1981 -6.0340 -6.0131 -5.9196 -5.8959 -5.7646 -5.7504 -5.7044 -5.6908 -5.2910 -5.2883 -5.2465 -5.2454 -5.0679 -5.0642 -5.0463 -5.0419 -3.4404 -3.4385 -3.4215 -3.4198 3.6361 3.6393 3.7855 3.7924 4.4900 4.4965 4.5740 4.5765 4.8333 4.8364 4.9361 4.9375 8.4048 8.4073 8.8714 8.8725 9.5722 9.5730 9.7873 9.7901 9.9996 10.0172 k = 0.0000 0.5790 0.3050 ( 5212 PWs) bands (ev): -22.0406 -22.0406 -22.0189 -22.0189 -21.1911 -21.1911 -21.1902 -21.1902 -6.8645 -6.8597 -6.7899 -6.7819 -6.3041 -6.3001 -6.2146 -6.2099 -6.0279 -6.0056 -5.9319 -5.9066 -5.7598 -5.7447 -5.7089 -5.6947 -5.2881 -5.2853 -5.2510 -5.2496 -5.0657 -5.0618 -5.0478 -5.0433 -3.4352 -3.4333 -3.4193 -3.4176 3.6377 3.6412 3.7612 3.7677 4.4943 4.4999 4.5659 4.5677 4.8392 4.8422 4.9273 4.9289 8.4661 8.4684 8.8730 8.8738 9.6171 9.6180 9.7630 9.7661 9.9771 9.9909 k = 0.0000 0.5790 0.3229 ( 5214 PWs) bands (ev): -22.0385 -22.0385 -22.0210 -22.0210 -21.1910 -21.1910 -21.1902 -21.1902 -6.8550 -6.8498 -6.7950 -6.7871 -6.2976 -6.2939 -6.2249 -6.2215 -6.0212 -5.9976 -5.9439 -5.9175 -5.7547 -5.7391 -5.7135 -5.6989 -5.2850 -5.2823 -5.2553 -5.2538 -5.0636 -5.0596 -5.0493 -5.0448 -3.4305 -3.4286 -3.4177 -3.4159 3.6408 3.6446 3.7389 3.7451 4.4995 4.5042 4.5579 4.5591 4.8458 4.8488 4.9178 4.9197 8.5270 8.5293 8.8668 8.8672 9.6632 9.6640 9.7473 9.7508 9.9473 9.9582 k = 0.0000 0.5790 0.3409 ( 5212 PWs) bands (ev): -22.0364 -22.0364 -22.0232 -22.0232 -21.1909 -21.1909 -21.1903 -21.1903 -6.8458 -6.8402 -6.8006 -6.7929 -6.2903 -6.2870 -6.2349 -6.2329 -6.0138 -5.9890 -5.9556 -5.9285 -5.7495 -5.7335 -5.7184 -5.7032 -5.2818 -5.2791 -5.2596 -5.2577 -5.0616 -5.0574 -5.0508 -5.0463 -3.4264 -3.4245 -3.4168 -3.4149 3.6456 3.6497 3.7188 3.7246 4.5054 4.5092 4.5500 4.5506 4.8531 4.8560 4.9081 4.9102 8.5868 8.5889 8.8512 8.8513 9.7088 9.7092 9.7420 9.7458 9.9162 9.9248 k = 0.0000 0.5790 0.3588 ( 5218 PWs) bands (ev): -22.0342 -22.0342 -22.0253 -22.0253 -21.1908 -21.1908 -21.1904 -21.1904 -6.8370 -6.8310 -6.8068 -6.7993 -6.2823 -6.2796 -6.2447 -6.2438 -6.0057 -5.9800 -5.9668 -5.9394 -5.7442 -5.7280 -5.7233 -5.7078 -5.2785 -5.2759 -5.2636 -5.2616 -5.0596 -5.0553 -5.0525 -5.0480 -3.4230 -3.4210 -3.4165 -3.4146 3.6523 3.6567 3.7009 3.7064 4.5119 4.5149 4.5423 4.5424 4.8611 4.8639 4.8982 4.9005 8.6444 8.6462 8.8255 8.8260 9.7419 9.7460 9.7543 9.7550 9.8909 9.8971 k = 0.0000 0.5790 0.3768 ( 5212 PWs) bands (ev): -22.0320 -22.0320 -22.0275 -22.0275 -21.1907 -21.1907 -21.1905 -21.1905 -6.8287 -6.8222 -6.8135 -6.8064 -6.2736 -6.2716 -6.2543 -6.2541 -5.9970 -5.9774 -5.9704 -5.9501 -5.7389 -5.7284 -5.7227 -5.7126 -5.2750 -5.2725 -5.2676 -5.2653 -5.0577 -5.0542 -5.0534 -5.0497 -3.4202 -3.4183 -3.4170 -3.4151 3.6611 3.6657 3.6853 3.6905 4.5189 4.5212 4.5342 4.5350 4.8697 4.8724 4.8884 4.8908 8.6985 8.7001 8.7906 8.7916 9.7558 9.7610 9.7755 9.7781 9.8864 9.8888 k = 0.0000 0.5790 0.3947 ( 5208 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8208 -6.8208 -6.8140 -6.8140 -6.2643 -6.2643 -6.2631 -6.2631 -5.9875 -5.9875 -5.9604 -5.9604 -5.7336 -5.7336 -5.7175 -5.7175 -5.2713 -5.2713 -5.2690 -5.2690 -5.0559 -5.0559 -5.0515 -5.0515 -3.4183 -3.4183 -3.4163 -3.4163 3.6721 3.6721 3.6770 3.6770 4.5264 4.5264 4.5279 4.5279 4.8789 4.8789 4.8814 4.8814 8.7478 8.7478 8.7491 8.7491 9.7709 9.7709 9.7758 9.7758 9.9139 9.9141 k = 0.0000 0.5790 0.3947 ( 5208 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8208 -6.8208 -6.8140 -6.8140 -6.2643 -6.2643 -6.2631 -6.2631 -5.9875 -5.9875 -5.9604 -5.9604 -5.7336 -5.7336 -5.7175 -5.7175 -5.2713 -5.2713 -5.2690 -5.2690 -5.0559 -5.0559 -5.0515 -5.0515 -3.4183 -3.4183 -3.4163 -3.4163 3.6721 3.6721 3.6770 3.6770 4.5264 4.5264 4.5279 4.5279 4.8789 4.8789 4.8814 4.8814 8.7478 8.7478 8.7491 8.7491 9.7709 9.7709 9.7758 9.7758 9.9139 9.9142 k = 0.0185 0.5790 0.3947 ( 5210 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8216 -6.8216 -6.8132 -6.8132 -6.2692 -6.2692 -6.2587 -6.2587 -5.9880 -5.9880 -5.9593 -5.9593 -5.7344 -5.7344 -5.7170 -5.7170 -5.2759 -5.2759 -5.2640 -5.2640 -5.0562 -5.0562 -5.0515 -5.0515 -3.4204 -3.4204 -3.4139 -3.4139 3.6691 3.6691 3.6816 3.6816 4.5204 4.5204 4.5330 4.5330 4.8775 4.8775 4.8813 4.8813 8.7470 8.7470 8.7529 8.7529 9.7687 9.7687 9.7739 9.7739 9.9149 9.9149 k = 0.0369 0.5790 0.3947 ( 5212 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8235 -6.8235 -6.8115 -6.8115 -6.2752 -6.2752 -6.2543 -6.2543 -5.9891 -5.9891 -5.9562 -5.9562 -5.7367 -5.7367 -5.7157 -5.7157 -5.2811 -5.2811 -5.2577 -5.2577 -5.0570 -5.0570 -5.0518 -5.0518 -3.4229 -3.4229 -3.4104 -3.4104 3.6661 3.6661 3.6895 3.6895 4.5127 4.5127 4.5380 4.5380 4.8741 4.8741 4.8804 4.8804 8.7486 8.7486 8.7604 8.7604 9.7625 9.7625 9.7686 9.7686 9.9191 9.9191 k = 0.0554 0.5790 0.3947 ( 5202 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8257 -6.8257 -6.8095 -6.8095 -6.2815 -6.2815 -6.2505 -6.2505 -5.9906 -5.9906 -5.9514 -5.9514 -5.7398 -5.7398 -5.7140 -5.7140 -5.2860 -5.2860 -5.2510 -5.2510 -5.0583 -5.0583 -5.0524 -5.0524 -3.4251 -3.4251 -3.4066 -3.4066 3.6643 3.6643 3.6992 3.6992 4.5040 4.5040 4.5425 4.5425 4.8689 4.8689 4.8784 4.8784 8.7531 8.7531 8.7707 8.7707 9.7535 9.7535 9.7606 9.7606 9.9260 9.9260 k = 0.0739 0.5790 0.3947 ( 5200 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8281 -6.8281 -6.8075 -6.8075 -6.2881 -6.2881 -6.2473 -6.2473 -5.9920 -5.9920 -5.9456 -5.9456 -5.7436 -5.7436 -5.7122 -5.7122 -5.2905 -5.2905 -5.2440 -5.2440 -5.0599 -5.0599 -5.0533 -5.0533 -3.4269 -3.4269 -3.4026 -3.4026 3.6640 3.6640 3.7105 3.7105 4.4940 4.4940 4.5465 4.5465 4.8622 4.8622 4.8754 4.8754 8.7602 8.7602 8.7838 8.7838 9.7426 9.7426 9.7510 9.7510 9.9347 9.9347 k = 0.0923 0.5790 0.3947 ( 5208 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8305 -6.8305 -6.8055 -6.8055 -6.2949 -6.2949 -6.2447 -6.2447 -5.9932 -5.9932 -5.9390 -5.9390 -5.7478 -5.7478 -5.7106 -5.7106 -5.2946 -5.2946 -5.2367 -5.2367 -5.0617 -5.0617 -5.0547 -5.0547 -3.4284 -3.4284 -3.3984 -3.3984 3.6649 3.6649 3.7234 3.7234 4.4829 4.4829 4.5503 4.5503 4.8538 4.8538 4.8715 4.8715 8.7695 8.7695 8.7993 8.7993 9.7308 9.7308 9.7405 9.7405 9.9445 9.9445 k = 0.1108 0.5790 0.3947 ( 5202 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8328 -6.8328 -6.8036 -6.8036 -6.3018 -6.3018 -6.2427 -6.2427 -5.9941 -5.9941 -5.9317 -5.9317 -5.7524 -5.7524 -5.7090 -5.7090 -5.2983 -5.2983 -5.2291 -5.2291 -5.0638 -5.0638 -5.0565 -5.0565 -3.4295 -3.4295 -3.3942 -3.3942 3.6670 3.6670 3.7376 3.7376 4.4707 4.4707 4.5541 4.5541 4.8438 4.8438 4.8670 4.8670 8.7808 8.7808 8.8167 8.8167 9.7188 9.7188 9.7298 9.7298 9.9551 9.9551 k = 0.1293 0.5790 0.3947 ( 5194 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1907 -21.1907 -21.1906 -21.1906 -6.8351 -6.8351 -6.8018 -6.8018 -6.3086 -6.3086 -6.2411 -6.2411 -5.9948 -5.9948 -5.9241 -5.9241 -5.7571 -5.7571 -5.7077 -5.7077 -5.3016 -5.3016 -5.2213 -5.2213 -5.0659 -5.0659 -5.0587 -5.0587 -3.4302 -3.4302 -3.3898 -3.3898 3.6699 3.6699 3.7530 3.7530 4.4574 4.4574 4.5581 4.5581 4.8325 4.8325 4.8620 4.8620 8.7935 8.7935 8.8358 8.8358 9.7069 9.7069 9.7195 9.7195 9.9664 9.9664 k = 0.1477 0.5790 0.3947 ( 5196 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1907 -21.1907 -21.1907 -21.1907 -6.8373 -6.8373 -6.8002 -6.8002 -6.3153 -6.3153 -6.2400 -6.2400 -5.9952 -5.9952 -5.9161 -5.9161 -5.7621 -5.7621 -5.7065 -5.7065 -5.3046 -5.3046 -5.2133 -5.2133 -5.0682 -5.0682 -5.0614 -5.0614 -3.4307 -3.4307 -3.3855 -3.3855 3.6737 3.6737 3.7694 3.7694 4.4432 4.4432 4.5624 4.5624 4.8199 4.8199 4.8567 4.8567 8.8072 8.8072 8.8557 8.8557 9.6956 9.6956 9.7098 9.7098 9.9784 9.9784 k = 0.1662 0.5790 0.3947 ( 5202 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8394 -6.8394 -6.7987 -6.7987 -6.3217 -6.3217 -6.2393 -6.2393 -5.9955 -5.9955 -5.9081 -5.9081 -5.7672 -5.7672 -5.7055 -5.7055 -5.3072 -5.3072 -5.2053 -5.2053 -5.0707 -5.0707 -5.0643 -5.0643 -3.4308 -3.4308 -3.3813 -3.3813 3.6780 3.6780 3.7866 3.7866 4.4282 4.4282 4.5672 4.5672 4.8060 4.8060 4.8513 4.8513 8.8211 8.8211 8.8761 8.8761 9.6851 9.6851 9.7009 9.7009 9.9916 9.9916 k = 0.1847 0.5790 0.3947 ( 5202 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8414 -6.8414 -6.7973 -6.7973 -6.3278 -6.3278 -6.2389 -6.2389 -5.9956 -5.9956 -5.9002 -5.9002 -5.7723 -5.7723 -5.7047 -5.7047 -5.3095 -5.3095 -5.1972 -5.1972 -5.0734 -5.0734 -5.0674 -5.0674 -3.4306 -3.4306 -3.3773 -3.3773 3.6827 3.6827 3.8041 3.8041 4.4127 4.4127 4.5728 4.5728 4.7913 4.7913 4.8459 4.8459 8.8349 8.8349 8.8961 8.8961 9.6757 9.6757 9.6930 9.6930 10.0062 10.0062 k = 0.2031 0.5790 0.3947 ( 5208 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8431 -6.8431 -6.7962 -6.7962 -6.3333 -6.3333 -6.2388 -6.2388 -5.9955 -5.9955 -5.8924 -5.8924 -5.7774 -5.7774 -5.7040 -5.7040 -5.3115 -5.3115 -5.1891 -5.1891 -5.0767 -5.0767 -5.0703 -5.0703 -3.4303 -3.4303 -3.3734 -3.3734 3.6874 3.6874 3.8217 3.8217 4.3971 4.3971 4.5792 4.5792 4.7758 4.7758 4.8408 4.8408 8.8479 8.8479 8.9152 8.9152 9.6675 9.6675 9.6861 9.6861 10.0226 10.0226 k = 0.2216 0.5790 0.3947 ( 5202 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8447 -6.8447 -6.7951 -6.7951 -6.3384 -6.3384 -6.2388 -6.2388 -5.9954 -5.9954 -5.8851 -5.8851 -5.7823 -5.7823 -5.7034 -5.7034 -5.3131 -5.3131 -5.1811 -5.1811 -5.0805 -5.0805 -5.0728 -5.0728 -3.4297 -3.4297 -3.3699 -3.3699 3.6920 3.6920 3.8388 3.8388 4.3817 4.3817 4.5866 4.5866 4.7597 4.7597 4.8361 4.8361 8.8597 8.8597 8.9327 8.9327 9.6605 9.6605 9.6804 9.6804 10.0412 10.0412 k = 0.2401 0.5790 0.3947 ( 5190 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8461 -6.8461 -6.7943 -6.7943 -6.3427 -6.3427 -6.2390 -6.2390 -5.9953 -5.9953 -5.8783 -5.8783 -5.7869 -5.7869 -5.7029 -5.7029 -5.3145 -5.3145 -5.1733 -5.1733 -5.0850 -5.0850 -5.0747 -5.0747 -3.4291 -3.4291 -3.3667 -3.3667 3.6963 3.6963 3.8549 3.8549 4.3672 4.3672 4.5951 4.5951 4.7434 4.7434 4.8319 4.8319 8.8698 8.8698 8.9479 8.9479 9.6549 9.6549 9.6756 9.6756 10.0620 10.0621 k = 0.2585 0.5790 0.3947 ( 5190 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8473 -6.8473 -6.7936 -6.7936 -6.3465 -6.3465 -6.2392 -6.2392 -5.9951 -5.9951 -5.8722 -5.8722 -5.7912 -5.7912 -5.7025 -5.7025 -5.3156 -5.3156 -5.1660 -5.1660 -5.0897 -5.0897 -5.0763 -5.0763 -3.4284 -3.4284 -3.3639 -3.3639 3.7001 3.7001 3.8694 3.8694 4.3540 4.3540 4.6046 4.6046 4.7271 4.7271 4.8284 4.8284 8.8780 8.8780 8.9606 8.9606 9.6505 9.6505 9.6720 9.6720 10.0852 10.0854 k = 0.2770 0.5790 0.3947 ( 5184 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8482 -6.8482 -6.7931 -6.7931 -6.3494 -6.3494 -6.2395 -6.2395 -5.9950 -5.9950 -5.8672 -5.8672 -5.7947 -5.7947 -5.7021 -5.7021 -5.3164 -5.3164 -5.1593 -5.1593 -5.0944 -5.0944 -5.0774 -5.0774 -3.4277 -3.4277 -3.3616 -3.3616 3.7032 3.7032 3.8816 3.8816 4.3428 4.3428 4.6149 4.6149 4.7112 4.7112 4.8256 4.8256 8.8841 8.8841 8.9703 8.9703 9.6474 9.6474 9.6693 9.6693 10.1104 10.1108 k = 0.2955 0.5790 0.3947 ( 5180 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8488 -6.8488 -6.7927 -6.7927 -6.3516 -6.3516 -6.2397 -6.2397 -5.9949 -5.9949 -5.8635 -5.8635 -5.7974 -5.7974 -5.7019 -5.7019 -5.3171 -5.3171 -5.1536 -5.1536 -5.0987 -5.0987 -5.0783 -5.0783 -3.4271 -3.4271 -3.3599 -3.3599 3.7054 3.7054 3.8908 3.8908 4.3344 4.3344 4.6256 4.6256 4.6966 4.6966 4.8235 4.8235 8.8881 8.8881 8.9770 8.9770 9.6452 9.6452 9.6674 9.6674 10.1370 10.1370 k = 0.3139 0.5790 0.3947 ( 5170 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8492 -6.8492 -6.7925 -6.7925 -6.3529 -6.3529 -6.2398 -6.2398 -5.9948 -5.9948 -5.8611 -5.8611 -5.7992 -5.7992 -5.7017 -5.7017 -5.3174 -5.3174 -5.1496 -5.1496 -5.1019 -5.1019 -5.0788 -5.0788 -3.4267 -3.4267 -3.3587 -3.3587 3.7068 3.7068 3.8965 3.8965 4.3290 4.3290 4.6349 4.6349 4.6848 4.6848 4.8223 4.8223 8.8903 8.8903 8.9807 8.9807 9.6439 9.6439 9.6662 9.6662 10.1619 10.1619 k = 0.3324 0.5790 0.3947 ( 5174 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8494 -6.8494 -6.7924 -6.7924 -6.3534 -6.3534 -6.2399 -6.2399 -5.9948 -5.9948 -5.8603 -5.8603 -5.7998 -5.7998 -5.7016 -5.7016 -5.3176 -5.3176 -5.1479 -5.1479 -5.1033 -5.1033 -5.0790 -5.0790 -3.4265 -3.4265 -3.3583 -3.3583 3.7072 3.7072 3.8983 3.8983 4.3273 4.3273 4.6384 4.6384 4.6806 4.6806 4.8220 4.8220 8.8910 8.8910 8.9819 8.9819 9.6430 9.6430 9.6653 9.6653 10.1751 10.1751 k = 0.3324 0.5790 0.3947 ( 5174 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8494 -6.8494 -6.7924 -6.7924 -6.3534 -6.3534 -6.2399 -6.2399 -5.9948 -5.9948 -5.8603 -5.8603 -5.7998 -5.7998 -5.7016 -5.7016 -5.3176 -5.3176 -5.1479 -5.1479 -5.1033 -5.1033 -5.0790 -5.0790 -3.4265 -3.4265 -3.3583 -3.3583 3.7072 3.7072 3.8983 3.8983 4.3273 4.3273 4.6384 4.6384 4.6806 4.6806 4.8220 4.8220 8.8910 8.8910 8.9819 8.9819 9.6430 9.6430 9.6653 9.6653 10.1751 10.1751 k = 0.3232 0.5629 0.3947 ( 5178 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1908 -21.1908 -21.1907 -21.1907 -6.8492 -6.8492 -6.7925 -6.7925 -6.3529 -6.3529 -6.2399 -6.2399 -5.9948 -5.9948 -5.8611 -5.8611 -5.7991 -5.7991 -5.7018 -5.7018 -5.3174 -5.3174 -5.1499 -5.1499 -5.1016 -5.1016 -5.0787 -5.0787 -3.4267 -3.4267 -3.3588 -3.3588 3.7069 3.7069 3.8966 3.8966 4.3290 4.3290 4.6360 4.6360 4.6837 4.6837 4.8223 4.8223 8.8906 8.8906 8.9810 8.9810 9.6445 9.6445 9.6669 9.6669 10.1583 10.1585 k = 0.3139 0.5468 0.3947 ( 5186 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1908 -21.1908 -21.1907 -21.1907 -6.8488 -6.8488 -6.7927 -6.7927 -6.3515 -6.3515 -6.2397 -6.2397 -5.9948 -5.9948 -5.8631 -5.8631 -5.7978 -5.7978 -5.7021 -5.7021 -5.3170 -5.3170 -5.1540 -5.1540 -5.0983 -5.0983 -5.0782 -5.0782 -3.4274 -3.4274 -3.3602 -3.3602 3.7056 3.7056 3.8912 3.8912 4.3341 4.3341 4.6267 4.6267 4.6953 4.6953 4.8234 4.8234 8.8898 8.8898 8.9788 8.9788 9.6457 9.6457 9.6681 9.6681 10.1276 10.1277 k = 0.3047 0.5307 0.3947 ( 5186 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8481 -6.8481 -6.7930 -6.7930 -6.3491 -6.3491 -6.2392 -6.2392 -5.9949 -5.9949 -5.8659 -5.8659 -5.7961 -5.7961 -5.7025 -5.7025 -5.3163 -5.3163 -5.1596 -5.1596 -5.0940 -5.0940 -5.0774 -5.0774 -3.4285 -3.4285 -3.3623 -3.3623 3.7034 3.7034 3.8825 3.8825 4.3421 4.3421 4.6153 4.6153 4.7104 4.7104 4.8252 4.8252 8.8890 8.8890 8.9759 8.9759 9.6462 9.6462 9.6685 9.6685 10.0939 10.0939 k = 0.2955 0.5147 0.3947 ( 5190 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8472 -6.8472 -6.7934 -6.7934 -6.3458 -6.3458 -6.2385 -6.2385 -5.9949 -5.9949 -5.8691 -5.8691 -5.7943 -5.7943 -5.7030 -5.7030 -5.3154 -5.3154 -5.1660 -5.1660 -5.0894 -5.0894 -5.0763 -5.0763 -3.4301 -3.4301 -3.3654 -3.3654 3.7005 3.7005 3.8713 3.8713 4.3521 4.3521 4.6037 4.6037 4.7268 4.7268 4.8278 4.8278 8.8888 8.8888 8.9728 8.9728 9.6456 9.6456 9.6675 9.6675 10.0593 10.0593 k = 0.2862 0.4986 0.3947 ( 5192 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8460 -6.8460 -6.7939 -6.7939 -6.3415 -6.3415 -6.2374 -6.2374 -5.9949 -5.9949 -5.8727 -5.8727 -5.7927 -5.7927 -5.7038 -5.7038 -5.3142 -5.3142 -5.1729 -5.1729 -5.0849 -5.0849 -5.0748 -5.0748 -3.4323 -3.4323 -3.3693 -3.3693 3.6971 3.6971 3.8582 3.8582 4.3636 4.3636 4.5926 4.5926 4.7436 4.7436 4.8308 4.8308 8.8895 8.8895 8.9702 8.9702 9.6433 9.6433 9.6647 9.6647 10.0245 10.0245 k = 0.2770 0.4825 0.3947 ( 5194 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8445 -6.8445 -6.7945 -6.7945 -6.3363 -6.3363 -6.2360 -6.2360 -5.9949 -5.9949 -5.8764 -5.8764 -5.7913 -5.7913 -5.7047 -5.7047 -5.3128 -5.3128 -5.1798 -5.1798 -5.0808 -5.0808 -5.0730 -5.0730 -3.4351 -3.4351 -3.3741 -3.3741 3.6933 3.6933 3.8440 3.8440 4.3758 4.3758 4.5820 4.5820 4.7603 4.7603 4.8343 4.8343 8.8917 8.8917 8.9685 8.9685 9.6391 9.6391 9.6596 9.6596 9.9893 9.9893 k = 0.2678 0.4664 0.3947 ( 5196 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8429 -6.8429 -6.7950 -6.7950 -6.3302 -6.3302 -6.2342 -6.2342 -5.9948 -5.9948 -5.8801 -5.8801 -5.7904 -5.7904 -5.7059 -5.7059 -5.3110 -5.3110 -5.1868 -5.1868 -5.0774 -5.0774 -5.0707 -5.0707 -3.4386 -3.4386 -3.3799 -3.3799 3.6893 3.6893 3.8293 3.8293 4.3882 4.3882 4.5721 4.5721 4.7766 4.7766 4.8381 4.8381 8.8956 8.8956 8.9683 8.9683 9.6324 9.6324 9.6518 9.6518 9.9537 9.9537 k = 0.2585 0.4503 0.3947 ( 5204 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1907 -21.1907 -21.1906 -21.1906 -6.8411 -6.8411 -6.7957 -6.7957 -6.3232 -6.3232 -6.2320 -6.2320 -5.9947 -5.9947 -5.8838 -5.8838 -5.7898 -5.7898 -5.7074 -5.7074 -5.3089 -5.3089 -5.1936 -5.1936 -5.0748 -5.0748 -5.0679 -5.0679 -3.4428 -3.4428 -3.3867 -3.3867 3.6855 3.6855 3.8146 3.8146 4.4003 4.4003 4.5628 4.5628 4.7921 4.7921 4.8420 4.8420 8.9016 8.9016 8.9698 8.9698 9.6229 9.6229 9.6411 9.6411 9.9175 9.9175 k = 0.2493 0.4342 0.3947 ( 5204 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8390 -6.8390 -6.7963 -6.7963 -6.3153 -6.3153 -6.2293 -6.2293 -5.9944 -5.9944 -5.8873 -5.8873 -5.7898 -5.7898 -5.7092 -5.7092 -5.3066 -5.3066 -5.2001 -5.2001 -5.0728 -5.0728 -5.0649 -5.0649 -3.4478 -3.4478 -3.3944 -3.3944 3.6819 3.6819 3.8005 3.8005 4.4116 4.4116 4.5540 4.5540 4.8065 4.8065 4.8457 4.8457 8.9097 8.9097 8.9734 8.9734 9.6103 9.6103 9.6271 9.6271 9.8807 9.8807 k = 0.2401 0.4182 0.3947 ( 5216 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8369 -6.8369 -6.7969 -6.7969 -6.3066 -6.3066 -6.2261 -6.2261 -5.9941 -5.9941 -5.8908 -5.8908 -5.7902 -5.7902 -5.7113 -5.7113 -5.3039 -5.3039 -5.2063 -5.2063 -5.0712 -5.0712 -5.0620 -5.0620 -3.4536 -3.4536 -3.4031 -3.4031 3.6789 3.6789 3.7872 3.7872 4.4219 4.4219 4.5457 4.5457 4.8196 4.8196 4.8493 4.8493 8.9202 8.9202 8.9791 8.9791 9.5941 9.5941 9.6095 9.6095 9.8433 9.8433 k = 0.2308 0.4021 0.3947 ( 5216 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8347 -6.8347 -6.7975 -6.7975 -6.2972 -6.2972 -6.2224 -6.2224 -5.9937 -5.9937 -5.8940 -5.8940 -5.7910 -5.7910 -5.7138 -5.7138 -5.3008 -5.3008 -5.2121 -5.2121 -5.0697 -5.0697 -5.0594 -5.0594 -3.4602 -3.4602 -3.4127 -3.4127 3.6767 3.6767 3.7751 3.7751 4.4310 4.4310 4.5376 4.5376 4.8311 4.8311 4.8524 4.8524 8.9328 8.9328 8.9872 8.9872 9.5739 9.5739 9.5879 9.5879 9.8058 9.8058 k = 0.2216 0.3860 0.3947 ( 5216 PWs) bands (ev): -22.0300 -22.0300 -22.0300 -22.0300 -21.1905 -21.1905 -21.1905 -21.1905 -6.8323 -6.8323 -6.7981 -6.7981 -6.2871 -6.2871 -6.2181 -6.2181 -5.9931 -5.9931 -5.8971 -5.8971 -5.7923 -5.7923 -5.7167 -5.7167 -5.2975 -5.2975 -5.2173 -5.2173 -5.0685 -5.0685 -5.0572 -5.0572 -3.4675 -3.4675 -3.4233 -3.4233 3.6754 3.6754 3.7645 3.7645 4.4386 4.4386 4.5298 4.5298 4.8409 4.8409 4.8549 4.8549 8.9475 8.9475 8.9973 8.9973 9.5492 9.5492 9.5616 9.5616 9.7689 9.7689 k = 0.2124 0.3699 0.3947 ( 5220 PWs) bands (ev): -22.0301 -22.0301 -22.0301 -22.0301 -21.1904 -21.1904 -21.1904 -21.1904 -6.8299 -6.8299 -6.7987 -6.7987 -6.2764 -6.2764 -6.2133 -6.2133 -5.9924 -5.9924 -5.9000 -5.9000 -5.7940 -5.7940 -5.7201 -5.7201 -5.2938 -5.2938 -5.2219 -5.2219 -5.0674 -5.0674 -5.0554 -5.0554 -3.4757 -3.4757 -3.4347 -3.4347 3.6752 3.6752 3.7556 3.7556 4.4447 4.4447 4.5221 4.5221 4.8487 4.8487 4.8569 4.8569 8.9637 8.9637 9.0092 9.0092 9.5197 9.5197 9.5303 9.5303 9.7336 9.7336 k = 0.2031 0.3538 0.3947 ( 5220 PWs) bands (ev): -22.0302 -22.0302 -22.0302 -22.0302 -21.1904 -21.1904 -21.1903 -21.1903 -6.8275 -6.8275 -6.7992 -6.7992 -6.2651 -6.2651 -6.2080 -6.2080 -5.9915 -5.9915 -5.9027 -5.9027 -5.7960 -5.7960 -5.7239 -5.7239 -5.2897 -5.2897 -5.2260 -5.2260 -5.0666 -5.0666 -5.0540 -5.0540 -3.4847 -3.4847 -3.4469 -3.4469 3.6763 3.6763 3.7486 3.7486 4.4493 4.4493 4.5144 4.5144 4.8539 4.8539 4.8585 4.8585 8.9810 8.9810 9.0224 9.0224 9.4855 9.4855 9.4941 9.4941 9.7011 9.7011 k = 0.1939 0.3377 0.3947 ( 5218 PWs) bands (ev): -22.0303 -22.0303 -22.0303 -22.0303 -21.1903 -21.1903 -21.1903 -21.1903 -6.8251 -6.8251 -6.7996 -6.7996 -6.2534 -6.2534 -6.2020 -6.2020 -5.9905 -5.9905 -5.9052 -5.9052 -5.7984 -5.7984 -5.7281 -5.7281 -5.2854 -5.2854 -5.2293 -5.2293 -5.0659 -5.0659 -5.0531 -5.0531 -3.4943 -3.4943 -3.4598 -3.4598 3.6789 3.6789 3.7435 3.7435 4.4524 4.4524 4.5067 4.5067 4.8555 4.8555 4.8605 4.8605 8.9983 8.9983 9.0358 9.0358 9.4475 9.4475 9.4540 9.4540 9.6716 9.6716 k = 0.1847 0.3217 0.3947 ( 5218 PWs) bands (ev): -22.0304 -22.0304 -22.0304 -22.0304 -21.1902 -21.1902 -21.1902 -21.1902 -6.8228 -6.8228 -6.8000 -6.8000 -6.2413 -6.2413 -6.1954 -6.1954 -5.9893 -5.9893 -5.9075 -5.9075 -5.8012 -5.8012 -5.7329 -5.7329 -5.2808 -5.2808 -5.2320 -5.2320 -5.0655 -5.0655 -5.0527 -5.0527 -3.5047 -3.5047 -3.4735 -3.4735 3.6830 3.6830 3.7405 3.7405 4.4540 4.4540 4.4989 4.4989 4.8545 4.8545 4.8619 4.8619 9.0141 9.0141 9.0480 9.0480 9.4075 9.4075 9.4121 9.4121 9.6453 9.6453 k = 0.1754 0.3056 0.3947 ( 5226 PWs) bands (ev): -22.0305 -22.0305 -22.0305 -22.0305 -21.1902 -21.1902 -21.1901 -21.1901 -6.8205 -6.8205 -6.8003 -6.8003 -6.2290 -6.2290 -6.1881 -6.1881 -5.9880 -5.9880 -5.9096 -5.9096 -5.8042 -5.8042 -5.7381 -5.7381 -5.2758 -5.2758 -5.2339 -5.2339 -5.0653 -5.0653 -5.0528 -5.0528 -3.5158 -3.5158 -3.4877 -3.4877 3.6887 3.6887 3.7397 3.7397 4.4541 4.4541 4.4910 4.4910 4.8519 4.8519 4.8614 4.8614 9.0264 9.0264 9.0568 9.0568 9.3684 9.3684 9.3717 9.3717 9.6216 9.6216 k = 0.1662 0.2895 0.3947 ( 5224 PWs) bands (ev): -22.0306 -22.0306 -22.0306 -22.0306 -21.1901 -21.1901 -21.1901 -21.1901 -6.8182 -6.8182 -6.8006 -6.8006 -6.2167 -6.2167 -6.1802 -6.1802 -5.9864 -5.9864 -5.9116 -5.9116 -5.8074 -5.8074 -5.7437 -5.7437 -5.2706 -5.2706 -5.2350 -5.2350 -5.0655 -5.0655 -5.0533 -5.0533 -3.5274 -3.5274 -3.5024 -3.5024 3.6960 3.6960 3.7410 3.7410 4.4530 4.4530 4.4830 4.4830 4.8477 4.8477 4.8589 4.8589 9.0320 9.0320 9.0587 9.0587 9.3343 9.3343 9.3370 9.3370 9.6001 9.6001 k = 0.1570 0.2734 0.3947 ( 5234 PWs) bands (ev): -22.0307 -22.0307 -22.0307 -22.0307 -21.1900 -21.1900 -21.1900 -21.1900 -6.8161 -6.8161 -6.8007 -6.8007 -6.2044 -6.2044 -6.1717 -6.1717 -5.9846 -5.9846 -5.9133 -5.9133 -5.8108 -5.8108 -5.7498 -5.7498 -5.2651 -5.2651 -5.2353 -5.2353 -5.0659 -5.0659 -5.0543 -5.0543 -3.5395 -3.5395 -3.5175 -3.5175 3.7050 3.7050 3.7444 3.7444 4.4508 4.4508 4.4750 4.4750 4.8420 4.8420 4.8542 4.8542 9.0273 9.0273 9.0496 9.0496 9.3100 9.3100 9.3122 9.3122 9.5803 9.5803 k = 0.1477 0.2573 0.3947 ( 5234 PWs) bands (ev): -22.0309 -22.0309 -22.0309 -22.0309 -21.1899 -21.1899 -21.1899 -21.1899 -6.8141 -6.8141 -6.8008 -6.8008 -6.1924 -6.1924 -6.1624 -6.1624 -5.9827 -5.9827 -5.9149 -5.9149 -5.8145 -5.8145 -5.7562 -5.7562 -5.2593 -5.2593 -5.2349 -5.2349 -5.0666 -5.0666 -5.0557 -5.0557 -3.5519 -3.5519 -3.5329 -3.5329 3.7156 3.7156 3.7499 3.7499 4.4477 4.4477 4.4671 4.4671 4.8347 4.8347 4.8473 4.8473 9.0099 9.0099 9.0276 9.0276 9.2980 9.2980 9.3003 9.3003 9.5619 9.5619 k = 0.1385 0.2412 0.3947 ( 5230 PWs) bands (ev): -22.0310 -22.0310 -22.0310 -22.0310 -21.1899 -21.1899 -21.1899 -21.1899 -6.8122 -6.8122 -6.8008 -6.8008 -6.1808 -6.1808 -6.1525 -6.1525 -5.9805 -5.9805 -5.9163 -5.9163 -5.8184 -5.8184 -5.7631 -5.7631 -5.2533 -5.2533 -5.2336 -5.2336 -5.0677 -5.0677 -5.0576 -5.0576 -3.5647 -3.5647 -3.5483 -3.5483 3.7277 3.7277 3.7573 3.7573 4.4439 4.4439 4.4593 4.4593 4.8256 4.8256 4.8383 4.8383 8.9810 8.9810 8.9945 8.9945 9.2971 9.2971 9.3002 9.3002 9.5448 9.5448 k = 0.1293 0.2252 0.3947 ( 5242 PWs) bands (ev): -22.0311 -22.0311 -22.0311 -22.0311 -21.1898 -21.1898 -21.1898 -21.1898 -6.8105 -6.8105 -6.8008 -6.8008 -6.1696 -6.1696 -6.1421 -6.1421 -5.9781 -5.9781 -5.9174 -5.9174 -5.8225 -5.8225 -5.7703 -5.7703 -5.2470 -5.2470 -5.2315 -5.2315 -5.0692 -5.0692 -5.0599 -5.0599 -3.5776 -3.5776 -3.5638 -3.5638 3.7413 3.7413 3.7666 3.7666 4.4396 4.4396 4.4519 4.4519 4.8148 4.8148 4.8272 4.8272 8.9443 8.9443 8.9546 8.9546 9.3041 9.3041 9.3079 9.3079 9.5288 9.5288 k = 0.1200 0.2091 0.3947 ( 5242 PWs) bands (ev): -22.0312 -22.0312 -22.0312 -22.0312 -21.1897 -21.1897 -21.1897 -21.1897 -6.8089 -6.8089 -6.8007 -6.8007 -6.1588 -6.1588 -6.1313 -6.1313 -5.9756 -5.9756 -5.9182 -5.9182 -5.8268 -5.8268 -5.7777 -5.7777 -5.2405 -5.2405 -5.2287 -5.2287 -5.0710 -5.0710 -5.0626 -5.0626 -3.5906 -3.5906 -3.5791 -3.5791 3.7561 3.7561 3.7776 3.7776 4.4350 4.4350 4.4451 4.4451 4.8023 4.8023 4.8141 4.8141 8.9034 8.9034 8.9114 8.9114 9.3155 9.3155 9.3197 9.3197 9.5139 9.5139 k = 0.1108 0.1930 0.3947 ( 5254 PWs) bands (ev): -22.0313 -22.0313 -22.0313 -22.0313 -21.1897 -21.1897 -21.1897 -21.1897 -6.8075 -6.8075 -6.8005 -6.8005 -6.1485 -6.1485 -6.1204 -6.1204 -5.9728 -5.9728 -5.9187 -5.9187 -5.8313 -5.8313 -5.7854 -5.7854 -5.2337 -5.2337 -5.2251 -5.2251 -5.0733 -5.0733 -5.0659 -5.0659 -3.6035 -3.6035 -3.5941 -3.5941 3.7720 3.7720 3.7901 3.7901 4.4305 4.4305 4.4390 4.4390 4.7880 4.7880 4.7992 4.7992 8.8613 8.8613 8.8677 8.8677 9.3288 9.3288 9.3332 9.3332 9.5000 9.5000 k = 0.1016 0.1769 0.3947 ( 5258 PWs) bands (ev): -22.0314 -22.0314 -22.0314 -22.0314 -21.1896 -21.1896 -21.1896 -21.1896 -6.8062 -6.8062 -6.8003 -6.8003 -6.1385 -6.1385 -6.1098 -6.1098 -5.9698 -5.9698 -5.9187 -5.9187 -5.8361 -5.8361 -5.7933 -5.7933 -5.2268 -5.2268 -5.2208 -5.2208 -5.0760 -5.0760 -5.0695 -5.0695 -3.6161 -3.6161 -3.6086 -3.6086 3.7888 3.7888 3.8037 3.8037 4.4262 4.4262 4.4338 4.4338 4.7721 4.7721 4.7825 4.7825 8.8197 8.8197 8.8250 8.8250 9.3424 9.3424 9.3469 9.3469 9.4873 9.4873 k = 0.0923 0.1608 0.3947 ( 5246 PWs) bands (ev): -22.0315 -22.0315 -22.0315 -22.0315 -21.1895 -21.1895 -21.1895 -21.1895 -6.8050 -6.8050 -6.8000 -6.8000 -6.1288 -6.1288 -6.0995 -6.0995 -5.9666 -5.9666 -5.9182 -5.9182 -5.8413 -5.8413 -5.8012 -5.8012 -5.2196 -5.2196 -5.2157 -5.2157 -5.0792 -5.0792 -5.0735 -5.0735 -3.6283 -3.6283 -3.6225 -3.6225 3.8060 3.8060 3.8183 3.8183 4.4225 4.4225 4.4299 4.4299 4.7545 4.7545 4.7642 4.7642 8.7799 8.7799 8.7843 8.7843 9.3552 9.3552 9.3600 9.3600 9.4757 9.4757 k = 0.0831 0.1447 0.3947 ( 5242 PWs) bands (ev): -22.0316 -22.0316 -22.0316 -22.0316 -21.1895 -21.1895 -21.1895 -21.1895 -6.8040 -6.8040 -6.7997 -6.7997 -6.1195 -6.1195 -6.0900 -6.0900 -5.9633 -5.9633 -5.9171 -5.9171 -5.8468 -5.8468 -5.8091 -5.8091 -5.2124 -5.2124 -5.2100 -5.2100 -5.0829 -5.0829 -5.0779 -5.0779 -3.6400 -3.6400 -3.6356 -3.6356 3.8235 3.8235 3.8334 3.8334 4.4197 4.4197 4.4273 4.4273 4.7356 4.7356 4.7447 4.7447 8.7426 8.7426 8.7464 8.7464 9.3665 9.3665 9.3718 9.3718 9.4653 9.4653 k = 0.0739 0.1287 0.3947 ( 5242 PWs) bands (ev): -22.0317 -22.0317 -22.0317 -22.0317 -21.1894 -21.1894 -21.1894 -21.1894 -6.8032 -6.8032 -6.7994 -6.7994 -6.1105 -6.1105 -6.0814 -6.0814 -5.9597 -5.9597 -5.9154 -5.9154 -5.8527 -5.8527 -5.8169 -5.8169 -5.2053 -5.2053 -5.2034 -5.2034 -5.0870 -5.0870 -5.0827 -5.0827 -3.6511 -3.6511 -3.6477 -3.6477 3.8408 3.8408 3.8486 3.8486 4.4182 4.4182 4.4262 4.4262 4.7154 4.7154 4.7242 4.7242 8.7085 8.7085 8.7117 8.7117 9.3760 9.3760 9.3820 9.3820 9.4561 9.4561 k = 0.0646 0.1126 0.3947 ( 5250 PWs) bands (ev): -22.0318 -22.0318 -22.0318 -22.0318 -21.1894 -21.1894 -21.1893 -21.1893 -6.8024 -6.8024 -6.7992 -6.7992 -6.1020 -6.1020 -6.0739 -6.0739 -5.9558 -5.9558 -5.9129 -5.9129 -5.8590 -5.8590 -5.8246 -5.8246 -5.1983 -5.1983 -5.1962 -5.1962 -5.0916 -5.0916 -5.0878 -5.0878 -3.6612 -3.6612 -3.6588 -3.6588 3.8575 3.8575 3.8636 3.8636 4.4181 4.4181 4.4266 4.4266 4.6944 4.6944 4.7029 4.7029 8.6778 8.6778 8.6805 8.6805 9.3833 9.3833 9.3904 9.3904 9.4484 9.4484 k = 0.0554 0.0965 0.3947 ( 5242 PWs) bands (ev): -22.0319 -22.0319 -22.0319 -22.0319 -21.1893 -21.1893 -21.1893 -21.1893 -6.8017 -6.8017 -6.7990 -6.7990 -6.0940 -6.0940 -6.0678 -6.0678 -5.9515 -5.9515 -5.9098 -5.9098 -5.8656 -5.8656 -5.8321 -5.8321 -5.1913 -5.1913 -5.1887 -5.1887 -5.0967 -5.0967 -5.0932 -5.0932 -3.6704 -3.6704 -3.6687 -3.6687 3.8731 3.8731 3.8779 3.8779 4.4198 4.4198 4.4287 4.4287 4.6729 4.6729 4.6814 4.6814 8.6509 8.6509 8.6532 8.6532 9.3885 9.3885 9.3967 9.3967 9.4424 9.4424 k = 0.0462 0.0804 0.3947 ( 5230 PWs) bands (ev): -22.0319 -22.0319 -22.0319 -22.0319 -21.1892 -21.1892 -21.1892 -21.1892 -6.8011 -6.8011 -6.7988 -6.7988 -6.0865 -6.0865 -6.0630 -6.0630 -5.9468 -5.9468 -5.9062 -5.9062 -5.8723 -5.8723 -5.8394 -5.8394 -5.1841 -5.1841 -5.1812 -5.1812 -5.1021 -5.1021 -5.0988 -5.0988 -3.6785 -3.6785 -3.6772 -3.6772 3.8873 3.8873 3.8909 3.8909 4.4233 4.4233 4.4323 4.4323 4.6517 4.6517 4.6600 4.6600 8.6279 8.6279 8.6298 8.6298 9.3918 9.3918 9.4005 9.4005 9.4386 9.4386 k = 0.0369 0.0643 0.3947 ( 5226 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.8006 -6.8006 -6.7987 -6.7987 -6.0797 -6.0797 -6.0597 -6.0597 -5.9416 -5.9416 -5.9027 -5.9027 -5.8787 -5.8787 -5.8465 -5.8465 -5.1768 -5.1768 -5.1738 -5.1738 -5.1078 -5.1078 -5.1047 -5.1047 -3.6853 -3.6853 -3.6843 -3.6843 3.8996 3.8996 3.9023 3.9023 4.4284 4.4284 4.4373 4.4373 4.6315 4.6315 4.6395 4.6395 8.6090 8.6090 8.6106 8.6106 9.3936 9.3936 9.4017 9.4017 9.4370 9.4370 k = 0.0277 0.0482 0.3947 ( 5230 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.8001 -6.8001 -6.7987 -6.7987 -6.0736 -6.0736 -6.0579 -6.0579 -5.9358 -5.9358 -5.9008 -5.9008 -5.8830 -5.8830 -5.8534 -5.8534 -5.1698 -5.1698 -5.1667 -5.1667 -5.1135 -5.1135 -5.1106 -5.1106 -3.6907 -3.6907 -3.6899 -3.6899 3.9096 3.9096 3.9115 3.9115 4.4349 4.4349 4.4429 4.4429 4.6134 4.6134 4.6206 4.6206 8.5943 8.5943 8.5954 8.5954 9.3944 9.3944 9.4011 9.4011 9.4373 9.4373 k = 0.0185 0.0322 0.3947 ( 5226 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.7997 -6.7997 -6.7987 -6.7987 -6.0684 -6.0684 -6.0575 -6.0575 -5.9296 -5.9296 -5.9032 -5.9032 -5.8826 -5.8826 -5.8601 -5.8601 -5.1633 -5.1633 -5.1606 -5.1606 -5.1187 -5.1187 -5.1162 -5.1162 -3.6945 -3.6945 -3.6940 -3.6940 3.9171 3.9171 3.9183 3.9183 4.4418 4.4418 4.4481 4.4481 4.5989 4.5989 4.6046 4.6046 8.5838 8.5838 8.5846 8.5846 9.3949 9.3949 9.3995 9.3995 9.4385 9.4385 k = 0.0092 0.0161 0.3947 ( 5230 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.7993 -6.7993 -6.7989 -6.7989 -6.0640 -6.0640 -6.0585 -6.0585 -5.9229 -5.9229 -5.9091 -5.9091 -5.8785 -5.8785 -5.8667 -5.8667 -5.1580 -5.1580 -5.1563 -5.1563 -5.1225 -5.1225 -5.1209 -5.1209 -3.6968 -3.6968 -3.6966 -3.6966 3.9218 3.9218 3.9224 3.9224 4.4478 4.4478 4.4514 4.4514 4.5898 4.5898 4.5931 4.5931 8.5776 8.5776 8.5779 8.5779 9.3956 9.3956 9.3979 9.3979 9.4399 9.4399 k = 0.0000 0.0000 0.3947 ( 5246 PWs) bands (ev): -22.0321 -22.0321 -22.0321 -22.0321 -21.1892 -21.1892 -21.1892 -21.1892 -6.7991 -6.7991 -6.7991 -6.7991 -6.0607 -6.0607 -6.0607 -6.0607 -5.9159 -5.9159 -5.9159 -5.9159 -5.8729 -5.8729 -5.8729 -5.8729 -5.1553 -5.1553 -5.1553 -5.1553 -5.1234 -5.1234 -5.1234 -5.1234 -3.6975 -3.6975 -3.6975 -3.6975 3.9236 3.9236 3.9236 3.9236 4.4514 4.4514 4.4514 4.4514 4.5877 4.5877 4.5877 4.5877 8.5756 8.5756 8.5756 8.5756 9.3965 9.3965 9.3965 9.3965 9.4411 9.4411 k = 0.0000 0.0000 0.3947 ( 5246 PWs) bands (ev): -22.0321 -22.0321 -22.0321 -22.0321 -21.1892 -21.1892 -21.1892 -21.1892 -6.7991 -6.7991 -6.7991 -6.7991 -6.0607 -6.0607 -6.0607 -6.0607 -5.9159 -5.9159 -5.9159 -5.9159 -5.8729 -5.8729 -5.8729 -5.8729 -5.1553 -5.1553 -5.1553 -5.1553 -5.1234 -5.1234 -5.1234 -5.1234 -3.6975 -3.6975 -3.6975 -3.6975 3.9236 3.9236 3.9236 3.9236 4.4514 4.4514 4.4514 4.4514 4.5877 4.5877 4.5877 4.5877 8.5756 8.5756 8.5756 8.5756 9.3965 9.3965 9.3965 9.3965 9.4411 9.4411 k = 0.0000 0.0000 0.3768 ( 5242 PWs) bands (ev): -22.0344 -22.0344 -22.0297 -22.0297 -21.1892 -21.1892 -21.1891 -21.1891 -6.8067 -6.8067 -6.7920 -6.7920 -6.0692 -6.0692 -6.0518 -6.0518 -5.9232 -5.9232 -5.9091 -5.9091 -5.8780 -5.8780 -5.8667 -5.8667 -5.1593 -5.1593 -5.1507 -5.1507 -5.1279 -5.1279 -5.1189 -5.1189 -3.7072 -3.7072 -3.6891 -3.6891 3.9020 3.9020 3.9468 3.9468 4.4232 4.4232 4.4824 4.4824 4.5679 4.5679 4.6081 4.6081 8.4843 8.4843 8.6667 8.6667 9.3743 9.3743 9.4116 9.4116 9.4161 9.4161 k = 0.0000 0.0000 0.3588 ( 5232 PWs) bands (ev): -22.0367 -22.0367 -22.0274 -22.0274 -21.1893 -21.1893 -21.1891 -21.1891 -6.8149 -6.8149 -6.7855 -6.7855 -6.0771 -6.0771 -6.0426 -6.0426 -5.9305 -5.9305 -5.9042 -5.9042 -5.8809 -5.8809 -5.8601 -5.8601 -5.1628 -5.1628 -5.1456 -5.1456 -5.1324 -5.1324 -5.1145 -5.1145 -3.7179 -3.7179 -3.6819 -3.6819 3.8823 3.8823 3.9714 3.9714 4.3977 4.3977 4.5160 4.5160 4.5490 4.5490 4.6288 4.6288 8.3932 8.3932 8.7570 8.7570 9.3451 9.3451 9.3840 9.3840 9.4204 9.4204 k = 0.0000 0.0000 0.3409 ( 5228 PWs) bands (ev): -22.0390 -22.0390 -22.0251 -22.0251 -21.1893 -21.1893 -21.1890 -21.1890 -6.8235 -6.8235 -6.7795 -6.7795 -6.0844 -6.0844 -6.0333 -6.0333 -5.9376 -5.9376 -5.9035 -5.9035 -5.8790 -5.8790 -5.8532 -5.8532 -5.1657 -5.1657 -5.1402 -5.1402 -5.1367 -5.1367 -5.1102 -5.1102 -3.7298 -3.7298 -3.6759 -3.6759 3.8645 3.8645 3.9973 3.9973 4.3748 4.3748 4.5287 4.5287 4.5547 4.5547 4.6499 4.6499 8.3029 8.3029 8.8460 8.8460 9.3096 9.3096 9.3459 9.3459 9.4227 9.4227 k = 0.0000 0.0000 0.3229 ( 5228 PWs) bands (ev): -22.0413 -22.0413 -22.0228 -22.0228 -21.1893 -21.1893 -21.1890 -21.1890 -6.8326 -6.8326 -6.7742 -6.7742 -6.0910 -6.0910 -6.0240 -6.0240 -5.9445 -5.9445 -5.9067 -5.9067 -5.8728 -5.8728 -5.8460 -5.8460 -5.1682 -5.1682 -5.1418 -5.1418 -5.1334 -5.1334 -5.1059 -5.1059 -3.7428 -3.7428 -3.6711 -3.6711 3.8486 3.8486 4.0240 4.0240 4.3543 4.3543 4.5112 4.5112 4.5944 4.5944 4.6712 4.6712 8.2137 8.2137 8.9330 8.9330 9.2686 9.2686 9.3025 9.3025 9.4197 9.4197 k = 0.0000 0.0000 0.3050 ( 5234 PWs) bands (ev): -22.0435 -22.0435 -22.0206 -22.0206 -21.1894 -21.1894 -21.1890 -21.1890 -6.8419 -6.8419 -6.7694 -6.7694 -6.0969 -6.0969 -6.0148 -6.0148 -5.9512 -5.9512 -5.9114 -5.9114 -5.8647 -5.8647 -5.8386 -5.8386 -5.1702 -5.1702 -5.1463 -5.1463 -5.1267 -5.1267 -5.1019 -5.1019 -3.7566 -3.7566 -3.6674 -3.6674 3.8347 3.8347 4.0513 4.0513 4.3361 4.3361 4.4940 4.4940 4.6380 4.6380 4.6926 4.6926 8.1260 8.1260 9.0173 9.0173 9.2231 9.2231 9.2547 9.2547 9.4123 9.4123 k = 0.0000 0.0000 0.2871 ( 5246 PWs) bands (ev): -22.0456 -22.0456 -22.0184 -22.0184 -21.1894 -21.1894 -21.1889 -21.1889 -6.8515 -6.8515 -6.7652 -6.7652 -6.1020 -6.1020 -6.0060 -6.0060 -5.9576 -5.9576 -5.9166 -5.9166 -5.8560 -5.8560 -5.8308 -5.8308 -5.1716 -5.1716 -5.1508 -5.1508 -5.1196 -5.1196 -5.0979 -5.0979 -3.7712 -3.7712 -3.6648 -3.6648 3.8227 3.8227 4.0787 4.0787 4.3202 4.3202 4.4774 4.4774 4.6850 4.6850 4.7139 4.7139 8.0401 8.0401 9.0977 9.0977 9.1746 9.1746 9.2038 9.2038 9.4012 9.4012 k = 0.0000 0.0000 0.2691 ( 5236 PWs) bands (ev): -22.0477 -22.0477 -22.0163 -22.0163 -21.1895 -21.1895 -21.1889 -21.1889 -6.8612 -6.8612 -6.7616 -6.7616 -6.1062 -6.1062 -5.9976 -5.9976 -5.9636 -5.9636 -5.9217 -5.9217 -5.8473 -5.8473 -5.8226 -5.8226 -5.1727 -5.1727 -5.1551 -5.1551 -5.1119 -5.1119 -5.0941 -5.0941 -3.7865 -3.7865 -3.6632 -3.6632 3.8124 3.8124 4.1060 4.1060 4.3064 4.3064 4.4617 4.4617 4.7348 4.7348 4.7356 4.7356 7.9563 7.9563 9.1218 9.1218 9.1488 9.1488 9.1780 9.1780 9.3875 9.3875 k = 0.0000 0.0000 0.2512 ( 5240 PWs) bands (ev): -22.0497 -22.0497 -22.0142 -22.0142 -21.1895 -21.1895 -21.1889 -21.1889 -6.8710 -6.8710 -6.7584 -6.7584 -6.1097 -6.1097 -5.9903 -5.9903 -5.9689 -5.9689 -5.9268 -5.9268 -5.8388 -5.8388 -5.8139 -5.8139 -5.1733 -5.1733 -5.1594 -5.1594 -5.1040 -5.1040 -5.0905 -5.0905 -3.8023 -3.8023 -3.6626 -3.6626 3.8037 3.8037 4.1329 4.1329 4.2947 4.2947 4.4468 4.4468 4.7560 4.7560 4.7887 4.7887 7.8749 7.8749 9.0702 9.0702 9.0955 9.0955 9.2481 9.2481 9.3719 9.3719 k = 0.0000 0.0000 0.2332 ( 5240 PWs) bands (ev): -22.0516 -22.0516 -22.0123 -22.0123 -21.1895 -21.1895 -21.1888 -21.1888 -6.8807 -6.8807 -6.7556 -6.7556 -6.1125 -6.1125 -5.9852 -5.9852 -5.9723 -5.9723 -5.9315 -5.9315 -5.8309 -5.8309 -5.8047 -5.8047 -5.1737 -5.1737 -5.1635 -5.1635 -5.0957 -5.0957 -5.0871 -5.0871 -3.8184 -3.8184 -3.6627 -3.6627 3.7966 3.7966 4.1590 4.1590 4.2850 4.2850 4.4329 4.4329 4.7765 4.7765 4.8451 4.8451 7.7962 7.7962 9.0180 9.0180 9.0411 9.0411 9.3133 9.3133 9.3558 9.3558 k = 0.0000 0.0000 0.2153 ( 5236 PWs) bands (ev): -22.0534 -22.0534 -22.0105 -22.0105 -21.1896 -21.1896 -21.1888 -21.1888 -6.8902 -6.8902 -6.7533 -6.7533 -6.1146 -6.1146 -5.9858 -5.9858 -5.9705 -5.9705 -5.9359 -5.9359 -5.8236 -5.8236 -5.7950 -5.7950 -5.1738 -5.1738 -5.1673 -5.1673 -5.0873 -5.0873 -5.0838 -5.0838 -3.8347 -3.8347 -3.6635 -3.6635 3.7907 3.7907 4.1840 4.1840 4.2770 4.2770 4.4198 4.4198 4.7965 4.7965 4.9041 4.9041 7.7204 7.7204 8.9664 8.9664 8.9875 8.9875 9.3337 9.3337 9.3769 9.3769 k = 0.0000 0.0000 0.1974 ( 5240 PWs) bands (ev): -22.0551 -22.0551 -22.0087 -22.0087 -21.1896 -21.1896 -21.1888 -21.1888 -6.8993 -6.8993 -6.7513 -6.7513 -6.1160 -6.1160 -5.9898 -5.9898 -5.9659 -5.9659 -5.9397 -5.9397 -5.8170 -5.8170 -5.7851 -5.7851 -5.1739 -5.1739 -5.1707 -5.1707 -5.0810 -5.0810 -5.0786 -5.0786 -3.8509 -3.8509 -3.6649 -3.6649 3.7859 3.7859 4.2077 4.2077 4.2708 4.2708 4.4077 4.4077 4.8156 4.8156 4.9652 4.9652 7.6476 7.6476 8.9165 8.9165 8.9355 8.9355 9.3142 9.3142 9.3869 9.3869 k = 0.0000 0.0000 0.1794 ( 5245 PWs) bands (ev): -22.0567 -22.0567 -22.0071 -22.0071 -21.1897 -21.1897 -21.1888 -21.1888 -6.9081 -6.9081 -6.7497 -6.7497 -6.1168 -6.1168 -5.9946 -5.9946 -5.9615 -5.9615 -5.9426 -5.9426 -5.8111 -5.8111 -5.7753 -5.7753 -5.1756 -5.1756 -5.1721 -5.1721 -5.0782 -5.0782 -5.0702 -5.0702 -3.8668 -3.8668 -3.6668 -3.6668 3.7821 3.7821 4.2299 4.2299 4.2662 4.2662 4.3966 4.3966 4.8339 4.8339 5.0276 5.0276 7.5783 7.5783 8.8688 8.8688 8.8858 8.8858 9.2860 9.2860 9.3566 9.3566 k = 0.0000 0.0000 0.1615 ( 5249 PWs) bands (ev): -22.0581 -22.0581 -22.0056 -22.0056 -21.1897 -21.1897 -21.1888 -21.1888 -6.9164 -6.9164 -6.7483 -6.7483 -6.1171 -6.1171 -5.9993 -5.9993 -5.9588 -5.9588 -5.9438 -5.9438 -5.8057 -5.8057 -5.7656 -5.7656 -5.1786 -5.1786 -5.1718 -5.1718 -5.0756 -5.0756 -5.0618 -5.0618 -3.8821 -3.8821 -3.6690 -3.6690 3.7790 3.7790 4.2502 4.2502 4.2633 4.2633 4.3865 4.3865 4.8511 4.8511 5.0906 5.0906 7.5125 7.5125 8.8239 8.8239 8.8391 8.8391 9.2240 9.2240 9.3106 9.3106 k = 0.0000 0.0000 0.1435 ( 5243 PWs) bands (ev): -22.0595 -22.0595 -22.0043 -22.0043 -21.1897 -21.1897 -21.1887 -21.1887 -6.9241 -6.9241 -6.7472 -6.7472 -6.1170 -6.1170 -6.0039 -6.0039 -5.9586 -5.9586 -5.9427 -5.9427 -5.8009 -5.8009 -5.7565 -5.7565 -5.1815 -5.1815 -5.1711 -5.1711 -5.0733 -5.0733 -5.0537 -5.0537 -3.8967 -3.8967 -3.6713 -3.6713 3.7766 3.7766 4.2599 4.2599 4.2702 4.2702 4.3774 4.3774 4.8671 4.8671 5.1532 5.1532 7.4506 7.4506 8.7824 8.7824 8.7959 8.7959 9.1320 9.1320 9.2857 9.2857 k = 0.0000 0.0000 0.1256 ( 5239 PWs) bands (ev): -22.0606 -22.0606 -22.0030 -22.0030 -21.1898 -21.1898 -21.1887 -21.1887 -6.9311 -6.9311 -6.7463 -6.7463 -6.1165 -6.1165 -6.0082 -6.0082 -5.9599 -5.9599 -5.9401 -5.9401 -5.7966 -5.7966 -5.7480 -5.7480 -5.1842 -5.1842 -5.1703 -5.1703 -5.0713 -5.0713 -5.0461 -5.0461 -3.9103 -3.9103 -3.6737 -3.6737 3.7747 3.7747 4.2591 4.2591 4.2867 4.2867 4.3694 4.3694 4.8817 4.8817 5.2142 5.2142 7.3931 7.3931 8.7447 8.7447 8.7568 8.7568 9.0396 9.0396 9.2689 9.2689 k = 0.0000 0.0000 0.1076 ( 5245 PWs) bands (ev): -22.0617 -22.0617 -22.0020 -22.0020 -21.1898 -21.1898 -21.1887 -21.1887 -6.9373 -6.9373 -6.7456 -6.7456 -6.1158 -6.1158 -6.0121 -6.0121 -5.9618 -5.9618 -5.9372 -5.9372 -5.7929 -5.7929 -5.7403 -5.7403 -5.1866 -5.1866 -5.1695 -5.1695 -5.0695 -5.0695 -5.0391 -5.0391 -3.9227 -3.9227 -3.6761 -3.6761 3.7732 3.7732 4.2587 4.2587 4.3014 4.3014 4.3625 4.3625 4.8947 4.8947 5.2722 5.2722 7.3404 7.3404 8.7112 8.7112 8.7221 8.7221 8.9546 8.9546 9.2553 9.2553 k = 0.0000 0.0000 0.0897 ( 5255 PWs) bands (ev): -22.0626 -22.0626 -22.0011 -22.0011 -21.1898 -21.1898 -21.1887 -21.1887 -6.9427 -6.9427 -6.7450 -6.7450 -6.1149 -6.1149 -6.0157 -6.0157 -5.9637 -5.9637 -5.9345 -5.9345 -5.7897 -5.7897 -5.7336 -5.7336 -5.1887 -5.1887 -5.1687 -5.1687 -5.0680 -5.0680 -5.0328 -5.0328 -3.9336 -3.9336 -3.6783 -3.6783 3.7721 3.7721 4.2588 4.2588 4.3140 4.3140 4.3567 4.3567 4.9060 4.9060 5.3257 5.3257 7.2933 7.2933 8.6823 8.6823 8.6922 8.6922 8.8797 8.8797 9.2439 9.2439 k = 0.0000 0.0000 0.0718 ( 5249 PWs) bands (ev): -22.0633 -22.0633 -22.0003 -22.0003 -21.1898 -21.1898 -21.1887 -21.1887 -6.9472 -6.9472 -6.7446 -6.7446 -6.1140 -6.1140 -6.0187 -6.0187 -5.9653 -5.9653 -5.9322 -5.9322 -5.7871 -5.7871 -5.7280 -5.7280 -5.1904 -5.1904 -5.1680 -5.1680 -5.0667 -5.0667 -5.0274 -5.0274 -3.9429 -3.9429 -3.6802 -3.6802 3.7712 3.7712 4.2592 4.2592 4.3243 4.3243 4.3521 4.3521 4.9154 4.9154 5.3730 5.3730 7.2527 7.2527 8.6581 8.6581 8.6675 8.6675 8.8164 8.8164 9.2347 9.2347 k = 0.0000 0.0000 0.0538 ( 5251 PWs) bands (ev): -22.0639 -22.0639 -21.9997 -21.9997 -21.1898 -21.1898 -21.1887 -21.1887 -6.9507 -6.9507 -6.7443 -6.7443 -6.1132 -6.1132 -6.0212 -6.0212 -5.9666 -5.9666 -5.9304 -5.9304 -5.7851 -5.7851 -5.7235 -5.7235 -5.1918 -5.1918 -5.1675 -5.1675 -5.0657 -5.0657 -5.0230 -5.0230 -3.9503 -3.9503 -3.6818 -3.6818 3.7706 3.7706 4.2598 4.2598 4.3319 4.3319 4.3489 4.3489 4.9229 4.9229 5.4123 5.4123 7.2194 7.2194 8.6390 8.6390 8.6480 8.6480 8.7661 8.7661 9.2275 9.2275 k = 0.0000 0.0000 0.0359 ( 5247 PWs) bands (ev): -22.0643 -22.0643 -21.9993 -21.9993 -21.1899 -21.1899 -21.1887 -21.1887 -6.9533 -6.9533 -6.7440 -6.7440 -6.1125 -6.1125 -6.0230 -6.0230 -5.9676 -5.9676 -5.9290 -5.9290 -5.7836 -5.7836 -5.7203 -5.7203 -5.1928 -5.1928 -5.1670 -5.1670 -5.0650 -5.0650 -5.0198 -5.0198 -3.9557 -3.9557 -3.6830 -3.6830 3.7701 3.7701 4.2602 4.2602 4.3365 4.3365 4.3475 4.3475 4.9283 4.9283 5.4418 5.4418 7.1947 7.1947 8.6252 8.6252 8.6340 8.6340 8.7294 8.7294 9.2223 9.2223 k = 0.0000 0.0000 0.0179 ( 5245 PWs) bands (ev): -22.0645 -22.0645 -21.9991 -21.9991 -21.1899 -21.1899 -21.1887 -21.1887 -6.9549 -6.9549 -6.7439 -6.7439 -6.1121 -6.1121 -6.0241 -6.0241 -5.9682 -5.9682 -5.9282 -5.9282 -5.7827 -5.7827 -5.7183 -5.7183 -5.1934 -5.1934 -5.1667 -5.1667 -5.0646 -5.0646 -5.0179 -5.0179 -3.9590 -3.9590 -3.6838 -3.6838 3.7699 3.7699 4.2606 4.2606 4.3382 4.3382 4.3478 4.3478 4.9315 4.9315 5.4602 5.4602 7.1794 7.1794 8.6169 8.6169 8.6256 8.6256 8.7071 8.7071 9.2191 9.2191 k = 0.0000 0.0000 0.0000 ( 5247 PWs) bands (ev): -22.0646 -22.0646 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9554 -6.9554 -6.7439 -6.7439 -6.1119 -6.1119 -6.0245 -6.0245 -5.9684 -5.9684 -5.9280 -5.9280 -5.7824 -5.7824 -5.7176 -5.7176 -5.1936 -5.1936 -5.1666 -5.1666 -5.0645 -5.0645 -5.0172 -5.0172 -3.9601 -3.9601 -3.6840 -3.6840 3.7698 3.7698 4.2607 4.2607 4.3385 4.3385 4.3482 4.3482 4.9326 4.9326 5.4665 5.4665 7.1742 7.1742 8.6141 8.6141 8.6228 8.6228 8.6997 8.6997 9.2181 9.2181 k = 0.0000 0.0000 0.0000 ( 5247 PWs) bands (ev): -22.0646 -22.0646 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9554 -6.9554 -6.7439 -6.7439 -6.1119 -6.1119 -6.0245 -6.0245 -5.9684 -5.9684 -5.9280 -5.9280 -5.7824 -5.7824 -5.7176 -5.7176 -5.1936 -5.1936 -5.1666 -5.1666 -5.0645 -5.0645 -5.0172 -5.0172 -3.9601 -3.9601 -3.6840 -3.6840 3.7698 3.7698 4.2607 4.2607 4.3385 4.3385 4.3482 4.3482 4.9326 4.9326 5.4665 5.4665 7.1742 7.1742 8.6141 8.6141 8.6228 8.6228 8.6997 8.6997 9.2181 9.2181 k =-0.0161 0.0093 0.0000 ( 5247 PWs) bands (ev): -22.0646 -22.0646 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9555 -6.9554 -6.7439 -6.7438 -6.1172 -6.1085 -6.0280 -6.0233 -5.9702 -5.9630 -5.9285 -5.9280 -5.7840 -5.7810 -5.7181 -5.7173 -5.1936 -5.1936 -5.1669 -5.1660 -5.0654 -5.0653 -5.0179 -5.0172 -3.9585 -3.9582 -3.6840 -3.6831 3.7701 3.7709 4.2612 4.2619 4.3343 4.3420 4.3443 4.3512 4.9302 4.9303 5.4641 5.4649 7.1812 7.1815 8.6180 8.6182 8.6239 8.6241 8.7005 8.7007 9.2081 9.2091 k =-0.0323 0.0185 0.0000 ( 5247 PWs) bands (ev): -22.0646 -22.0646 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9557 -6.9555 -6.7440 -6.7438 -6.1239 -6.1073 -6.0331 -6.0237 -5.9685 -5.9549 -5.9295 -5.9284 -5.7855 -5.7796 -5.7187 -5.7173 -5.1937 -5.1936 -5.1667 -5.1649 -5.0680 -5.0678 -5.0191 -5.0178 -3.9535 -3.9529 -3.6830 -3.6814 3.7718 3.7735 4.2634 4.2646 4.3289 4.3382 4.3463 4.3540 4.9232 4.9233 5.4580 5.4596 7.2021 7.2028 8.6268 8.6272 8.6301 8.6311 8.7033 8.7036 9.1778 9.1795 k =-0.0484 0.0278 0.0000 ( 5247 PWs) bands (ev): -22.0645 -22.0645 -21.9990 -21.9990 -21.1899 -21.1899 -21.1887 -21.1887 -6.9561 -6.9558 -6.7441 -6.7438 -6.1319 -6.1086 -6.0387 -6.0251 -5.9642 -5.9456 -5.9310 -5.9287 -5.7872 -5.7783 -5.7194 -5.7173 -5.1938 -5.1936 -5.1661 -5.1634 -5.0724 -5.0720 -5.0207 -5.0189 -3.9452 -3.9442 -3.6812 -3.6787 3.7749 3.7774 4.2672 4.2691 4.3213 4.3301 4.3511 4.3574 4.9121 4.9123 5.4485 5.4507 7.2362 7.2373 8.6330 8.6332 8.6496 8.6508 8.7079 8.7084 9.1318 9.1336 k =-0.0645 0.0370 0.0000 ( 5246 PWs) bands (ev): -22.0644 -22.0644 -21.9990 -21.9990 -21.1900 -21.1900 -21.1887 -21.1887 -6.9566 -6.9562 -6.7442 -6.7438 -6.1409 -6.1125 -6.0439 -6.0270 -5.9585 -5.9387 -5.9328 -5.9262 -5.7888 -5.7769 -5.7203 -5.7175 -5.1940 -5.1937 -5.1651 -5.1615 -5.0786 -5.0778 -5.0225 -5.0204 -3.9338 -3.9325 -3.6785 -3.6752 3.7795 3.7828 4.2727 4.2751 4.3108 4.3192 4.3568 4.3619 4.8976 4.8980 5.4357 5.4385 7.2826 7.2841 8.6412 8.6413 8.6763 8.6776 8.7145 8.7155 9.0791 9.0805 k =-0.0806 0.0463 0.0000 ( 5246 PWs) bands (ev): -22.0643 -22.0643 -21.9990 -21.9990 -21.1900 -21.1900 -21.1887 -21.1887 -6.9572 -6.9567 -6.7444 -6.7438 -6.1505 -6.1190 -6.0480 -6.0290 -5.9526 -5.9382 -5.9342 -5.9174 -5.7904 -5.7755 -5.7213 -5.7179 -5.1942 -5.1939 -5.1637 -5.1592 -5.0864 -5.0852 -5.0244 -5.0221 -3.9195 -3.9180 -3.6749 -3.6708 3.7854 3.7894 4.2797 4.2826 4.2973 4.3054 4.3637 4.3676 4.8808 4.8815 5.4202 5.4234 7.3399 7.3417 8.6516 8.6517 8.7073 8.7077 8.7249 8.7278 9.0257 9.0264 k =-0.0968 0.0556 0.0000 ( 5230 PWs) bands (ev): -22.0642 -22.0642 -21.9989 -21.9989 -21.1901 -21.1901 -21.1887 -21.1887 -6.9579 -6.9573 -6.7445 -6.7439 -6.1607 -6.1275 -6.0511 -6.0311 -5.9489 -5.9405 -5.9334 -5.9061 -5.7919 -5.7740 -5.7224 -5.7183 -5.1946 -5.1942 -5.1619 -5.1567 -5.0956 -5.0940 -5.0263 -5.0238 -3.9028 -3.9010 -3.6705 -3.6657 3.7926 3.7972 4.2804 4.2872 4.2895 4.2917 4.3716 4.3745 4.8625 4.8637 5.4024 5.4059 7.4064 7.4088 8.6642 8.6643 8.7260 8.7265 8.7537 8.7590 8.9751 8.9759 k =-0.1129 0.0648 0.0000 ( 5220 PWs) bands (ev): -22.0641 -22.0641 -21.9989 -21.9989 -21.1901 -21.1901 -21.1887 -21.1887 -6.9587 -6.9580 -6.7447 -6.7440 -6.1712 -6.1376 -6.0533 -6.0331 -5.9496 -5.9439 -5.9284 -5.8945 -5.7930 -5.7723 -5.7236 -5.7189 -5.1950 -5.1946 -5.1598 -5.1542 -5.1057 -5.1038 -5.0281 -5.0256 -3.8839 -3.8818 -3.6653 -3.6598 3.8011 3.8063 4.2602 4.2680 4.2985 4.3022 4.3806 4.3826 4.8439 4.8457 5.3827 5.3863 7.4807 7.4835 8.6790 8.6791 8.7371 8.7372 8.7934 8.8014 8.9309 8.9348 k =-0.1290 0.0741 0.0000 ( 5232 PWs) bands (ev): -22.0640 -22.0640 -21.9989 -21.9989 -21.1902 -21.1902 -21.1887 -21.1887 -6.9596 -6.9589 -6.7449 -6.7442 -6.1820 -6.1487 -6.0551 -6.0353 -5.9531 -5.9480 -5.9212 -5.8833 -5.7938 -5.7705 -5.7250 -5.7196 -5.1955 -5.1951 -5.1577 -5.1520 -5.1161 -5.1143 -5.0299 -5.0274 -3.8632 -3.8608 -3.6594 -3.6532 3.8107 3.8163 4.2369 4.2446 4.3099 4.3140 4.3908 4.3918 4.8257 4.8281 5.3615 5.3651 7.5609 7.5642 8.6959 8.6959 8.7461 8.7468 8.8226 8.8360 8.9075 8.9173 k =-0.1452 0.0833 0.0000 ( 5224 PWs) bands (ev): -22.0638 -22.0638 -21.9989 -21.9989 -21.1903 -21.1903 -21.1887 -21.1887 -6.9606 -6.9598 -6.7451 -6.7444 -6.1928 -6.1605 -6.0566 -6.0375 -5.9577 -5.9526 -5.9136 -5.8727 -5.7939 -5.7683 -5.7263 -5.7203 -5.1960 -5.1957 -5.1561 -5.1515 -5.1252 -5.1246 -5.0316 -5.0291 -3.8411 -3.8385 -3.6527 -3.6460 3.8214 3.8273 4.2106 4.2182 4.3227 4.3270 4.4019 4.4020 4.8086 4.8117 5.3391 5.3427 7.6449 7.6488 8.7147 8.7148 8.7512 8.7530 8.8224 8.8332 8.9365 8.9448 k =-0.1613 0.0926 0.0000 ( 5224 PWs) bands (ev): -22.0637 -22.0637 -21.9989 -21.9989 -21.1903 -21.1903 -21.1888 -21.1888 -6.9616 -6.9607 -6.7454 -6.7446 -6.2036 -6.1725 -6.0579 -6.0397 -5.9631 -5.9577 -5.9062 -5.8634 -5.7929 -5.7657 -5.7277 -5.7210 -5.1967 -5.1964 -5.1565 -5.1555 -5.1330 -5.1300 -5.0333 -5.0308 -3.8179 -3.8150 -3.6455 -3.6382 3.8330 3.8391 4.1817 4.1893 4.3367 4.3411 4.4133 4.4141 4.7928 4.7967 5.3158 5.3194 7.7307 7.7351 8.7345 8.7355 8.7484 8.7515 8.8178 8.8238 8.9911 8.9970 k =-0.1774 0.1019 0.0000 ( 5228 PWs) bands (ev): -22.0635 -22.0635 -21.9989 -21.9989 -21.1904 -21.1904 -21.1888 -21.1888 -6.9627 -6.9618 -6.7457 -6.7449 -6.2144 -6.1847 -6.0591 -6.0421 -5.9689 -5.9632 -5.8993 -5.8558 -5.7904 -5.7628 -5.7291 -5.7217 -5.1974 -5.1972 -5.1646 -5.1618 -5.1365 -5.1296 -5.0350 -5.0324 -3.7940 -3.7909 -3.6377 -3.6299 3.8453 3.8515 4.1510 4.1585 4.3517 4.3560 4.4256 4.4272 4.7787 4.7833 5.2920 5.2955 7.8155 7.8205 8.7351 8.7420 8.7588 8.7597 8.8240 8.8275 9.0510 9.0562 k =-0.1935 0.1111 0.0000 ( 5230 PWs) bands (ev): -22.0633 -22.0633 -21.9988 -21.9988 -21.1906 -21.1906 -21.1888 -21.1888 -6.9639 -6.9629 -6.7461 -6.7453 -6.2250 -6.1969 -6.0604 -6.0445 -5.9751 -5.9689 -5.8930 -5.8502 -5.7861 -5.7594 -5.7305 -5.7223 -5.1984 -5.1982 -5.1755 -5.1712 -5.1356 -5.1269 -5.0365 -5.0340 -3.7696 -3.7662 -3.6295 -3.6211 3.8581 3.8642 4.1190 4.1266 4.3676 4.3716 4.4389 4.4413 4.7661 4.7716 5.2679 5.2713 7.8962 7.9017 8.7275 8.7353 8.7830 8.7837 8.8373 8.8398 9.1110 9.1165 k =-0.2097 0.1204 0.0000 ( 5236 PWs) bands (ev): -22.0631 -22.0631 -21.9988 -21.9988 -21.1907 -21.1906 -21.1888 -21.1888 -6.9651 -6.9640 -6.7465 -6.7457 -6.2353 -6.2089 -6.0616 -6.0470 -5.9815 -5.9749 -5.8875 -5.8467 -5.7800 -5.7558 -5.7319 -5.7226 -5.2009 -5.1997 -5.1858 -5.1816 -5.1330 -5.1233 -5.0380 -5.0355 -3.7451 -3.7415 -3.6208 -3.6121 3.8709 3.8767 4.0868 4.0944 4.3841 4.3875 4.4534 4.4563 4.7550 4.7614 5.2437 5.2470 7.9687 7.9748 8.7290 8.7378 8.8090 8.8096 8.8545 8.8565 9.1676 9.1741 k =-0.2258 0.1296 0.0000 ( 5236 PWs) bands (ev): -22.0630 -22.0630 -21.9988 -21.9988 -21.1908 -21.1908 -21.1889 -21.1889 -6.9663 -6.9651 -6.7470 -6.7462 -6.2454 -6.2208 -6.0629 -6.0497 -5.9881 -5.9811 -5.8828 -5.8450 -5.7723 -5.7520 -5.7332 -5.7226 -5.2074 -5.2033 -5.1921 -5.1901 -5.1296 -5.1195 -5.0394 -5.0368 -3.7208 -3.7168 -3.6119 -3.6028 3.8829 3.8881 4.0556 4.0632 4.4009 4.4034 4.4691 4.4724 4.7452 4.7525 5.2197 5.2229 8.0289 8.0355 8.7440 8.7542 8.8364 8.8370 8.8745 8.8763 9.2170 9.2253 k =-0.2419 0.1389 0.0000 ( 5232 PWs) bands (ev): -22.0628 -22.0628 -21.9988 -21.9988 -21.1909 -21.1909 -21.1889 -21.1889 -6.9675 -6.9663 -6.7475 -6.7467 -6.2552 -6.2323 -6.0643 -6.0523 -5.9947 -5.9873 -5.8790 -5.8446 -5.7637 -5.7483 -5.7345 -5.7219 -5.2175 -5.2114 -5.1944 -5.1940 -5.1260 -5.1156 -5.0406 -5.0380 -3.6968 -3.6926 -3.6028 -3.5933 3.8924 3.8968 4.0274 4.0354 4.4179 4.4190 4.4861 4.4896 4.7365 4.7448 5.1959 5.1991 8.0731 8.0800 8.7751 8.7868 8.8651 8.8657 8.8974 8.8991 9.2553 9.2660 k =-0.2581 0.1482 0.0000 ( 5224 PWs) bands (ev): -22.0625 -22.0625 -21.9988 -21.9988 -21.1910 -21.1910 -21.1889 -21.1889 -6.9687 -6.9674 -6.7480 -6.7473 -6.2647 -6.2435 -6.0656 -6.0551 -6.0013 -5.9935 -5.8759 -5.8451 -5.7547 -5.7452 -5.7357 -5.7202 -5.2286 -5.2218 -5.1952 -5.1952 -5.1225 -5.1119 -5.0416 -5.0390 -3.6735 -3.6689 -3.5935 -3.5837 3.8961 3.8994 4.0061 4.0145 4.4339 4.4345 4.5046 4.5080 4.7286 4.7380 5.1727 5.1757 8.0997 8.1066 8.8216 8.8353 8.8949 8.8955 8.9241 8.9259 9.2790 9.2930 k =-0.2742 0.1574 0.0000 ( 5224 PWs) bands (ev): -22.0624 -22.0624 -21.9988 -21.9988 -21.1911 -21.1911 -21.1889 -21.1889 -6.9698 -6.9686 -6.7486 -6.7479 -6.2737 -6.2542 -6.0670 -6.0578 -6.0078 -5.9997 -5.8734 -5.8461 -5.7457 -5.7430 -5.7365 -5.7173 -5.2397 -5.2325 -5.1956 -5.1955 -5.1191 -5.1085 -5.0423 -5.0397 -3.6510 -3.6461 -3.5842 -3.5741 3.8893 3.8917 3.9964 4.0049 4.4479 4.4507 4.5244 4.5275 4.7216 4.7321 5.1500 5.1528 8.1095 8.1161 8.8789 8.8943 8.9254 8.9261 8.9569 8.9601 9.2860 9.3047 k =-0.2903 0.1667 0.0000 ( 5216 PWs) bands (ev): -22.0621 -22.0621 -21.9987 -21.9987 -21.1912 -21.1912 -21.1889 -21.1889 -6.9710 -6.9697 -6.7492 -6.7485 -6.2823 -6.2645 -6.0684 -6.0606 -6.0142 -6.0058 -5.8716 -5.8475 -5.7418 -5.7401 -5.7338 -5.7132 -5.2503 -5.2430 -5.1955 -5.1954 -5.1160 -5.1055 -5.0428 -5.0402 -3.6296 -3.6242 -3.5750 -3.5646 3.8717 3.8739 3.9991 4.0068 4.4609 4.4659 4.5456 4.5482 4.7152 4.7268 5.1278 5.1306 8.1051 8.1114 8.9372 8.9508 8.9566 8.9573 9.0011 9.0114 9.2770 9.3024 k =-0.3065 0.1759 0.0000 ( 5212 PWs) bands (ev): -22.0620 -22.0620 -21.9987 -21.9987 -21.1913 -21.1913 -21.1890 -21.1890 -6.9721 -6.9708 -6.7498 -6.7492 -6.2904 -6.2742 -6.0698 -6.0633 -6.0203 -6.0118 -5.8702 -5.8491 -5.7414 -5.7403 -5.7257 -5.7082 -5.2603 -5.2530 -5.1951 -5.1951 -5.1131 -5.1029 -5.0429 -5.0405 -3.6095 -3.6037 -3.5658 -3.5550 3.8481 3.8504 4.0092 4.0160 4.4726 4.4800 4.5678 4.5699 4.7095 4.7223 5.1063 5.1089 8.0896 8.0954 8.9872 8.9878 8.9888 8.9963 9.0587 9.0847 9.2544 9.2919 k =-0.3226 0.1852 0.0000 ( 5212 PWs) bands (ev): -22.0618 -22.0618 -21.9987 -21.9987 -21.1914 -21.1914 -21.1890 -21.1890 -6.9731 -6.9719 -6.7505 -6.7499 -6.2980 -6.2834 -6.0712 -6.0659 -6.0261 -6.0175 -5.8692 -5.8508 -5.7415 -5.7411 -5.7171 -5.7027 -5.2696 -5.2625 -5.1947 -5.1946 -5.1107 -5.1009 -5.0426 -5.0404 -3.5910 -3.5847 -3.5565 -3.5455 3.8227 3.8250 4.0229 4.0288 4.4831 4.4926 4.5909 4.5925 4.7045 4.7183 5.0855 5.0879 8.0659 8.0711 9.0191 9.0202 9.0324 9.0384 9.1123 9.1683 9.2223 9.2873 k =-0.3387 0.1945 0.0000 ( 5220 PWs) bands (ev): -22.0616 -22.0616 -21.9987 -21.9987 -21.1915 -21.1915 -21.1890 -21.1890 -6.9741 -6.9729 -6.7511 -6.7506 -6.3050 -6.2920 -6.0725 -6.0684 -6.0315 -6.0231 -5.8685 -5.8525 -5.7421 -5.7419 -5.7089 -5.6970 -5.2783 -5.2713 -5.1941 -5.1940 -5.1086 -5.0995 -5.0420 -5.0401 -3.5743 -3.5677 -3.5470 -3.5360 3.7975 3.7997 4.0382 4.0432 4.4922 4.5036 4.6146 4.6159 4.7005 4.7152 5.0651 5.0674 8.0364 8.0411 9.0498 9.0512 9.0776 9.0815 9.1326 9.1854 9.2546 9.3142 k =-0.3548 0.2037 0.0000 ( 5228 PWs) bands (ev): -22.0615 -22.0615 -21.9987 -21.9987 -21.1916 -21.1916 -21.1891 -21.1891 -6.9750 -6.9738 -6.7518 -6.7513 -6.3115 -6.3000 -6.0737 -6.0706 -6.0366 -6.0283 -5.8680 -5.8542 -5.7430 -5.7425 -5.7011 -5.6914 -5.2862 -5.2795 -5.1935 -5.1933 -5.1069 -5.0985 -5.0411 -5.0395 -3.5598 -3.5537 -3.5365 -3.5263 3.7734 3.7755 4.0541 4.0582 4.4998 4.5127 4.6387 4.6396 4.6976 4.7127 5.0453 5.0475 8.0033 8.0075 9.0787 9.0815 9.1048 9.1147 9.1377 9.1606 9.3387 9.3731 k =-0.3710 0.2130 0.0000 ( 5230 PWs) bands (ev): -22.0613 -22.0613 -21.9987 -21.9987 -21.1916 -21.1916 -21.1891 -21.1891 -6.9758 -6.9747 -6.7524 -6.7520 -6.3173 -6.3073 -6.0749 -6.0727 -6.0412 -6.0332 -5.8677 -5.8559 -5.7438 -5.7431 -5.6939 -5.6861 -5.2932 -5.2870 -5.1928 -5.1925 -5.1056 -5.0979 -5.0400 -5.0387 -3.5476 -3.5429 -3.5248 -3.5164 3.7511 3.7529 4.0698 4.0732 4.5059 4.5197 4.6628 4.6635 4.6961 4.7113 5.0259 5.0279 7.9686 7.9723 9.0776 9.0840 9.1106 9.1145 9.1864 9.1954 9.4174 9.4409 k =-0.3871 0.2222 0.0000 ( 5238 PWs) bands (ev): -22.0612 -22.0612 -21.9987 -21.9987 -21.1917 -21.1917 -21.1891 -21.1891 -6.9765 -6.9755 -6.7530 -6.7526 -6.3225 -6.3138 -6.0759 -6.0746 -6.0453 -6.0378 -5.8674 -5.8574 -5.7445 -5.7438 -5.6874 -5.6811 -5.2995 -5.2938 -5.1920 -5.1917 -5.1045 -5.0978 -5.0388 -5.0378 -3.5377 -3.5348 -3.5128 -3.5065 3.7309 3.7325 4.0850 4.0877 4.5105 4.5245 4.6858 4.6863 4.6976 4.7111 5.0067 5.0085 7.9339 7.9371 9.0424 9.0485 9.1380 9.1389 9.2434 9.2502 9.4830 9.4965 k =-0.4032 0.2315 0.0000 ( 5230 PWs) bands (ev): -22.0610 -22.0610 -21.9987 -21.9987 -21.1918 -21.1918 -21.1891 -21.1891 -6.9771 -6.9763 -6.7535 -6.7532 -6.3269 -6.3196 -6.0768 -6.0761 -6.0488 -6.0420 -5.8672 -5.8589 -5.7451 -5.7445 -5.6816 -5.6766 -5.3049 -5.2998 -5.1912 -5.1909 -5.1037 -5.0979 -5.0376 -5.0368 -3.5298 -3.5283 -3.5015 -3.4970 3.7130 3.7144 4.0993 4.1013 4.5138 4.5272 4.6941 4.7041 4.7142 4.7172 4.9878 4.9894 7.9007 7.9035 9.0077 9.0120 9.1632 9.1636 9.3043 9.3102 9.5162 9.5193 k =-0.4194 0.2407 0.0000 ( 5210 PWs) bands (ev): -22.0609 -22.0609 -21.9986 -21.9986 -21.1918 -21.1918 -21.1891 -21.1891 -6.9776 -6.9769 -6.7540 -6.7537 -6.3306 -6.3246 -6.0776 -6.0773 -6.0518 -6.0457 -5.8669 -5.8601 -5.7457 -5.7450 -5.6766 -5.6727 -5.3094 -5.3050 -5.1905 -5.1901 -5.1031 -5.0982 -5.0363 -5.0358 -3.5236 -3.5229 -3.4916 -3.4884 3.6976 3.6988 4.1122 4.1137 4.5160 4.5281 4.6965 4.7076 4.7372 4.7375 4.9690 4.9705 7.8704 7.8727 8.9760 8.9790 9.1857 9.1859 9.3677 9.3732 9.5314 9.5322 k =-0.4355 0.2500 0.0000 ( 5210 PWs) bands (ev): -22.0608 -22.0608 -21.9986 -21.9986 -21.1919 -21.1919 -21.1891 -21.1891 -6.9781 -6.9774 -6.7544 -6.7542 -6.3336 -6.3289 -6.0783 -6.0782 -6.0542 -6.0490 -5.8667 -5.8614 -5.7461 -5.7456 -5.6724 -5.6695 -5.3130 -5.3094 -5.1898 -5.1895 -5.1026 -5.0987 -5.0353 -5.0349 -3.5188 -3.5186 -3.4832 -3.4810 3.6848 3.6858 4.1234 4.1244 4.5173 4.5276 4.6990 4.7086 4.7600 4.7601 4.9504 4.9517 7.8441 7.8459 8.9488 8.9508 9.2050 9.2051 9.4323 9.4375 9.5424 9.5424 k =-0.4516 0.2593 0.0000 ( 5216 PWs) bands (ev): -22.0608 -22.0608 -21.9986 -21.9986 -21.1919 -21.1919 -21.1891 -21.1891 -6.9784 -6.9779 -6.7547 -6.7545 -6.3359 -6.3323 -6.0790 -6.0788 -6.0559 -6.0518 -5.8664 -5.8625 -5.7464 -5.7460 -5.6690 -5.6669 -5.3158 -5.3130 -5.1892 -5.1890 -5.1022 -5.0992 -5.0344 -5.0341 -3.5152 -3.5152 -3.4766 -3.4751 3.6748 3.6756 4.1325 4.1332 4.5182 4.5262 4.7018 4.7092 4.7817 4.7820 4.9322 4.9334 7.8227 7.8241 8.9269 8.9282 9.2206 9.2207 9.4959 9.5005 9.5509 9.5520 k =-0.4677 0.2685 0.0000 ( 5208 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1891 -21.1891 -6.9786 -6.9782 -6.7549 -6.7548 -6.3373 -6.3349 -6.0794 -6.0792 -6.0569 -6.0541 -5.8660 -5.8634 -5.7466 -5.7464 -5.6665 -5.6652 -5.3176 -5.3157 -5.1888 -5.1886 -5.1017 -5.0998 -5.0337 -5.0336 -3.5127 -3.5126 -3.4718 -3.4709 3.6677 3.6682 4.1393 4.1397 4.5189 4.5244 4.7043 4.7094 4.8015 4.8019 4.9152 4.9161 7.8069 7.8079 8.9109 8.9117 9.2321 9.2321 9.5472 9.5476 9.5661 9.5723 k =-0.4839 0.2778 0.0000 ( 5214 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1891 -21.1891 -6.9786 -6.9785 -6.7551 -6.7550 -6.3379 -6.3367 -6.0796 -6.0795 -6.0572 -6.0558 -5.8655 -5.8642 -5.7468 -5.7466 -5.6649 -5.6642 -5.3185 -5.3175 -5.1885 -5.1884 -5.1013 -5.1003 -5.0333 -5.0332 -3.5113 -3.5112 -3.4688 -3.4684 3.6634 3.6637 4.1435 4.1437 4.5198 4.5226 4.7065 4.7091 4.8172 4.8175 4.9014 4.9020 7.7974 7.7978 8.9012 8.9016 9.2391 9.2392 9.5563 9.5568 9.6136 9.6197 k =-0.5000 0.2870 0.0000 ( 5204 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9786 -6.9786 -6.7551 -6.7551 -6.3377 -6.3377 -6.0796 -6.0796 -6.0568 -6.0568 -5.8649 -5.8649 -5.7467 -5.7467 -5.6641 -5.6641 -5.3184 -5.3184 -5.1884 -5.1884 -5.1008 -5.1008 -5.0331 -5.0331 -3.5107 -3.5107 -3.4677 -3.4677 3.6621 3.6621 4.1450 4.1450 4.5210 4.5210 4.7081 4.7081 4.8239 4.8239 4.8957 4.8957 7.7943 7.7943 8.8981 8.8981 9.2415 9.2415 9.5582 9.5582 9.6447 9.6447 k =-0.5000 0.2870 0.0000 ( 5204 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9786 -6.9786 -6.7551 -6.7551 -6.3377 -6.3377 -6.0796 -6.0796 -6.0568 -6.0568 -5.8649 -5.8649 -5.7467 -5.7467 -5.6641 -5.6641 -5.3184 -5.3184 -5.1884 -5.1884 -5.1008 -5.1008 -5.0331 -5.0331 -3.5107 -3.5107 -3.4677 -3.4677 3.6621 3.6621 4.1450 4.1450 4.5210 4.5210 4.7081 4.7081 4.8239 4.8239 4.8957 4.8957 7.7943 7.7943 8.8981 8.8981 9.2415 9.2415 9.5582 9.5582 9.6447 9.6447 k =-0.4912 0.3024-0.0000 ( 5214 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9786 -6.9786 -6.7554 -6.7550 -6.3380 -6.3373 -6.0906 -6.0821 -6.0537 -6.0464 -5.8652 -5.8650 -5.7480 -5.7458 -5.6649 -5.6637 -5.3189 -5.3175 -5.1891 -5.1875 -5.1013 -5.1000 -5.0342 -5.0326 -3.5116 -3.5098 -3.4680 -3.4669 3.6633 3.6634 4.1434 4.1443 4.5198 4.5213 4.7049 4.7098 4.8222 4.8233 4.8966 4.9000 7.7962 7.7963 8.8715 8.8757 9.2637 9.2714 9.5570 9.5606 9.6460 9.6469 k =-0.4824 0.3178-0.0000 ( 5206 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9785 -6.9784 -6.7559 -6.7550 -6.3381 -6.3368 -6.1044 -6.0939 -6.0411 -6.0331 -5.8656 -5.8653 -5.7496 -5.7452 -5.6658 -5.6635 -5.3187 -5.3159 -5.1897 -5.1866 -5.1015 -5.0989 -5.0359 -5.0327 -3.5124 -3.5089 -3.4677 -3.4656 3.6670 3.6672 4.1396 4.1412 4.5178 4.5209 4.7004 4.7097 4.8184 4.8206 4.9025 4.9089 7.8019 7.8021 8.8121 8.8182 9.3228 9.3366 9.5569 9.5654 9.6501 9.6526 k =-0.4735 0.3331-0.0000 ( 5206 PWs) bands (ev): -22.0606 -22.0606 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9784 -6.9782 -6.7565 -6.7552 -6.3380 -6.3361 -6.1185 -6.1071 -6.0271 -6.0193 -5.8663 -5.8659 -5.7516 -5.7450 -5.6671 -5.6635 -5.3179 -5.3139 -5.1902 -5.1857 -5.1013 -5.0974 -5.0382 -5.0335 -3.5132 -3.5080 -3.4669 -3.4639 3.6731 3.6735 4.1336 4.1360 4.5148 4.5194 4.6952 4.7082 4.8127 4.8161 4.9130 4.9217 7.8112 7.8115 8.7395 8.7460 9.3935 9.4139 9.5595 9.5768 9.6462 9.6575 k =-0.4647 0.3485-0.0000 ( 5210 PWs) bands (ev): -22.0606 -22.0606 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9781 -6.9779 -6.7573 -6.7556 -6.3379 -6.3352 -6.1326 -6.1204 -6.0129 -6.0055 -5.8673 -5.8666 -5.7538 -5.7451 -5.6687 -5.6637 -5.3165 -5.3116 -5.1904 -5.1846 -5.1009 -5.0957 -5.0410 -5.0348 -3.5137 -3.5072 -3.4655 -3.4619 3.6815 3.6821 4.1259 4.1289 4.5106 4.5168 4.6897 4.7056 4.8057 4.8103 4.9271 4.9376 7.8238 7.8242 8.6630 8.6693 9.4521 9.4798 9.5679 9.6040 9.6239 9.6474 k =-0.4559 0.3639-0.0000 ( 5210 PWs) bands (ev): -22.0606 -22.0606 -21.9986 -21.9986 -21.1919 -21.1919 -21.1893 -21.1893 -6.9779 -6.9776 -6.7583 -6.7561 -6.3376 -6.3342 -6.1463 -6.1335 -5.9988 -5.9920 -5.8685 -5.8676 -5.7563 -5.7455 -5.6705 -5.6641 -5.3146 -5.3090 -5.1904 -5.1835 -5.1002 -5.0938 -5.0442 -5.0367 -3.5141 -3.5064 -3.4637 -3.4595 3.6921 3.6929 4.1168 4.1202 4.5049 4.5126 4.6843 4.7023 4.7978 4.8038 4.9440 4.9557 7.8392 7.8397 8.5867 8.5926 9.4799 9.5076 9.5634 9.5881 9.6628 9.6846 k =-0.4471 0.3792-0.0000 ( 5218 PWs) bands (ev): -22.0606 -22.0606 -21.9986 -21.9986 -21.1918 -21.1918 -21.1894 -21.1894 -6.9775 -6.9772 -6.7593 -6.7568 -6.3371 -6.3331 -6.1596 -6.1462 -5.9852 -5.9787 -5.8699 -5.8686 -5.7589 -5.7462 -5.6725 -5.6647 -5.3122 -5.3064 -5.1901 -5.1823 -5.0993 -5.0918 -5.0479 -5.0391 -3.5143 -3.5057 -3.4614 -3.4570 3.7048 3.7058 4.1067 4.1104 4.4975 4.5067 4.6791 4.6984 4.7897 4.7971 4.9630 4.9754 7.8569 7.8575 8.5124 8.5179 9.4819 9.5067 9.5395 9.5581 9.6987 9.7082 k =-0.4383 0.3946-0.0000 ( 5216 PWs) bands (ev): -22.0605 -22.0605 -21.9986 -21.9986 -21.1918 -21.1918 -21.1894 -21.1894 -6.9772 -6.9768 -6.7605 -6.7575 -6.3366 -6.3318 -6.1724 -6.1585 -5.9720 -5.9660 -5.8714 -5.8698 -5.7617 -5.7470 -5.6747 -5.6654 -5.3093 -5.3037 -5.1893 -5.1810 -5.0983 -5.0897 -5.0519 -5.0419 -3.5143 -3.5049 -3.4588 -3.4542 3.7193 3.7206 4.0959 4.0997 4.4883 4.4986 4.6742 4.6942 4.7820 4.7911 4.9832 4.9960 7.8762 7.8768 8.4414 8.4463 9.4659 9.4832 9.5234 9.5346 9.7238 9.7304 k =-0.4294 0.4100-0.0000 ( 5212 PWs) bands (ev): -22.0605 -22.0605 -21.9986 -21.9986 -21.1917 -21.1917 -21.1895 -21.1895 -6.9768 -6.9764 -6.7617 -6.7583 -6.3360 -6.3305 -6.1846 -6.1701 -5.9595 -5.9539 -5.8731 -5.8710 -5.7645 -5.7480 -5.6771 -5.6661 -5.3062 -5.3012 -5.1882 -5.1795 -5.0972 -5.0875 -5.0561 -5.0451 -3.5141 -3.5041 -3.4560 -3.4514 3.7353 3.7370 4.0849 4.0887 4.4770 4.4883 4.6696 4.6895 4.7754 4.7861 5.0040 5.0170 7.8965 7.8970 8.3742 8.3787 9.4374 9.4480 9.5148 9.5194 9.7500 9.7555 k =-0.4206 0.4253-0.0000 ( 5212 PWs) bands (ev): -22.0605 -22.0605 -21.9986 -21.9986 -21.1917 -21.1917 -21.1896 -21.1896 -6.9764 -6.9759 -6.7630 -6.7591 -6.3353 -6.3292 -6.1960 -6.1812 -5.9478 -5.9425 -5.8748 -5.8722 -5.7672 -5.7491 -5.6795 -5.6669 -5.3029 -5.2990 -5.1866 -5.1780 -5.0962 -5.0854 -5.0604 -5.0486 -3.5138 -3.5033 -3.4530 -3.4484 3.7525 3.7547 4.0742 4.0777 4.4637 4.4755 4.6653 4.6846 4.7702 4.7825 5.0248 5.0379 7.9168 7.9173 8.3115 8.3155 9.4046 9.4120 9.5064 9.5078 9.7785 9.7835 k =-0.4118 0.4407-0.0000 ( 5212 PWs) bands (ev): -22.0604 -22.0604 -21.9986 -21.9986 -21.1916 -21.1916 -21.1897 -21.1897 -6.9760 -6.9755 -6.7643 -6.7600 -6.3346 -6.3278 -6.2066 -6.1915 -5.9370 -5.9319 -5.8766 -5.8733 -5.7699 -5.7502 -5.6820 -5.6677 -5.2994 -5.2971 -5.1846 -5.1764 -5.0952 -5.0833 -5.0646 -5.0522 -3.5132 -3.5024 -3.4498 -3.4455 3.7705 3.7733 4.0639 4.0671 4.4487 4.4607 4.6615 4.6796 4.7666 4.7804 5.0451 5.0581 7.9365 7.9368 8.2536 8.2571 9.3729 9.3788 9.4968 9.4970 9.8095 9.8142 k =-0.4030 0.4561-0.0000 ( 5212 PWs) bands (ev): -22.0604 -22.0604 -21.9986 -21.9986 -21.1915 -21.1915 -21.1898 -21.1898 -6.9756 -6.9750 -6.7656 -6.7609 -6.3338 -6.3265 -6.2163 -6.2010 -5.9273 -5.9223 -5.8782 -5.8743 -5.7724 -5.7513 -5.6844 -5.6686 -5.2960 -5.2956 -5.1823 -5.1748 -5.0944 -5.0814 -5.0687 -5.0560 -3.5125 -3.5016 -3.4467 -3.4427 3.7887 3.7923 4.0546 4.0572 4.4322 4.4440 4.6582 4.6748 4.7644 4.7796 5.0645 5.0773 7.9547 7.9549 8.2010 8.2039 9.3450 9.3502 9.4851 9.4863 9.8431 9.8475 k =-0.3941 0.4714-0.0000 ( 5208 PWs) bands (ev): -22.0603 -22.0603 -21.9986 -21.9986 -21.1914 -21.1914 -21.1899 -21.1899 -6.9752 -6.9746 -6.7668 -6.7617 -6.3330 -6.3252 -6.2249 -6.2097 -5.9188 -5.9140 -5.8796 -5.8750 -5.7746 -5.7523 -5.6867 -5.6693 -5.2945 -5.2926 -5.1797 -5.1731 -5.0939 -5.0797 -5.0723 -5.0596 -3.5118 -3.5007 -3.4437 -3.4400 3.8066 3.8112 4.0466 4.0482 4.4149 4.4263 4.6555 4.6703 4.7636 4.7799 5.0826 5.0950 7.9709 7.9709 8.1538 8.1562 9.3226 9.3274 9.4724 9.4744 9.8790 9.8831 k =-0.3853 0.4868-0.0000 ( 5212 PWs) bands (ev): -22.0603 -22.0603 -21.9985 -21.9985 -21.1914 -21.1914 -21.1900 -21.1900 -6.9748 -6.9743 -6.7679 -6.7625 -6.3323 -6.3242 -6.2324 -6.2176 -5.9117 -5.9071 -5.8804 -5.8754 -5.7766 -5.7532 -5.6888 -5.6700 -5.2939 -5.2894 -5.1770 -5.1716 -5.0939 -5.0781 -5.0752 -5.0631 -3.5109 -3.4998 -3.4408 -3.4375 3.8235 3.8293 4.0400 4.0406 4.3974 4.4081 4.6534 4.6665 4.7636 4.7809 5.0989 5.1110 7.9842 7.9845 8.1125 8.1143 9.3064 9.3112 9.4588 9.4612 9.9170 9.9209 k =-0.3765 0.5022-0.0000 ( 5220 PWs) bands (ev): -22.0603 -22.0603 -21.9985 -21.9985 -21.1913 -21.1913 -21.1902 -21.1902 -6.9745 -6.9740 -6.7690 -6.7631 -6.3316 -6.3234 -6.2386 -6.2244 -5.9061 -5.9023 -5.8803 -5.8755 -5.7782 -5.7540 -5.6907 -5.6706 -5.2937 -5.2864 -5.1744 -5.1701 -5.0943 -5.0774 -5.0769 -5.0663 -3.5101 -3.4990 -3.4381 -3.4352 3.8387 3.8458 4.0344 4.0351 4.3808 4.3905 4.6520 4.6632 4.7643 4.7823 5.1133 5.1249 7.9946 7.9952 8.0772 8.0785 9.2970 9.3018 9.4441 9.4470 9.9569 9.9605 k =-0.3677 0.5175-0.0000 ( 5226 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1912 -21.1912 -21.1903 -21.1903 -6.9743 -6.9738 -6.7699 -6.7637 -6.3310 -6.3230 -6.2435 -6.2303 -5.9020 -5.8998 -5.8789 -5.8753 -5.7795 -5.7546 -5.6922 -5.6711 -5.2938 -5.2837 -5.1720 -5.1689 -5.0952 -5.0787 -5.0760 -5.0689 -3.5092 -3.4983 -3.4358 -3.4333 3.8515 3.8601 4.0299 4.0318 4.3658 4.3744 4.6512 4.6606 4.7654 4.7838 5.1254 5.1366 8.0019 8.0030 8.0482 8.0488 9.2942 9.2994 9.4286 9.4318 9.9983 10.0017 k =-0.3589 0.5329-0.0000 ( 5202 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1911 -21.1911 -21.1904 -21.1904 -6.9740 -6.9736 -6.7707 -6.7641 -6.3304 -6.3228 -6.2468 -6.2350 -5.8993 -5.8991 -5.8764 -5.8749 -5.7804 -5.7550 -5.6933 -5.6714 -5.2942 -5.2812 -5.1700 -5.1679 -5.0960 -5.0793 -5.0757 -5.0707 -3.5085 -3.4977 -3.4338 -3.4317 3.8613 3.8713 4.0271 4.0301 4.3535 4.3608 4.6510 4.6587 4.7665 4.7852 5.1352 5.1457 8.0060 8.0081 8.0256 8.0261 9.2976 9.3032 9.4127 9.4159 10.0409 10.0440 k =-0.3500 0.5483-0.0000 ( 5210 PWs) bands (ev): -22.0602 -22.0602 -21.9985 -21.9985 -21.1910 -21.1910 -21.1905 -21.1905 -6.9738 -6.9735 -6.7712 -6.7644 -6.3300 -6.3231 -6.2488 -6.2387 -5.9002 -5.8973 -5.8746 -5.8736 -5.7809 -5.7553 -5.6940 -5.6716 -5.2949 -5.2792 -5.1686 -5.1673 -5.0966 -5.0796 -5.0762 -5.0714 -3.5080 -3.4972 -3.4323 -3.4306 3.8679 3.8790 4.0257 4.0294 4.3447 4.3504 4.6513 4.6572 4.7675 4.7863 5.1423 5.1522 8.0043 8.0079 8.0117 8.0141 9.3058 9.3122 9.3970 9.3998 10.0840 10.0868 k =-0.3412 0.5636-0.0000 ( 5206 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1909 -21.1909 -21.1906 -21.1906 -6.9737 -6.9735 -6.7717 -6.7646 -6.3296 -6.3236 -6.2493 -6.2412 -5.9018 -5.8962 -5.8746 -5.8711 -5.7812 -5.7553 -5.6944 -5.6718 -5.2957 -5.2775 -5.1677 -5.1671 -5.0968 -5.0797 -5.0770 -5.0714 -3.5076 -3.4970 -3.4313 -3.4301 3.8714 3.8831 4.0255 4.0292 4.3400 4.3439 4.6521 4.6562 4.7684 4.7871 5.1468 5.1561 7.9970 7.9981 8.0125 8.0126 9.3155 9.3235 9.3837 9.3855 10.1264 10.1289 k =-0.3324 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1908 -21.1908 -21.1907 -21.1907 -6.9736 -6.9735 -6.7719 -6.7646 -6.3294 -6.3242 -6.2485 -6.2427 -5.9038 -5.8956 -5.8751 -5.8689 -5.7812 -5.7551 -5.6944 -5.6720 -5.2967 -5.2761 -5.1676 -5.1672 -5.0963 -5.0796 -5.0777 -5.0712 -3.5075 -3.4971 -3.4309 -3.4301 3.8720 3.8838 4.0259 4.0290 4.3396 4.3415 4.6531 4.6556 4.7690 4.7874 5.1488 5.1573 7.9941 7.9942 8.0122 8.0133 9.3190 9.3291 9.3793 9.3795 10.1539 10.1580 k =-0.3324 0.5790-0.0000 ( 5206 PWs) bands (ev): -22.0601 -22.0601 -21.9985 -21.9985 -21.1908 -21.1908 -21.1907 -21.1907 -6.9736 -6.9735 -6.7719 -6.7646 -6.3294 -6.3242 -6.2485 -6.2427 -5.9038 -5.8956 -5.8751 -5.8689 -5.7812 -5.7551 -5.6944 -5.6720 -5.2967 -5.2761 -5.1676 -5.1672 -5.0963 -5.0796 -5.0777 -5.0712 -3.5075 -3.4971 -3.4309 -3.4301 3.8720 3.8838 4.0259 4.0290 4.3396 4.3415 4.6531 4.6556 4.7690 4.7874 5.1488 5.1573 7.9941 7.9942 8.0122 8.0133 9.3190 9.3291 9.3793 9.3795 10.1539 10.1580 k =-0.3324 0.5790 0.0179 ( 5202 PWs) bands (ev): -22.0600 -22.0600 -21.9986 -21.9986 -21.1908 -21.1908 -21.1907 -21.1907 -6.9731 -6.9730 -6.7719 -6.7646 -6.3295 -6.3243 -6.2485 -6.2427 -5.9036 -5.8957 -5.8753 -5.8693 -5.7813 -5.7554 -5.6945 -5.6721 -5.2969 -5.2764 -5.1674 -5.1670 -5.0964 -5.0796 -5.0777 -5.0713 -3.5071 -3.4968 -3.4306 -3.4297 3.8713 3.8830 4.0261 4.0293 4.3379 4.3397 4.6538 4.6562 4.7681 4.7864 5.1470 5.1555 7.9975 7.9977 8.0152 8.0162 9.3215 9.3316 9.3817 9.3819 10.1557 10.1598 k =-0.3324 0.5790 0.0359 ( 5200 PWs) bands (ev): -22.0598 -22.0598 -21.9988 -21.9988 -21.1908 -21.1908 -21.1907 -21.1907 -6.9716 -6.9715 -6.7721 -6.7647 -6.3299 -6.3248 -6.2485 -6.2428 -5.9032 -5.8959 -5.8759 -5.8704 -5.7819 -5.7563 -5.6947 -5.6724 -5.2974 -5.2772 -5.1671 -5.1666 -5.0966 -5.0796 -5.0779 -5.0715 -3.5059 -3.4957 -3.4295 -3.4286 3.8690 3.8806 4.0269 4.0300 4.3328 4.3346 4.6558 4.6581 4.7655 4.7837 5.1420 5.1504 8.0072 8.0076 8.0246 8.0253 9.3290 9.3391 9.3888 9.3890 10.1610 10.1650 k =-0.3324 0.5790 0.0538 ( 5206 PWs) bands (ev): -22.0594 -22.0594 -21.9992 -21.9992 -21.1908 -21.1908 -21.1907 -21.1907 -6.9691 -6.9689 -6.7724 -6.7649 -6.3305 -6.3255 -6.2485 -6.2430 -5.9026 -5.8963 -5.8767 -5.8722 -5.7827 -5.7578 -5.6950 -5.6729 -5.2982 -5.2785 -5.1664 -5.1659 -5.0969 -5.0797 -5.0782 -5.0719 -3.5040 -3.4938 -3.4277 -3.4268 3.8651 3.8766 4.0280 4.0311 4.3248 4.3264 4.6588 4.6611 4.7614 4.7792 5.1336 5.1420 8.0220 8.0228 8.0414 8.0418 9.3415 9.3514 9.4005 9.4006 10.1696 10.1736 k =-0.3324 0.5790 0.0718 ( 5200 PWs) bands (ev): -22.0589 -22.0589 -21.9998 -21.9998 -21.1908 -21.1908 -21.1907 -21.1907 -6.9658 -6.9654 -6.7728 -6.7652 -6.3314 -6.3265 -6.2484 -6.2432 -5.9018 -5.8972 -5.8776 -5.8747 -5.7839 -5.7598 -5.6954 -5.6736 -5.2992 -5.2802 -5.1655 -5.1649 -5.0974 -5.0797 -5.0787 -5.0724 -3.5013 -3.4913 -3.4252 -3.4244 3.8599 3.8710 4.0293 4.0323 4.3146 4.3159 4.6627 4.6649 4.7557 4.7731 5.1222 5.1306 8.0408 8.0419 8.0667 8.0667 9.3586 9.3685 9.4168 9.4168 10.1807 10.1851 k =-0.3324 0.5790 0.0897 ( 5204 PWs) bands (ev): -22.0582 -22.0582 -22.0005 -22.0005 -21.1908 -21.1908 -21.1907 -21.1907 -6.9615 -6.9610 -6.7733 -6.7656 -6.3325 -6.3277 -6.2483 -6.2434 -5.9010 -5.8990 -5.8783 -5.8777 -5.7852 -5.7623 -5.6959 -5.6745 -5.3005 -5.2823 -5.1645 -5.1637 -5.0979 -5.0798 -5.0793 -5.0730 -3.4979 -3.4882 -3.4221 -3.4213 3.8533 3.8641 4.0305 4.0334 4.3028 4.3039 4.6671 4.6691 4.7488 4.7656 5.1080 5.1162 8.0634 8.0647 8.0999 8.1001 9.3803 9.3900 9.4372 9.4373 10.1876 10.1909 k =-0.3324 0.5790 0.1076 ( 5213 PWs) bands (ev): -22.0574 -22.0574 -22.0013 -22.0013 -21.1908 -21.1908 -21.1907 -21.1907 -6.9564 -6.9557 -6.7739 -6.7661 -6.3338 -6.3292 -6.2482 -6.2436 -5.9019 -5.9005 -5.8811 -5.8784 -5.7868 -5.7651 -5.6965 -5.6756 -5.3019 -5.2847 -5.1633 -5.1624 -5.0986 -5.0802 -5.0798 -5.0736 -3.4939 -3.4846 -3.4185 -3.4177 3.8454 3.8558 4.0310 4.0338 4.2906 4.2914 4.6716 4.6736 4.7409 4.7570 5.0913 5.0994 8.0900 8.0914 8.1406 8.1410 9.4061 9.4157 9.4616 9.4618 10.1636 10.1653 k =-0.3324 0.5790 0.1256 ( 5215 PWs) bands (ev): -22.0564 -22.0564 -22.0023 -22.0023 -21.1908 -21.1908 -21.1907 -21.1907 -6.9505 -6.9496 -6.7747 -6.7667 -6.3353 -6.3308 -6.2480 -6.2439 -5.9059 -5.9008 -5.8842 -5.8780 -5.7884 -5.7681 -5.6972 -5.6769 -5.3035 -5.2873 -5.1620 -5.1610 -5.0993 -5.0812 -5.0799 -5.0741 -3.4894 -3.4804 -3.4144 -3.4136 3.8363 3.8463 4.0304 4.0330 4.2788 4.2793 4.6760 4.6780 4.7322 4.7475 5.0723 5.0804 8.1209 8.1223 8.1883 8.1888 9.4359 9.4453 9.4897 9.4901 10.1243 10.1258 k =-0.3324 0.5790 0.1435 ( 5220 PWs) bands (ev): -22.0553 -22.0553 -22.0034 -22.0034 -21.1908 -21.1908 -21.1907 -21.1907 -6.9440 -6.9428 -6.7756 -6.7674 -6.3369 -6.3326 -6.2477 -6.2441 -5.9111 -5.9032 -5.8859 -5.8771 -5.7901 -5.7712 -5.6979 -5.6783 -5.3051 -5.2900 -5.1606 -5.1596 -5.1001 -5.0825 -5.0800 -5.0746 -3.4845 -3.4759 -3.4098 -3.4091 3.8263 3.8357 4.0282 4.0305 4.2686 4.2687 4.6801 4.6822 4.7231 4.7374 5.0516 5.0595 8.1559 8.1574 8.2424 8.2429 9.4692 9.4785 9.5213 9.5220 10.0785 10.0799 k =-0.3324 0.5790 0.1615 ( 5210 PWs) bands (ev): -22.0541 -22.0541 -22.0047 -22.0047 -21.1908 -21.1908 -21.1907 -21.1907 -6.9368 -6.9353 -6.7766 -6.7682 -6.3385 -6.3345 -6.2474 -6.2443 -5.9173 -5.9080 -5.8858 -5.8757 -5.7917 -5.7743 -5.6987 -5.6798 -5.3068 -5.2928 -5.1592 -5.1581 -5.1008 -5.0839 -5.0800 -5.0751 -3.4792 -3.4710 -3.4050 -3.4043 3.8155 3.8243 4.0237 4.0257 4.2606 4.2609 4.6837 4.6860 4.7138 4.7270 5.0296 5.0373 8.1951 8.1965 8.3023 8.3029 9.5059 9.5150 9.5561 9.5570 10.0278 10.0292 k =-0.3324 0.5790 0.1794 ( 5208 PWs) bands (ev): -22.0527 -22.0527 -22.0061 -22.0061 -21.1908 -21.1908 -21.1907 -21.1907 -6.9292 -6.9273 -6.7778 -6.7691 -6.3403 -6.3365 -6.2470 -6.2444 -5.9242 -5.9146 -5.8844 -5.8741 -5.7932 -5.7774 -5.6995 -5.6814 -5.3085 -5.2957 -5.1578 -5.1567 -5.1016 -5.0855 -5.0800 -5.0755 -3.4736 -3.4660 -3.4000 -3.3993 3.8041 3.8123 4.0166 4.0183 4.2557 4.2564 4.6864 4.6891 4.7048 4.7165 5.0065 5.0141 8.2381 8.2396 8.3674 8.3681 9.5455 9.5545 9.5938 9.5951 9.9732 9.9746 k =-0.3324 0.5790 0.1974 ( 5212 PWs) bands (ev): -22.0512 -22.0512 -22.0076 -22.0076 -21.1908 -21.1908 -21.1907 -21.1907 -6.9211 -6.9189 -6.7791 -6.7702 -6.3421 -6.3385 -6.2465 -6.2444 -5.9318 -5.9224 -5.8825 -5.8723 -5.7947 -5.7803 -5.7003 -5.6832 -5.3101 -5.2985 -5.1564 -5.1553 -5.1023 -5.0872 -5.0801 -5.0759 -3.4680 -3.4608 -3.3948 -3.3942 3.7923 3.7998 4.0070 4.0084 4.2543 4.2553 4.6868 4.6914 4.6977 4.7065 4.9829 4.9903 8.2849 8.2864 8.4372 8.4379 9.5879 9.5967 9.6341 9.6359 9.9156 9.9171 k =-0.3324 0.5790 0.2153 ( 5212 PWs) bands (ev): -22.0496 -22.0496 -22.0092 -22.0092 -21.1908 -21.1908 -21.1907 -21.1907 -6.9129 -6.9102 -6.7805 -6.7715 -6.3438 -6.3406 -6.2459 -6.2442 -5.9398 -5.9309 -5.8801 -5.8704 -5.7960 -5.7831 -5.7011 -5.6850 -5.3116 -5.3011 -5.1551 -5.1541 -5.1030 -5.0890 -5.0801 -5.0762 -3.4623 -3.4557 -3.3896 -3.3890 3.7803 3.7872 3.9952 3.9964 4.2563 4.2575 4.6821 4.6912 4.6953 4.6987 4.9592 4.9664 8.3353 8.3367 8.5109 8.5118 9.6328 9.6414 9.6767 9.6792 9.8557 9.8577 k =-0.3324 0.5790 0.2332 ( 5216 PWs) bands (ev): -22.0479 -22.0479 -22.0110 -22.0110 -21.1908 -21.1908 -21.1908 -21.1908 -6.9044 -6.9013 -6.7821 -6.7730 -6.3455 -6.3425 -6.2452 -6.2440 -5.9480 -5.9397 -5.8777 -5.8685 -5.7972 -5.7857 -5.7018 -5.6869 -5.3131 -5.3037 -5.1538 -5.1529 -5.1037 -5.0908 -5.0801 -5.0766 -3.4567 -3.4507 -3.3846 -3.3840 3.7685 3.7747 3.9819 3.9829 4.2612 4.2626 4.6747 4.6846 4.6953 4.6970 4.9360 4.9429 8.3888 8.3903 8.5879 8.5888 9.6797 9.6879 9.7199 9.7249 9.7947 9.7989 k =-0.3324 0.5790 0.2512 ( 5208 PWs) bands (ev): -22.0461 -22.0461 -22.0128 -22.0128 -21.1908 -21.1908 -21.1907 -21.1907 -6.8960 -6.8925 -6.7838 -6.7747 -6.3471 -6.3444 -6.2445 -6.2437 -5.9562 -5.9487 -5.8751 -5.8667 -5.7982 -5.7881 -5.7025 -5.6888 -5.3143 -5.3061 -5.1527 -5.1518 -5.1042 -5.0925 -5.0801 -5.0769 -3.4514 -3.4459 -3.3797 -3.3792 3.7571 3.7626 3.9680 3.9687 4.2684 4.2699 4.6673 4.6761 4.6953 4.6970 4.9137 4.9203 8.4453 8.4467 8.6669 8.6680 9.7190 9.7205 9.7413 9.7445 9.7731 9.7783 k =-0.3324 0.5790 0.2691 ( 5209 PWs) bands (ev): -22.0442 -22.0442 -22.0147 -22.0147 -21.1908 -21.1908 -21.1907 -21.1907 -6.8878 -6.8839 -6.7856 -6.7766 -6.3486 -6.3462 -6.2437 -6.2432 -5.9642 -5.9576 -5.8726 -5.8649 -5.7991 -5.7903 -5.7030 -5.6908 -5.3155 -5.3083 -5.1516 -5.1509 -5.1046 -5.0942 -5.0800 -5.0772 -3.4463 -3.4415 -3.3752 -3.3747 3.7463 3.7511 3.9540 3.9545 4.2772 4.2788 4.6604 4.6681 4.6947 4.6964 4.8929 4.8991 8.5042 8.5057 8.7464 8.7477 9.6679 9.6703 9.7826 9.7912 9.8228 9.8228 k =-0.3324 0.5790 0.2871 ( 5202 PWs) bands (ev): -22.0423 -22.0423 -22.0167 -22.0167 -21.1908 -21.1908 -21.1907 -21.1907 -6.8798 -6.8757 -6.7874 -6.7787 -6.3499 -6.3479 -6.2428 -6.2427 -5.9717 -5.9660 -5.8701 -5.8633 -5.7997 -5.7923 -5.7034 -5.6927 -5.3164 -5.3104 -5.1507 -5.1500 -5.1049 -5.0959 -5.0799 -5.0775 -3.4416 -3.4375 -3.3710 -3.3706 3.7364 3.7405 3.9406 3.9411 4.2869 4.2884 4.6544 4.6609 4.6932 4.6950 4.8740 4.8798 8.5652 8.5667 8.8242 8.8256 9.6122 9.6141 9.8350 9.8436 9.8726 9.8741 k =-0.3324 0.5790 0.3050 ( 5191 PWs) bands (ev): -22.0403 -22.0403 -22.0187 -22.0187 -21.1908 -21.1908 -21.1907 -21.1907 -6.8723 -6.8680 -6.7893 -6.7810 -6.3511 -6.3494 -6.2421 -6.2420 -5.9786 -5.9738 -5.8678 -5.8620 -5.8002 -5.7941 -5.7036 -5.6945 -5.3171 -5.3121 -5.1499 -5.1493 -5.1050 -5.0974 -5.0798 -5.0777 -3.4375 -3.4340 -3.3673 -3.3670 3.7277 3.7311 3.9285 3.9289 4.2968 4.2983 4.6492 4.6546 4.6911 4.6927 4.8577 4.8628 8.6277 8.6291 8.8962 8.8979 9.5633 9.5651 9.8884 9.8966 9.9233 9.9260 k =-0.3324 0.5790 0.3229 ( 5193 PWs) bands (ev): -22.0382 -22.0382 -22.0208 -22.0208 -21.1908 -21.1908 -21.1907 -21.1907 -6.8655 -6.8613 -6.7910 -6.7835 -6.3520 -6.3507 -6.2415 -6.2413 -5.9845 -5.9806 -5.8657 -5.8609 -5.8006 -5.7956 -5.7037 -5.6962 -5.3177 -5.3137 -5.1492 -5.1488 -5.1050 -5.0989 -5.0797 -5.0780 -3.4339 -3.4311 -3.3642 -3.3639 3.7203 3.7230 3.9180 3.9183 4.3063 4.3076 4.6449 4.6492 4.6883 4.6898 4.8443 4.8486 8.6907 8.6922 8.9562 8.9582 9.5281 9.5301 9.9345 9.9398 9.9710 9.9732 k =-0.3324 0.5790 0.3409 ( 5185 PWs) bands (ev): -22.0360 -22.0360 -22.0229 -22.0229 -21.1908 -21.1908 -21.1907 -21.1907 -6.8595 -6.8558 -6.7923 -6.7861 -6.3527 -6.3517 -6.2409 -6.2407 -5.9892 -5.9863 -5.8639 -5.8602 -5.8007 -5.7970 -5.7035 -5.6978 -5.3180 -5.3150 -5.1487 -5.1484 -5.1048 -5.1002 -5.0795 -5.0783 -3.4310 -3.4289 -3.3617 -3.3615 3.7144 3.7164 3.9096 3.9098 4.3147 4.3157 4.6417 4.6449 4.6854 4.6866 4.8340 4.8373 8.7532 8.7547 8.9953 8.9975 9.5160 9.5182 9.9056 9.9068 10.0155 10.0216 k =-0.3324 0.5790 0.3588 ( 5183 PWs) bands (ev): -22.0339 -22.0339 -22.0251 -22.0251 -21.1908 -21.1908 -21.1907 -21.1907 -6.8546 -6.8517 -6.7932 -6.7886 -6.3532 -6.3525 -6.2404 -6.2402 -5.9926 -5.9907 -5.8623 -5.8599 -5.8006 -5.7981 -5.7031 -5.6993 -5.3181 -5.3161 -5.1483 -5.1481 -5.1045 -5.1014 -5.0794 -5.0785 -3.4287 -3.4273 -3.3598 -3.3597 3.7102 3.7115 3.9033 3.9035 4.3213 4.3221 4.6395 4.6416 4.6828 4.6837 4.8269 4.8292 8.8129 8.8144 9.0067 9.0089 9.5345 9.5368 9.8225 9.8244 10.0710 10.0788 k =-0.3324 0.5790 0.3768 ( 5176 PWs) bands (ev): -22.0317 -22.0317 -22.0273 -22.0273 -21.1907 -21.1907 -21.1907 -21.1907 -6.8512 -6.8496 -6.7932 -6.7907 -6.3534 -6.3531 -6.2400 -6.2399 -5.9945 -5.9936 -5.8611 -5.8599 -5.8003 -5.7991 -5.7025 -5.7006 -5.3180 -5.3170 -5.1480 -5.1479 -5.1040 -5.1024 -5.0792 -5.0787 -3.4272 -3.4265 -3.3587 -3.3586 3.7078 3.7084 3.8996 3.8996 4.3256 4.3260 4.6384 4.6394 4.6811 4.6815 4.8229 4.8241 8.8648 8.8660 8.9945 8.9961 9.5826 9.5848 9.7358 9.7378 10.1285 10.1368 k =-0.3324 0.5790 0.3947 ( 5174 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8494 -6.8494 -6.7924 -6.7924 -6.3534 -6.3534 -6.2399 -6.2399 -5.9948 -5.9948 -5.8603 -5.8603 -5.7998 -5.7998 -5.7016 -5.7016 -5.3176 -5.3176 -5.1479 -5.1479 -5.1033 -5.1033 -5.0790 -5.0790 -3.4265 -3.4265 -3.3583 -3.3583 3.7072 3.7072 3.8983 3.8983 4.3273 4.3273 4.6384 4.6384 4.6806 4.6806 4.8220 4.8220 8.8910 8.8910 8.9819 8.9819 9.6430 9.6430 9.6653 9.6653 10.1751 10.1751 k =-0.3324 0.5790 0.3947 ( 5174 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8494 -6.8494 -6.7924 -6.7924 -6.3534 -6.3534 -6.2399 -6.2399 -5.9948 -5.9948 -5.8603 -5.8603 -5.7998 -5.7998 -5.7016 -5.7016 -5.3176 -5.3176 -5.1479 -5.1479 -5.1033 -5.1033 -5.0790 -5.0790 -3.4265 -3.4265 -3.3583 -3.3583 3.7072 3.7072 3.8983 3.8983 4.3273 4.3273 4.6384 4.6384 4.6806 4.6806 4.8220 4.8220 8.8910 8.8910 8.9819 8.9819 9.6430 9.6430 9.6653 9.6653 10.1751 10.1751 k =-0.3412 0.5636 0.3947 ( 5182 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8493 -6.8493 -6.7924 -6.7924 -6.3530 -6.3530 -6.2397 -6.2397 -5.9949 -5.9949 -5.8609 -5.8609 -5.7995 -5.7995 -5.7016 -5.7016 -5.3176 -5.3176 -5.1487 -5.1487 -5.1027 -5.1027 -5.0789 -5.0789 -3.4265 -3.4265 -3.3585 -3.3585 3.7065 3.7065 3.8961 3.8961 4.3290 4.3290 4.6320 4.6320 4.6877 4.6877 4.8225 4.8225 8.8905 8.8905 8.9810 8.9810 9.6418 9.6418 9.6639 9.6639 10.1648 10.1648 k =-0.3500 0.5483 0.3947 ( 5194 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1908 -21.1908 -21.1907 -21.1907 -6.8489 -6.8489 -6.7926 -6.7926 -6.3518 -6.3518 -6.2395 -6.2395 -5.9950 -5.9950 -5.8629 -5.8629 -5.7983 -5.7983 -5.7016 -5.7016 -5.3174 -5.3174 -5.1519 -5.1519 -5.1002 -5.1002 -5.0786 -5.0786 -3.4268 -3.4268 -3.3593 -3.3593 3.7049 3.7049 3.8904 3.8904 4.3339 4.3339 4.6221 4.6221 4.7001 4.7001 4.8238 4.8238 8.8888 8.8888 8.9779 8.9779 9.6411 9.6411 9.6631 9.6631 10.1398 10.1399 k =-0.3589 0.5329 0.3947 ( 5194 PWs) bands (ev): -22.0295 -22.0295 -22.0295 -22.0295 -21.1907 -21.1907 -21.1907 -21.1907 -6.8483 -6.8483 -6.7929 -6.7929 -6.3498 -6.3498 -6.2391 -6.2391 -5.9950 -5.9950 -5.8662 -5.8662 -5.7960 -5.7960 -5.7018 -5.7018 -5.3169 -5.3169 -5.1569 -5.1569 -5.0964 -5.0964 -5.0779 -5.0779 -3.4272 -3.4272 -3.3606 -3.3606 3.7024 3.7024 3.8813 3.8813 4.3419 4.3419 4.6115 4.6115 4.7146 4.7146 4.8259 4.8259 8.8855 8.8855 8.9724 8.9724 9.6414 9.6414 9.6630 9.6630 10.1121 10.1129 k =-0.3677 0.5175 0.3947 ( 5198 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8475 -6.8475 -6.7933 -6.7933 -6.3471 -6.3471 -6.2388 -6.2388 -5.9952 -5.9952 -5.8709 -5.8709 -5.7928 -5.7928 -5.7020 -5.7020 -5.3163 -5.3163 -5.1630 -5.1630 -5.0920 -5.0920 -5.0770 -5.0770 -3.4277 -3.4277 -3.3625 -3.3625 3.6991 3.6991 3.8694 3.8694 4.3524 4.3524 4.6015 4.6015 4.7299 4.7299 4.8288 4.8288 8.8804 8.8804 8.9641 8.9641 9.6428 9.6428 9.6641 9.6641 10.0851 10.0852 k =-0.3765 0.5022 0.3947 ( 5206 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8464 -6.8464 -6.7939 -6.7939 -6.3436 -6.3436 -6.2384 -6.2384 -5.9953 -5.9953 -5.8766 -5.8766 -5.7890 -5.7890 -5.7023 -5.7023 -5.3154 -5.3154 -5.1700 -5.1700 -5.0873 -5.0873 -5.0757 -5.0757 -3.4282 -3.4282 -3.3649 -3.3649 3.6950 3.6950 3.8553 3.8553 4.3649 4.3649 4.5925 4.5925 4.7457 4.7457 4.8323 4.8323 8.8735 8.8735 8.9532 8.9532 9.6456 9.6456 9.6665 9.6665 10.0601 10.0601 k =-0.3853 0.4868 0.3947 ( 5204 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8452 -6.8452 -6.7946 -6.7946 -6.3395 -6.3395 -6.2381 -6.2381 -5.9954 -5.9954 -5.8830 -5.8830 -5.7846 -5.7846 -5.7027 -5.7027 -5.3143 -5.3143 -5.1773 -5.1773 -5.0828 -5.0828 -5.0741 -5.0741 -3.4287 -3.4287 -3.3676 -3.3676 3.6904 3.6904 3.8396 3.8396 4.3787 4.3787 4.5844 4.5844 4.7614 4.7614 4.8364 4.8364 8.8647 8.8647 8.9397 8.9397 9.6499 9.6499 9.6704 9.6704 10.0374 10.0374 k =-0.3941 0.4714 0.3947 ( 5208 PWs) bands (ev): -22.0296 -22.0296 -22.0296 -22.0296 -21.1907 -21.1907 -21.1907 -21.1907 -6.8437 -6.8437 -6.7955 -6.7955 -6.3348 -6.3348 -6.2378 -6.2378 -5.9954 -5.9954 -5.8902 -5.8902 -5.7799 -5.7799 -5.7032 -5.7032 -5.3130 -5.3130 -5.1850 -5.1850 -5.0787 -5.0787 -5.0721 -5.0721 -3.4291 -3.4291 -3.3708 -3.3708 3.6854 3.6854 3.8228 3.8228 4.3935 4.3935 4.5774 4.5774 4.7770 4.7770 4.8411 4.8411 8.8542 8.8542 8.9240 8.9240 9.6559 9.6559 9.6758 9.6758 10.0171 10.0171 k =-0.4030 0.4561 0.3947 ( 5200 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1907 -21.1907 -21.1906 -21.1906 -6.8420 -6.8420 -6.7966 -6.7966 -6.3295 -6.3295 -6.2377 -6.2377 -5.9954 -5.9954 -5.8978 -5.8978 -5.7750 -5.7750 -5.7039 -5.7039 -5.3113 -5.3113 -5.1928 -5.1928 -5.0752 -5.0752 -5.0697 -5.0697 -3.4294 -3.4294 -3.3742 -3.3742 3.6802 3.6802 3.8054 3.8054 4.4086 4.4086 4.5714 4.5714 4.7921 4.7921 4.8462 4.8462 8.8424 8.8424 8.9064 8.9064 9.6636 9.6636 9.6827 9.6827 9.9991 9.9991 k =-0.4118 0.4407 0.3947 ( 5204 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8402 -6.8402 -6.7978 -6.7978 -6.3238 -6.3238 -6.2378 -6.2378 -5.9952 -5.9952 -5.9057 -5.9057 -5.7700 -5.7700 -5.7047 -5.7047 -5.3094 -5.3094 -5.2007 -5.2007 -5.0722 -5.0722 -5.0669 -5.0669 -3.4296 -3.4296 -3.3778 -3.3778 3.6750 3.6750 3.7880 3.7880 4.4236 4.4236 4.5663 4.5663 4.8066 4.8066 4.8515 4.8515 8.8295 8.8295 8.8876 8.8876 9.6728 9.6728 9.6909 9.6909 9.9834 9.9834 k =-0.4206 0.4253 0.3947 ( 5204 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8382 -6.8382 -6.7991 -6.7991 -6.3177 -6.3177 -6.2382 -6.2382 -5.9949 -5.9949 -5.9138 -5.9138 -5.7650 -5.7650 -5.7057 -5.7057 -5.3071 -5.3071 -5.2085 -5.2085 -5.0697 -5.0697 -5.0639 -5.0639 -3.4295 -3.4295 -3.3817 -3.3817 3.6700 3.6700 3.7708 3.7708 4.4384 4.4384 4.5620 4.5620 4.8202 4.8202 4.8571 4.8571 8.8160 8.8160 8.8680 8.8680 9.6836 9.6836 9.7005 9.7005 9.9694 9.9694 k =-0.4294 0.4100 0.3947 ( 5210 PWs) bands (ev): -22.0297 -22.0297 -22.0297 -22.0297 -21.1906 -21.1906 -21.1906 -21.1906 -6.8361 -6.8361 -6.8007 -6.8007 -6.3113 -6.3113 -6.2389 -6.2389 -5.9944 -5.9944 -5.9219 -5.9219 -5.7599 -5.7599 -5.7069 -5.7069 -5.3046 -5.3046 -5.2164 -5.2164 -5.0673 -5.0673 -5.0612 -5.0612 -3.4292 -3.4292 -3.3856 -3.3856 3.6655 3.6655 3.7542 3.7542 4.4525 4.4525 4.5583 4.5583 4.8329 4.8329 4.8626 4.8626 8.8025 8.8025 8.8484 8.8484 9.6956 9.6956 9.7113 9.7113 9.9569 9.9569 k =-0.4383 0.3946 0.3947 ( 5206 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8339 -6.8339 -6.8023 -6.8023 -6.3047 -6.3047 -6.2400 -6.2400 -5.9937 -5.9937 -5.9299 -5.9299 -5.7550 -5.7550 -5.7083 -5.7083 -5.3016 -5.3016 -5.2240 -5.2240 -5.0651 -5.0651 -5.0588 -5.0588 -3.4285 -3.4285 -3.3896 -3.3896 3.6615 3.6615 3.7384 3.7384 4.4658 4.4658 4.5550 4.5550 4.8444 4.8444 4.8679 4.8679 8.7895 8.7895 8.8293 8.8293 9.7088 9.7088 9.7230 9.7230 9.9453 9.9453 k =-0.4471 0.3792 0.3947 ( 5210 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8316 -6.8316 -6.8041 -6.8041 -6.2980 -6.2980 -6.2414 -6.2414 -5.9926 -5.9926 -5.9378 -5.9378 -5.7501 -5.7501 -5.7100 -5.7100 -5.2984 -5.2984 -5.2315 -5.2315 -5.0629 -5.0629 -5.0568 -5.0568 -3.4276 -3.4276 -3.3937 -3.3937 3.6584 3.6584 3.7237 3.7237 4.4781 4.4781 4.5520 4.5520 4.8547 4.8547 4.8729 4.8729 8.7774 8.7774 8.8113 8.8113 9.7227 9.7227 9.7354 9.7354 9.9344 9.9344 k =-0.4559 0.3639 0.3947 ( 5218 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1906 -21.1906 -6.8292 -6.8292 -6.8060 -6.8060 -6.2914 -6.2914 -6.2434 -6.2434 -5.9911 -5.9911 -5.9454 -5.9454 -5.7455 -5.7455 -5.7119 -5.7119 -5.2948 -5.2948 -5.2388 -5.2388 -5.0609 -5.0609 -5.0552 -5.0552 -3.4264 -3.4264 -3.3976 -3.3976 3.6562 3.6562 3.7101 3.7101 4.4894 4.4894 4.5491 4.5491 4.8636 4.8636 4.8774 4.8774 8.7668 8.7668 8.7947 8.7947 9.7372 9.7372 9.7483 9.7483 9.9237 9.9237 k =-0.4647 0.3485 0.3947 ( 5210 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1906 -21.1906 -21.1905 -21.1905 -6.8268 -6.8268 -6.8080 -6.8080 -6.2848 -6.2848 -6.2459 -6.2459 -5.9891 -5.9891 -5.9525 -5.9525 -5.7410 -5.7410 -5.7140 -5.7140 -5.2908 -5.2908 -5.2459 -5.2459 -5.0591 -5.0591 -5.0541 -5.0541 -3.4248 -3.4248 -3.4015 -3.4015 3.6551 3.6551 3.6980 3.6980 4.4996 4.4996 4.5461 4.5461 4.8711 4.8711 4.8813 4.8813 8.7580 8.7580 8.7802 8.7802 9.7518 9.7518 9.7611 9.7611 9.9133 9.9133 k =-0.4735 0.3331 0.3947 ( 5212 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1905 -21.1905 -21.1905 -21.1905 -6.8243 -6.8243 -6.8102 -6.8102 -6.2784 -6.2784 -6.2489 -6.2489 -5.9867 -5.9867 -5.9592 -5.9592 -5.7367 -5.7367 -5.7164 -5.7164 -5.2864 -5.2864 -5.2527 -5.2527 -5.0574 -5.0574 -5.0535 -5.0535 -3.4230 -3.4230 -3.4053 -3.4053 3.6553 3.6553 3.6873 3.6873 4.5087 4.5087 4.5428 4.5428 4.8772 4.8772 4.8842 4.8842 8.7514 8.7514 8.7679 8.7679 9.7657 9.7657 9.7732 9.7732 9.9033 9.9033 k =-0.4824 0.3178 0.3947 ( 5208 PWs) bands (ev): -22.0298 -22.0298 -22.0298 -22.0298 -21.1905 -21.1905 -21.1905 -21.1905 -6.8219 -6.8219 -6.8124 -6.8124 -6.2723 -6.2723 -6.2525 -6.2525 -5.9837 -5.9837 -5.9653 -5.9653 -5.7327 -5.7327 -5.7191 -5.7191 -5.2817 -5.2817 -5.2591 -5.2591 -5.0559 -5.0559 -5.0532 -5.0532 -3.4207 -3.4207 -3.4089 -3.4089 3.6568 3.6568 3.6781 3.6781 4.5167 4.5167 4.5390 4.5390 4.8818 4.8818 4.8862 4.8862 8.7472 8.7472 8.7582 8.7582 9.7781 9.7781 9.7835 9.7835 9.8945 9.8946 k =-0.4912 0.3024 0.3947 ( 5212 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8194 -6.8194 -6.8147 -6.8147 -6.2666 -6.2666 -6.2566 -6.2566 -5.9800 -5.9800 -5.9709 -5.9709 -5.7289 -5.7289 -5.7221 -5.7221 -5.2766 -5.2766 -5.2653 -5.2653 -5.0548 -5.0548 -5.0534 -5.0534 -3.4182 -3.4182 -3.4122 -3.4122 3.6598 3.6598 3.6704 3.6704 4.5236 4.5236 4.5347 4.5347 4.8849 4.8849 4.8870 4.8870 8.7457 8.7457 8.7512 8.7512 9.7875 9.7875 9.7904 9.7904 9.8884 9.8884 k =-0.5000 0.2870 0.3947 ( 5212 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8170 -6.8170 -6.8170 -6.8170 -6.2614 -6.2614 -6.2614 -6.2614 -5.9758 -5.9758 -5.9758 -5.9758 -5.7253 -5.7253 -5.7253 -5.7253 -5.2711 -5.2711 -5.2711 -5.2711 -5.0539 -5.0539 -5.0539 -5.0539 -3.4154 -3.4154 -3.4154 -3.4154 3.6643 3.6643 3.6643 3.6643 4.5296 4.5296 4.5296 4.5296 4.8866 4.8866 4.8866 4.8866 8.7470 8.7470 8.7470 8.7470 9.7920 9.7920 9.7920 9.7920 9.8866 9.8866 k =-0.5000 0.2870 0.3947 ( 5212 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8170 -6.8170 -6.8170 -6.8170 -6.2614 -6.2614 -6.2614 -6.2614 -5.9758 -5.9758 -5.9758 -5.9758 -5.7253 -5.7253 -5.7253 -5.7253 -5.2711 -5.2711 -5.2711 -5.2711 -5.0539 -5.0539 -5.0539 -5.0539 -3.4154 -3.4154 -3.4154 -3.4154 3.6643 3.6643 3.6643 3.6643 4.5296 4.5296 4.5296 4.5296 4.8866 4.8866 4.8866 4.8866 8.7470 8.7470 8.7470 8.7470 9.7920 9.7920 9.7920 9.7920 9.8866 9.8866 k =-0.5000 0.2870 0.3768 ( 5212 PWs) bands (ev): -22.0321 -22.0321 -22.0276 -22.0276 -21.1906 -21.1906 -21.1904 -21.1904 -6.8251 -6.8251 -6.8095 -6.8095 -6.2704 -6.2704 -6.2518 -6.2518 -5.9855 -5.9855 -5.9656 -5.9656 -5.7305 -5.7305 -5.7203 -5.7203 -5.2747 -5.2747 -5.2674 -5.2674 -5.0557 -5.0557 -5.0522 -5.0522 -3.4173 -3.4173 -3.4142 -3.4142 3.6539 3.6539 3.6771 3.6771 4.5229 4.5229 4.5366 4.5366 4.8777 4.8777 4.8959 4.8959 8.6970 8.6970 8.7907 8.7907 9.7662 9.7662 9.8241 9.8241 9.8334 9.8334 k =-0.5000 0.2870 0.3588 ( 5216 PWs) bands (ev): -22.0343 -22.0343 -22.0254 -22.0254 -21.1907 -21.1907 -21.1903 -21.1903 -6.8337 -6.8337 -6.8026 -6.8026 -6.2788 -6.2788 -6.2417 -6.2417 -5.9946 -5.9946 -5.9549 -5.9549 -5.7359 -5.7359 -5.7154 -5.7154 -5.2782 -5.2782 -5.2635 -5.2635 -5.0576 -5.0576 -5.0506 -5.0506 -3.4200 -3.4200 -3.4138 -3.4138 3.6457 3.6457 3.6923 3.6923 4.5166 4.5166 4.5438 4.5438 4.8693 4.8693 4.9053 4.9053 8.6421 8.6421 8.8263 8.8263 9.7490 9.7490 9.7809 9.7809 9.8616 9.8616 k =-0.5000 0.2870 0.3409 ( 5216 PWs) bands (ev): -22.0364 -22.0364 -22.0233 -22.0233 -21.1908 -21.1908 -21.1902 -21.1902 -6.8428 -6.8428 -6.7962 -6.7962 -6.2866 -6.2866 -6.2313 -6.2313 -6.0031 -6.0031 -5.9439 -5.9439 -5.7412 -5.7412 -5.7106 -5.7106 -5.2815 -5.2815 -5.2595 -5.2595 -5.0595 -5.0595 -5.0490 -5.0490 -3.4233 -3.4233 -3.4141 -3.4141 3.6396 3.6396 3.7098 3.7098 4.5107 4.5107 4.5513 4.5513 4.8614 4.8614 4.9148 4.9148 8.5838 8.5838 8.8528 8.8528 9.7280 9.7280 9.7444 9.7444 9.9013 9.9013 k =-0.5000 0.2870 0.3229 ( 5208 PWs) bands (ev): -22.0386 -22.0386 -22.0211 -22.0211 -21.1909 -21.1909 -21.1901 -21.1901 -6.8522 -6.8522 -6.7904 -6.7904 -6.2937 -6.2937 -6.2205 -6.2205 -6.0111 -6.0111 -5.9326 -5.9326 -5.7467 -5.7467 -5.7061 -5.7061 -5.2847 -5.2847 -5.2553 -5.2553 -5.0615 -5.0615 -5.0475 -5.0475 -3.4274 -3.4274 -3.4151 -3.4151 3.6354 3.6354 3.7297 3.7297 4.5054 4.5054 4.5589 4.5589 4.8541 4.8541 4.9240 4.9240 8.5234 8.5234 8.8695 8.8695 9.6798 9.6798 9.7482 9.7482 9.9415 9.9415 k =-0.5000 0.2870 0.3050 ( 5206 PWs) bands (ev): -22.0407 -22.0407 -22.0190 -22.0190 -21.1910 -21.1910 -21.1900 -21.1900 -6.8619 -6.8619 -6.7852 -6.7852 -6.3002 -6.3002 -6.2094 -6.2094 -6.0184 -6.0184 -5.9211 -5.9211 -5.7521 -5.7521 -5.7017 -5.7017 -5.2878 -5.2878 -5.2511 -5.2511 -5.0637 -5.0637 -5.0461 -5.0461 -3.4320 -3.4320 -3.4168 -3.4168 3.6330 3.6330 3.7519 3.7519 4.5008 4.5008 4.5667 4.5667 4.8476 4.8476 4.9327 4.9327 8.4618 8.4618 8.8769 8.8769 9.6326 9.6326 9.7637 9.7637 9.9802 9.9802 k =-0.5000 0.2870 0.2871 ( 5200 PWs) bands (ev): -22.0427 -22.0427 -22.0169 -22.0169 -21.1911 -21.1911 -21.1899 -21.1899 -6.8719 -6.8719 -6.7806 -6.7806 -6.3060 -6.3060 -6.1981 -6.1981 -6.0252 -6.0252 -5.9095 -5.9095 -5.7574 -5.7574 -5.6976 -5.6976 -5.2908 -5.2908 -5.2467 -5.2467 -5.0659 -5.0659 -5.0448 -5.0448 -3.4372 -3.4372 -3.4191 -3.4191 3.6320 3.6320 3.7761 3.7761 4.4969 4.4969 4.5747 4.5747 4.8418 4.8418 4.9407 4.9407 8.4000 8.4000 8.8764 8.8764 9.5876 9.5876 9.7886 9.7886 10.0146 10.0146 k =-0.5000 0.2870 0.2691 ( 5204 PWs) bands (ev): -22.0447 -22.0447 -22.0149 -22.0149 -21.1912 -21.1912 -21.1899 -21.1899 -6.8820 -6.8820 -6.7765 -6.7765 -6.3112 -6.3112 -6.1867 -6.1867 -6.0313 -6.0313 -5.8981 -5.8981 -5.7626 -5.7626 -5.6936 -5.6936 -5.2937 -5.2937 -5.2422 -5.2422 -5.0683 -5.0683 -5.0435 -5.0435 -3.4428 -3.4428 -3.4220 -3.4220 3.6324 3.6324 3.8023 3.8023 4.4938 4.4938 4.5828 4.5828 4.8368 4.8368 4.9478 4.9478 8.3387 8.3387 8.8700 8.8700 9.5449 9.5449 9.8202 9.8202 10.0388 10.0388 k =-0.5000 0.2870 0.2512 ( 5206 PWs) bands (ev): -22.0466 -22.0466 -22.0130 -22.0130 -21.1913 -21.1913 -21.1898 -21.1898 -6.8921 -6.8921 -6.7729 -6.7729 -6.3157 -6.3157 -6.1754 -6.1754 -6.0369 -6.0369 -5.8871 -5.8871 -5.7674 -5.7674 -5.6899 -5.6899 -5.2964 -5.2964 -5.2376 -5.2376 -5.0707 -5.0707 -5.0423 -5.0423 -3.4488 -3.4488 -3.4253 -3.4253 3.6337 3.6337 3.8301 3.8301 4.4917 4.4917 4.5911 4.5911 4.8325 4.8325 4.9537 4.9537 8.2785 8.2785 8.8600 8.8600 9.5048 9.5048 9.8543 9.8543 10.0253 10.0253 k =-0.5000 0.2870 0.2332 ( 5210 PWs) bands (ev): -22.0484 -22.0484 -22.0112 -22.0112 -21.1914 -21.1914 -21.1897 -21.1897 -6.9021 -6.9021 -6.7698 -6.7698 -6.3197 -6.3197 -6.1641 -6.1641 -6.0419 -6.0419 -5.8769 -5.8769 -5.7717 -5.7717 -5.6865 -5.6865 -5.2991 -5.2991 -5.2330 -5.2330 -5.0732 -5.0732 -5.0412 -5.0412 -3.4550 -3.4550 -3.4289 -3.4289 3.6358 3.6358 3.8593 3.8593 4.4904 4.4904 4.5996 4.5996 4.8290 4.8290 4.9582 4.9582 8.2199 8.2199 8.8484 8.8484 9.4673 9.4673 9.8816 9.8816 9.9822 9.9822 k =-0.5000 0.2870 0.2153 ( 5208 PWs) bands (ev): -22.0501 -22.0501 -22.0094 -22.0094 -21.1914 -21.1914 -21.1896 -21.1896 -6.9118 -6.9118 -6.7670 -6.7670 -6.3232 -6.3232 -6.1529 -6.1529 -6.0464 -6.0464 -5.8677 -5.8677 -5.7751 -5.7751 -5.6832 -5.6832 -5.3016 -5.3016 -5.2283 -5.2283 -5.0758 -5.0758 -5.0401 -5.0401 -3.4613 -3.4613 -3.4329 -3.4329 3.6385 3.6385 3.8895 3.8895 4.4902 4.4902 4.6083 4.6083 4.8262 4.8262 4.9611 4.9611 8.1636 8.1636 8.8371 8.8371 9.4326 9.4326 9.8770 9.8770 9.9622 9.9622 k =-0.5000 0.2870 0.1974 ( 5200 PWs) bands (ev): -22.0517 -22.0517 -22.0078 -22.0078 -21.1915 -21.1915 -21.1895 -21.1895 -6.9213 -6.9213 -6.7647 -6.7647 -6.3261 -6.3261 -6.1420 -6.1420 -6.0503 -6.0503 -5.8600 -5.8600 -5.7773 -5.7773 -5.6802 -5.6802 -5.3040 -5.3040 -5.2235 -5.2235 -5.0785 -5.0785 -5.0390 -5.0390 -3.4677 -3.4677 -3.4370 -3.4370 3.6415 3.6415 3.9203 3.9203 4.4908 4.4908 4.6173 4.6173 4.8240 4.8240 4.9621 4.9621 8.1098 8.1098 8.8275 8.8275 9.4008 9.4008 9.8400 9.8400 9.9299 9.9299 k =-0.5000 0.2870 0.1794 ( 5208 PWs) bands (ev): -22.0532 -22.0532 -22.0063 -22.0063 -21.1916 -21.1916 -21.1895 -21.1895 -6.9303 -6.9303 -6.7627 -6.7627 -6.3286 -6.3286 -6.1315 -6.1315 -6.0537 -6.0537 -5.8545 -5.8545 -5.7778 -5.7778 -5.6774 -5.6774 -5.3062 -5.3062 -5.2189 -5.2189 -5.0812 -5.0812 -5.0381 -5.0381 -3.4740 -3.4740 -3.4413 -3.4413 3.6446 3.6446 3.9512 3.9512 4.4924 4.4924 4.6266 4.6266 4.8224 4.8224 4.9612 4.9612 8.0591 8.0591 8.8208 8.8208 9.3720 9.3720 9.7965 9.7965 9.8903 9.8903 k =-0.5000 0.2870 0.1615 ( 5208 PWs) bands (ev): -22.0546 -22.0546 -22.0049 -22.0049 -21.1916 -21.1916 -21.1894 -21.1894 -6.9388 -6.9388 -6.7610 -6.7610 -6.3307 -6.3307 -6.1215 -6.1215 -6.0566 -6.0566 -5.8513 -5.8513 -5.7766 -5.7766 -5.6749 -5.6749 -5.3083 -5.3083 -5.2143 -5.2143 -5.0839 -5.0839 -5.0372 -5.0372 -3.4801 -3.4801 -3.4454 -3.4454 3.6477 3.6477 3.9818 3.9818 4.4948 4.4948 4.6361 4.6361 4.8214 4.8214 4.9584 4.9584 8.0119 8.0119 8.8177 8.8177 9.3462 9.3462 9.7541 9.7541 9.8528 9.8528 k =-0.5000 0.2870 0.1435 ( 5212 PWs) bands (ev): -22.0558 -22.0558 -22.0036 -22.0036 -21.1917 -21.1917 -21.1894 -21.1894 -6.9467 -6.9467 -6.7596 -6.7596 -6.3324 -6.3324 -6.1121 -6.1121 -6.0589 -6.0589 -5.8503 -5.8503 -5.7736 -5.7736 -5.6727 -5.6727 -5.3103 -5.3103 -5.2098 -5.2098 -5.0867 -5.0867 -5.0364 -5.0364 -3.4859 -3.4859 -3.4495 -3.4495 3.6506 3.6506 4.0113 4.0113 4.4978 4.4978 4.6459 4.6459 4.8209 4.8209 4.9536 4.9536 7.9684 7.9684 8.8185 8.8185 9.3234 9.3234 9.7148 9.7148 9.8185 9.8185 k =-0.5000 0.2870 0.1256 ( 5218 PWs) bands (ev): -22.0569 -22.0569 -22.0025 -22.0025 -21.1918 -21.1918 -21.1893 -21.1893 -6.9539 -6.9539 -6.7584 -6.7584 -6.3339 -6.3339 -6.1035 -6.1035 -6.0606 -6.0606 -5.8512 -5.8512 -5.7694 -5.7694 -5.6707 -5.6707 -5.3121 -5.3121 -5.2055 -5.2055 -5.0894 -5.0894 -5.0356 -5.0356 -3.4912 -3.4912 -3.4534 -3.4534 3.6532 3.6532 4.0393 4.0393 4.5013 4.5013 4.6559 4.6559 4.8208 4.8208 4.9470 4.9470 7.9292 7.9292 8.8236 8.8236 9.3035 9.3035 9.6790 9.6790 9.7876 9.7876 k =-0.5000 0.2870 0.1076 ( 5214 PWs) bands (ev): -22.0579 -22.0579 -22.0015 -22.0015 -21.1918 -21.1918 -21.1893 -21.1893 -6.9602 -6.9602 -6.7575 -6.7575 -6.3350 -6.3350 -6.0960 -6.0960 -6.0617 -6.0617 -5.8532 -5.8532 -5.7646 -5.7646 -5.6690 -5.6690 -5.3137 -5.3137 -5.2015 -5.2015 -5.0920 -5.0920 -5.0350 -5.0350 -3.4961 -3.4961 -3.4569 -3.4569 3.6556 3.6556 4.0652 4.0652 4.5052 4.5052 4.6660 4.6660 4.8210 4.8210 4.9389 4.9389 7.8944 7.8944 8.8324 8.8324 9.2866 9.2866 9.6474 9.6474 9.7603 9.7603 k =-0.5000 0.2870 0.0897 ( 5214 PWs) bands (ev): -22.0588 -22.0588 -22.0006 -22.0006 -21.1919 -21.1919 -21.1892 -21.1892 -6.9657 -6.9657 -6.7567 -6.7567 -6.3359 -6.3359 -6.0899 -6.0899 -6.0619 -6.0619 -5.8558 -5.8558 -5.7598 -5.7598 -5.6675 -5.6675 -5.3151 -5.3151 -5.1978 -5.1978 -5.0944 -5.0944 -5.0344 -5.0344 -3.5004 -3.5004 -3.4600 -3.4600 3.6576 3.6576 4.0882 4.0882 4.5091 4.5091 4.6760 4.6760 4.8214 4.8214 4.9298 4.9298 7.8644 7.8644 8.8445 8.8445 9.2725 9.2725 9.6202 9.6202 9.7368 9.7368 k =-0.5000 0.2870 0.0718 ( 5210 PWs) bands (ev): -22.0594 -22.0594 -21.9999 -21.9999 -21.1919 -21.1919 -21.1892 -21.1892 -6.9703 -6.9703 -6.7561 -6.7561 -6.3366 -6.3366 -6.0853 -6.0853 -6.0613 -6.0613 -5.8586 -5.8586 -5.7554 -5.7554 -5.6663 -5.6663 -5.3163 -5.3163 -5.1946 -5.1946 -5.0965 -5.0965 -5.0340 -5.0340 -3.5040 -3.5040 -3.4627 -3.4627 3.6592 3.6592 4.1080 4.1080 4.5129 4.5129 4.6857 4.6857 4.8220 4.8220 4.9201 4.9201 7.8395 7.8395 8.8586 8.8586 9.2611 9.2611 9.5977 9.5977 9.7167 9.7167 k =-0.5000 0.2870 0.0538 ( 5214 PWs) bands (ev): -22.0600 -22.0600 -21.9994 -21.9994 -21.1919 -21.1919 -21.1892 -21.1892 -6.9739 -6.9739 -6.7556 -6.7556 -6.3371 -6.3371 -6.0823 -6.0823 -6.0600 -6.0600 -5.8611 -5.8611 -5.7518 -5.7518 -5.6653 -5.6653 -5.3172 -5.3172 -5.1920 -5.1920 -5.0983 -5.0983 -5.0336 -5.0336 -3.5069 -3.5069 -3.4648 -3.4648 3.6605 3.6605 4.1239 4.1239 4.5162 4.5162 4.6945 4.6945 4.8227 4.8227 4.9109 4.9109 7.8199 7.8199 8.8731 8.8731 9.2525 9.2525 9.5802 9.5802 9.6982 9.6982 k =-0.5000 0.2870 0.0359 ( 5212 PWs) bands (ev): -22.0604 -22.0604 -21.9990 -21.9990 -21.1919 -21.1919 -21.1892 -21.1892 -6.9765 -6.9765 -6.7553 -6.7553 -6.3375 -6.3375 -6.0806 -6.0806 -6.0585 -6.0585 -5.8632 -5.8632 -5.7490 -5.7490 -5.6647 -5.6647 -5.3179 -5.3179 -5.1900 -5.1900 -5.0997 -5.0997 -5.0333 -5.0333 -3.5090 -3.5090 -3.4664 -3.4664 3.6614 3.6614 4.1355 4.1355 4.5188 4.5188 4.7016 4.7016 4.8233 4.8233 4.9030 4.9030 7.8057 7.8057 8.8859 8.8859 9.2464 9.2464 9.5678 9.5678 9.6753 9.6753 k =-0.5000 0.2870 0.0179 ( 5200 PWs) bands (ev): -22.0606 -22.0606 -21.9987 -21.9987 -21.1919 -21.1919 -21.1891 -21.1891 -6.9781 -6.9781 -6.7551 -6.7551 -6.3377 -6.3377 -6.0798 -6.0798 -6.0573 -6.0573 -5.8645 -5.8645 -5.7473 -5.7473 -5.6643 -5.6643 -5.3183 -5.3183 -5.1888 -5.1888 -5.1005 -5.1005 -5.0331 -5.0331 -3.5103 -3.5103 -3.4674 -3.4674 3.6619 3.6619 4.1426 4.1426 4.5204 4.5204 4.7064 4.7064 4.8237 4.8237 4.8976 4.8976 7.7972 7.7972 8.8949 8.8949 9.2427 9.2427 9.5606 9.5606 9.6531 9.6531 k =-0.5000 0.2870 0.0000 ( 5204 PWs) bands (ev): -22.0607 -22.0607 -21.9986 -21.9986 -21.1919 -21.1919 -21.1892 -21.1892 -6.9786 -6.9786 -6.7551 -6.7551 -6.3377 -6.3377 -6.0796 -6.0796 -6.0568 -6.0568 -5.8649 -5.8649 -5.7467 -5.7467 -5.6641 -5.6641 -5.3184 -5.3184 -5.1884 -5.1884 -5.1008 -5.1008 -5.0331 -5.0331 -3.5107 -3.5107 -3.4677 -3.4677 3.6621 3.6621 4.1450 4.1450 4.5210 4.5210 4.7081 4.7081 4.8239 4.8239 4.8957 4.8957 7.7943 7.7943 8.8981 8.8981 9.2415 9.2415 9.5582 9.5582 9.6447 9.6447 k = 0.0000 0.0000 0.3947 ( 5246 PWs) bands (ev): -22.0321 -22.0321 -22.0321 -22.0321 -21.1892 -21.1892 -21.1892 -21.1892 -6.7991 -6.7991 -6.7991 -6.7991 -6.0607 -6.0607 -6.0607 -6.0607 -5.9159 -5.9159 -5.9159 -5.9159 -5.8729 -5.8729 -5.8729 -5.8729 -5.1553 -5.1553 -5.1553 -5.1553 -5.1234 -5.1234 -5.1234 -5.1234 -3.6975 -3.6975 -3.6975 -3.6975 3.9236 3.9236 3.9236 3.9236 4.4514 4.4514 4.4514 4.4514 4.5877 4.5877 4.5877 4.5877 8.5756 8.5756 8.5756 8.5756 9.3965 9.3965 9.3965 9.3965 9.4411 9.4411 k =-0.0161 0.0093 0.3947 ( 5228 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.7991 -6.7991 -6.7991 -6.7991 -6.0620 -6.0620 -6.0606 -6.0606 -5.9172 -5.9172 -5.9164 -5.9164 -5.8730 -5.8730 -5.8704 -5.8704 -5.1576 -5.1576 -5.1567 -5.1567 -5.1222 -5.1222 -5.1212 -5.1212 -3.6969 -3.6969 -3.6965 -3.6965 3.9215 3.9215 3.9226 3.9226 4.4492 4.4492 4.4500 4.4500 4.5914 4.5914 4.5916 4.5916 8.5777 8.5777 8.5779 8.5779 9.3963 9.3963 9.3964 9.3964 9.4411 9.4411 k =-0.0323 0.0185 0.3947 ( 5234 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.7992 -6.7992 -6.7992 -6.7992 -6.0645 -6.0645 -6.0617 -6.0617 -5.9197 -5.9197 -5.9185 -5.9185 -5.8708 -5.8708 -5.8662 -5.8662 -5.1627 -5.1627 -5.1612 -5.1612 -5.1183 -5.1183 -5.1167 -5.1167 -3.6946 -3.6946 -3.6938 -3.6938 3.9165 3.9165 3.9187 3.9187 4.4440 4.4440 4.4455 4.4455 4.6018 4.6018 4.6022 4.6022 8.5842 8.5842 8.5846 8.5846 9.3956 9.3956 9.3958 9.3958 9.4415 9.4415 k =-0.0484 0.0278 0.3947 ( 5226 PWs) bands (ev): -22.0320 -22.0320 -22.0320 -22.0320 -21.1892 -21.1892 -21.1892 -21.1892 -6.7994 -6.7994 -6.7994 -6.7994 -6.0682 -6.0682 -6.0641 -6.0641 -5.9230 -5.9230 -5.9218 -5.9218 -5.8668 -5.8668 -5.8607 -5.8607 -5.1691 -5.1691 -5.1673 -5.1673 -5.1130 -5.1130 -5.1111 -5.1111 -3.6907 -3.6907 -3.6896 -3.6896 3.9088 3.9088 3.9120 3.9120 4.4376 4.4376 4.4397 4.4397 4.6171 4.6171 4.6178 4.6178 8.5951 8.5951 8.5956 8.5956 9.3941 9.3941 9.3944 9.3944 9.4426 9.4426 k =-0.0645 0.0370 0.3947 ( 5222 PWs) bands (ev): -22.0320 -22.0320 -22.0319 -22.0319 -21.1892 -21.1892 -21.1892 -21.1892 -6.7996 -6.7996 -6.7996 -6.7996 -6.0729 -6.0729 -6.0677 -6.0677 -5.9266 -5.9266 -5.9256 -5.9256 -5.8617 -5.8617 -5.8544 -5.8544 -5.1762 -5.1762 -5.1742 -5.1742 -5.1074 -5.1074 -5.1053 -5.1053 -3.6853 -3.6853 -3.6838 -3.6838 3.8985 3.8985 3.9026 3.9026 4.4312 4.4312 4.4338 4.4338 4.6357 4.6357 4.6366 4.6366 8.6103 8.6103 8.6109 8.6109 9.3912 9.3912 9.3918 9.3918 9.4448 9.4448 k =-0.0806 0.0463 0.3947 ( 5222 PWs) bands (ev): -22.0319 -22.0319 -22.0319 -22.0319 -21.1892 -21.1892 -21.1892 -21.1892 -6.8000 -6.8000 -6.7999 -6.7999 -6.0786 -6.0786 -6.0724 -6.0724 -5.9302 -5.9302 -5.9296 -5.9296 -5.8557 -5.8557 -5.8477 -5.8477 -5.1836 -5.1836 -5.1815 -5.1815 -5.1017 -5.1017 -5.0995 -5.0995 -3.6784 -3.6784 -3.6766 -3.6766 3.8861 3.8861 3.8910 3.8910 4.4259 4.4259 4.4289 4.4289 4.6562 4.6562 4.6573 4.6573 8.6297 8.6297 8.6305 8.6305 9.3867 9.3867 9.3876 9.3876 9.4484 9.4484 k =-0.0968 0.0556 0.3947 ( 5234 PWs) bands (ev): -22.0319 -22.0319 -22.0319 -22.0319 -21.1893 -21.1893 -21.1893 -21.1893 -6.8004 -6.8004 -6.8003 -6.8003 -6.0852 -6.0852 -6.0783 -6.0783 -5.9338 -5.9338 -5.9336 -5.9336 -5.8493 -5.8493 -5.8407 -5.8407 -5.1910 -5.1910 -5.1888 -5.1888 -5.0962 -5.0962 -5.0940 -5.0940 -3.6701 -3.6701 -3.6680 -3.6680 3.8720 3.8720 3.8775 3.8775 4.4222 4.4222 4.4256 4.4256 4.6776 4.6776 4.6789 4.6789 8.6533 8.6533 8.6543 8.6543 9.3802 9.3802 9.3815 9.3815 9.4537 9.4537 k =-0.1129 0.0648 0.3947 ( 5246 PWs) bands (ev): -22.0318 -22.0318 -22.0318 -22.0318 -21.1893 -21.1893 -21.1893 -21.1893 -6.8008 -6.8008 -6.8008 -6.8008 -6.0926 -6.0926 -6.0852 -6.0852 -5.9374 -5.9374 -5.9372 -5.9372 -5.8426 -5.8426 -5.8336 -5.8336 -5.1983 -5.1983 -5.1960 -5.1960 -5.0911 -5.0911 -5.0887 -5.0887 -3.6606 -3.6606 -3.6582 -3.6582 3.8564 3.8564 3.8625 3.8625 4.4203 4.4203 4.4239 4.4239 4.6992 4.6992 4.7006 4.7006 8.6810 8.6810 8.6822 8.6822 9.3717 9.3717 9.3732 9.3732 9.4606 9.4606 k =-0.1290 0.0741 0.3947 ( 5242 PWs) bands (ev): -22.0317 -22.0317 -22.0317 -22.0317 -21.1894 -21.1894 -21.1894 -21.1894 -6.8014 -6.8014 -6.8013 -6.8013 -6.1007 -6.1007 -6.0930 -6.0930 -5.9408 -5.9408 -5.9403 -5.9403 -5.8357 -5.8357 -5.8264 -5.8264 -5.2054 -5.2054 -5.2031 -5.2031 -5.0863 -5.0863 -5.0839 -5.0839 -3.6499 -3.6499 -3.6472 -3.6472 3.8400 3.8400 3.8464 3.8464 4.4203 4.4203 4.4240 4.4240 4.7205 4.7205 4.7220 4.7220 8.7126 8.7126 8.7139 8.7139 9.3611 9.3611 9.3630 9.3630 9.4692 9.4692 k =-0.1452 0.0833 0.3947 ( 5234 PWs) bands (ev): -22.0316 -22.0316 -22.0316 -22.0316 -21.1894 -21.1894 -21.1894 -21.1894 -6.8020 -6.8020 -6.8018 -6.8018 -6.1094 -6.1094 -6.1015 -6.1015 -5.9441 -5.9441 -5.9433 -5.9433 -5.8286 -5.8286 -5.8192 -5.8192 -5.2123 -5.2123 -5.2099 -5.2099 -5.0818 -5.0818 -5.0794 -5.0794 -3.6382 -3.6382 -3.6354 -3.6354 3.8231 3.8231 3.8298 3.8298 4.4219 4.4219 4.4258 4.4258 4.7410 4.7410 4.7425 4.7425 8.7478 8.7478 8.7493 8.7493 9.3487 9.3487 9.3507 9.3507 9.4793 9.4793 k =-0.1613 0.0926 0.3947 ( 5234 PWs) bands (ev): -22.0315 -22.0315 -22.0315 -22.0315 -21.1895 -21.1895 -21.1895 -21.1895 -6.8026 -6.8026 -6.8024 -6.8024 -6.1186 -6.1186 -6.1107 -6.1107 -5.9470 -5.9470 -5.9461 -5.9461 -5.8216 -5.8216 -5.8121 -5.8121 -5.2188 -5.2188 -5.2163 -5.2163 -5.0778 -5.0778 -5.0754 -5.0754 -3.6257 -3.6257 -3.6227 -3.6227 3.8061 3.8061 3.8130 3.8130 4.4251 4.4251 4.4290 4.4290 4.7604 4.7604 4.7619 4.7619 8.7862 8.7862 8.7879 8.7879 9.3346 9.3346 9.3367 9.3367 9.4910 9.4910 k =-0.1774 0.1019 0.3947 ( 5246 PWs) bands (ev): -22.0315 -22.0315 -22.0315 -22.0315 -21.1896 -21.1896 -21.1896 -21.1896 -6.8033 -6.8033 -6.8031 -6.8031 -6.1281 -6.1281 -6.1204 -6.1204 -5.9498 -5.9498 -5.9488 -5.9488 -5.8145 -5.8145 -5.8051 -5.8051 -5.2250 -5.2250 -5.2224 -5.2224 -5.0742 -5.0742 -5.0717 -5.0717 -3.6125 -3.6125 -3.6094 -3.6094 3.7894 3.7894 3.7963 3.7963 4.4296 4.4296 4.4335 4.4335 4.7784 4.7784 4.7800 4.7800 8.8273 8.8273 8.8292 8.8292 9.3192 9.3192 9.3215 9.3215 9.5041 9.5043 k =-0.1935 0.1111 0.3947 ( 5246 PWs) bands (ev): -22.0314 -22.0314 -22.0314 -22.0314 -21.1896 -21.1896 -21.1896 -21.1896 -6.8041 -6.8041 -6.8038 -6.8038 -6.1379 -6.1379 -6.1304 -6.1304 -5.9523 -5.9523 -5.9513 -5.9513 -5.8075 -5.8075 -5.7982 -5.7982 -5.2308 -5.2308 -5.2281 -5.2281 -5.0710 -5.0710 -5.0685 -5.0685 -3.5988 -3.5988 -3.5955 -3.5955 3.7732 3.7732 3.7801 3.7801 4.4353 4.4353 4.4392 4.4392 4.7950 4.7950 4.7965 4.7965 8.8701 8.8701 8.8722 8.8722 9.3034 9.3034 9.3058 9.3058 9.5187 9.5188 k =-0.2097 0.1204 0.3947 ( 5246 PWs) bands (ev): -22.0312 -22.0312 -22.0312 -22.0312 -21.1897 -21.1897 -21.1897 -21.1897 -6.8049 -6.8049 -6.8046 -6.8046 -6.1479 -6.1479 -6.1407 -6.1407 -5.9547 -5.9547 -5.9536 -5.9536 -5.8006 -5.8006 -5.7915 -5.7915 -5.2362 -5.2362 -5.2334 -5.2334 -5.0682 -5.0682 -5.0657 -5.0657 -3.5847 -3.5847 -3.5814 -3.5814 3.7578 3.7578 3.7646 3.7646 4.4418 4.4418 4.4457 4.4457 4.8099 4.8099 4.8113 4.8113 8.9131 8.9131 8.9152 8.9152 9.2887 9.2887 9.2910 9.2910 9.5347 9.5348 k =-0.2258 0.1296 0.3947 ( 5254 PWs) bands (ev): -22.0311 -22.0311 -22.0311 -22.0311 -21.1898 -21.1898 -21.1898 -21.1898 -6.8058 -6.8058 -6.8054 -6.8054 -6.1579 -6.1579 -6.1511 -6.1511 -5.9569 -5.9569 -5.9559 -5.9559 -5.7938 -5.7938 -5.7849 -5.7849 -5.2411 -5.2411 -5.2383 -5.2383 -5.0657 -5.0657 -5.0633 -5.0633 -3.5704 -3.5704 -3.5671 -3.5671 3.7434 3.7434 3.7501 3.7501 4.4491 4.4491 4.4528 4.4528 4.8231 4.8231 4.8244 4.8244 8.9533 8.9533 8.9556 8.9556 9.2776 9.2776 9.2799 9.2799 9.5520 9.5521 k =-0.2419 0.1389 0.3947 ( 5248 PWs) bands (ev): -22.0310 -22.0310 -22.0310 -22.0310 -21.1898 -21.1898 -21.1898 -21.1898 -6.8067 -6.8067 -6.8063 -6.8063 -6.1679 -6.1679 -6.1615 -6.1615 -5.9590 -5.9590 -5.9580 -5.9580 -5.7871 -5.7871 -5.7786 -5.7786 -5.2456 -5.2456 -5.2428 -5.2428 -5.0636 -5.0636 -5.0612 -5.0612 -3.5560 -3.5560 -3.5527 -3.5527 3.7302 3.7302 3.7367 3.7367 4.4568 4.4568 4.4604 4.4604 4.8347 4.8347 4.8359 4.8359 8.9865 8.9865 8.9888 8.9888 9.2746 9.2746 9.2768 9.2768 9.5706 9.5707 k =-0.2581 0.1482 0.3947 ( 5244 PWs) bands (ev): -22.0309 -22.0309 -22.0309 -22.0309 -21.1899 -21.1899 -21.1899 -21.1899 -6.8076 -6.8076 -6.8072 -6.8072 -6.1777 -6.1777 -6.1718 -6.1718 -5.9610 -5.9610 -5.9600 -5.9600 -5.7807 -5.7807 -5.7725 -5.7725 -5.2496 -5.2496 -5.2468 -5.2468 -5.0618 -5.0618 -5.0594 -5.0594 -3.5418 -3.5418 -3.5385 -3.5385 3.7182 3.7182 3.7245 3.7245 4.4647 4.4647 4.4682 4.4682 4.8446 4.8446 4.8457 4.8457 9.0069 9.0069 9.0090 9.0090 9.2853 9.2853 9.2873 9.2873 9.5905 9.5906 k =-0.2742 0.1574 0.3947 ( 5238 PWs) bands (ev): -22.0308 -22.0308 -22.0308 -22.0308 -21.1900 -21.1900 -21.1900 -21.1900 -6.8085 -6.8085 -6.8081 -6.8081 -6.1873 -6.1873 -6.1818 -6.1818 -5.9628 -5.9628 -5.9619 -5.9619 -5.7744 -5.7744 -5.7667 -5.7667 -5.2532 -5.2532 -5.2504 -5.2504 -5.0603 -5.0603 -5.0579 -5.0579 -3.5278 -3.5278 -3.5246 -3.5246 3.7075 3.7075 3.7136 3.7136 4.4726 4.4726 4.4761 4.4761 4.8530 4.8530 4.8540 4.8540 9.0111 9.0111 9.0129 9.0129 9.3129 9.3129 9.3144 9.3144 9.6116 9.6117 k =-0.2903 0.1667 0.3947 ( 5246 PWs) bands (ev): -22.0307 -22.0307 -22.0307 -22.0307 -21.1900 -21.1900 -21.1900 -21.1900 -6.8094 -6.8094 -6.8090 -6.8090 -6.1966 -6.1966 -6.1916 -6.1916 -5.9645 -5.9645 -5.9637 -5.9637 -5.7685 -5.7685 -5.7612 -5.7612 -5.2564 -5.2564 -5.2537 -5.2537 -5.0590 -5.0590 -5.0567 -5.0567 -3.5142 -3.5142 -3.5111 -3.5111 3.6982 3.6982 3.7040 3.7040 4.4805 4.4805 4.4837 4.4837 4.8600 4.8600 4.8609 4.8609 9.0011 9.0011 9.0025 9.0025 9.3550 9.3550 9.3562 9.3562 9.6337 9.6339 k =-0.3065 0.1759 0.3947 ( 5262 PWs) bands (ev): -22.0306 -22.0306 -22.0306 -22.0306 -21.1901 -21.1901 -21.1901 -21.1901 -6.8104 -6.8104 -6.8099 -6.8099 -6.2055 -6.2055 -6.2010 -6.2010 -5.9662 -5.9662 -5.9654 -5.9654 -5.7628 -5.7628 -5.7560 -5.7560 -5.2593 -5.2593 -5.2566 -5.2566 -5.0580 -5.0580 -5.0558 -5.0558 -3.5010 -3.5010 -3.4981 -3.4981 3.6902 3.6902 3.6957 3.6957 4.4880 4.4880 4.4911 4.4911 4.8658 4.8658 4.8665 4.8665 8.9815 8.9815 8.9826 8.9826 9.4064 9.4064 9.4075 9.4075 9.6569 9.6570 k =-0.3226 0.1852 0.3947 ( 5260 PWs) bands (ev): -22.0305 -22.0305 -22.0305 -22.0305 -21.1902 -21.1902 -21.1902 -21.1902 -6.8113 -6.8113 -6.8108 -6.8108 -6.2139 -6.2139 -6.2099 -6.2099 -5.9677 -5.9677 -5.9669 -5.9669 -5.7574 -5.7574 -5.7511 -5.7511 -5.2617 -5.2617 -5.2591 -5.2591 -5.0571 -5.0571 -5.0551 -5.0551 -3.4885 -3.4885 -3.4857 -3.4857 3.6835 3.6835 3.6886 3.6886 4.4950 4.4950 4.4979 4.4979 4.8705 4.8705 4.8711 4.8711 8.9564 8.9564 8.9574 8.9574 9.4624 9.4624 9.4635 9.4635 9.6810 9.6812 k =-0.3387 0.1945 0.3947 ( 5256 PWs) bands (ev): -22.0304 -22.0304 -22.0304 -22.0304 -21.1902 -21.1902 -21.1902 -21.1902 -6.8122 -6.8122 -6.8117 -6.8117 -6.2218 -6.2218 -6.2182 -6.2182 -5.9691 -5.9691 -5.9684 -5.9684 -5.7524 -5.7524 -5.7466 -5.7466 -5.2638 -5.2638 -5.2613 -5.2613 -5.0564 -5.0564 -5.0545 -5.0545 -3.4767 -3.4767 -3.4741 -3.4741 3.6781 3.6781 3.6828 3.6828 4.5015 4.5015 4.5042 4.5042 4.8742 4.8742 4.8747 4.8747 8.9287 8.9287 8.9295 8.9295 9.5194 9.5194 9.5206 9.5206 9.7057 9.7059 k =-0.3548 0.2037 0.3947 ( 5240 PWs) bands (ev): -22.0303 -22.0303 -22.0303 -22.0303 -21.1903 -21.1903 -21.1903 -21.1903 -6.8130 -6.8130 -6.8126 -6.8126 -6.2290 -6.2290 -6.2260 -6.2260 -5.9703 -5.9703 -5.9697 -5.9697 -5.7477 -5.7477 -5.7424 -5.7424 -5.2656 -5.2656 -5.2632 -5.2632 -5.0559 -5.0559 -5.0541 -5.0541 -3.4658 -3.4658 -3.4634 -3.4634 3.6737 3.6737 3.6781 3.6781 4.5073 4.5073 4.5098 4.5098 4.8772 4.8772 4.8776 4.8776 8.9002 8.9002 8.9009 8.9009 9.5744 9.5744 9.5758 9.5758 9.7308 9.7309 k =-0.3710 0.2130 0.3947 ( 5224 PWs) bands (ev): -22.0302 -22.0302 -22.0302 -22.0302 -21.1903 -21.1903 -21.1903 -21.1903 -6.8138 -6.8138 -6.8134 -6.8134 -6.2357 -6.2357 -6.2330 -6.2330 -5.9715 -5.9715 -5.9709 -5.9709 -5.7434 -5.7434 -5.7387 -5.7387 -5.2670 -5.2670 -5.2649 -5.2649 -5.0554 -5.0554 -5.0538 -5.0538 -3.4557 -3.4557 -3.4535 -3.4535 3.6704 3.6704 3.6743 3.6743 4.5124 4.5124 4.5147 4.5147 4.8796 4.8796 4.8799 4.8799 8.8721 8.8721 8.8727 8.8727 9.6250 9.6250 9.6266 9.6266 9.7560 9.7562 k =-0.3871 0.2222 0.3947 ( 5220 PWs) bands (ev): -22.0301 -22.0301 -22.0301 -22.0301 -21.1904 -21.1904 -21.1904 -21.1904 -6.8145 -6.8145 -6.8141 -6.8141 -6.2417 -6.2417 -6.2394 -6.2394 -5.9725 -5.9725 -5.9720 -5.9720 -5.7395 -5.7395 -5.7354 -5.7354 -5.2683 -5.2683 -5.2663 -5.2663 -5.0551 -5.0551 -5.0536 -5.0536 -3.4467 -3.4467 -3.4447 -3.4447 3.6679 3.6679 3.6714 3.6714 4.5167 4.5167 4.5188 4.5188 4.8814 4.8814 4.8817 4.8817 8.8454 8.8454 8.8460 8.8460 9.6692 9.6692 9.6711 9.6711 9.7810 9.7810 k =-0.4032 0.2315 0.3947 ( 5216 PWs) bands (ev): -22.0301 -22.0301 -22.0301 -22.0301 -21.1904 -21.1904 -21.1904 -21.1904 -6.8152 -6.8152 -6.8148 -6.8148 -6.2469 -6.2469 -6.2450 -6.2450 -5.9734 -5.9734 -5.9730 -5.9730 -5.7361 -5.7361 -5.7325 -5.7325 -5.2692 -5.2692 -5.2675 -5.2675 -5.0548 -5.0548 -5.0535 -5.0535 -3.4387 -3.4387 -3.4370 -3.4370 3.6662 3.6662 3.6692 3.6692 4.5203 4.5203 4.5221 4.5221 4.8829 4.8829 4.8831 4.8831 8.8209 8.8209 8.8214 8.8214 9.7060 9.7060 9.7080 9.7080 9.8049 9.8049 k =-0.4194 0.2407 0.3947 ( 5208 PWs) bands (ev): -22.0300 -22.0300 -22.0300 -22.0300 -21.1904 -21.1904 -21.1904 -21.1904 -6.8158 -6.8158 -6.8154 -6.8154 -6.2514 -6.2514 -6.2498 -6.2498 -5.9741 -5.9741 -5.9738 -5.9738 -5.7331 -5.7331 -5.7301 -5.7301 -5.2700 -5.2700 -5.2685 -5.2685 -5.0546 -5.0546 -5.0535 -5.0535 -3.4318 -3.4318 -3.4303 -3.4303 3.6651 3.6651 3.6676 3.6676 4.5233 4.5233 4.5248 4.5248 4.8841 4.8841 4.8842 4.8842 8.7993 8.7993 8.7997 8.7997 9.7351 9.7351 9.7370 9.7370 9.8271 9.8272 k =-0.4355 0.2500 0.3947 ( 5212 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8162 -6.8162 -6.8160 -6.8160 -6.2551 -6.2551 -6.2538 -6.2538 -5.9747 -5.9747 -5.9745 -5.9745 -5.7305 -5.7305 -5.7282 -5.7282 -5.2705 -5.2705 -5.2693 -5.2693 -5.0544 -5.0544 -5.0535 -5.0535 -3.4260 -3.4260 -3.4249 -3.4249 3.6644 3.6644 3.6665 3.6665 4.5255 4.5255 4.5268 4.5268 4.8850 4.8850 4.8851 4.8851 8.7809 8.7809 8.7813 8.7813 9.7572 9.7572 9.7589 9.7589 9.8469 9.8470 k =-0.4516 0.2593 0.3947 ( 5216 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8166 -6.8166 -6.8164 -6.8164 -6.2579 -6.2579 -6.2570 -6.2570 -5.9752 -5.9752 -5.9750 -5.9750 -5.7285 -5.7285 -5.7267 -5.7267 -5.2709 -5.2709 -5.2700 -5.2700 -5.0543 -5.0543 -5.0536 -5.0536 -3.4215 -3.4215 -3.4206 -3.4206 3.6641 3.6641 3.6657 3.6657 4.5273 4.5273 4.5282 4.5282 4.8857 4.8857 4.8858 4.8858 8.7663 8.7663 8.7665 8.7665 9.7730 9.7730 9.7744 9.7744 9.8635 9.8635 k =-0.4677 0.2685 0.3947 ( 5206 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8169 -6.8169 -6.8167 -6.8167 -6.2599 -6.2599 -6.2593 -6.2593 -5.9755 -5.9755 -5.9754 -5.9754 -5.7269 -5.7269 -5.7257 -5.7257 -5.2711 -5.2711 -5.2705 -5.2705 -5.0541 -5.0541 -5.0537 -5.0537 -3.4182 -3.4182 -3.4176 -3.4176 3.6640 3.6640 3.6651 3.6651 4.5285 4.5285 4.5291 4.5291 4.8862 4.8862 4.8863 4.8863 8.7556 8.7556 8.7558 8.7558 9.7836 9.7836 9.7846 9.7846 9.8760 9.8761 k =-0.4839 0.2778 0.3947 ( 5210 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8170 -6.8170 -6.8169 -6.8169 -6.2611 -6.2611 -6.2608 -6.2608 -5.9757 -5.9757 -5.9757 -5.9757 -5.7259 -5.7259 -5.7253 -5.7253 -5.2712 -5.2712 -5.2709 -5.2709 -5.0540 -5.0540 -5.0538 -5.0538 -3.4161 -3.4161 -3.4159 -3.4159 3.6641 3.6641 3.6647 3.6647 4.5292 4.5292 4.5295 4.5295 4.8865 4.8865 4.8866 4.8866 8.7492 8.7492 8.7492 8.7492 9.7898 9.7898 9.7903 9.7903 9.8839 9.8840 k =-0.5000 0.2870 0.3947 ( 5212 PWs) bands (ev): -22.0299 -22.0299 -22.0299 -22.0299 -21.1905 -21.1905 -21.1905 -21.1905 -6.8170 -6.8170 -6.8170 -6.8170 -6.2614 -6.2614 -6.2614 -6.2614 -5.9758 -5.9758 -5.9758 -5.9758 -5.7253 -5.7253 -5.7253 -5.7253 -5.2711 -5.2711 -5.2711 -5.2711 -5.0539 -5.0539 -5.0539 -5.0539 -3.4154 -3.4154 -3.4154 -3.4154 3.6643 3.6643 3.6643 3.6643 4.5296 4.5296 4.5296 4.5296 4.8866 4.8866 4.8866 4.8866 8.7470 8.7470 8.7470 8.7470 9.7920 9.7920 9.7920 9.7920 9.8866 9.8866 Writing output data file Rb2Te.save init_run : 4.69s CPU 14.01s WALL ( 1 calls) electrons : 1303.69s CPU 1314.33s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.28s CPU 1.60s WALL ( 1 calls) Called by electrons: c_bands : 1303.64s CPU 1313.83s WALL ( 1 calls) v_of_rho : 0.04s CPU 0.91s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.04s CPU 0.62s WALL ( 1 calls) newd : 0.73s CPU 0.81s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.16s WALL ( 308 calls) cegterg : 1200.29s CPU 1206.58s WALL ( 1129 calls) Called by sum_band: Called by *egterg: h_psi : 499.70s CPU 511.67s WALL ( 21529 calls) s_psi : 65.52s CPU 65.96s WALL ( 21529 calls) g_psi : 1.09s CPU 1.14s WALL ( 20092 calls) cdiaghg : 493.07s CPU 488.16s WALL ( 20400 calls) cegterg:over : 82.67s CPU 78.34s WALL ( 20092 calls) cegterg:upda : 22.02s CPU 28.28s WALL ( 20092 calls) cegterg:last : 13.71s CPU 14.47s WALL ( 2079 calls) Called by h_psi: h_psi:vloc : 375.76s CPU 385.69s WALL ( 21529 calls) h_psi:vnl : 123.34s CPU 124.70s WALL ( 21529 calls) add_vuspsi : 47.36s CPU 54.39s WALL ( 21529 calls) General routines calbec : 75.88s CPU 70.15s WALL ( 21529 calls) fft : 0.21s CPU 1.34s WALL ( 19 calls) ffts : 0.01s CPU 0.01s WALL ( 4 calls) fftw : 355.81s CPU 362.72s WALL ( 1541556 calls) interpolate : 0.12s CPU 0.15s WALL ( 4 calls) davcio : 0.02s CPU 2.76s WALL ( 616 calls) Parallel routines fft_scatter : 193.91s CPU 199.30s WALL ( 1541579 calls) PWSCF : 22m55.80s CPU 28m31.61s WALL This run was terminated on: 13:34:36 23Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=