Program PWSCF v.5.1.1 starts on 28Nov2015 at 21:28:11 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: ./CrxClOx2.save/ file Cr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3P 3P 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 86 37 10 5109 1420 216 Max 87 38 11 5115 1452 221 Sum 4161 1779 511 245379 68897 10483 bravais-lattice index = 14 lattice parameter (alat) = 9.3938 a.u. unit-cell volume = 1487.5495 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 3 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 49.0000 Ry charge density cutoff = 457.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.393828 celldm(2)= 1.296520 celldm(3)= 1.443372 celldm(4)= 0.283647 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.296520 0.000000 ) a(3) = ( 0.000000 0.409408 1.384090 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.771296 -0.228146 ) b(3) = ( 0.000000 0.000000 0.722496 ) PseudoPot. # 1 for Cr read from file: /home/autes/Pseudo/Cr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 5eb7f017135fb502322d448d1515490d Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1183 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 O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Cl read from file: /home/autes/Pseudo/Cl.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 689bc0dc0caaad1d61892f37b0005eca Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1157 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 Cr 14.00 51.99610 Cr( 1.00) O 6.00 15.99940 O( 1.00) Cl 7.00 35.45300 Cl( 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 [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) 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= 245 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040816 k( 2) = ( 0.0000000 0.0000000 0.0157064), wk = 0.0040816 k( 3) = ( 0.0000000 0.0000000 0.0314129), wk = 0.0040816 k( 4) = ( 0.0000000 0.0000000 0.0471193), wk = 0.0040816 k( 5) = ( 0.0000000 0.0000000 0.0628258), wk = 0.0040816 k( 6) = ( 0.0000000 0.0000000 0.0785322), wk = 0.0040816 k( 7) = ( 0.0000000 0.0000000 0.0942386), wk = 0.0040816 k( 8) = ( 0.0000000 0.0000000 0.1099451), wk = 0.0040816 k( 9) = ( 0.0000000 0.0000000 0.1256515), wk = 0.0040816 k( 10) = ( 0.0000000 0.0000000 0.1413579), wk = 0.0040816 k( 11) = ( 0.0000000 0.0000000 0.1570644), wk = 0.0040816 k( 12) = ( 0.0000000 0.0000000 0.1727708), wk = 0.0040816 k( 13) = ( 0.0000000 0.0000000 0.1884773), wk = 0.0040816 k( 14) = ( 0.0000000 0.0000000 0.2041837), wk = 0.0040816 k( 15) = ( 0.0000000 0.0000000 0.2198901), wk = 0.0040816 k( 16) = ( 0.0000000 0.0000000 0.2355966), wk = 0.0040816 k( 17) = ( 0.0000000 0.0000000 0.2513030), wk = 0.0040816 k( 18) = ( 0.0000000 0.0000000 0.2670094), wk = 0.0040816 k( 19) = ( 0.0000000 0.0000000 0.2827159), wk = 0.0040816 k( 20) = ( 0.0000000 0.0000000 0.2984223), wk = 0.0040816 k( 21) = ( 0.0000000 0.0000000 0.3141288), wk = 0.0040816 k( 22) = ( 0.0000000 0.0000000 0.3298352), wk = 0.0040816 k( 23) = ( 0.0000000 0.0000000 0.3455416), wk = 0.0040816 k( 24) = ( 0.0000000 0.0000000 0.3612481), wk = 0.0040816 k( 25) = ( 0.0000000 0.0000000 0.3612481), wk = 0.0040816 k( 26) = ( 0.0000000 0.0156267 0.3612481), wk = 0.0040816 k( 27) = ( 0.0000000 0.0312534 0.3612481), wk = 0.0040816 k( 28) = ( 0.0000000 0.0468802 0.3612481), wk = 0.0040816 k( 29) = ( 0.0000000 0.0625069 0.3612481), wk = 0.0040816 k( 30) = ( 0.0000000 0.0781336 0.3612481), wk = 0.0040816 k( 31) = ( 0.0000000 0.0937603 0.3612481), wk = 0.0040816 k( 32) = ( 0.0000000 0.1093871 0.3612481), wk = 0.0040816 k( 33) = ( 0.0000000 0.1250138 0.3612481), wk = 0.0040816 k( 34) = ( 0.0000000 0.1406405 0.3612481), wk = 0.0040816 k( 35) = ( 0.0000000 0.1562672 0.3612481), wk = 0.0040816 k( 36) = ( 0.0000000 0.1718939 0.3612481), wk = 0.0040816 k( 37) = ( 0.0000000 0.1875207 0.3612481), wk = 0.0040816 k( 38) = ( 0.0000000 0.2031474 0.3612481), wk = 0.0040816 k( 39) = ( 0.0000000 0.2187741 0.3612481), wk = 0.0040816 k( 40) = ( 0.0000000 0.2344008 0.3612481), wk = 0.0040816 k( 41) = ( 0.0000000 0.2500275 0.3612481), wk = 0.0040816 k( 42) = ( 0.0000000 0.2656543 0.3612481), wk = 0.0040816 k( 43) = ( 0.0000000 0.2812810 0.3612481), wk = 0.0040816 k( 44) = ( 0.0000000 0.2969077 0.3612481), wk = 0.0040816 k( 45) = ( 0.0000000 0.3125344 0.3612481), wk = 0.0040816 k( 46) = ( 0.0000000 0.3125344 0.3612481), wk = 0.0040816 k( 47) = ( 0.0000000 0.3206581 0.3485733), wk = 0.0040816 k( 48) = ( 0.0000000 0.3287818 0.3358985), wk = 0.0040816 k( 49) = ( 0.0000000 0.3369055 0.3232237), wk = 0.0040816 k( 50) = ( 0.0000000 0.3450293 0.3105489), wk = 0.0040816 k( 51) = ( 0.0000000 0.3531530 0.2978742), wk = 0.0040816 k( 52) = ( 0.0000000 0.3612767 0.2851994), wk = 0.0040816 k( 53) = ( 0.0000000 0.3694004 0.2725246), wk = 0.0040816 k( 54) = ( 0.0000000 0.3775241 0.2598498), wk = 0.0040816 k( 55) = ( 0.0000000 0.3856478 0.2471750), wk = 0.0040816 k( 56) = ( 0.0000000 0.3856478 0.2471750), wk = 0.0040816 k( 57) = ( 0.0156250 0.3856478 0.2471750), wk = 0.0040816 k( 58) = ( 0.0312500 0.3856478 0.2471750), wk = 0.0040816 k( 59) = ( 0.0468750 0.3856478 0.2471750), wk = 0.0040816 k( 60) = ( 0.0625000 0.3856478 0.2471750), wk = 0.0040816 k( 61) = ( 0.0781250 0.3856478 0.2471750), wk = 0.0040816 k( 62) = ( 0.0937500 0.3856478 0.2471750), wk = 0.0040816 k( 63) = ( 0.1093750 0.3856478 0.2471750), wk = 0.0040816 k( 64) = ( 0.1250000 0.3856478 0.2471750), wk = 0.0040816 k( 65) = ( 0.1406250 0.3856478 0.2471750), wk = 0.0040816 k( 66) = ( 0.1562500 0.3856478 0.2471750), wk = 0.0040816 k( 67) = ( 0.1718750 0.3856478 0.2471750), wk = 0.0040816 k( 68) = ( 0.1875000 0.3856478 0.2471750), wk = 0.0040816 k( 69) = ( 0.2031250 0.3856478 0.2471750), wk = 0.0040816 k( 70) = ( 0.2187500 0.3856478 0.2471750), wk = 0.0040816 k( 71) = ( 0.2343750 0.3856478 0.2471750), wk = 0.0040816 k( 72) = ( 0.2500000 0.3856478 0.2471750), wk = 0.0040816 k( 73) = ( 0.2656250 0.3856478 0.2471750), wk = 0.0040816 k( 74) = ( 0.2812500 0.3856478 0.2471750), wk = 0.0040816 k( 75) = ( 0.2968750 0.3856478 0.2471750), wk = 0.0040816 k( 76) = ( 0.3125000 0.3856478 0.2471750), wk = 0.0040816 k( 77) = ( 0.3281250 0.3856478 0.2471750), wk = 0.0040816 k( 78) = ( 0.3437500 0.3856478 0.2471750), wk = 0.0040816 k( 79) = ( 0.3593750 0.3856478 0.2471750), wk = 0.0040816 k( 80) = ( 0.3750000 0.3856478 0.2471750), wk = 0.0040816 k( 81) = ( 0.3906250 0.3856478 0.2471750), wk = 0.0040816 k( 82) = ( 0.4062500 0.3856478 0.2471750), wk = 0.0040816 k( 83) = ( 0.4218750 0.3856478 0.2471750), wk = 0.0040816 k( 84) = ( 0.4375000 0.3856478 0.2471750), wk = 0.0040816 k( 85) = ( 0.4531250 0.3856478 0.2471750), wk = 0.0040816 k( 86) = ( 0.4687500 0.3856478 0.2471750), wk = 0.0040816 k( 87) = ( 0.4843750 0.3856478 0.2471750), wk = 0.0040816 k( 88) = ( 0.5000000 0.3856478 0.2471750), wk = 0.0040816 k( 89) = ( 0.5000000 0.3856478 0.2471750), wk = 0.0040816 k( 90) = ( 0.5000000 0.3937715 0.2345003), wk = 0.0040816 k( 91) = ( 0.5000000 0.4018952 0.2218255), wk = 0.0040816 k( 92) = ( 0.5000000 0.4100189 0.2091507), wk = 0.0040816 k( 93) = ( 0.5000000 0.4181426 0.1964759), wk = 0.0040816 k( 94) = ( 0.5000000 0.4262663 0.1838011), wk = 0.0040816 k( 95) = ( 0.5000000 0.4343900 0.1711264), wk = 0.0040816 k( 96) = ( 0.5000000 0.4425137 0.1584516), wk = 0.0040816 k( 97) = ( 0.5000000 0.4506374 0.1457768), wk = 0.0040816 k( 98) = ( 0.5000000 0.4587611 0.1331020), wk = 0.0040816 k( 99) = ( 0.5000000 0.4587611 0.1331020), wk = 0.0040816 k( 100) = ( 0.5000000 0.4544604 0.1185623), wk = 0.0040816 k( 101) = ( 0.5000000 0.4501596 0.1040226), wk = 0.0040816 k( 102) = ( 0.5000000 0.4458588 0.0894829), wk = 0.0040816 k( 103) = ( 0.5000000 0.4415580 0.0749432), wk = 0.0040816 k( 104) = ( 0.5000000 0.4372572 0.0604035), wk = 0.0040816 k( 105) = ( 0.5000000 0.4329564 0.0458638), wk = 0.0040816 k( 106) = ( 0.5000000 0.4286556 0.0313241), wk = 0.0040816 k( 107) = ( 0.5000000 0.4243549 0.0167844), wk = 0.0040816 k( 108) = ( 0.5000000 0.4200541 0.0022446), wk = 0.0040816 k( 109) = ( 0.5000000 0.4157533 -0.0122951), wk = 0.0040816 k( 110) = ( 0.5000000 0.4114525 -0.0268348), wk = 0.0040816 k( 111) = ( 0.5000000 0.4071517 -0.0413745), wk = 0.0040816 k( 112) = ( 0.5000000 0.4028509 -0.0559142), wk = 0.0040816 k( 113) = ( 0.5000000 0.3985501 -0.0704539), wk = 0.0040816 k( 114) = ( 0.5000000 0.3942494 -0.0849936), wk = 0.0040816 k( 115) = ( 0.5000000 0.3899486 -0.0995333), wk = 0.0040816 k( 116) = ( 0.5000000 0.3856478 -0.1140730), wk = 0.0040816 k( 117) = ( 0.5000000 0.3856478 -0.1140730), wk = 0.0040816 k( 118) = ( 0.4843750 0.3856478 -0.1140730), wk = 0.0040816 k( 119) = ( 0.4687500 0.3856478 -0.1140730), wk = 0.0040816 k( 120) = ( 0.4531250 0.3856478 -0.1140730), wk = 0.0040816 k( 121) = ( 0.4375000 0.3856478 -0.1140730), wk = 0.0040816 k( 122) = ( 0.4218750 0.3856478 -0.1140730), wk = 0.0040816 k( 123) = ( 0.4062500 0.3856478 -0.1140730), wk = 0.0040816 k( 124) = ( 0.3906250 0.3856478 -0.1140730), wk = 0.0040816 k( 125) = ( 0.3750000 0.3856478 -0.1140730), wk = 0.0040816 k( 126) = ( 0.3593750 0.3856478 -0.1140730), wk = 0.0040816 k( 127) = ( 0.3437500 0.3856478 -0.1140730), wk = 0.0040816 k( 128) = ( 0.3281250 0.3856478 -0.1140730), wk = 0.0040816 k( 129) = ( 0.3125000 0.3856478 -0.1140730), wk = 0.0040816 k( 130) = ( 0.2968750 0.3856478 -0.1140730), wk = 0.0040816 k( 131) = ( 0.2812500 0.3856478 -0.1140730), wk = 0.0040816 k( 132) = ( 0.2656250 0.3856478 -0.1140730), wk = 0.0040816 k( 133) = ( 0.2500000 0.3856478 -0.1140730), wk = 0.0040816 k( 134) = ( 0.2343750 0.3856478 -0.1140730), wk = 0.0040816 k( 135) = ( 0.2187500 0.3856478 -0.1140730), wk = 0.0040816 k( 136) = ( 0.2031250 0.3856478 -0.1140730), wk = 0.0040816 k( 137) = ( 0.1875000 0.3856478 -0.1140730), wk = 0.0040816 k( 138) = ( 0.1718750 0.3856478 -0.1140730), wk = 0.0040816 k( 139) = ( 0.1562500 0.3856478 -0.1140730), wk = 0.0040816 k( 140) = ( 0.1406250 0.3856478 -0.1140730), wk = 0.0040816 k( 141) = ( 0.1250000 0.3856478 -0.1140730), wk = 0.0040816 k( 142) = ( 0.1093750 0.3856478 -0.1140730), wk = 0.0040816 k( 143) = ( 0.0937500 0.3856478 -0.1140730), wk = 0.0040816 k( 144) = ( 0.0781250 0.3856478 -0.1140730), wk = 0.0040816 k( 145) = ( 0.0625000 0.3856478 -0.1140730), wk = 0.0040816 k( 146) = ( 0.0468750 0.3856478 -0.1140730), wk = 0.0040816 k( 147) = ( 0.0312500 0.3856478 -0.1140730), wk = 0.0040816 k( 148) = ( 0.0156250 0.3856478 -0.1140730), wk = 0.0040816 k( 149) = ( 0.0000000 0.3856478 -0.1140730), wk = 0.0040816 k( 150) = ( 0.0000000 0.3856478 -0.1140730), wk = 0.0040816 k( 151) = ( 0.0000000 0.3899486 -0.0995333), wk = 0.0040816 k( 152) = ( 0.0000000 0.3942494 -0.0849936), wk = 0.0040816 k( 153) = ( 0.0000000 0.3985501 -0.0704539), wk = 0.0040816 k( 154) = ( 0.0000000 0.4028509 -0.0559142), wk = 0.0040816 k( 155) = ( 0.0000000 0.4071517 -0.0413745), wk = 0.0040816 k( 156) = ( 0.0000000 0.4114525 -0.0268348), wk = 0.0040816 k( 157) = ( 0.0000000 0.4157533 -0.0122951), wk = 0.0040816 k( 158) = ( 0.0000000 0.4200541 0.0022446), wk = 0.0040816 k( 159) = ( 0.0000000 0.4243549 0.0167844), wk = 0.0040816 k( 160) = ( 0.0000000 0.4286556 0.0313241), wk = 0.0040816 k( 161) = ( 0.0000000 0.4329564 0.0458638), wk = 0.0040816 k( 162) = ( 0.0000000 0.4372572 0.0604035), wk = 0.0040816 k( 163) = ( 0.0000000 0.4415580 0.0749432), wk = 0.0040816 k( 164) = ( 0.0000000 0.4458588 0.0894829), wk = 0.0040816 k( 165) = ( 0.0000000 0.4501596 0.1040226), wk = 0.0040816 k( 166) = ( 0.0000000 0.4544604 0.1185623), wk = 0.0040816 k( 167) = ( 0.0000000 0.4587611 0.1331020), wk = 0.0040816 k( 168) = ( 0.5000000 0.3125344 0.3612481), wk = 0.0040816 k( 169) = ( 0.5000000 0.2969077 0.3612481), wk = 0.0040816 k( 170) = ( 0.5000000 0.2812810 0.3612481), wk = 0.0040816 k( 171) = ( 0.5000000 0.2656543 0.3612481), wk = 0.0040816 k( 172) = ( 0.5000000 0.2500275 0.3612481), wk = 0.0040816 k( 173) = ( 0.5000000 0.2344008 0.3612481), wk = 0.0040816 k( 174) = ( 0.5000000 0.2187741 0.3612481), wk = 0.0040816 k( 175) = ( 0.5000000 0.2031474 0.3612481), wk = 0.0040816 k( 176) = ( 0.5000000 0.1875207 0.3612481), wk = 0.0040816 k( 177) = ( 0.5000000 0.1718939 0.3612481), wk = 0.0040816 k( 178) = ( 0.5000000 0.1562672 0.3612481), wk = 0.0040816 k( 179) = ( 0.5000000 0.1406405 0.3612481), wk = 0.0040816 k( 180) = ( 0.5000000 0.1250138 0.3612481), wk = 0.0040816 k( 181) = ( 0.5000000 0.1093871 0.3612481), wk = 0.0040816 k( 182) = ( 0.5000000 0.0937603 0.3612481), wk = 0.0040816 k( 183) = ( 0.5000000 0.0781336 0.3612481), wk = 0.0040816 k( 184) = ( 0.5000000 0.0625069 0.3612481), wk = 0.0040816 k( 185) = ( 0.5000000 0.0468802 0.3612481), wk = 0.0040816 k( 186) = ( 0.5000000 0.0312534 0.3612481), wk = 0.0040816 k( 187) = ( 0.5000000 0.0156267 0.3612481), wk = 0.0040816 k( 188) = ( 0.5000000 -0.0000000 0.3612481), wk = 0.0040816 k( 189) = ( 0.5000000 -0.0000000 0.3612481), wk = 0.0040816 k( 190) = ( 0.5000000 -0.0000000 0.3455416), wk = 0.0040816 k( 191) = ( 0.5000000 -0.0000000 0.3298352), wk = 0.0040816 k( 192) = ( 0.5000000 -0.0000000 0.3141288), wk = 0.0040816 k( 193) = ( 0.5000000 -0.0000000 0.2984223), wk = 0.0040816 k( 194) = ( 0.5000000 -0.0000000 0.2827159), wk = 0.0040816 k( 195) = ( 0.5000000 -0.0000000 0.2670094), wk = 0.0040816 k( 196) = ( 0.5000000 -0.0000000 0.2513030), wk = 0.0040816 k( 197) = ( 0.5000000 -0.0000000 0.2355966), wk = 0.0040816 k( 198) = ( 0.5000000 -0.0000000 0.2198901), wk = 0.0040816 k( 199) = ( 0.5000000 -0.0000000 0.2041837), wk = 0.0040816 k( 200) = ( 0.5000000 -0.0000000 0.1884773), wk = 0.0040816 k( 201) = ( 0.5000000 -0.0000000 0.1727708), wk = 0.0040816 k( 202) = ( 0.5000000 -0.0000000 0.1570644), wk = 0.0040816 k( 203) = ( 0.5000000 -0.0000000 0.1413579), wk = 0.0040816 k( 204) = ( 0.5000000 -0.0000000 0.1256515), wk = 0.0040816 k( 205) = ( 0.5000000 -0.0000000 0.1099451), wk = 0.0040816 k( 206) = ( 0.5000000 -0.0000000 0.0942386), wk = 0.0040816 k( 207) = ( 0.5000000 -0.0000000 0.0785322), wk = 0.0040816 k( 208) = ( 0.5000000 -0.0000000 0.0628258), wk = 0.0040816 k( 209) = ( 0.5000000 -0.0000000 0.0471193), wk = 0.0040816 k( 210) = ( 0.5000000 -0.0000000 0.0314129), wk = 0.0040816 k( 211) = ( 0.5000000 -0.0000000 0.0157064), wk = 0.0040816 k( 212) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0040816 k( 213) = ( 0.0000000 0.0000000 0.3612481), wk = 0.0040816 k( 214) = ( 0.0156250 -0.0000000 0.3612481), wk = 0.0040816 k( 215) = ( 0.0312500 -0.0000000 0.3612481), wk = 0.0040816 k( 216) = ( 0.0468750 -0.0000000 0.3612481), wk = 0.0040816 k( 217) = ( 0.0625000 -0.0000000 0.3612481), wk = 0.0040816 k( 218) = ( 0.0781250 -0.0000000 0.3612481), wk = 0.0040816 k( 219) = ( 0.0937500 -0.0000000 0.3612481), wk = 0.0040816 k( 220) = ( 0.1093750 -0.0000000 0.3612481), wk = 0.0040816 k( 221) = ( 0.1250000 -0.0000000 0.3612481), wk = 0.0040816 k( 222) = ( 0.1406250 -0.0000000 0.3612481), wk = 0.0040816 k( 223) = ( 0.1562500 -0.0000000 0.3612481), wk = 0.0040816 k( 224) = ( 0.1718750 -0.0000000 0.3612481), wk = 0.0040816 k( 225) = ( 0.1875000 -0.0000000 0.3612481), wk = 0.0040816 k( 226) = ( 0.2031250 -0.0000000 0.3612481), wk = 0.0040816 k( 227) = ( 0.2187500 -0.0000000 0.3612481), wk = 0.0040816 k( 228) = ( 0.2343750 -0.0000000 0.3612481), wk = 0.0040816 k( 229) = ( 0.2500000 -0.0000000 0.3612481), wk = 0.0040816 k( 230) = ( 0.2656250 -0.0000000 0.3612481), wk = 0.0040816 k( 231) = ( 0.2812500 -0.0000000 0.3612481), wk = 0.0040816 k( 232) = ( 0.2968750 -0.0000000 0.3612481), wk = 0.0040816 k( 233) = ( 0.3125000 -0.0000000 0.3612481), wk = 0.0040816 k( 234) = ( 0.3281250 -0.0000000 0.3612481), wk = 0.0040816 k( 235) = ( 0.3437500 -0.0000000 0.3612481), wk = 0.0040816 k( 236) = ( 0.3593750 -0.0000000 0.3612481), wk = 0.0040816 k( 237) = ( 0.3750000 -0.0000000 0.3612481), wk = 0.0040816 k( 238) = ( 0.3906250 -0.0000000 0.3612481), wk = 0.0040816 k( 239) = ( 0.4062500 -0.0000000 0.3612481), wk = 0.0040816 k( 240) = ( 0.4218750 -0.0000000 0.3612481), wk = 0.0040816 k( 241) = ( 0.4375000 -0.0000000 0.3612481), wk = 0.0040816 k( 242) = ( 0.4531250 -0.0000000 0.3612481), wk = 0.0040816 k( 243) = ( 0.4687500 -0.0000000 0.3612481), wk = 0.0040816 k( 244) = ( 0.4843750 -0.0000000 0.3612481), wk = 0.0040816 k( 245) = ( 0.5000000 -0.0000000 0.3612481), wk = 0.0040816 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040816 k( 2) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0040816 k( 3) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0040816 k( 4) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0040816 k( 5) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0040816 k( 6) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0040816 k( 7) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0040816 k( 8) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0040816 k( 9) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0040816 k( 10) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0040816 k( 11) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0040816 k( 12) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0040816 k( 13) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0040816 k( 14) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0040816 k( 15) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0040816 k( 16) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0040816 k( 17) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0040816 k( 18) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0040816 k( 19) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0040816 k( 20) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0040816 k( 21) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0040816 k( 22) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0040816 k( 23) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0040816 k( 24) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040816 k( 25) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040816 k( 26) = ( 0.0000000 0.0202603 0.5063977), wk = 0.0040816 k( 27) = ( 0.0000000 0.0405207 0.5127954), wk = 0.0040816 k( 28) = ( 0.0000000 0.0607811 0.5191931), wk = 0.0040816 k( 29) = ( 0.0000000 0.0810414 0.5255908), wk = 0.0040816 k( 30) = ( 0.0000000 0.1013018 0.5319885), wk = 0.0040816 k( 31) = ( 0.0000000 0.1215621 0.5383862), wk = 0.0040816 k( 32) = ( 0.0000000 0.1418225 0.5447840), wk = 0.0040816 k( 33) = ( 0.0000000 0.1620828 0.5511817), wk = 0.0040816 k( 34) = ( 0.0000000 0.1823432 0.5575794), wk = 0.0040816 k( 35) = ( 0.0000000 0.2026035 0.5639771), wk = 0.0040816 k( 36) = ( 0.0000000 0.2228639 0.5703748), wk = 0.0040816 k( 37) = ( 0.0000000 0.2431242 0.5767725), wk = 0.0040816 k( 38) = ( 0.0000000 0.2633846 0.5831702), wk = 0.0040816 k( 39) = ( 0.0000000 0.2836450 0.5895679), wk = 0.0040816 k( 40) = ( 0.0000000 0.3039053 0.5959656), wk = 0.0040816 k( 41) = ( 0.0000000 0.3241657 0.6023633), wk = 0.0040816 k( 42) = ( 0.0000000 0.3444260 0.6087611), wk = 0.0040816 k( 43) = ( 0.0000000 0.3646864 0.6151588), wk = 0.0040816 k( 44) = ( 0.0000000 0.3849467 0.6215565), wk = 0.0040816 k( 45) = ( 0.0000000 0.4052071 0.6279542), wk = 0.0040816 k( 46) = ( 0.0000000 0.4052071 0.6279542), wk = 0.0040816 k( 47) = ( 0.0000000 0.4157396 0.6137370), wk = 0.0040816 k( 48) = ( 0.0000000 0.4262722 0.5995199), wk = 0.0040816 k( 49) = ( 0.0000000 0.4368047 0.5853028), wk = 0.0040816 k( 50) = ( 0.0000000 0.4473373 0.5710857), wk = 0.0040816 k( 51) = ( 0.0000000 0.4578698 0.5568685), wk = 0.0040816 k( 52) = ( 0.0000000 0.4684024 0.5426514), wk = 0.0040816 k( 53) = ( 0.0000000 0.4789349 0.5284343), wk = 0.0040816 k( 54) = ( 0.0000000 0.4894675 0.5142171), wk = 0.0040816 k( 55) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0040816 k( 56) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0040816 k( 57) = ( 0.0156250 0.5000000 0.5000000), wk = 0.0040816 k( 58) = ( 0.0312500 0.5000000 0.5000000), wk = 0.0040816 k( 59) = ( 0.0468750 0.5000000 0.5000000), wk = 0.0040816 k( 60) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0040816 k( 61) = ( 0.0781250 0.5000000 0.5000000), wk = 0.0040816 k( 62) = ( 0.0937500 0.5000000 0.5000000), wk = 0.0040816 k( 63) = ( 0.1093750 0.5000000 0.5000000), wk = 0.0040816 k( 64) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0040816 k( 65) = ( 0.1406250 0.5000000 0.5000000), wk = 0.0040816 k( 66) = ( 0.1562500 0.5000000 0.5000000), wk = 0.0040816 k( 67) = ( 0.1718750 0.5000000 0.5000000), wk = 0.0040816 k( 68) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0040816 k( 69) = ( 0.2031250 0.5000000 0.5000000), wk = 0.0040816 k( 70) = ( 0.2187500 0.5000000 0.5000000), wk = 0.0040816 k( 71) = ( 0.2343750 0.5000000 0.5000000), wk = 0.0040816 k( 72) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0040816 k( 73) = ( 0.2656250 0.5000000 0.5000000), wk = 0.0040816 k( 74) = ( 0.2812500 0.5000000 0.5000000), wk = 0.0040816 k( 75) = ( 0.2968750 0.5000000 0.5000000), wk = 0.0040816 k( 76) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0040816 k( 77) = ( 0.3281250 0.5000000 0.5000000), wk = 0.0040816 k( 78) = ( 0.3437500 0.5000000 0.5000000), wk = 0.0040816 k( 79) = ( 0.3593750 0.5000000 0.5000000), wk = 0.0040816 k( 80) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0040816 k( 81) = ( 0.3906250 0.5000000 0.5000000), wk = 0.0040816 k( 82) = ( 0.4062500 0.5000000 0.5000000), wk = 0.0040816 k( 83) = ( 0.4218750 0.5000000 0.5000000), wk = 0.0040816 k( 84) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0040816 k( 85) = ( 0.4531250 0.5000000 0.5000000), wk = 0.0040816 k( 86) = ( 0.4687500 0.5000000 0.5000000), wk = 0.0040816 k( 87) = ( 0.4843750 0.5000000 0.5000000), wk = 0.0040816 k( 88) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0040816 k( 89) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0040816 k( 90) = ( 0.5000000 0.5105325 0.4857829), wk = 0.0040816 k( 91) = ( 0.5000000 0.5210651 0.4715657), wk = 0.0040816 k( 92) = ( 0.5000000 0.5315976 0.4573486), wk = 0.0040816 k( 93) = ( 0.5000000 0.5421302 0.4431315), wk = 0.0040816 k( 94) = ( 0.5000000 0.5526627 0.4289144), wk = 0.0040816 k( 95) = ( 0.5000000 0.5631953 0.4146972), wk = 0.0040816 k( 96) = ( 0.5000000 0.5737278 0.4004801), wk = 0.0040816 k( 97) = ( 0.5000000 0.5842604 0.3862630), wk = 0.0040816 k( 98) = ( 0.5000000 0.5947929 0.3720458), wk = 0.0040816 k( 99) = ( 0.5000000 0.5947929 0.3720458), wk = 0.0040816 k( 100) = ( 0.5000000 0.5892169 0.3501608), wk = 0.0040816 k( 101) = ( 0.5000000 0.5836408 0.3282757), wk = 0.0040816 k( 102) = ( 0.5000000 0.5780648 0.3063907), wk = 0.0040816 k( 103) = ( 0.5000000 0.5724887 0.2845056), wk = 0.0040816 k( 104) = ( 0.5000000 0.5669127 0.2626206), wk = 0.0040816 k( 105) = ( 0.5000000 0.5613366 0.2407355), wk = 0.0040816 k( 106) = ( 0.5000000 0.5557605 0.2188505), wk = 0.0040816 k( 107) = ( 0.5000000 0.5501845 0.1969654), wk = 0.0040816 k( 108) = ( 0.5000000 0.5446084 0.1750804), wk = 0.0040816 k( 109) = ( 0.5000000 0.5390324 0.1531953), wk = 0.0040816 k( 110) = ( 0.5000000 0.5334563 0.1313103), wk = 0.0040816 k( 111) = ( 0.5000000 0.5278803 0.1094252), wk = 0.0040816 k( 112) = ( 0.5000000 0.5223042 0.0875402), wk = 0.0040816 k( 113) = ( 0.5000000 0.5167282 0.0656551), wk = 0.0040816 k( 114) = ( 0.5000000 0.5111521 0.0437701), wk = 0.0040816 k( 115) = ( 0.5000000 0.5055761 0.0218850), wk = 0.0040816 k( 116) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040816 k( 117) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0040816 k( 118) = ( 0.4843750 0.5000000 -0.0000000), wk = 0.0040816 k( 119) = ( 0.4687500 0.5000000 -0.0000000), wk = 0.0040816 k( 120) = ( 0.4531250 0.5000000 -0.0000000), wk = 0.0040816 k( 121) = ( 0.4375000 0.5000000 -0.0000000), wk = 0.0040816 k( 122) = ( 0.4218750 0.5000000 -0.0000000), wk = 0.0040816 k( 123) = ( 0.4062500 0.5000000 -0.0000000), wk = 0.0040816 k( 124) = ( 0.3906250 0.5000000 -0.0000000), wk = 0.0040816 k( 125) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0040816 k( 126) = ( 0.3593750 0.5000000 -0.0000000), wk = 0.0040816 k( 127) = ( 0.3437500 0.5000000 -0.0000000), wk = 0.0040816 k( 128) = ( 0.3281250 0.5000000 -0.0000000), wk = 0.0040816 k( 129) = ( 0.3125000 0.5000000 -0.0000000), wk = 0.0040816 k( 130) = ( 0.2968750 0.5000000 -0.0000000), wk = 0.0040816 k( 131) = ( 0.2812500 0.5000000 -0.0000000), wk = 0.0040816 k( 132) = ( 0.2656250 0.5000000 0.0000000), wk = 0.0040816 k( 133) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0040816 k( 134) = ( 0.2343750 0.5000000 0.0000000), wk = 0.0040816 k( 135) = ( 0.2187500 0.5000000 0.0000000), wk = 0.0040816 k( 136) = ( 0.2031250 0.5000000 0.0000000), wk = 0.0040816 k( 137) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0040816 k( 138) = ( 0.1718750 0.5000000 0.0000000), wk = 0.0040816 k( 139) = ( 0.1562500 0.5000000 0.0000000), wk = 0.0040816 k( 140) = ( 0.1406250 0.5000000 0.0000000), wk = 0.0040816 k( 141) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0040816 k( 142) = ( 0.1093750 0.5000000 0.0000000), wk = 0.0040816 k( 143) = ( 0.0937500 0.5000000 -0.0000000), wk = 0.0040816 k( 144) = ( 0.0781250 0.5000000 0.0000000), wk = 0.0040816 k( 145) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0040816 k( 146) = ( 0.0468750 0.5000000 0.0000000), wk = 0.0040816 k( 147) = ( 0.0312500 0.5000000 0.0000000), wk = 0.0040816 k( 148) = ( 0.0156250 0.5000000 0.0000000), wk = 0.0040816 k( 149) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0040816 k( 150) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0040816 k( 151) = ( 0.0000000 0.5055761 0.0218851), wk = 0.0040816 k( 152) = ( 0.0000000 0.5111521 0.0437701), wk = 0.0040816 k( 153) = ( 0.0000000 0.5167282 0.0656551), wk = 0.0040816 k( 154) = ( 0.0000000 0.5223042 0.0875402), wk = 0.0040816 k( 155) = ( 0.0000000 0.5278803 0.1094252), wk = 0.0040816 k( 156) = ( 0.0000000 0.5334563 0.1313103), wk = 0.0040816 k( 157) = ( 0.0000000 0.5390324 0.1531953), wk = 0.0040816 k( 158) = ( 0.0000000 0.5446084 0.1750804), wk = 0.0040816 k( 159) = ( 0.0000000 0.5501845 0.1969654), wk = 0.0040816 k( 160) = ( 0.0000000 0.5557605 0.2188505), wk = 0.0040816 k( 161) = ( 0.0000000 0.5613366 0.2407355), wk = 0.0040816 k( 162) = ( 0.0000000 0.5669127 0.2626206), wk = 0.0040816 k( 163) = ( 0.0000000 0.5724887 0.2845056), wk = 0.0040816 k( 164) = ( 0.0000000 0.5780648 0.3063907), wk = 0.0040816 k( 165) = ( 0.0000000 0.5836408 0.3282757), wk = 0.0040816 k( 166) = ( 0.0000000 0.5892169 0.3501608), wk = 0.0040816 k( 167) = ( 0.0000000 0.5947929 0.3720458), wk = 0.0040816 k( 168) = ( 0.5000000 0.4052071 0.6279542), wk = 0.0040816 k( 169) = ( 0.5000000 0.3849467 0.6215565), wk = 0.0040816 k( 170) = ( 0.5000000 0.3646864 0.6151588), wk = 0.0040816 k( 171) = ( 0.5000000 0.3444260 0.6087611), wk = 0.0040816 k( 172) = ( 0.5000000 0.3241657 0.6023633), wk = 0.0040816 k( 173) = ( 0.5000000 0.3039053 0.5959656), wk = 0.0040816 k( 174) = ( 0.5000000 0.2836450 0.5895679), wk = 0.0040816 k( 175) = ( 0.5000000 0.2633846 0.5831702), wk = 0.0040816 k( 176) = ( 0.5000000 0.2431242 0.5767725), wk = 0.0040816 k( 177) = ( 0.5000000 0.2228639 0.5703748), wk = 0.0040816 k( 178) = ( 0.5000000 0.2026035 0.5639771), wk = 0.0040816 k( 179) = ( 0.5000000 0.1823432 0.5575794), wk = 0.0040816 k( 180) = ( 0.5000000 0.1620828 0.5511817), wk = 0.0040816 k( 181) = ( 0.5000000 0.1418225 0.5447840), wk = 0.0040816 k( 182) = ( 0.5000000 0.1215621 0.5383862), wk = 0.0040816 k( 183) = ( 0.5000000 0.1013018 0.5319885), wk = 0.0040816 k( 184) = ( 0.5000000 0.0810414 0.5255908), wk = 0.0040816 k( 185) = ( 0.5000000 0.0607811 0.5191931), wk = 0.0040816 k( 186) = ( 0.5000000 0.0405207 0.5127954), wk = 0.0040816 k( 187) = ( 0.5000000 0.0202604 0.5063977), wk = 0.0040816 k( 188) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0040816 k( 189) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0040816 k( 190) = ( 0.5000000 0.0000000 0.4782609), wk = 0.0040816 k( 191) = ( 0.5000000 0.0000000 0.4565217), wk = 0.0040816 k( 192) = ( 0.5000000 0.0000000 0.4347826), wk = 0.0040816 k( 193) = ( 0.5000000 0.0000000 0.4130435), wk = 0.0040816 k( 194) = ( 0.5000000 0.0000000 0.3913044), wk = 0.0040816 k( 195) = ( 0.5000000 0.0000000 0.3695652), wk = 0.0040816 k( 196) = ( 0.5000000 0.0000000 0.3478261), wk = 0.0040816 k( 197) = ( 0.5000000 0.0000000 0.3260870), wk = 0.0040816 k( 198) = ( 0.5000000 0.0000000 0.3043478), wk = 0.0040816 k( 199) = ( 0.5000000 0.0000000 0.2826087), wk = 0.0040816 k( 200) = ( 0.5000000 0.0000000 0.2608696), wk = 0.0040816 k( 201) = ( 0.5000000 0.0000000 0.2391304), wk = 0.0040816 k( 202) = ( 0.5000000 0.0000000 0.2173913), wk = 0.0040816 k( 203) = ( 0.5000000 0.0000000 0.1956522), wk = 0.0040816 k( 204) = ( 0.5000000 0.0000000 0.1739130), wk = 0.0040816 k( 205) = ( 0.5000000 0.0000000 0.1521739), wk = 0.0040816 k( 206) = ( 0.5000000 0.0000000 0.1304348), wk = 0.0040816 k( 207) = ( 0.5000000 0.0000000 0.1086957), wk = 0.0040816 k( 208) = ( 0.5000000 0.0000000 0.0869565), wk = 0.0040816 k( 209) = ( 0.5000000 0.0000000 0.0652174), wk = 0.0040816 k( 210) = ( 0.5000000 0.0000000 0.0434783), wk = 0.0040816 k( 211) = ( 0.5000000 0.0000000 0.0217391), wk = 0.0040816 k( 212) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0040816 k( 213) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040816 k( 214) = ( 0.0156250 0.0000000 0.5000000), wk = 0.0040816 k( 215) = ( 0.0312500 0.0000000 0.5000000), wk = 0.0040816 k( 216) = ( 0.0468750 0.0000000 0.5000000), wk = 0.0040816 k( 217) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0040816 k( 218) = ( 0.0781250 0.0000000 0.5000000), wk = 0.0040816 k( 219) = ( 0.0937500 0.0000000 0.5000000), wk = 0.0040816 k( 220) = ( 0.1093750 0.0000000 0.5000000), wk = 0.0040816 k( 221) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0040816 k( 222) = ( 0.1406250 0.0000000 0.5000000), wk = 0.0040816 k( 223) = ( 0.1562500 0.0000000 0.5000000), wk = 0.0040816 k( 224) = ( 0.1718750 0.0000000 0.5000000), wk = 0.0040816 k( 225) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0040816 k( 226) = ( 0.2031250 0.0000000 0.5000000), wk = 0.0040816 k( 227) = ( 0.2187500 0.0000000 0.5000000), wk = 0.0040816 k( 228) = ( 0.2343750 0.0000000 0.5000000), wk = 0.0040816 k( 229) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0040816 k( 230) = ( 0.2656250 0.0000000 0.5000000), wk = 0.0040816 k( 231) = ( 0.2812500 0.0000000 0.5000000), wk = 0.0040816 k( 232) = ( 0.2968750 0.0000000 0.5000000), wk = 0.0040816 k( 233) = ( 0.3125000 0.0000000 0.5000000), wk = 0.0040816 k( 234) = ( 0.3281250 0.0000000 0.5000000), wk = 0.0040816 k( 235) = ( 0.3437500 0.0000000 0.5000000), wk = 0.0040816 k( 236) = ( 0.3593750 0.0000000 0.5000000), wk = 0.0040816 k( 237) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0040816 k( 238) = ( 0.3906250 0.0000000 0.5000000), wk = 0.0040816 k( 239) = ( 0.4062500 0.0000000 0.5000000), wk = 0.0040816 k( 240) = ( 0.4218750 0.0000000 0.5000000), wk = 0.0040816 k( 241) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0040816 k( 242) = ( 0.4531250 0.0000000 0.5000000), wk = 0.0040816 k( 243) = ( 0.4687500 0.0000000 0.5000000), wk = 0.0040816 k( 244) = ( 0.4843750 0.0000000 0.5000000), wk = 0.0040816 k( 245) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0040816 Dense grid: 245379 G-vectors FFT dimensions: ( 64, 90, 96) Smooth grid: 68897 G-vectors FFT dimensions: ( 45, 60, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.54 Mb ( 368, 96) NL pseudopotentials 0.73 Mb ( 184, 260) Each V/rho on FFT grid 0.18 Mb ( 11520) Each G-vector array 0.04 Mb ( 5113) G-vector shells 0.04 Mb ( 5073) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.16 Mb ( 368, 384) Each subspace H/S matrix 2.25 Mb ( 384, 384) Each matrix 0.76 Mb ( 260, 2, 96) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CrxClOx2.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 52.4 secs Computing kpt #: 2 total cpu time spent up to now is 63.0 secs Computing kpt #: 3 total cpu time spent up to now is 73.8 secs Computing kpt #: 4 total cpu time spent up to now is 84.2 secs Computing kpt #: 5 total cpu time spent up to now is 94.7 secs Computing kpt #: 6 total cpu time spent up to now is 105.3 secs Computing kpt #: 7 total cpu time spent up to now is 116.0 secs Computing kpt #: 8 total cpu time spent up to now is 126.7 secs Computing kpt #: 9 total cpu time spent up to now is 137.2 secs Computing kpt #: 10 total cpu time spent up to now is 147.7 secs Computing kpt #: 11 total cpu time spent up to now is 158.2 secs Computing kpt #: 12 total cpu time spent up to now is 169.0 secs Computing kpt #: 13 total cpu time spent up to now is 180.1 secs Computing kpt #: 14 total cpu time spent up to now is 191.3 secs Computing kpt #: 15 total cpu time spent up to now is 202.9 secs Computing kpt #: 16 total cpu time spent up to now is 213.7 secs Computing kpt #: 17 total cpu time spent up to now is 224.1 secs Computing kpt #: 18 total cpu time spent up to now is 235.7 secs Computing kpt #: 19 total cpu time spent up to now is 246.2 secs Computing kpt #: 20 total cpu time spent up to now is 256.7 secs Computing kpt #: 21 total cpu time spent up to now is 267.3 secs Computing kpt #: 22 total cpu time spent up to now is 278.9 secs Computing kpt #: 23 total cpu time spent up to now is 290.4 secs Computing kpt #: 24 total cpu time spent up to now is 302.3 secs Computing kpt #: 25 total cpu time spent up to now is 313.2 secs Computing kpt #: 26 total cpu time spent up to now is 325.3 secs Computing kpt #: 27 total cpu time spent up to now is 336.5 secs Computing kpt #: 28 total cpu time spent up to now is 348.8 secs Computing kpt #: 29 total cpu time spent up to now is 359.8 secs Computing kpt #: 30 total cpu time spent up to now is 370.7 secs Computing kpt #: 31 total cpu time spent up to now is 382.1 secs Computing kpt #: 32 total cpu time spent up to now is 392.6 secs Computing kpt #: 33 total cpu time spent up to now is 404.1 secs Computing kpt #: 34 total cpu time spent up to now is 414.7 secs Computing kpt #: 35 total cpu time spent up to now is 426.0 secs Computing kpt #: 36 total cpu time spent up to now is 437.5 secs Computing kpt #: 37 total cpu time spent up to now is 449.7 secs Computing kpt #: 38 total cpu time spent up to now is 460.4 secs Computing kpt #: 39 total cpu time spent up to now is 471.7 secs Computing kpt #: 40 total cpu time spent up to now is 484.9 secs Computing kpt #: 41 total cpu time spent up to now is 495.1 secs Computing kpt #: 42 total cpu time spent up to now is 506.4 secs Computing kpt #: 43 total cpu time spent up to now is 517.2 secs Computing kpt #: 44 total cpu time spent up to now is 527.6 secs Computing kpt #: 45 total cpu time spent up to now is 537.9 secs Computing kpt #: 46 total cpu time spent up to now is 548.0 secs Computing kpt #: 47 total cpu time spent up to now is 558.2 secs Computing kpt #: 48 total cpu time spent up to now is 568.4 secs Computing kpt #: 49 total cpu time spent up to now is 578.5 secs Computing kpt #: 50 total cpu time spent up to now is 588.8 secs Computing kpt #: 51 total cpu time spent up to now is 599.3 secs Computing kpt #: 52 total cpu time spent up to now is 609.9 secs Computing kpt #: 53 total cpu time spent up to now is 620.2 secs Computing kpt #: 54 total cpu time spent up to now is 631.7 secs Computing kpt #: 55 total cpu time spent up to now is 642.6 secs Computing kpt #: 56 total cpu time spent up to now is 652.8 secs Computing kpt #: 57 total cpu time spent up to now is 662.7 secs Computing kpt #: 58 total cpu time spent up to now is 672.8 secs Computing kpt #: 59 total cpu time spent up to now is 682.9 secs Computing kpt #: 60 total cpu time spent up to now is 693.0 secs Computing kpt #: 61 total cpu time spent up to now is 703.3 secs Computing kpt #: 62 total cpu time spent up to now is 713.5 secs Computing kpt #: 63 total cpu time spent up to now is 724.5 secs Computing kpt #: 64 total cpu time spent up to now is 734.6 secs Computing kpt #: 65 total cpu time spent up to now is 744.8 secs Computing kpt #: 66 total cpu time spent up to now is 755.0 secs Computing kpt #: 67 total cpu time spent up to now is 765.3 secs Computing kpt #: 68 total cpu time spent up to now is 775.4 secs Computing kpt #: 69 total cpu time spent up to now is 788.2 secs Computing kpt #: 70 total cpu time spent up to now is 798.2 secs Computing kpt #: 71 total cpu time spent up to now is 808.5 secs Computing kpt #: 72 total cpu time spent up to now is 818.5 secs Computing kpt #: 73 total cpu time spent up to now is 828.7 secs Computing kpt #: 74 total cpu time spent up to now is 838.9 secs Computing kpt #: 75 total cpu time spent up to now is 849.0 secs Computing kpt #: 76 total cpu time spent up to now is 859.3 secs Computing kpt #: 77 total cpu time spent up to now is 869.3 secs Computing kpt #: 78 total cpu time spent up to now is 879.2 secs Computing kpt #: 79 total cpu time spent up to now is 889.3 secs Computing kpt #: 80 total cpu time spent up to now is 899.6 secs Computing kpt #: 81 total cpu time spent up to now is 909.7 secs Computing kpt #: 82 total cpu time spent up to now is 919.9 secs Computing kpt #: 83 total cpu time spent up to now is 930.0 secs Computing kpt #: 84 total cpu time spent up to now is 939.9 secs Computing kpt #: 85 total cpu time spent up to now is 949.7 secs Computing kpt #: 86 total cpu time spent up to now is 959.7 secs Computing kpt #: 87 total cpu time spent up to now is 969.5 secs Computing kpt #: 88 total cpu time spent up to now is 979.2 secs Computing kpt #: 89 total cpu time spent up to now is 989.2 secs Computing kpt #: 90 total cpu time spent up to now is 999.1 secs Computing kpt #: 91 total cpu time spent up to now is 1009.0 secs Computing kpt #: 92 total cpu time spent up to now is 1019.0 secs Computing kpt #: 93 total cpu time spent up to now is 1028.7 secs Computing kpt #: 94 total cpu time spent up to now is 1038.7 secs Computing kpt #: 95 total cpu time spent up to now is 1048.7 secs Computing kpt #: 96 total cpu time spent up to now is 1058.6 secs Computing kpt #: 97 total cpu time spent up to now is 1068.6 secs Computing kpt #: 98 total cpu time spent up to now is 1079.3 secs Computing kpt #: 99 total cpu time spent up to now is 1089.6 secs Computing kpt #: 100 total cpu time spent up to now is 1099.3 secs Computing kpt #: 101 total cpu time spent up to now is 1109.3 secs Computing kpt #: 102 total cpu time spent up to now is 1119.3 secs Computing kpt #: 103 total cpu time spent up to now is 1129.3 secs Computing kpt #: 104 total cpu time spent up to now is 1139.3 secs Computing kpt #: 105 total cpu time spent up to now is 1149.0 secs Computing kpt #: 106 total cpu time spent up to now is 1159.0 secs Computing kpt #: 107 total cpu time spent up to now is 1168.9 secs Computing kpt #: 108 total cpu time spent up to now is 1178.8 secs Computing kpt #: 109 total cpu time spent up to now is 1188.8 secs Computing kpt #: 110 total cpu time spent up to now is 1199.0 secs Computing kpt #: 111 total cpu time spent up to now is 1209.2 secs Computing kpt #: 112 total cpu time spent up to now is 1219.1 secs Computing kpt #: 113 total cpu time spent up to now is 1229.0 secs Computing kpt #: 114 total cpu time spent up to now is 1238.8 secs Computing kpt #: 115 total cpu time spent up to now is 1249.0 secs Computing kpt #: 116 total cpu time spent up to now is 1258.8 secs Computing kpt #: 117 total cpu time spent up to now is 1268.8 secs Computing kpt #: 118 total cpu time spent up to now is 1278.6 secs Computing kpt #: 119 total cpu time spent up to now is 1288.4 secs Computing kpt #: 120 total cpu time spent up to now is 1298.4 secs Computing kpt #: 121 total cpu time spent up to now is 1308.5 secs Computing kpt #: 122 total cpu time spent up to now is 1318.6 secs Computing kpt #: 123 total cpu time spent up to now is 1328.7 secs Computing kpt #: 124 total cpu time spent up to now is 1338.8 secs Computing kpt #: 125 total cpu time spent up to now is 1348.7 secs Computing kpt #: 126 total cpu time spent up to now is 1358.8 secs Computing kpt #: 127 total cpu time spent up to now is 1368.8 secs Computing kpt #: 128 total cpu time spent up to now is 1380.1 secs Computing kpt #: 129 total cpu time spent up to now is 1391.2 secs Computing kpt #: 130 total cpu time spent up to now is 1401.2 secs Computing kpt #: 131 total cpu time spent up to now is 1411.4 secs Computing kpt #: 132 total cpu time spent up to now is 1421.5 secs Computing kpt #: 133 total cpu time spent up to now is 1431.9 secs Computing kpt #: 134 total cpu time spent up to now is 1442.1 secs Computing kpt #: 135 total cpu time spent up to now is 1452.2 secs Computing kpt #: 136 total cpu time spent up to now is 1462.4 secs Computing kpt #: 137 total cpu time spent up to now is 1472.6 secs Computing kpt #: 138 total cpu time spent up to now is 1482.8 secs Computing kpt #: 139 total cpu time spent up to now is 1493.1 secs Computing kpt #: 140 total cpu time spent up to now is 1503.4 secs Computing kpt #: 141 total cpu time spent up to now is 1513.9 secs Computing kpt #: 142 total cpu time spent up to now is 1524.2 secs Computing kpt #: 143 total cpu time spent up to now is 1534.3 secs Computing kpt #: 144 total cpu time spent up to now is 1544.5 secs Computing kpt #: 145 total cpu time spent up to now is 1554.7 secs Computing kpt #: 146 total cpu time spent up to now is 1565.1 secs Computing kpt #: 147 total cpu time spent up to now is 1575.3 secs Computing kpt #: 148 total cpu time spent up to now is 1585.6 secs Computing kpt #: 149 total cpu time spent up to now is 1595.8 secs Computing kpt #: 150 total cpu time spent up to now is 1605.8 secs Computing kpt #: 151 total cpu time spent up to now is 1616.1 secs Computing kpt #: 152 total cpu time spent up to now is 1626.4 secs Computing kpt #: 153 total cpu time spent up to now is 1636.7 secs Computing kpt #: 154 total cpu time spent up to now is 1647.0 secs Computing kpt #: 155 total cpu time spent up to now is 1657.5 secs Computing kpt #: 156 total cpu time spent up to now is 1667.7 secs Computing kpt #: 157 total cpu time spent up to now is 1678.7 secs Computing kpt #: 158 total cpu time spent up to now is 1688.9 secs Computing kpt #: 159 total cpu time spent up to now is 1699.3 secs Computing kpt #: 160 total cpu time spent up to now is 1709.6 secs Computing kpt #: 161 total cpu time spent up to now is 1719.8 secs Computing kpt #: 162 total cpu time spent up to now is 1730.1 secs Computing kpt #: 163 total cpu time spent up to now is 1740.2 secs Computing kpt #: 164 total cpu time spent up to now is 1750.5 secs Computing kpt #: 165 total cpu time spent up to now is 1760.8 secs Computing kpt #: 166 total cpu time spent up to now is 1771.1 secs Computing kpt #: 167 total cpu time spent up to now is 1781.3 secs Computing kpt #: 168 total cpu time spent up to now is 1791.4 secs Computing kpt #: 169 total cpu time spent up to now is 1801.5 secs Computing kpt #: 170 total cpu time spent up to now is 1811.3 secs Computing kpt #: 171 total cpu time spent up to now is 1821.2 secs Computing kpt #: 172 total cpu time spent up to now is 1831.1 secs Computing kpt #: 173 total cpu time spent up to now is 1841.1 secs Computing kpt #: 174 total cpu time spent up to now is 1851.1 secs Computing kpt #: 175 total cpu time spent up to now is 1861.1 secs Computing kpt #: 176 total cpu time spent up to now is 1871.1 secs Computing kpt #: 177 total cpu time spent up to now is 1881.0 secs Computing kpt #: 178 total cpu time spent up to now is 1890.9 secs Computing kpt #: 179 total cpu time spent up to now is 1901.0 secs Computing kpt #: 180 total cpu time spent up to now is 1910.7 secs Computing kpt #: 181 total cpu time spent up to now is 1920.6 secs Computing kpt #: 182 total cpu time spent up to now is 1930.3 secs Computing kpt #: 183 total cpu time spent up to now is 1940.2 secs Computing kpt #: 184 total cpu time spent up to now is 1950.1 secs Computing kpt #: 185 total cpu time spent up to now is 1959.9 secs Computing kpt #: 186 total cpu time spent up to now is 1970.7 secs Computing kpt #: 187 total cpu time spent up to now is 1982.7 secs Computing kpt #: 188 total cpu time spent up to now is 1992.7 secs Computing kpt #: 189 total cpu time spent up to now is 2002.6 secs Computing kpt #: 190 total cpu time spent up to now is 2012.4 secs Computing kpt #: 191 total cpu time spent up to now is 2022.4 secs Computing kpt #: 192 total cpu time spent up to now is 2032.6 secs Computing kpt #: 193 total cpu time spent up to now is 2042.5 secs Computing kpt #: 194 total cpu time spent up to now is 2052.4 secs Computing kpt #: 195 total cpu time spent up to now is 2062.3 secs Computing kpt #: 196 total cpu time spent up to now is 2072.1 secs Computing kpt #: 197 total cpu time spent up to now is 2082.1 secs Computing kpt #: 198 total cpu time spent up to now is 2092.1 secs Computing kpt #: 199 total cpu time spent up to now is 2102.0 secs Computing kpt #: 200 total cpu time spent up to now is 2111.8 secs Computing kpt #: 201 total cpu time spent up to now is 2121.6 secs Computing kpt #: 202 total cpu time spent up to now is 2131.5 secs Computing kpt #: 203 total cpu time spent up to now is 2141.3 secs Computing kpt #: 204 total cpu time spent up to now is 2151.6 secs Computing kpt #: 205 total cpu time spent up to now is 2161.4 secs Computing kpt #: 206 total cpu time spent up to now is 2171.0 secs Computing kpt #: 207 total cpu time spent up to now is 2181.1 secs Computing kpt #: 208 total cpu time spent up to now is 2190.9 secs Computing kpt #: 209 total cpu time spent up to now is 2200.7 secs Computing kpt #: 210 total cpu time spent up to now is 2210.4 secs Computing kpt #: 211 total cpu time spent up to now is 2220.2 secs Computing kpt #: 212 total cpu time spent up to now is 2230.1 secs Computing kpt #: 213 total cpu time spent up to now is 2240.6 secs Computing kpt #: 214 total cpu time spent up to now is 2251.2 secs Computing kpt #: 215 total cpu time spent up to now is 2262.0 secs Computing kpt #: 216 total cpu time spent up to now is 2272.6 secs Computing kpt #: 217 total cpu time spent up to now is 2285.4 secs Computing kpt #: 218 total cpu time spent up to now is 2295.9 secs Computing kpt #: 219 total cpu time spent up to now is 2306.5 secs Computing kpt #: 220 total cpu time spent up to now is 2317.1 secs Computing kpt #: 221 total cpu time spent up to now is 2327.7 secs Computing kpt #: 222 total cpu time spent up to now is 2338.1 secs Computing kpt #: 223 total cpu time spent up to now is 2348.6 secs Computing kpt #: 224 total cpu time spent up to now is 2359.1 secs Computing kpt #: 225 total cpu time spent up to now is 2369.3 secs Computing kpt #: 226 total cpu time spent up to now is 2379.7 secs Computing kpt #: 227 total cpu time spent up to now is 2390.2 secs Computing kpt #: 228 total cpu time spent up to now is 2400.4 secs Computing kpt #: 229 total cpu time spent up to now is 2410.7 secs Computing kpt #: 230 total cpu time spent up to now is 2420.8 secs Computing kpt #: 231 total cpu time spent up to now is 2430.9 secs Computing kpt #: 232 total cpu time spent up to now is 2441.1 secs Computing kpt #: 233 total cpu time spent up to now is 2451.2 secs Computing kpt #: 234 total cpu time spent up to now is 2461.4 secs Computing kpt #: 235 total cpu time spent up to now is 2471.6 secs Computing kpt #: 236 total cpu time spent up to now is 2481.4 secs Computing kpt #: 237 total cpu time spent up to now is 2491.3 secs Computing kpt #: 238 total cpu time spent up to now is 2501.4 secs Computing kpt #: 239 total cpu time spent up to now is 2511.4 secs Computing kpt #: 240 total cpu time spent up to now is 2521.3 secs Computing kpt #: 241 total cpu time spent up to now is 2531.3 secs Computing kpt #: 242 total cpu time spent up to now is 2541.1 secs Computing kpt #: 243 total cpu time spent up to now is 2551.2 secs Computing kpt #: 244 total cpu time spent up to now is 2561.1 secs Computing kpt #: 245 total cpu time spent up to now is 2571.0 secs ethr = 1.25E-11, avg # of iterations = 36.1 total cpu time spent up to now is 2571.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8595 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4501 -42.4501 -16.0375 -16.0375 -15.9416 -15.9416 -15.6447 -15.6447 -15.5901 -15.5901 -12.9386 -12.9386 -12.7554 -12.7554 -12.6480 -12.6480 -12.6286 -12.6286 -3.0700 -3.0700 -3.0060 -3.0060 -2.8220 -2.8220 -2.7898 -2.7898 -2.6979 -2.6979 -2.6344 -2.6344 -2.4757 -2.4757 -2.3603 -2.3603 -2.2959 -2.2959 -2.2178 -2.2178 -2.1028 -2.1028 -1.9275 -1.9275 -1.5847 -1.5847 -1.4011 -1.4011 -1.2213 -1.2213 -1.1300 -1.1300 -0.6622 -0.6622 -0.5892 -0.5892 -0.1561 -0.1561 -0.0701 -0.0701 -0.0448 -0.0448 0.1051 0.1051 0.1434 0.1434 0.2740 0.2740 2.6126 2.6126 2.8066 2.8066 3.1787 3.1787 3.3563 3.3563 3.6320 3.6320 3.7806 3.7806 4.7294 4.7294 4.8346 4.8346 k = 0.0000 0.0000 0.0157 ( 8591 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4502 -42.4502 -42.4501 -42.4501 -16.0375 -16.0374 -15.9417 -15.9416 -15.6447 -15.6447 -15.5901 -15.5901 -12.9384 -12.9383 -12.7553 -12.7553 -12.6495 -12.6493 -12.6276 -12.6275 -3.0702 -3.0697 -3.0060 -3.0057 -2.8221 -2.8215 -2.7898 -2.7897 -2.6983 -2.6970 -2.6346 -2.6334 -2.4761 -2.4756 -2.3622 -2.3610 -2.2953 -2.2945 -2.2209 -2.2188 -2.1008 -2.0996 -1.9278 -1.9273 -1.5891 -1.5837 -1.4026 -1.3960 -1.2268 -1.2170 -1.1339 -1.1248 -0.6688 -0.6566 -0.5950 -0.5830 -0.1596 -0.1543 -0.0842 -0.0632 -0.0499 -0.0321 0.1049 0.1054 0.1417 0.1446 0.2720 0.2755 2.6128 2.6133 2.8064 2.8067 3.1784 3.1791 3.3560 3.3563 3.6310 3.6316 3.7791 3.7794 4.7293 4.7300 4.8345 4.8350 k = 0.0000 0.0000 0.0314 ( 8587 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4502 -42.4502 -42.4501 -42.4501 -16.0373 -16.0372 -15.9420 -15.9418 -15.6447 -15.6446 -15.5902 -15.5901 -12.9377 -12.9376 -12.7550 -12.7550 -12.6530 -12.6527 -12.6252 -12.6250 -3.0703 -3.0693 -3.0059 -3.0053 -2.8219 -2.8208 -2.7898 -2.7896 -2.6980 -2.6956 -2.6339 -2.6315 -2.4767 -2.4758 -2.3662 -2.3640 -2.2929 -2.2915 -2.2274 -2.2236 -2.0939 -2.0918 -1.9282 -1.9273 -1.5964 -1.5862 -1.4004 -1.3879 -1.2334 -1.2143 -1.1362 -1.1187 -0.6761 -0.6528 -0.5998 -0.5768 -0.1648 -0.1538 -0.0991 -0.0725 -0.0384 -0.0184 0.1049 0.1058 0.1395 0.1454 0.2697 0.2766 2.6138 2.6148 2.8061 2.8069 3.1781 3.1795 3.3554 3.3561 3.6285 3.6297 3.7750 3.7756 4.7298 4.7312 4.8347 4.8358 k = 0.0000 0.0000 0.0471 ( 8591 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4502 -42.4501 -42.4501 -16.0369 -16.0368 -15.9424 -15.9422 -15.6446 -15.6445 -15.5903 -15.5902 -12.9366 -12.9365 -12.7545 -12.7545 -12.6578 -12.6574 -12.6223 -12.6221 -3.0702 -3.0687 -3.0055 -3.0047 -2.8215 -2.8198 -2.7896 -2.7893 -2.6972 -2.6937 -2.6323 -2.6288 -2.4777 -2.4763 -2.3717 -2.3688 -2.2895 -2.2879 -2.2359 -2.2304 -2.0834 -2.0806 -1.9287 -1.9275 -1.6057 -1.5917 -1.3951 -1.3776 -1.2408 -1.2138 -1.1364 -1.1119 -0.6839 -0.6517 -0.6025 -0.5708 -0.1717 -0.1546 -0.1141 -0.0832 -0.0253 -0.0045 0.1047 0.1061 0.1371 0.1458 0.2671 0.2772 2.6156 2.6171 2.8058 2.8069 3.1778 3.1799 3.3545 3.3556 3.6245 3.6263 3.7683 3.7692 4.7309 4.7329 4.8352 4.8369 k = 0.0000 0.0000 0.0628 ( 8590 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4502 -42.4501 -42.4501 -16.0364 -16.0362 -15.9429 -15.9427 -15.6444 -15.6443 -15.5905 -15.5904 -12.9351 -12.9349 -12.7538 -12.7538 -12.6633 -12.6629 -12.6193 -12.6191 -3.0700 -3.0681 -3.0051 -3.0040 -2.8208 -2.8186 -2.7894 -2.7891 -2.6958 -2.6913 -2.6299 -2.6255 -2.4791 -2.4772 -2.3781 -2.3748 -2.2865 -2.2851 -2.2444 -2.2375 -2.0705 -2.0673 -1.9294 -1.9278 -1.6162 -1.5996 -1.3873 -1.3655 -1.2490 -1.2154 -1.1343 -1.1046 -0.6921 -0.6541 -0.6024 -0.5652 -0.1801 -0.1564 -0.1289 -0.0931 -0.0126 0.0093 0.1038 0.1061 0.1349 0.1462 0.2643 0.2774 2.6182 2.6202 2.8055 2.8069 3.1776 3.1804 3.3533 3.3547 3.6193 3.6216 3.7592 3.7605 4.7325 4.7352 4.8359 4.8382 k = 0.0000 0.0000 0.0785 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0358 -16.0356 -15.9436 -15.9433 -15.6442 -15.6441 -15.5907 -15.5906 -12.9331 -12.9329 -12.7530 -12.7529 -12.6693 -12.6689 -12.6164 -12.6162 -3.0695 -3.0672 -3.0045 -3.0033 -2.8198 -2.8171 -2.7892 -2.7888 -2.6937 -2.6884 -2.6268 -2.6215 -2.4808 -2.4784 -2.3850 -2.3815 -2.2858 -2.2850 -2.2506 -2.2425 -2.0562 -2.0526 -1.9301 -1.9282 -1.6272 -1.6090 -1.3779 -1.3525 -1.2579 -1.2191 -1.1299 -1.0966 -0.7006 -0.6598 -0.5995 -0.5600 -0.1899 -0.1591 -0.1434 -0.1021 -0.0010 0.0228 0.1014 0.1056 0.1335 0.1469 0.2615 0.2772 2.6216 2.6240 2.8051 2.8068 3.1775 3.1809 3.3519 3.3537 3.6127 3.6157 3.7480 3.7496 4.7346 4.7379 4.8368 4.8397 k = 0.0000 0.0000 0.0942 ( 8599 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0350 -16.0347 -15.9444 -15.9441 -15.6440 -15.6439 -15.5910 -15.5908 -12.9307 -12.9304 -12.7519 -12.7518 -12.6758 -12.6754 -12.6137 -12.6136 -3.0688 -3.0662 -3.0039 -3.0025 -2.8186 -2.8153 -2.7889 -2.7885 -2.6910 -2.6850 -2.6229 -2.6169 -2.4830 -2.4800 -2.3921 -2.3885 -2.2894 -2.2891 -2.2523 -2.2439 -2.0409 -2.0371 -1.9308 -1.9287 -1.6383 -1.6191 -1.3679 -1.3389 -1.2675 -1.2242 -1.1236 -1.0882 -0.7095 -0.6679 -0.5949 -0.5552 -0.2004 -0.1631 -0.1568 -0.1104 0.0091 0.0358 0.0969 0.1045 0.1333 0.1482 0.2588 0.2768 2.6257 2.6285 2.8046 2.8066 3.1774 3.1815 3.3502 3.3523 3.6051 3.6086 3.7350 3.7368 4.7372 4.7411 4.8379 4.8412 k = 0.0000 0.0000 0.1099 ( 8607 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0341 -16.0338 -15.9454 -15.9450 -15.6437 -15.6436 -15.5913 -15.5911 -12.9279 -12.9275 -12.7507 -12.7506 -12.6826 -12.6821 -12.6114 -12.6112 -3.0678 -3.0649 -3.0034 -3.0017 -2.8173 -2.8134 -2.7887 -2.7881 -2.6876 -2.6811 -2.6184 -2.6119 -2.4856 -2.4822 -2.3991 -2.3955 -2.2974 -2.2958 -2.2504 -2.2423 -2.0252 -2.0212 -1.9315 -1.9293 -1.6490 -1.6295 -1.3581 -1.3253 -1.2776 -1.2300 -1.1158 -1.0793 -0.7187 -0.6778 -0.5892 -0.5509 -0.2113 -0.1724 -0.1649 -0.1182 0.0170 0.0483 0.0903 0.1034 0.1345 0.1501 0.2564 0.2762 2.6305 2.6336 2.8040 2.8062 3.1774 3.1820 3.3483 3.3507 3.5965 3.6005 3.7204 3.7224 4.7402 4.7447 4.8389 4.8428 k = 0.0000 0.0000 0.1257 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0330 -16.0327 -15.9465 -15.9461 -15.6435 -15.6433 -15.5916 -15.5914 -12.9247 -12.9243 -12.7494 -12.7492 -12.6896 -12.6892 -12.6093 -12.6091 -3.0666 -3.0634 -3.0028 -3.0010 -2.8157 -2.8114 -2.7884 -2.7877 -2.6836 -2.6768 -2.6133 -2.6064 -2.4887 -2.4848 -2.4058 -2.4024 -2.3068 -2.3043 -2.2470 -2.2393 -2.0093 -2.0052 -1.9319 -1.9296 -1.6590 -1.6396 -1.3495 -1.3132 -1.2868 -1.2353 -1.1069 -1.0700 -0.7285 -0.6889 -0.5830 -0.5469 -0.2223 -0.1848 -0.1694 -0.1258 0.0221 0.0601 0.0818 0.1029 0.1367 0.1525 0.2543 0.2754 2.6358 2.6393 2.8032 2.8057 3.1775 3.1827 3.3462 3.3489 3.5870 3.5916 3.7045 3.7069 4.7436 4.7486 4.8399 4.8444 k = 0.0000 0.0000 0.1414 ( 8619 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0319 -16.0316 -15.9476 -15.9472 -15.6431 -15.6430 -15.5920 -15.5917 -12.9211 -12.9206 -12.7480 -12.7478 -12.6969 -12.6964 -12.6075 -12.6073 -3.0650 -3.0615 -3.0024 -3.0005 -2.8141 -2.8093 -2.7881 -2.7873 -2.6791 -2.6720 -2.6078 -2.6006 -2.4923 -2.4880 -2.4122 -2.4090 -2.3164 -2.3133 -2.2437 -2.2361 -1.9935 -1.9891 -1.9319 -1.9297 -1.6680 -1.6492 -1.3436 -1.3104 -1.2875 -1.2388 -1.0971 -1.0603 -0.7387 -0.7010 -0.5764 -0.5432 -0.2328 -0.1969 -0.1738 -0.1332 0.0235 0.0693 0.0737 0.1041 0.1395 0.1551 0.2526 0.2746 2.6417 2.6455 2.8023 2.8050 3.1778 3.1834 3.3439 3.3469 3.5769 3.5819 3.6879 3.6904 4.7474 4.7529 4.8409 4.8458 k = 0.0000 0.0000 0.1571 ( 8620 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5523 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0307 -16.0303 -15.9489 -15.9484 -15.6428 -15.6426 -15.5923 -15.5921 -12.9171 -12.9166 -12.7465 -12.7463 -12.7044 -12.7039 -12.6060 -12.6059 -3.0631 -3.0594 -3.0021 -3.0000 -2.8123 -2.8071 -2.7878 -2.7868 -2.6740 -2.6667 -2.6019 -2.5945 -2.4964 -2.4919 -2.4183 -2.4152 -2.3255 -2.3220 -2.2410 -2.2336 -1.9780 -1.9734 -1.9312 -1.9290 -1.6761 -1.6581 -1.3419 -1.3202 -1.2763 -1.2390 -1.0867 -1.0503 -0.7495 -0.7140 -0.5697 -0.5398 -0.2428 -0.2083 -0.1782 -0.1405 0.0211 0.0595 0.0824 0.1073 0.1426 0.1579 0.2514 0.2738 2.6481 2.6521 2.8012 2.8040 3.1781 3.1841 3.3415 3.3447 3.5664 3.5718 3.6708 3.6735 4.7515 4.7574 4.8416 4.8471 k = 0.0000 0.0000 0.1728 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0294 -16.0290 -15.9502 -15.9497 -15.6425 -15.6423 -15.5927 -15.5924 -12.9128 -12.9122 -12.7451 -12.7448 -12.7119 -12.7114 -12.6047 -12.6046 -3.0608 -3.0571 -3.0020 -2.9998 -2.8105 -2.8051 -2.7875 -2.7863 -2.6685 -2.6612 -2.5958 -2.5884 -2.5010 -2.4963 -2.4239 -2.4209 -2.3338 -2.3300 -2.2396 -2.2322 -1.9630 -1.9582 -1.9293 -1.9274 -1.6831 -1.6662 -1.3452 -1.3333 -1.2625 -1.2349 -1.0759 -1.0401 -0.7610 -0.7276 -0.5629 -0.5367 -0.2520 -0.2189 -0.1824 -0.1478 0.0155 0.0469 0.0923 0.1123 0.1459 0.1606 0.2507 0.2730 2.6549 2.6590 2.7999 2.8028 3.1786 3.1849 3.3389 3.3424 3.5555 3.5612 3.6536 3.6566 4.7558 4.7622 4.8422 4.8481 k = 0.0000 0.0000 0.1885 ( 8617 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0280 -16.0276 -15.9516 -15.9511 -15.6421 -15.6419 -15.5931 -15.5928 -12.9081 -12.9075 -12.7437 -12.7434 -12.7194 -12.7189 -12.6037 -12.6036 -3.0583 -3.0544 -3.0021 -2.9997 -2.8088 -2.8031 -2.7871 -2.7857 -2.6627 -2.6554 -2.5897 -2.5823 -2.5059 -2.5011 -2.4293 -2.4261 -2.3409 -2.3370 -2.2397 -2.2322 -1.9493 -1.9442 -1.9257 -1.9240 -1.6891 -1.6736 -1.3535 -1.3470 -1.2481 -1.2268 -1.0651 -1.0299 -0.7729 -0.7417 -0.5563 -0.5336 -0.2603 -0.2289 -0.1864 -0.1550 0.0074 0.0335 0.1016 0.1184 0.1491 0.1632 0.2504 0.2722 2.6619 2.6662 2.7984 2.8013 3.1792 3.1858 3.3362 3.3399 3.5445 3.5505 3.6367 3.6398 4.7604 4.7671 4.8425 4.8488 k = 0.0000 0.0000 0.2042 ( 8621 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5523 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0266 -16.0261 -15.9530 -15.9525 -15.6417 -15.6415 -15.5935 -15.5932 -12.9031 -12.9025 -12.7428 -12.7424 -12.7265 -12.7262 -12.6030 -12.6029 -3.0555 -3.0515 -3.0025 -2.9999 -2.8070 -2.8014 -2.7865 -2.7849 -2.6565 -2.6494 -2.5837 -2.5763 -2.5110 -2.5063 -2.4346 -2.4310 -2.3468 -2.3427 -2.2414 -2.2339 -1.9378 -1.9329 -1.9191 -1.9172 -1.6944 -1.6802 -1.3661 -1.3604 -1.2332 -1.2158 -1.0544 -1.0200 -0.7854 -0.7562 -0.5498 -0.5307 -0.2677 -0.2382 -0.1900 -0.1621 -0.0021 0.0197 0.1103 0.1249 0.1523 0.1655 0.2505 0.2715 2.6692 2.6735 2.7966 2.7996 3.1799 3.1866 3.3333 3.3372 3.5335 3.5397 3.6204 3.6237 4.7651 4.7720 4.8426 4.8492 k = 0.0000 0.0000 0.2199 ( 8629 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0251 -16.0247 -15.9545 -15.9540 -15.6413 -15.6412 -15.5939 -15.5936 -12.8979 -12.8973 -12.7433 -12.7427 -12.7322 -12.7321 -12.6024 -12.6023 -3.0524 -3.0483 -3.0031 -3.0004 -2.8053 -2.7999 -2.7859 -2.7842 -2.6502 -2.6433 -2.5781 -2.5709 -2.5160 -2.5114 -2.4399 -2.4356 -2.3513 -2.3470 -2.2448 -2.2374 -1.9295 -1.9251 -1.9090 -1.9062 -1.6989 -1.6863 -1.3810 -1.3741 -1.2180 -1.2029 -1.0442 -1.0107 -0.7980 -0.7709 -0.5436 -0.5279 -0.2743 -0.2470 -0.1932 -0.1689 -0.0123 0.0057 0.1184 0.1313 0.1552 0.1675 0.2509 0.2707 2.6766 2.6809 2.7945 2.7975 3.1808 3.1875 3.3305 3.3345 3.5228 3.5289 3.6051 3.6084 4.7698 4.7770 4.8424 4.8493 k = 0.0000 0.0000 0.2356 ( 8629 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0237 -16.0233 -15.9559 -15.9554 -15.6410 -15.6408 -15.5942 -15.5940 -12.8925 -12.8919 -12.7474 -12.7466 -12.7345 -12.7344 -12.6020 -12.6019 -3.0491 -3.0450 -3.0039 -3.0011 -2.8038 -2.7987 -2.7851 -2.7833 -2.6437 -2.6371 -2.5732 -2.5663 -2.5205 -2.5158 -2.4451 -2.4403 -2.3541 -2.3496 -2.2498 -2.2425 -1.9227 -1.9188 -1.8968 -1.8933 -1.7030 -1.6918 -1.3964 -1.3885 -1.2026 -1.1888 -1.0349 -1.0023 -0.8105 -0.7853 -0.5378 -0.5251 -0.2801 -0.2554 -0.1958 -0.1754 -0.0228 -0.0080 0.1257 0.1374 0.1580 0.1693 0.2515 0.2699 2.6841 2.6883 2.7922 2.7951 3.1818 3.1884 3.3277 3.3317 3.5125 3.5185 3.5910 3.5943 4.7746 4.7818 4.8420 4.8490 k = 0.0000 0.0000 0.2513 ( 8621 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5523 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0223 -16.0219 -15.9573 -15.9568 -15.6406 -15.6405 -15.5946 -15.5943 -12.8869 -12.8863 -12.7538 -12.7531 -12.7342 -12.7341 -12.6017 -12.6017 -3.0456 -3.0415 -3.0050 -3.0021 -2.8024 -2.7978 -2.7843 -2.7824 -2.6372 -2.6309 -2.5697 -2.5632 -2.5239 -2.5188 -2.4504 -2.4450 -2.3554 -2.3505 -2.2563 -2.2491 -1.9163 -1.9127 -1.8840 -1.8801 -1.7069 -1.6970 -1.4115 -1.4031 -1.1869 -1.1741 -1.0269 -0.9955 -0.8224 -0.7992 -0.5323 -0.5223 -0.2852 -0.2635 -0.1979 -0.1812 -0.0330 -0.0211 0.1323 0.1428 0.1607 0.1708 0.2524 0.2691 2.6914 2.6955 2.7896 2.7924 3.1829 3.1893 3.3249 3.3289 3.5029 3.5086 3.5783 3.5815 4.7793 4.7866 4.8413 4.8484 k = 0.0000 0.0000 0.2670 ( 8624 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0210 -16.0206 -15.9586 -15.9581 -15.6403 -15.6402 -15.5949 -15.5947 -12.8813 -12.8807 -12.7608 -12.7601 -12.7333 -12.7332 -12.6016 -12.6015 -3.0420 -3.0379 -3.0065 -3.0033 -2.8011 -2.7972 -2.7834 -2.7815 -2.6306 -2.6248 -2.5681 -2.5623 -2.5256 -2.5199 -2.4558 -2.4500 -2.3549 -2.3498 -2.2641 -2.2569 -1.9100 -1.9067 -1.8712 -1.8672 -1.7106 -1.7019 -1.4260 -1.4175 -1.1711 -1.1591 -1.0206 -0.9908 -0.8332 -0.8122 -0.5274 -0.5197 -0.2898 -0.2711 -0.1994 -0.1863 -0.0426 -0.0333 0.1380 0.1473 0.1633 0.1723 0.2534 0.2682 2.6986 2.7025 2.7868 2.7895 3.1842 3.1901 3.3223 3.3261 3.4941 3.4993 3.5673 3.5702 4.7840 4.7911 4.8405 4.8475 k = 0.0000 0.0000 0.2827 ( 8619 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0198 -16.0194 -15.9597 -15.9593 -15.6400 -15.6399 -15.5951 -15.5949 -12.8758 -12.8752 -12.7677 -12.7671 -12.7322 -12.7322 -12.6015 -12.6015 -3.0384 -3.0343 -3.0082 -3.0049 -2.8000 -2.7967 -2.7825 -2.7806 -2.6241 -2.6189 -2.5687 -2.5639 -2.5250 -2.5188 -2.4611 -2.4551 -2.3528 -2.3473 -2.2727 -2.2657 -1.9039 -1.9010 -1.8589 -1.8548 -1.7143 -1.7066 -1.4392 -1.4312 -1.1555 -1.1441 -1.0163 -0.9889 -0.8422 -0.8237 -0.5230 -0.5172 -0.2938 -0.2784 -0.2005 -0.1905 -0.0512 -0.0442 0.1428 0.1508 0.1660 0.1736 0.2544 0.2672 2.7055 2.7091 2.7839 2.7864 3.1855 3.1908 3.3199 3.3234 3.4864 3.4909 3.5580 3.5606 4.7884 4.7951 4.8396 4.8463 k = 0.0000 0.0000 0.2984 ( 8617 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4503 -42.4502 -42.4502 -16.0187 -16.0184 -15.9607 -15.9604 -15.6398 -15.6397 -15.5954 -15.5952 -12.8705 -12.8700 -12.7742 -12.7736 -12.7313 -12.7312 -12.6015 -12.6015 -3.0347 -3.0306 -3.0101 -3.0068 -2.7990 -2.7964 -2.7817 -2.7799 -2.6176 -2.6130 -2.5711 -2.5675 -2.5224 -2.5162 -2.4663 -2.4603 -2.3492 -2.3434 -2.2820 -2.2751 -1.8983 -1.8959 -1.8474 -1.8434 -1.7180 -1.7112 -1.4508 -1.4436 -1.1404 -1.1298 -1.0143 -0.9899 -0.8489 -0.8335 -0.5192 -0.5150 -0.2972 -0.2850 -0.2012 -0.1938 -0.0587 -0.0536 0.1468 0.1532 0.1687 0.1748 0.2556 0.2661 2.7119 2.7151 2.7809 2.7832 3.1868 3.1913 3.3179 3.3209 3.4799 3.4837 3.5504 3.5526 4.7925 4.7987 4.8387 4.8449 k = 0.0000 0.0000 0.3141 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0178 -16.0176 -15.9616 -15.9613 -15.6396 -15.6395 -15.5955 -15.5954 -12.8658 -12.8653 -12.7799 -12.7793 -12.7305 -12.7304 -12.6015 -12.6015 -3.0311 -3.0271 -3.0124 -3.0089 -2.7982 -2.7963 -2.7809 -2.7794 -2.6113 -2.6074 -2.5748 -2.5723 -2.5186 -2.5129 -2.4711 -2.4654 -2.3442 -2.3382 -2.2916 -2.2848 -1.8935 -1.8916 -1.8371 -1.8334 -1.7214 -1.7157 -1.4601 -1.4542 -1.1262 -1.1168 -1.0141 -0.9939 -0.8531 -0.8413 -0.5161 -0.5132 -0.2998 -0.2908 -0.2016 -0.1962 -0.0647 -0.0612 0.1499 0.1547 0.1711 0.1757 0.2568 0.2649 2.7176 2.7203 2.7781 2.7800 3.1880 3.1916 3.3162 3.3187 3.4748 3.4777 3.5445 3.5462 4.7962 4.8015 4.8381 4.8433 k = 0.0000 0.0000 0.3298 ( 8617 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0171 -16.0170 -15.9622 -15.9620 -15.6394 -15.6394 -15.5957 -15.5956 -12.8618 -12.8615 -12.7844 -12.7840 -12.7299 -12.7298 -12.6016 -12.6016 -3.0275 -3.0236 -3.0150 -3.0113 -2.7976 -2.7963 -2.7802 -2.7792 -2.6051 -2.6021 -2.5790 -2.5777 -2.5145 -2.5098 -2.4749 -2.4703 -2.3380 -2.3320 -2.3009 -2.2944 -1.8898 -1.8885 -1.8285 -1.8257 -1.7242 -1.7199 -1.4667 -1.4625 -1.1137 -1.1062 -1.0148 -1.0000 -0.8551 -0.8472 -0.5137 -0.5119 -0.3015 -0.2956 -0.2015 -0.1980 -0.0691 -0.0669 0.1522 0.1554 0.1733 0.1764 0.2581 0.2636 2.7223 2.7243 2.7758 2.7772 3.1892 3.1917 3.3151 3.3169 3.4712 3.4732 3.5405 3.5416 4.7994 4.8033 4.8377 4.8416 k = 0.0000 0.0000 0.3455 ( 8619 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0167 -16.0166 -15.9625 -15.9624 -15.6393 -15.6393 -15.5957 -15.5957 -12.8592 -12.8590 -12.7873 -12.7871 -12.7295 -12.7295 -12.6016 -12.6016 -3.0241 -3.0203 -3.0177 -3.0140 -2.7970 -2.7964 -2.7796 -2.7791 -2.5994 -2.5975 -2.5833 -2.5828 -2.5108 -2.5080 -2.4771 -2.4743 -2.3310 -2.3258 -2.3090 -2.3036 -1.8874 -1.8867 -1.8225 -1.8209 -1.7256 -1.7233 -1.4704 -1.4682 -1.1042 -1.0998 -1.0147 -1.0066 -0.8553 -0.8513 -0.5121 -0.5112 -0.3021 -0.2991 -0.2011 -0.1993 -0.0716 -0.0705 0.1539 0.1555 0.1750 0.1765 0.2595 0.2622 2.7256 2.7267 2.7744 2.7751 3.1902 3.1915 3.3147 3.3156 3.4693 3.4703 3.5382 3.5387 4.8019 4.8040 4.8380 4.8400 k = 0.0000 0.0000 0.3612 ( 8620 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9626 -15.9626 -15.6393 -15.6393 -15.5957 -15.5957 -12.8581 -12.8581 -12.7883 -12.7883 -12.7294 -12.7294 -12.6016 -12.6016 -3.0209 -3.0209 -3.0169 -3.0169 -2.7967 -2.7967 -2.7793 -2.7793 -2.5958 -2.5958 -2.5855 -2.5855 -2.5084 -2.5084 -2.4768 -2.4768 -2.3248 -2.3248 -2.3106 -2.3106 -1.8863 -1.8863 -1.8198 -1.8198 -1.7253 -1.7253 -1.4709 -1.4709 -1.0991 -1.0991 -1.0120 -1.0120 -0.8540 -0.8540 -0.5112 -0.5112 -0.3013 -0.3013 -0.2003 -0.2003 -0.0721 -0.0721 0.1550 0.1550 0.1760 0.1760 0.2608 0.2608 2.7272 2.7272 2.7741 2.7741 3.1910 3.1910 3.3148 3.3148 3.4690 3.4690 3.5376 3.5376 4.8035 4.8035 4.8388 4.8388 k = 0.0000 0.0000 0.3612 ( 8620 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9626 -15.9626 -15.6393 -15.6393 -15.5957 -15.5957 -12.8581 -12.8581 -12.7883 -12.7883 -12.7294 -12.7294 -12.6016 -12.6016 -3.0209 -3.0209 -3.0169 -3.0169 -2.7967 -2.7967 -2.7793 -2.7793 -2.5958 -2.5958 -2.5855 -2.5855 -2.5084 -2.5084 -2.4768 -2.4768 -2.3248 -2.3248 -2.3106 -2.3106 -1.8863 -1.8863 -1.8198 -1.8198 -1.7253 -1.7253 -1.4709 -1.4709 -1.0991 -1.0991 -1.0120 -1.0120 -0.8540 -0.8540 -0.5112 -0.5112 -0.3013 -0.3013 -0.2003 -0.2003 -0.0721 -0.0721 0.1550 0.1550 0.1760 0.1760 0.2608 0.2608 2.7272 2.7272 2.7741 2.7741 3.1910 3.1910 3.3148 3.3148 3.4690 3.4690 3.5376 3.5376 4.8035 4.8035 4.8388 4.8388 k = 0.0000 0.0156 0.3612 ( 8622 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9626 -15.9626 -15.6393 -15.6393 -15.5958 -15.5957 -12.8583 -12.8582 -12.7882 -12.7882 -12.7294 -12.7294 -12.6016 -12.6016 -3.0241 -3.0204 -3.0183 -3.0146 -2.7972 -2.7957 -2.7793 -2.7791 -2.5974 -2.5961 -2.5851 -2.5841 -2.5085 -2.5079 -2.4770 -2.4765 -2.3275 -2.3232 -2.3114 -2.3080 -1.8869 -1.8860 -1.8217 -1.8196 -1.7254 -1.7230 -1.4704 -1.4700 -1.1015 -1.0967 -1.0129 -1.0104 -0.8541 -0.8531 -0.5119 -0.5107 -0.3120 -0.2947 -0.2072 -0.1907 -0.0729 -0.0710 0.1511 0.1558 0.1746 0.1761 0.2599 0.2636 2.7268 2.7271 2.7739 2.7741 3.1910 3.1912 3.3147 3.3151 3.4680 3.4693 3.5376 3.5386 4.8027 4.8038 4.8380 4.8394 k = 0.0000 0.0313 0.3612 ( 8619 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -16.0165 -16.0165 -15.9626 -15.9625 -15.6394 -15.6393 -15.5958 -15.5957 -12.8585 -12.8584 -12.7880 -12.7880 -12.7297 -12.7297 -12.6014 -12.6014 -3.0281 -3.0244 -3.0168 -3.0130 -2.7973 -2.7944 -2.7791 -2.7787 -2.5999 -2.5979 -2.5830 -2.5815 -2.5083 -2.5071 -2.4770 -2.4760 -2.3303 -2.3235 -2.3094 -2.3044 -1.8879 -1.8860 -1.8250 -1.8211 -1.7231 -1.7186 -1.4686 -1.4679 -1.1037 -1.0943 -1.0129 -1.0080 -0.8535 -0.8514 -0.5128 -0.5103 -0.3251 -0.2940 -0.2094 -0.1799 -0.0735 -0.0695 0.1446 0.1534 0.1720 0.1748 0.2609 0.2677 2.7259 2.7267 2.7735 2.7740 3.1913 3.1917 3.3147 3.3155 3.4666 3.4691 3.5387 3.5407 4.8014 4.8036 4.8373 4.8400 k = 0.0000 0.0469 0.3612 ( 8621 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9625 -15.9624 -15.6394 -15.6393 -15.5958 -15.5956 -12.8589 -12.8587 -12.7877 -12.7877 -12.7302 -12.7302 -12.6012 -12.6011 -3.0329 -3.0292 -3.0159 -3.0121 -2.7970 -2.7928 -2.7788 -2.7782 -2.6027 -2.6002 -2.5804 -2.5787 -2.5077 -2.5061 -2.4769 -2.4754 -2.3331 -2.3251 -2.3053 -2.3000 -1.8893 -1.8864 -1.8290 -1.8238 -1.7188 -1.7127 -1.4656 -1.4645 -1.1058 -1.0920 -1.0122 -1.0051 -0.8521 -0.8491 -0.5138 -0.5101 -0.3396 -0.2996 -0.2065 -0.1692 -0.0739 -0.0675 0.1362 0.1480 0.1682 0.1722 0.2635 0.2728 2.7247 2.7258 2.7731 2.7738 3.1919 3.1925 3.3149 3.3160 3.4648 3.4683 3.5408 3.5436 4.7997 4.8028 4.8365 4.8404 k = 0.0000 0.0625 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9623 -15.9622 -15.6395 -15.6393 -15.5958 -15.5956 -12.8595 -12.8592 -12.7872 -12.7872 -12.7308 -12.7308 -12.6009 -12.6008 -3.0384 -3.0347 -3.0158 -3.0121 -2.7964 -2.7909 -2.7784 -2.7776 -2.6055 -2.6026 -2.5778 -2.5759 -2.5066 -2.5046 -2.4766 -2.4747 -2.3359 -2.3274 -2.3000 -2.2950 -1.8912 -1.8875 -1.8331 -1.8271 -1.7127 -1.7055 -1.4615 -1.4601 -1.1075 -1.0896 -1.0107 -1.0017 -0.8501 -0.8460 -0.5149 -0.5101 -0.3549 -0.3101 -0.1998 -0.1591 -0.0740 -0.0648 0.1262 0.1401 0.1632 0.1683 0.2673 0.2784 2.7230 2.7245 2.7724 2.7734 3.1928 3.1936 3.3152 3.3167 3.4628 3.4671 3.5438 3.5471 4.7976 4.8015 4.8356 4.8404 k = 0.0000 0.0781 0.3612 ( 8630 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9621 -15.9620 -15.6395 -15.6394 -15.5958 -15.5955 -12.8602 -12.8598 -12.7867 -12.7866 -12.7316 -12.7316 -12.6005 -12.6004 -3.0444 -3.0408 -3.0162 -3.0126 -2.7955 -2.7889 -2.7778 -2.7768 -2.6082 -2.6050 -2.5753 -2.5731 -2.5052 -2.5028 -2.4761 -2.4739 -2.3386 -2.3299 -2.2937 -2.2893 -1.8939 -1.8892 -1.8368 -1.8304 -1.7054 -1.6974 -1.4565 -1.4548 -1.1088 -1.0873 -1.0087 -0.9981 -0.8473 -0.8423 -0.5163 -0.5104 -0.3706 -0.3235 -0.1914 -0.1502 -0.0737 -0.0610 0.1151 0.1305 0.1570 0.1632 0.2717 0.2840 2.7210 2.7228 2.7717 2.7728 3.1939 3.1949 3.3156 3.3174 3.4608 3.4657 3.5475 3.5512 4.7954 4.7997 4.8346 4.8401 k = 0.0000 0.0938 0.3612 ( 8635 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0164 -15.9619 -15.9617 -15.6396 -15.6394 -15.5958 -15.5955 -12.8610 -12.8606 -12.7860 -12.7859 -12.7325 -12.7325 -12.6000 -12.5999 -3.0509 -3.0474 -3.0173 -3.0137 -2.7945 -2.7869 -2.7770 -2.7758 -2.6107 -2.6072 -2.5731 -2.5707 -2.5032 -2.5005 -2.4755 -2.4730 -2.3414 -2.3325 -2.2869 -2.2832 -1.8973 -1.8918 -1.8397 -1.8330 -1.6970 -1.6885 -1.4508 -1.4489 -1.1095 -1.0847 -1.0063 -0.9943 -0.8439 -0.8381 -0.5180 -0.5111 -0.3862 -0.3383 -0.1826 -0.1428 -0.0731 -0.0562 0.1031 0.1194 0.1497 0.1571 0.2764 0.2894 2.7186 2.7207 2.7708 2.7722 3.1953 3.1964 3.3161 3.3182 3.4588 3.4642 3.5517 3.5557 4.7929 4.7977 4.8333 4.8394 k = 0.0000 0.1094 0.3612 ( 8633 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0164 -15.9616 -15.9614 -15.6397 -15.6395 -15.5958 -15.5954 -12.8620 -12.8615 -12.7851 -12.7851 -12.7336 -12.7335 -12.5995 -12.5994 -3.0579 -3.0545 -3.0188 -3.0154 -2.7932 -2.7850 -2.7761 -2.7747 -2.6131 -2.6093 -2.5712 -2.5686 -2.5009 -2.4979 -2.4748 -2.4720 -2.3441 -2.3351 -2.2797 -2.2767 -1.9012 -1.8953 -1.8414 -1.8348 -1.6878 -1.6790 -1.4447 -1.4425 -1.1095 -1.0818 -1.0037 -0.9905 -0.8399 -0.8333 -0.5200 -0.5121 -0.4014 -0.3538 -0.1742 -0.1369 -0.0717 -0.0501 0.0904 0.1074 0.1415 0.1500 0.2808 0.2944 2.7158 2.7183 2.7699 2.7714 3.1970 3.1982 3.3166 3.3191 3.4570 3.4627 3.5564 3.5605 4.7904 4.7953 4.8317 4.8381 k = 0.0000 0.1250 0.3612 ( 8627 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0166 -16.0164 -15.9612 -15.9610 -15.6398 -15.6396 -15.5958 -15.5954 -12.8630 -12.8626 -12.7841 -12.7841 -12.7348 -12.7347 -12.5989 -12.5988 -3.0651 -3.0618 -3.0206 -3.0173 -2.7919 -2.7833 -2.7750 -2.7735 -2.6152 -2.6112 -2.5696 -2.5668 -2.4981 -2.4949 -2.4740 -2.4709 -2.3468 -2.3378 -2.2722 -2.2699 -1.9056 -1.8993 -1.8420 -1.8356 -1.6779 -1.6689 -1.4383 -1.4359 -1.1089 -1.0786 -1.0014 -0.9870 -0.8353 -0.8281 -0.5223 -0.5136 -0.4160 -0.3694 -0.1668 -0.1325 -0.0697 -0.0430 0.0773 0.0945 0.1325 0.1421 0.2849 0.2988 2.7128 2.7155 2.7689 2.7706 3.1990 3.2003 3.3171 3.3200 3.4555 3.4614 3.5613 3.5654 4.7878 4.7928 4.8297 4.8363 k = 0.0000 0.1406 0.3612 ( 8632 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0166 -16.0165 -15.9609 -15.9606 -15.6399 -15.6397 -15.5957 -15.5953 -12.8642 -12.8638 -12.7830 -12.7830 -12.7360 -12.7359 -12.5984 -12.5983 -3.0726 -3.0693 -3.0228 -3.0196 -2.7906 -2.7819 -2.7739 -2.7721 -2.6172 -2.6129 -2.5683 -2.5654 -2.4952 -2.4918 -2.4730 -2.4697 -2.3495 -2.3405 -2.2647 -2.2631 -1.9099 -1.9036 -1.8417 -1.8356 -1.6673 -1.6582 -1.4318 -1.4293 -1.1075 -1.0748 -0.9994 -0.9838 -0.8302 -0.8226 -0.5251 -0.5157 -0.4295 -0.3846 -0.1606 -0.1293 -0.0667 -0.0351 0.0640 0.0812 0.1229 0.1335 0.2885 0.3025 2.7094 2.7124 2.7678 2.7696 3.2011 3.2025 3.3177 3.3209 3.4543 3.4603 3.5664 3.5704 4.7851 4.7901 4.8273 4.8339 k = 0.0000 0.1563 0.3612 ( 8634 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0166 -16.0165 -15.9605 -15.9602 -15.6400 -15.6398 -15.5957 -15.5953 -12.8655 -12.8650 -12.7818 -12.7817 -12.7373 -12.7373 -12.5978 -12.5977 -3.0802 -3.0770 -3.0251 -3.0221 -2.7893 -2.7807 -2.7728 -2.7707 -2.6190 -2.6145 -2.5673 -2.5642 -2.4923 -2.4886 -2.4718 -2.4683 -2.3522 -2.3432 -2.2576 -2.2564 -1.9139 -1.9077 -1.8406 -1.8348 -1.6562 -1.6470 -1.4255 -1.4229 -1.1052 -1.0706 -0.9982 -0.9811 -0.8248 -0.8169 -0.5284 -0.5183 -0.4416 -0.3990 -0.1559 -0.1270 -0.0628 -0.0268 0.0506 0.0675 0.1129 0.1245 0.2914 0.3055 2.7058 2.7091 2.7667 2.7687 3.2035 3.2050 3.3182 3.3217 3.4535 3.4596 3.5716 3.5754 4.7825 4.7874 4.8244 4.8309 k = 0.0000 0.1719 0.3612 ( 8622 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0166 -16.0165 -15.9600 -15.9598 -15.6401 -15.6399 -15.5957 -15.5952 -12.8669 -12.8664 -12.7804 -12.7803 -12.7387 -12.7386 -12.5972 -12.5971 -3.0877 -3.0846 -3.0276 -3.0247 -2.7881 -2.7798 -2.7717 -2.7692 -2.6206 -2.6159 -2.5665 -2.5633 -2.4896 -2.4857 -2.4701 -2.4666 -2.3548 -2.3458 -2.2511 -2.2500 -1.9174 -1.9113 -1.8388 -1.8334 -1.6446 -1.6353 -1.4195 -1.4169 -1.1022 -1.0657 -0.9979 -0.9791 -0.8191 -0.8113 -0.5324 -0.5216 -0.4519 -0.4121 -0.1525 -0.1255 -0.0583 -0.0184 0.0374 0.0537 0.1028 0.1152 0.2934 0.3077 2.7020 2.7055 2.7656 2.7678 3.2060 3.2076 3.3186 3.3225 3.4532 3.4591 3.5767 3.5803 4.7798 4.7845 4.8211 4.8273 k = 0.0000 0.1875 0.3612 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 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-12.7772 -12.7416 -12.7415 -12.5961 -12.5960 -3.1026 -3.0997 -3.0326 -3.0300 -2.7858 -2.7786 -2.7697 -2.7665 -2.6232 -2.6183 -2.5650 -2.5617 -2.4855 -2.4816 -2.4650 -2.4620 -2.3596 -2.3506 -2.2409 -2.2389 -1.9214 -1.9160 -1.8343 -1.8295 -1.6197 -1.6102 -1.4090 -1.4065 -1.0940 -1.0544 -1.0011 -0.9782 -0.8075 -0.8007 -0.5421 -0.5296 -0.4665 -0.4334 -0.1491 -0.1239 -0.0495 -0.0042 0.0134 0.0274 0.0837 0.0969 0.2951 0.3094 2.6938 2.6977 2.7636 2.7659 3.2114 3.2134 3.3192 3.3238 3.4539 3.4594 3.5869 3.5899 4.7746 4.7787 4.8133 4.8188 k = 0.0000 0.2188 0.3612 ( 8629 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0169 -16.0168 -15.9586 -15.9583 -15.6404 -15.6402 -15.5955 -15.5950 -12.8716 -12.8711 -12.7755 -12.7754 -12.7430 -12.7429 -12.5956 -12.5955 -3.1098 -3.1070 -3.0349 -3.0325 -2.7849 -2.7783 -2.7688 -2.7653 -2.6242 -2.6193 -2.5644 -2.5610 -2.4844 -2.4806 -2.4615 -2.4592 -2.3618 -2.3528 -2.2372 -2.2348 -1.9218 -1.9167 -1.8317 -1.8273 -1.6065 -1.5969 -1.4046 -1.4023 -1.0890 -1.0481 -1.0048 -0.9794 -0.8019 -0.7962 -0.5475 -0.5340 -0.4706 -0.4411 -0.1486 -0.1235 -0.0476 -0.0019 0.0039 0.0179 0.0760 0.0884 0.2945 0.3088 2.6896 2.6936 2.7628 2.7651 3.2141 3.2163 3.3193 3.3243 3.4549 3.4602 3.5917 3.5943 4.7719 4.7758 4.8091 4.8140 k = 0.0000 0.2344 0.3612 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0170 -16.0169 -15.9581 -15.9578 -15.6405 -15.6404 -15.5954 -15.5949 -12.8733 -12.8728 -12.7737 -12.7735 -12.7444 -12.7443 -12.5952 -12.5951 -3.1167 -3.1139 -3.0372 -3.0349 -2.7840 -2.7781 -2.7681 -2.7643 -2.6250 -2.6201 -2.5637 -2.5602 -2.4837 -2.4803 -2.4578 -2.4560 -2.3637 -2.3547 -2.2347 -2.2318 -1.9211 -1.9164 -1.8290 -1.8249 -1.5929 -1.5832 -1.4008 -1.3988 -1.0836 -1.0419 -1.0099 -0.9820 -0.7968 -0.7924 -0.5529 -0.5384 -0.4728 -0.4465 -0.1484 -0.1232 -0.0493 -0.0084 -0.0010 0.0142 0.0707 0.0813 0.2931 0.3074 2.6854 2.6895 2.7620 2.7644 3.2169 3.2194 3.3193 3.3246 3.4565 3.4615 3.5963 3.5986 4.7692 4.7727 4.8048 4.8091 k = 0.0000 0.2500 0.3612 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0172 -16.0171 -15.9575 -15.9573 -15.6406 -15.6405 -15.5954 -15.5948 -12.8750 -12.8746 -12.7717 -12.7715 -12.7458 -12.7457 -12.5948 -12.5947 -3.1233 -3.1206 -3.0392 -3.0371 -2.7833 -2.7782 -2.7674 -2.7635 -2.6256 -2.6208 -2.5630 -2.5594 -2.4835 -2.4804 -2.4539 -2.4528 -2.3654 -2.3563 -2.2333 -2.2300 -1.9194 -1.9151 -1.8262 -1.8225 -1.5789 -1.5692 -1.3978 -1.3960 -1.0780 -1.0365 -1.0154 -0.9860 -0.7923 -0.7893 -0.5579 -0.5424 -0.4731 -0.4497 -0.1486 -0.1230 -0.0553 -0.0195 -0.0019 0.0116 0.0680 0.0768 0.2908 0.3051 2.6812 2.6854 2.7615 2.7639 3.2197 3.2224 3.3191 3.3247 3.4586 3.4632 3.6007 3.6026 4.7664 4.7694 4.8008 4.8042 k = 0.0000 0.2657 0.3612 ( 8617 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -16.0174 -16.0173 -15.9570 -15.9567 -15.6407 -15.6406 -15.5953 -15.5948 -12.8767 -12.8763 -12.7695 -12.7694 -12.7472 -12.7470 -12.5945 -12.5944 -3.1295 -3.1269 -3.0411 -3.0390 -2.7828 -2.7784 -2.7669 -2.7628 -2.6261 -2.6213 -2.5622 -2.5586 -2.4836 -2.4810 -2.4501 -2.4496 -2.3667 -2.3577 -2.2329 -2.2294 -1.9169 -1.9130 -1.8234 -1.8201 -1.5647 -1.5550 -1.3954 -1.3937 -1.0725 -1.0356 -1.0182 -0.9913 -0.7889 -0.7867 -0.5623 -0.5458 -0.4715 -0.4507 -0.1489 -0.1226 -0.0640 -0.0310 -0.0013 0.0066 0.0664 0.0772 0.2876 0.3018 2.6770 2.6813 2.7611 2.7635 3.2224 3.2254 3.3188 3.3246 3.4612 3.4654 3.6048 3.6063 4.7634 4.7659 4.7970 4.7997 k = 0.0000 0.2813 0.3612 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0176 -16.0175 -15.9564 -15.9562 -15.6408 -15.6407 -15.5952 -15.5947 -12.8785 -12.8781 -12.7673 -12.7671 -12.7485 -12.7483 -12.5943 -12.5942 -3.1353 -3.1327 -3.0427 -3.0408 -2.7824 -2.7787 -2.7664 -2.7623 -2.6264 -2.6216 -2.5615 -2.5578 -2.4840 -2.4819 -2.4465 -2.4463 -2.3678 -2.3587 -2.2335 -2.2298 -1.9139 -1.9104 -1.8206 -1.8177 -1.5504 -1.5409 -1.3938 -1.3920 -1.0674 -1.0423 -1.0151 -0.9973 -0.7871 -0.7844 -0.5659 -0.5486 -0.4684 -0.4496 -0.1493 -0.1221 -0.0738 -0.0418 -0.0010 -0.0004 0.0658 0.0820 0.2836 0.2978 2.6729 2.6773 2.7609 2.7633 3.2250 3.2282 3.3183 3.3243 3.4643 3.4681 3.6086 3.6097 4.7601 4.7623 4.7938 4.7958 k = 0.0000 0.2969 0.3612 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -16.0178 -16.0178 -15.9559 -15.9556 -15.6410 -15.6408 -15.5951 -15.5946 -12.8803 -12.8799 -12.7650 -12.7648 -12.7497 -12.7496 -12.5942 -12.5941 -3.1406 -3.1381 -3.0441 -3.0422 -2.7822 -2.7792 -2.7661 -2.7620 -2.6265 -2.6217 -2.5608 -2.5569 -2.4846 -2.4830 -2.4435 -2.4427 -2.3685 -2.3594 -2.2350 -2.2311 -1.9105 -1.9074 -1.8179 -1.8152 -1.5363 -1.5270 -1.3928 -1.3905 -1.0633 -1.0528 -1.0120 -1.0018 -0.7864 -0.7826 -0.5687 -0.5505 -0.4637 -0.4465 -0.1498 -0.1217 -0.0837 -0.0517 -0.0087 -0.0018 0.0675 0.0890 0.2788 0.2929 2.6690 2.6734 2.7610 2.7632 3.2274 3.2309 3.3177 3.3238 3.4680 3.4712 3.6121 3.6128 4.7565 4.7585 4.7912 4.7928 k = 0.0000 0.3125 0.3612 ( 8611 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0181 -16.0181 -15.9553 -15.9551 -15.6411 -15.6409 -15.5950 -15.5946 -12.8821 -12.8817 -12.7626 -12.7623 -12.7509 -12.7507 -12.5941 -12.5940 -3.1454 -3.1429 -3.0451 -3.0434 -2.7823 -2.7798 -2.7659 -2.7618 -2.6264 -2.6215 -2.5602 -2.5562 -2.4853 -2.4844 -2.4407 -2.4393 -2.3690 -2.3599 -2.2372 -2.2332 -1.9071 -1.9043 -1.8152 -1.8127 -1.5227 -1.5139 -1.3922 -1.3892 -1.0658 -1.0598 -1.0161 -0.9993 -0.7863 -0.7815 -0.5706 -0.5518 -0.4575 -0.4414 -0.1503 -0.1214 -0.0929 -0.0605 -0.0173 -0.0038 0.0716 0.0970 0.2732 0.2872 2.6653 2.6697 2.7612 2.7634 3.2297 3.2334 3.3170 3.3232 3.4722 3.4749 3.6151 3.6156 4.7526 4.7545 4.7893 4.7908 k = 0.0000 0.3125 0.3612 ( 8611 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0181 -16.0181 -15.9553 -15.9551 -15.6411 -15.6409 -15.5950 -15.5946 -12.8821 -12.8817 -12.7626 -12.7623 -12.7509 -12.7507 -12.5941 -12.5940 -3.1454 -3.1429 -3.0451 -3.0434 -2.7823 -2.7798 -2.7659 -2.7618 -2.6264 -2.6215 -2.5602 -2.5562 -2.4853 -2.4844 -2.4407 -2.4393 -2.3690 -2.3599 -2.2372 -2.2332 -1.9071 -1.9043 -1.8152 -1.8127 -1.5227 -1.5139 -1.3922 -1.3892 -1.0658 -1.0598 -1.0161 -0.9993 -0.7863 -0.7815 -0.5706 -0.5518 -0.4575 -0.4414 -0.1503 -0.1214 -0.0929 -0.0605 -0.0173 -0.0038 0.0716 0.0970 0.2732 0.2872 2.6653 2.6697 2.7612 2.7634 3.2297 3.2334 3.3170 3.3232 3.4722 3.4749 3.6151 3.6156 4.7526 4.7545 4.7893 4.7908 k = 0.0000 0.3207 0.3486 ( 8611 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4502 -42.4502 -42.4502 -42.4502 -16.0178 -16.0178 -15.9555 -15.9553 -15.6409 -15.6408 -15.5952 -15.5948 -12.8770 -12.8766 -12.7682 -12.7679 -12.7509 -12.7508 -12.5940 -12.5939 -3.1464 -3.1441 -3.0500 -3.0484 -2.7820 -2.7795 -2.7678 -2.7637 -2.6250 -2.6206 -2.5537 -2.5499 -2.4876 -2.4870 -2.4426 -2.4411 -2.3645 -2.3564 -2.2362 -2.2325 -1.9009 -1.8983 -1.8085 -1.8063 -1.5159 -1.5079 -1.4019 -1.3989 -1.0654 -1.0542 -1.0183 -0.9958 -0.7854 -0.7806 -0.5649 -0.5457 -0.4581 -0.4427 -0.1570 -0.1302 -0.1021 -0.0690 -0.0281 -0.0129 0.0819 0.1063 0.2678 0.2817 2.6676 2.6717 2.7596 2.7617 3.2326 3.2366 3.3131 3.3195 3.4671 3.4697 3.6106 3.6110 4.7566 4.7585 4.7894 4.7909 k = 0.0000 0.3288 0.3359 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0175 -16.0175 -15.9557 -15.9555 -15.6408 -15.6406 -15.5954 -15.5950 -12.8718 -12.8715 -12.7738 -12.7735 -12.7509 -12.7508 -12.5939 -12.5938 -3.1474 -3.1452 -3.0545 -3.0530 -2.7818 -2.7792 -2.7696 -2.7655 -2.6238 -2.6199 -2.5475 -2.5439 -2.4898 -2.4894 -2.4443 -2.4426 -2.3601 -2.3530 -2.2354 -2.2320 -1.8951 -1.8927 -1.8025 -1.8006 -1.5099 -1.5026 -1.4105 -1.4076 -1.0652 -1.0499 -1.0199 -0.9935 -0.7843 -0.7795 -0.5592 -0.5400 -0.4576 -0.4432 -0.1637 -0.1408 -0.1081 -0.0764 -0.0384 -0.0221 0.0924 0.1154 0.2620 0.2757 2.6697 2.6735 2.7581 2.7600 3.2355 3.2398 3.3093 3.3159 3.4626 3.4650 3.6066 3.6069 4.7604 4.7622 4.7894 4.7910 k = 0.0000 0.3369 0.3232 ( 8615 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0173 -16.0173 -15.9558 -15.9556 -15.6406 -15.6405 -15.5955 -15.5951 -12.8667 -12.8664 -12.7794 -12.7791 -12.7509 -12.7508 -12.5938 -12.5937 -3.1481 -3.1462 -3.0586 -3.0572 -2.7815 -2.7788 -2.7712 -2.7671 -2.6228 -2.6195 -2.5416 -2.5384 -2.4917 -2.4914 -2.4457 -2.4439 -2.3559 -2.3498 -2.2349 -2.2317 -1.8899 -1.8877 -1.7973 -1.7957 -1.5045 -1.4980 -1.4180 -1.4152 -1.0649 -1.0474 -1.0202 -0.9925 -0.7828 -0.7782 -0.5536 -0.5352 -0.4561 -0.4431 -0.1706 -0.1524 -0.1114 -0.0822 -0.0483 -0.0312 0.1027 0.1242 0.2560 0.2694 2.6717 2.6750 2.7568 2.7586 3.2384 3.2429 3.3057 3.3122 3.4588 3.4609 3.6030 3.6033 4.7639 4.7657 4.7894 4.7909 k = 0.0000 0.3450 0.3105 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5523 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0171 -16.0171 -15.9559 -15.9558 -15.6405 -15.6404 -15.5956 -15.5953 -12.8616 -12.8613 -12.7849 -12.7845 -12.7509 -12.7508 -12.5937 -12.5937 -3.1488 -3.1472 -3.0620 -3.0609 -2.7813 -2.7784 -2.7728 -2.7687 -2.6220 -2.6193 -2.5363 -2.5335 -2.4934 -2.4930 -2.4470 -2.4452 -2.3520 -2.3469 -2.2345 -2.2317 -1.8853 -1.8834 -1.7928 -1.7915 -1.4998 -1.4943 -1.4243 -1.4216 -1.0643 -1.0467 -1.0192 -0.9926 -0.7811 -0.7769 -0.5483 -0.5314 -0.4538 -0.4424 -0.1775 -0.1640 -0.1124 -0.0861 -0.0576 -0.0401 0.1128 0.1324 0.2500 0.2629 2.6734 2.6763 2.7557 2.7573 3.2413 3.2457 3.3025 3.3087 3.4555 3.4574 3.6000 3.6002 4.7672 4.7688 4.7892 4.7907 k = 0.0000 0.3532 0.2979 ( 8615 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0170 -16.0169 -15.9560 -15.9559 -15.6404 -15.6403 -15.5957 -15.5954 -12.8568 -12.8565 -12.7900 -12.7897 -12.7508 -12.7508 -12.5937 -12.5936 -3.1493 -3.1480 -3.0649 -3.0640 -2.7810 -2.7780 -2.7741 -2.7702 -2.6214 -2.6192 -2.5316 -2.5294 -2.4948 -2.4943 -2.4480 -2.4464 -2.3485 -2.3444 -2.2342 -2.2318 -1.8814 -1.8797 -1.7892 -1.7881 -1.4960 -1.4914 -1.4294 -1.4270 -1.0634 -1.0476 -1.0171 -0.9937 -0.7793 -0.7756 -0.5434 -0.5288 -0.4510 -0.4414 -0.1843 -0.1747 -0.1117 -0.0879 -0.0664 -0.0487 0.1224 0.1397 0.2444 0.2563 2.6749 2.6773 2.7548 2.7562 3.2441 3.2482 3.2996 3.3054 3.4529 3.4544 3.5975 3.5977 4.7701 4.7716 4.7890 4.7904 k = 0.0000 0.3613 0.2852 ( 8623 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0169 -16.0168 -15.9561 -15.9560 -15.6403 -15.6402 -15.5958 -15.5956 -12.8524 -12.8521 -12.7947 -12.7944 -12.7508 -12.7508 -12.5936 -12.5936 -3.1497 -3.1486 -3.0672 -3.0664 -2.7806 -2.7776 -2.7752 -2.7716 -2.6209 -2.6193 -2.5278 -2.5261 -2.4958 -2.4953 -2.4488 -2.4474 -2.3455 -2.3425 -2.2339 -2.2321 -1.8782 -1.8769 -1.7863 -1.7855 -1.4928 -1.4893 -1.4331 -1.4312 -1.0621 -1.0494 -1.0143 -0.9957 -0.7775 -0.7745 -0.5390 -0.5274 -0.4478 -0.4405 -0.1902 -0.1839 -0.1096 -0.0878 -0.0747 -0.0569 0.1312 0.1456 0.2397 0.2499 2.6761 2.6780 2.7542 2.7553 3.2466 3.2502 3.2974 3.3023 3.4508 3.4520 3.5955 3.5957 4.7726 4.7739 4.7887 4.7900 k = 0.0000 0.3694 0.2725 ( 8621 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -16.0168 -16.0167 -15.9561 -15.9560 -15.6402 -15.6402 -15.5958 -15.5957 -12.8486 -12.8484 -12.7985 -12.7983 -12.7508 -12.7508 -12.5936 -12.5936 -3.1499 -3.1492 -3.0688 -3.0683 -2.7801 -2.7775 -2.7758 -2.7728 -2.6205 -2.6194 -2.5248 -2.5237 -2.4965 -2.4961 -2.4493 -2.4483 -2.3431 -2.3411 -2.2337 -2.2325 -1.8758 -1.8749 -1.7843 -1.7837 -1.4905 -1.4881 -1.4356 -1.4342 -1.0605 -1.0516 -1.0111 -0.9982 -0.7759 -0.7738 -0.5352 -0.5271 -0.4448 -0.4398 -0.1949 -0.1911 -0.1062 -0.0862 -0.0822 -0.0644 0.1391 0.1495 0.2364 0.2441 2.6771 2.6784 2.7538 2.7546 3.2489 3.2516 3.2960 3.2996 3.4495 3.4503 3.5941 3.5942 4.7746 4.7757 4.7885 4.7894 k = 0.0000 0.3775 0.2598 ( 8621 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0167 -16.0167 -15.9561 -15.9561 -15.6402 -15.6402 -15.5958 -15.5957 -12.8460 -12.8459 -12.8011 -12.8010 -12.7508 -12.7507 -12.5936 -12.5936 -3.1499 -3.1496 -3.0697 -3.0695 -2.7795 -2.7781 -2.7755 -2.7738 -2.6201 -2.6196 -2.5229 -2.5224 -2.4969 -2.4966 -2.4496 -2.4490 -2.3414 -2.3405 -2.2334 -2.2328 -1.8742 -1.8738 -1.7830 -1.7827 -1.4888 -1.4876 -1.4369 -1.4362 -1.0586 -1.0540 -1.0078 -1.0012 -0.7747 -0.7736 -0.5320 -0.5279 -0.4423 -0.4398 -0.1977 -0.1959 -0.1017 -0.0899 -0.0820 -0.0713 0.1453 0.1509 0.2351 0.2393 2.6779 2.6785 2.7537 2.7541 3.2507 3.2521 3.2956 3.2975 3.4488 3.4492 3.5933 3.5934 4.7761 4.7767 4.7884 4.7889 k = 0.0000 0.3856 0.2472 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0167 -16.0167 -15.9561 -15.9561 -15.6402 -15.6402 -15.5958 -15.5958 -12.8450 -12.8450 -12.8020 -12.8020 -12.7508 -12.7508 -12.5936 -12.5936 -3.1498 -3.1498 -3.0700 -3.0700 -2.7788 -2.7788 -2.7748 -2.7748 -2.6198 -2.6198 -2.5221 -2.5221 -2.4969 -2.4969 -2.4495 -2.4495 -2.3406 -2.3406 -2.2332 -2.2332 -1.8735 -1.8735 -1.7824 -1.7824 -1.4879 -1.4879 -1.4371 -1.4371 -1.0564 -1.0564 -1.0044 -1.0044 -0.7739 -0.7739 -0.5295 -0.5295 -0.4406 -0.4406 -0.1981 -0.1981 -0.0962 -0.0962 -0.0772 -0.0772 0.1494 0.1494 0.2361 0.2361 2.6783 2.6783 2.7538 2.7538 3.2518 3.2518 3.2961 3.2961 3.4486 3.4486 3.5930 3.5930 4.7768 4.7768 4.7885 4.7885 k = 0.0000 0.3856 0.2472 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0167 -16.0167 -15.9561 -15.9561 -15.6402 -15.6402 -15.5958 -15.5958 -12.8450 -12.8450 -12.8020 -12.8020 -12.7508 -12.7508 -12.5936 -12.5936 -3.1498 -3.1498 -3.0700 -3.0700 -2.7788 -2.7788 -2.7748 -2.7748 -2.6198 -2.6198 -2.5221 -2.5221 -2.4969 -2.4969 -2.4495 -2.4495 -2.3406 -2.3406 -2.2332 -2.2332 -1.8735 -1.8735 -1.7824 -1.7824 -1.4879 -1.4879 -1.4371 -1.4371 -1.0564 -1.0564 -1.0044 -1.0044 -0.7739 -0.7739 -0.5295 -0.5295 -0.4406 -0.4406 -0.1981 -0.1981 -0.0962 -0.0962 -0.0772 -0.0772 0.1494 0.1494 0.2361 0.2361 2.6783 2.6783 2.7538 2.7538 3.2518 3.2518 3.2961 3.2961 3.4486 3.4486 3.5930 3.5930 4.7768 4.7768 4.7885 4.7885 k = 0.0156 0.3856 0.2472 ( 8632 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9559 -15.9559 -15.6403 -15.6403 -15.5959 -15.5959 -12.8450 -12.8450 -12.8019 -12.8019 -12.7508 -12.7508 -12.5937 -12.5937 -3.1499 -3.1498 -3.0701 -3.0700 -2.7811 -2.7800 -2.7771 -2.7755 -2.6201 -2.6199 -2.5224 -2.5221 -2.4974 -2.4970 -2.4503 -2.4498 -2.3405 -2.3404 -2.2332 -2.2329 -1.8743 -1.8743 -1.7833 -1.7829 -1.4882 -1.4875 -1.4371 -1.4367 -1.0559 -1.0553 -1.0039 -1.0030 -0.7722 -0.7721 -0.5297 -0.5296 -0.4399 -0.4393 -0.1986 -0.1979 -0.0960 -0.0959 -0.0770 -0.0765 0.1501 0.1502 0.2361 0.2364 2.6781 2.6787 2.7535 2.7539 3.2514 3.2515 3.2958 3.2960 3.4487 3.4492 3.5927 3.5930 4.7765 4.7766 4.7882 4.7882 k = 0.0312 0.3856 0.2472 ( 8632 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0160 -16.0159 -15.9555 -15.9555 -15.6406 -15.6405 -15.5962 -15.5962 -12.8449 -12.8449 -12.8016 -12.8016 -12.7509 -12.7509 -12.5941 -12.5940 -3.1499 -3.1499 -3.0704 -3.0703 -2.7865 -2.7851 -2.7818 -2.7794 -2.6206 -2.6204 -2.5230 -2.5223 -2.4986 -2.4977 -2.4522 -2.4512 -2.3401 -2.3399 -2.2331 -2.2324 -1.8765 -1.8765 -1.7855 -1.7846 -1.4885 -1.4871 -1.4368 -1.4360 -1.0541 -1.0526 -1.0014 -0.9994 -0.7671 -0.7670 -0.5302 -0.5299 -0.4372 -0.4359 -0.1995 -0.1980 -0.0955 -0.0954 -0.0758 -0.0746 0.1521 0.1523 0.2362 0.2369 2.6779 2.6791 2.7532 2.7540 3.2504 3.2505 3.2953 3.2956 3.4494 3.4503 3.5920 3.5925 4.7757 4.7759 4.7874 4.7874 k = 0.0469 0.3856 0.2472 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0151 -16.0150 -15.9548 -15.9547 -15.6411 -15.6410 -15.5968 -15.5967 -12.8446 -12.8446 -12.8011 -12.8011 -12.7512 -12.7511 -12.5947 -12.5946 -3.1499 -3.1499 -3.0708 -3.0708 -2.7949 -2.7937 -2.7889 -2.7863 -2.6216 -2.6213 -2.5238 -2.5228 -2.5007 -2.4992 -2.4551 -2.4535 -2.3394 -2.3391 -2.2328 -2.2317 -1.8802 -1.8801 -1.7888 -1.7875 -1.4889 -1.4868 -1.4362 -1.4350 -1.0514 -1.0488 -0.9964 -0.9931 -0.7589 -0.7588 -0.5308 -0.5304 -0.4325 -0.4306 -0.2007 -0.1986 -0.0954 -0.0948 -0.0731 -0.0711 0.1554 0.1558 0.2366 0.2376 2.6779 2.6796 2.7528 2.7540 3.2488 3.2489 3.2944 3.2949 3.4507 3.4520 3.5909 3.5917 4.7744 4.7748 4.7860 4.7860 k = 0.0625 0.3856 0.2472 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5857 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0139 -16.0138 -15.9538 -15.9537 -15.6417 -15.6416 -15.5975 -15.5974 -12.8443 -12.8443 -12.8003 -12.8003 -12.7515 -12.7514 -12.5955 -12.5954 -3.1500 -3.1500 -3.0715 -3.0714 -2.8062 -2.8055 -2.7985 -2.7960 -2.6231 -2.6227 -2.5248 -2.5234 -2.5037 -2.5017 -2.4587 -2.4565 -2.3385 -2.3381 -2.2323 -2.2310 -1.8850 -1.8849 -1.7933 -1.7915 -1.4892 -1.4865 -1.4354 -1.4338 -1.0483 -1.0444 -0.9884 -0.9837 -0.7478 -0.7478 -0.5318 -0.5312 -0.4259 -0.4234 -0.2020 -0.1994 -0.0959 -0.0947 -0.0685 -0.0657 0.1599 0.1605 0.2372 0.2386 2.6780 2.6803 2.7524 2.7539 3.2466 3.2467 3.2933 3.2940 3.4524 3.4542 3.5895 3.5905 4.7727 4.7732 4.7842 4.7842 k = 0.0781 0.3856 0.2472 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5857 -42.5857 -42.4502 -42.4502 -42.4502 -42.4502 -16.0123 -16.0122 -15.9525 -15.9524 -15.6425 -15.6424 -15.5984 -15.5983 -12.8439 -12.8439 -12.7994 -12.7993 -12.7518 -12.7518 -12.5965 -12.5965 -3.1502 -3.1501 -3.0724 -3.0723 -2.8200 -2.8198 -2.8106 -2.8084 -2.6253 -2.6249 -2.5259 -2.5242 -2.5079 -2.5054 -2.4627 -2.4600 -2.3374 -2.3370 -2.2318 -2.2302 -1.8909 -1.8906 -1.7987 -1.7965 -1.4896 -1.4862 -1.4344 -1.4325 -1.0450 -1.0399 -0.9771 -0.9711 -0.7343 -0.7343 -0.5330 -0.5322 -0.4175 -0.4143 -0.2035 -0.2004 -0.0970 -0.0951 -0.0620 -0.0584 0.1656 0.1663 0.2381 0.2398 2.6782 2.6810 2.7518 2.7538 3.2439 3.2440 3.2919 3.2926 3.4547 3.4569 3.5877 3.5890 4.7705 4.7711 4.7818 4.7818 k = 0.0938 0.3856 0.2472 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -16.0104 -16.0102 -15.9509 -15.9508 -15.6436 -15.6434 -15.5996 -15.5994 -12.8434 -12.8434 -12.7982 -12.7982 -12.7523 -12.7522 -12.5978 -12.5978 -3.1504 -3.1503 -3.0735 -3.0734 -2.8365 -2.8362 -2.8249 -2.8230 -2.6283 -2.6279 -2.5271 -2.5251 -2.5134 -2.5106 -2.4668 -2.4637 -2.3362 -2.3357 -2.2314 -2.2296 -1.8975 -1.8970 -1.8049 -1.8022 -1.4901 -1.4862 -1.4334 -1.4312 -1.0415 -1.0353 -0.9626 -0.9554 -0.7188 -0.7188 -0.5344 -0.5334 -0.4076 -0.4037 -0.2050 -0.2015 -0.0985 -0.0959 -0.0536 -0.0496 0.1722 0.1732 0.2391 0.2413 2.6784 2.6818 2.7512 2.7536 3.2408 3.2408 3.2901 3.2910 3.4573 3.4599 3.5856 3.5872 4.7679 4.7686 4.7789 4.7789 k = 0.1094 0.3856 0.2472 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0082 -16.0079 -15.9491 -15.9490 -15.6447 -15.6445 -15.6009 -15.6007 -12.8428 -12.8427 -12.7969 -12.7969 -12.7528 -12.7527 -12.5993 -12.5993 -3.1507 -3.1505 -3.0747 -3.0746 -2.8551 -2.8543 -2.8411 -2.8396 -2.6321 -2.6316 -2.5284 -2.5261 -2.5204 -2.5172 -2.4707 -2.4672 -2.3349 -2.3343 -2.2310 -2.2290 -1.9047 -1.9040 -1.8117 -1.8085 -1.4907 -1.4863 -1.4325 -1.4299 -1.0378 -1.0306 -0.9452 -0.9371 -0.7018 -0.7016 -0.5361 -0.5349 -0.3962 -0.3916 -0.2065 -0.2028 -0.0999 -0.0967 -0.0437 -0.0393 0.1796 0.1809 0.2403 0.2429 2.6788 2.6828 2.7505 2.7533 3.2372 3.2373 3.2880 3.2890 3.4602 3.4633 3.5833 3.5850 4.7649 4.7657 4.7756 4.7756 k = 0.1250 0.3856 0.2472 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -16.0056 -16.0054 -15.9470 -15.9469 -15.6460 -15.6458 -15.6024 -15.6022 -12.8421 -12.8421 -12.7954 -12.7954 -12.7533 -12.7532 -12.6011 -12.6010 -3.1511 -3.1509 -3.0762 -3.0761 -2.8753 -2.8742 -2.8590 -2.8578 -2.6367 -2.6363 -2.5307 -2.5300 -2.5259 -2.5245 -2.4741 -2.4706 -2.3336 -2.3328 -2.2309 -2.2288 -1.9123 -1.9111 -1.8190 -1.8153 -1.4914 -1.4866 -1.4316 -1.4288 -1.0335 -1.0254 -0.9255 -0.9166 -0.6835 -0.6831 -0.5378 -0.5364 -0.3838 -0.3783 -0.2080 -0.2041 -0.1013 -0.0973 -0.0324 -0.0279 0.1876 0.1893 0.2417 0.2449 2.6793 2.6838 2.7498 2.7530 3.2333 3.2335 3.2856 3.2867 3.4634 3.4668 3.5806 3.5826 4.7615 4.7624 4.7719 4.7719 k = 0.1406 0.3856 0.2472 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -16.0027 -16.0025 -15.9448 -15.9446 -15.6475 -15.6473 -15.6041 -15.6038 -12.8413 -12.8413 -12.7938 -12.7937 -12.7539 -12.7538 -12.6030 -12.6030 -3.1516 -3.1513 -3.0778 -3.0777 -2.8969 -2.8955 -2.8782 -2.8774 -2.6422 -2.6417 -2.5396 -2.5380 -2.5282 -2.5270 -2.4772 -2.4738 -2.3322 -2.3314 -2.2311 -2.2288 -1.9200 -1.9184 -1.8265 -1.8223 -1.4923 -1.4871 -1.4310 -1.4279 -1.0285 -1.0197 -0.9040 -0.8944 -0.6645 -0.6637 -0.5394 -0.5379 -0.3705 -0.3643 -0.2094 -0.2055 -0.1021 -0.0974 -0.0199 -0.0153 0.1962 0.1983 0.2432 0.2471 2.6800 2.6849 2.7489 2.7525 3.2292 3.2294 3.2829 3.2841 3.4667 3.4704 3.5778 3.5800 4.7578 4.7587 4.7678 4.7679 k = 0.1562 0.3856 0.2472 ( 8602 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -15.9996 -15.9993 -15.9423 -15.9421 -15.6491 -15.6488 -15.6060 -15.6057 -12.8404 -12.8404 -12.7920 -12.7920 -12.7544 -12.7543 -12.6052 -12.6051 -3.1523 -3.1520 -3.0798 -3.0797 -2.9194 -2.9178 -2.8985 -2.8980 -2.6483 -2.6478 -2.5508 -2.5489 -2.5295 -2.5277 -2.4801 -2.4768 -2.3309 -2.3300 -2.2315 -2.2292 -1.9276 -1.9256 -1.8342 -1.8295 -1.4933 -1.4878 -1.4305 -1.4273 -1.0228 -1.0134 -0.8812 -0.8711 -0.6453 -0.6438 -0.5406 -0.5392 -0.3568 -0.3497 -0.2109 -0.2069 -0.1023 -0.0967 -0.0065 -0.0019 0.2050 0.2077 0.2449 0.2496 2.6807 2.6861 2.7481 2.7520 3.2249 3.2252 3.2798 3.2812 3.4701 3.4742 3.5747 3.5772 4.7538 4.7547 4.7634 4.7635 k = 0.1719 0.3856 0.2472 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -15.9962 -15.9958 -15.9396 -15.9395 -15.6508 -15.6505 -15.6081 -15.6078 -12.8395 -12.8394 -12.7902 -12.7902 -12.7549 -12.7548 -12.6076 -12.6075 -3.1533 -3.1529 -3.0820 -3.0819 -2.9425 -2.9409 -2.9195 -2.9193 -2.6552 -2.6546 -2.5631 -2.5613 -2.5303 -2.5282 -2.4827 -2.4796 -2.3297 -2.3287 -2.2324 -2.2299 -1.9350 -1.9325 -1.8420 -1.8368 -1.4943 -1.4886 -1.4303 -1.4269 -1.0164 -1.0063 -0.8579 -0.8472 -0.6263 -0.6237 -0.5411 -0.5400 -0.3431 -0.3351 -0.2124 -0.2083 -0.1015 -0.0949 0.0077 0.0122 0.2139 0.2175 0.2468 0.2525 2.6816 2.6875 2.7471 2.7515 3.2206 3.2209 3.2765 3.2779 3.4735 3.4779 3.5715 3.5742 4.7495 4.7505 4.7588 4.7588 k = 0.1875 0.3856 0.2472 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -15.9925 -15.9921 -15.9368 -15.9367 -15.6526 -15.6523 -15.6104 -15.6100 -12.8384 -12.8384 -12.7884 -12.7883 -12.7553 -12.7552 -12.6102 -12.6101 -3.1547 -3.1541 -3.0846 -3.0846 -2.9658 -2.9642 -2.9409 -2.9407 -2.6626 -2.6620 -2.5761 -2.5745 -2.5309 -2.5287 -2.4853 -2.4823 -2.3285 -2.3274 -2.2336 -2.2311 -1.9421 -1.9391 -1.8497 -1.8440 -1.4954 -1.4896 -1.4303 -1.4269 -1.0092 -0.9985 -0.8343 -0.8233 -0.6083 -0.6040 -0.5400 -0.5399 -0.3297 -0.3209 -0.2139 -0.2098 -0.0995 -0.0919 0.0226 0.0269 0.2227 0.2274 0.2489 0.2559 2.6825 2.6889 2.7461 2.7509 3.2161 3.2166 3.2728 3.2743 3.4768 3.4816 3.5682 3.5712 4.7450 4.7460 4.7539 4.7539 k = 0.2031 0.3856 0.2472 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -15.9886 -15.9882 -15.9339 -15.9337 -15.6545 -15.6542 -15.6128 -15.6124 -12.8373 -12.8373 -12.7866 -12.7866 -12.7555 -12.7554 -12.6129 -12.6129 -3.1565 -3.1558 -3.0879 -3.0877 -2.9890 -2.9874 -2.9624 -2.9620 -2.6705 -2.6698 -2.5897 -2.5884 -2.5313 -2.5290 -2.4877 -2.4850 -2.3274 -2.3263 -2.2353 -2.2327 -1.9488 -1.9453 -1.8573 -1.8511 -1.4965 -1.4906 -1.4307 -1.4271 -1.0012 -0.9901 -0.8112 -0.7998 -0.5926 -0.5856 -0.5379 -0.5361 -0.3171 -0.3076 -0.2154 -0.2113 -0.0958 -0.0873 0.0379 0.0419 0.2309 0.2372 0.2513 0.2601 2.6836 2.6904 2.7450 2.7502 3.2117 3.2123 3.2688 3.2704 3.4801 3.4851 3.5647 3.5680 4.7403 4.7413 4.7488 4.7488 k = 0.2188 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -15.9844 -15.9840 -15.9309 -15.9307 -15.6565 -15.6562 -15.6154 -15.6150 -12.8361 -12.8361 -12.7850 -12.7849 -12.7555 -12.7553 -12.6159 -12.6158 -3.1589 -3.1580 -3.0922 -3.0918 -3.0112 -3.0099 -2.9835 -2.9827 -2.6787 -2.6779 -2.6038 -2.6026 -2.5316 -2.5293 -2.4902 -2.4876 -2.3264 -2.3252 -2.2374 -2.2348 -1.9550 -1.9509 -1.8647 -1.8580 -1.4976 -1.4917 -1.4313 -1.4277 -0.9925 -0.9811 -0.7892 -0.7775 -0.5804 -0.5699 -0.5324 -0.5281 -0.3057 -0.2956 -0.2170 -0.2129 -0.0903 -0.0809 0.0535 0.0572 0.2383 0.2460 0.2548 0.2653 2.6848 2.6919 2.7439 2.7494 3.2074 3.2081 3.2646 3.2662 3.4833 3.4886 3.5613 3.5648 4.7355 4.7364 4.7436 4.7436 k = 0.2344 0.3856 0.2472 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9801 -15.9797 -15.9279 -15.9277 -15.6585 -15.6582 -15.6181 -15.6177 -12.8348 -12.8348 -12.7837 -12.7836 -12.7551 -12.7549 -12.6191 -12.6190 -3.1622 -3.1611 -3.0982 -3.0974 -3.0315 -3.0307 -3.0038 -3.0026 -2.6872 -2.6864 -2.6180 -2.6171 -2.5319 -2.5295 -2.4926 -2.4902 -2.3255 -2.3242 -2.2399 -2.2372 -1.9606 -1.9560 -1.8720 -1.8648 -1.4985 -1.4927 -1.4323 -1.4287 -0.9833 -0.9714 -0.7688 -0.7571 -0.5716 -0.5585 -0.5217 -0.5156 -0.2956 -0.2852 -0.2186 -0.2145 -0.0828 -0.0727 0.0692 0.0725 0.2446 0.2519 0.2613 0.2717 2.6860 2.6936 2.7427 2.7486 3.2032 3.2040 3.2600 3.2617 3.4863 3.4918 3.5578 3.5616 4.7306 4.7315 4.7383 4.7383 k = 0.2500 0.3856 0.2472 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9756 -15.9752 -15.9248 -15.9246 -15.6605 -15.6602 -15.6209 -15.6205 -12.8335 -12.8334 -12.7827 -12.7826 -12.7542 -12.7540 -12.6224 -12.6223 -3.1666 -3.1652 -3.1072 -3.1058 -3.0486 -3.0484 -3.0227 -3.0212 -2.6958 -2.6949 -2.6323 -2.6315 -2.5320 -2.5297 -2.4951 -2.4928 -2.3246 -2.3233 -2.2427 -2.2400 -1.9656 -1.9604 -1.8790 -1.8714 -1.4994 -1.4937 -1.4335 -1.4299 -0.9734 -0.9613 -0.7507 -0.7392 -0.5643 -0.5502 -0.5066 -0.5004 -0.2871 -0.2766 -0.2202 -0.2161 -0.0732 -0.0626 0.0847 0.0876 0.2499 0.2554 0.2701 0.2790 2.6874 2.6953 2.7414 2.7477 3.1991 3.2001 3.2553 3.2570 3.4892 3.4949 3.5544 3.5584 4.7256 4.7265 4.7329 4.7329 k = 0.2656 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9710 -15.9706 -15.9217 -15.9216 -15.6625 -15.6622 -15.6239 -15.6235 -12.8320 -12.8320 -12.7821 -12.7820 -12.7528 -12.7526 -12.6260 -12.6259 -3.1723 -3.1707 -3.1200 -3.1180 -3.0617 -3.0612 -3.0398 -3.0379 -2.7044 -2.7036 -2.6464 -2.6458 -2.5321 -2.5298 -2.4975 -2.4953 -2.3238 -2.3224 -2.2459 -2.2432 -1.9700 -1.9643 -1.8858 -1.8778 -1.5001 -1.4946 -1.4351 -1.4315 -0.9631 -0.9507 -0.7355 -0.7247 -0.5564 -0.5423 -0.4897 -0.4839 -0.2801 -0.2699 -0.2219 -0.2178 -0.0617 -0.0508 0.0999 0.1023 0.2546 0.2583 0.2794 0.2869 2.6888 2.6970 2.7401 2.7468 3.1953 3.1963 3.2503 3.2521 3.4919 3.4978 3.5511 3.5553 4.7207 4.7216 4.7276 4.7276 k = 0.2812 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9663 -15.9658 -15.9188 -15.9186 -15.6644 -15.6641 -15.6270 -15.6266 -12.8305 -12.8305 -12.7820 -12.7820 -12.7508 -12.7507 -12.6297 -12.6296 -3.1797 -3.1778 -3.1363 -3.1339 -3.0706 -3.0696 -3.0545 -3.0523 -2.7130 -2.7121 -2.6604 -2.6599 -2.5321 -2.5298 -2.4999 -2.4978 -2.3230 -2.3216 -2.2493 -2.2466 -1.9737 -1.9674 -1.8923 -1.8840 -1.5006 -1.4953 -1.4369 -1.4334 -0.9523 -0.9398 -0.7237 -0.7141 -0.5467 -0.5332 -0.4725 -0.4672 -0.2745 -0.2648 -0.2237 -0.2195 -0.0485 -0.0376 0.1145 0.1163 0.2590 0.2612 0.2886 0.2950 2.6903 2.6988 2.7387 2.7457 3.1917 3.1928 3.2452 3.2470 3.4944 3.5005 3.5478 3.5523 4.7158 4.7167 4.7223 4.7223 k = 0.2969 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9615 -15.9610 -15.9159 -15.9157 -15.6663 -15.6660 -15.6302 -15.6298 -12.8290 -12.8289 -12.7823 -12.7823 -12.7483 -12.7482 -12.6335 -12.6334 -3.1888 -3.1867 -3.1544 -3.1518 -3.0766 -3.0752 -3.0666 -3.0642 -2.7214 -2.7205 -2.6739 -2.6736 -2.5321 -2.5298 -2.5022 -2.5002 -2.3223 -2.3209 -2.2530 -2.2503 -1.9767 -1.9700 -1.8987 -1.8899 -1.5009 -1.4958 -1.4390 -1.4356 -0.9412 -0.9286 -0.7153 -0.7074 -0.5349 -0.5222 -0.4558 -0.4510 -0.2702 -0.2612 -0.2256 -0.2212 -0.0340 -0.0233 0.1282 0.1293 0.2634 0.2643 0.2973 0.3030 2.6918 2.7006 2.7372 2.7446 3.1883 3.1896 3.2399 3.2418 3.4968 3.5030 3.5446 3.5493 4.7110 4.7119 4.7171 4.7171 k = 0.3125 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9566 -15.9561 -15.9132 -15.9130 -15.6680 -15.6678 -15.6335 -15.6330 -12.8273 -12.8273 -12.7831 -12.7830 -12.7454 -12.7453 -12.6375 -12.6374 -3.1994 -3.1972 -3.1730 -3.1704 -3.0809 -3.0792 -3.0760 -3.0736 -2.7296 -2.7287 -2.6870 -2.6867 -2.5320 -2.5297 -2.5045 -2.5026 -2.3216 -2.3201 -2.2569 -2.2543 -1.9791 -1.9719 -1.9048 -1.8958 -1.5009 -1.4962 -1.4413 -1.4381 -0.9298 -0.9171 -0.7104 -0.7043 -0.5212 -0.5095 -0.4398 -0.4356 -0.2668 -0.2587 -0.2276 -0.2229 -0.0186 -0.0081 0.1407 0.1410 0.2679 0.2680 0.3056 0.3108 2.6934 2.7025 2.7357 2.7434 3.1853 3.1867 3.2346 3.2365 3.4989 3.5053 3.5416 3.5465 4.7064 4.7072 4.7121 4.7121 k = 0.3281 0.3856 0.2472 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9517 -15.9512 -15.9106 -15.9105 -15.6696 -15.6694 -15.6368 -15.6363 -12.8256 -12.8256 -12.7841 -12.7841 -12.7421 -12.7419 -12.6416 -12.6415 -3.2112 -3.2090 -3.1913 -3.1887 -3.0850 -3.0823 -3.0823 -3.0806 -2.7374 -2.7365 -2.6995 -2.6993 -2.5318 -2.5296 -2.5068 -2.5049 -2.3208 -2.3192 -2.2610 -2.2583 -1.9808 -1.9731 -1.9108 -1.9014 -1.5006 -1.4963 -1.4439 -1.4408 -0.9182 -0.9055 -0.7083 -0.7042 -0.5062 -0.4954 -0.4248 -0.4214 -0.2642 -0.2572 -0.2296 -0.2246 -0.0026 0.0075 0.1512 0.1517 0.2721 0.2732 0.3132 0.3181 2.6950 2.7043 2.7341 2.7421 3.1827 3.1841 3.2292 3.2312 3.5009 3.5074 3.5387 3.5438 4.7019 4.7027 4.7072 4.7073 k = 0.3438 0.3856 0.2472 ( 8604 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9469 -15.9464 -15.9084 -15.9083 -15.6710 -15.6708 -15.6401 -15.6397 -12.8239 -12.8238 -12.7853 -12.7853 -12.7384 -12.7383 -12.6459 -12.6458 -3.2236 -3.2214 -3.2088 -3.2062 -3.0894 -3.0862 -3.0856 -3.0844 -2.7448 -2.7439 -2.7112 -2.7112 -2.5316 -2.5294 -2.5089 -2.5072 -2.3199 -2.3184 -2.2651 -2.2625 -1.9819 -1.9738 -1.9166 -1.9069 -1.5001 -1.4961 -1.4467 -1.4438 -0.9063 -0.8937 -0.7088 -0.7065 -0.4905 -0.4805 -0.4111 -0.4084 -0.2622 -0.2563 -0.2316 -0.2262 0.0136 0.0233 0.1595 0.1609 0.2769 0.2789 0.3202 0.3248 2.6967 2.7062 2.7324 2.7408 3.1804 3.1819 3.2239 3.2259 3.5027 3.5094 3.5359 3.5412 4.6978 4.6985 4.7026 4.7027 k = 0.3594 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9421 -15.9416 -15.9064 -15.9064 -15.6722 -15.6720 -15.6435 -15.6431 -12.8221 -12.8220 -12.7868 -12.7868 -12.7345 -12.7343 -12.6502 -12.6501 -3.2361 -3.2340 -3.2252 -3.2226 -3.0930 -3.0899 -3.0879 -3.0865 -2.7517 -2.7508 -2.7223 -2.7223 -2.5313 -2.5291 -2.5110 -2.5093 -2.3190 -2.3174 -2.2693 -2.2667 -1.9823 -1.9739 -1.9222 -1.9122 -1.4992 -1.4956 -1.4497 -1.4469 -0.8944 -0.8818 -0.7112 -0.7106 -0.4747 -0.4653 -0.3988 -0.3970 -0.2604 -0.2558 -0.2336 -0.2277 0.0297 0.0390 0.1660 0.1681 0.2824 0.2852 0.3263 0.3307 2.6983 2.7081 2.7307 2.7394 3.1784 3.1801 3.2186 3.2206 3.5044 3.5111 3.5333 3.5388 4.6939 4.6946 4.6983 4.6984 k = 0.3750 0.3856 0.2472 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4502 -15.9374 -15.9369 -15.9048 -15.9048 -15.6731 -15.6730 -15.6468 -15.6464 -12.8202 -12.8202 -12.7884 -12.7884 -12.7303 -12.7302 -12.6547 -12.6546 -3.2482 -3.2462 -3.2402 -3.2377 -3.0955 -3.0925 -3.0897 -3.0882 -2.7579 -2.7571 -2.7325 -2.7325 -2.5309 -2.5288 -2.5130 -2.5113 -2.3180 -2.3163 -2.2735 -2.2709 -1.9822 -1.9734 -1.9276 -1.9175 -1.4981 -1.4949 -1.4528 -1.4503 -0.8823 -0.8699 -0.7162 -0.7152 -0.4593 -0.4503 -0.3879 -0.3872 -0.2588 -0.2555 -0.2356 -0.2293 0.0455 0.0544 0.1704 0.1733 0.2887 0.2921 0.3316 0.3359 2.7000 2.7099 2.7290 2.7379 3.1770 3.1786 3.2134 3.2155 3.5060 3.5127 3.5309 3.5366 4.6903 4.6910 4.6942 4.6944 k = 0.3906 0.3856 0.2472 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9328 -15.9323 -15.9036 -15.9036 -15.6738 -15.6737 -15.6501 -15.6497 -12.8183 -12.8183 -12.7902 -12.7902 -12.7260 -12.7259 -12.6593 -12.6592 -3.2596 -3.2577 -3.2537 -3.2512 -3.0972 -3.0943 -3.0913 -3.0897 -2.7635 -2.7627 -2.7418 -2.7417 -2.5305 -2.5284 -2.5149 -2.5132 -2.3168 -2.3150 -2.2776 -2.2751 -1.9816 -1.9724 -1.9328 -1.9225 -1.4966 -1.4938 -1.4560 -1.4537 -0.8703 -0.8581 -0.7229 -0.7205 -0.4445 -0.4358 -0.3792 -0.3787 -0.2571 -0.2554 -0.2375 -0.2307 0.0609 0.0694 0.1728 0.1764 0.2955 0.2993 0.3360 0.3402 2.7018 2.7118 2.7272 2.7363 3.1759 3.1777 3.2084 3.2105 3.5074 3.5142 3.5286 3.5345 4.6871 4.6878 4.6906 4.6908 k = 0.4062 0.3856 0.2472 ( 8604 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9284 -15.9279 -15.9028 -15.9027 -15.6741 -15.6740 -15.6533 -15.6529 -12.8163 -12.8163 -12.7920 -12.7920 -12.7215 -12.7214 -12.6640 -12.6638 -3.2699 -3.2681 -3.2656 -3.2632 -3.0983 -3.0955 -3.0927 -3.0910 -2.7683 -2.7676 -2.7502 -2.7501 -2.5299 -2.5279 -2.5167 -2.5150 -2.3154 -2.3136 -2.2817 -2.2792 -1.9804 -1.9709 -1.9379 -1.9275 -1.4949 -1.4924 -1.4593 -1.4573 -0.8582 -0.8463 -0.7305 -0.7268 -0.4307 -0.4222 -0.3730 -0.3713 -0.2553 -0.2552 -0.2394 -0.2322 0.0756 0.0837 0.1734 0.1775 0.3026 0.3067 0.3394 0.3436 2.7035 2.7136 2.7254 2.7347 3.1753 3.1772 3.2036 3.2057 3.5088 3.5156 3.5265 3.5325 4.6843 4.6849 4.6873 4.6875 k = 0.4219 0.3856 0.2472 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4502 -15.9242 -15.9238 -15.9025 -15.9024 -15.6741 -15.6741 -15.6564 -15.6560 -12.8144 -12.8143 -12.7939 -12.7939 -12.7170 -12.7169 -12.6687 -12.6686 -3.2790 -3.2772 -3.2758 -3.2735 -3.0990 -3.0963 -3.0940 -3.0921 -2.7724 -2.7716 -2.7576 -2.7574 -2.5294 -2.5273 -2.5184 -2.5167 -2.3138 -2.3120 -2.2856 -2.2832 -1.9787 -1.9690 -1.9429 -1.9323 -1.4928 -1.4908 -1.4626 -1.4609 -0.8462 -0.8346 -0.7389 -0.7340 -0.4180 -0.4096 -0.3687 -0.3658 -0.2549 -0.2534 -0.2413 -0.2337 0.0896 0.0973 0.1723 0.1768 0.3097 0.3140 0.3418 0.3460 2.7053 2.7155 2.7236 2.7331 3.1752 3.1771 3.1991 3.2012 3.5101 3.5170 3.5245 3.5307 4.6819 4.6825 4.6844 4.6847 k = 0.4375 0.3856 0.2472 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9203 -15.9199 -15.9026 -15.9025 -15.6738 -15.6737 -15.6593 -15.6590 -12.8123 -12.8123 -12.7959 -12.7959 -12.7123 -12.7122 -12.6735 -12.6734 -3.2866 -3.2848 -3.2843 -3.2820 -3.0992 -3.0966 -3.0951 -3.0931 -2.7755 -2.7748 -2.7639 -2.7636 -2.5287 -2.5267 -2.5199 -2.5183 -2.3121 -2.3102 -2.2894 -2.2871 -1.9766 -1.9667 -1.9476 -1.9370 -1.4905 -1.4889 -1.4660 -1.4646 -0.8344 -0.8231 -0.7479 -0.7420 -0.4066 -0.3981 -0.3664 -0.3621 -0.2544 -0.2513 -0.2431 -0.2352 0.1027 0.1101 0.1696 0.1745 0.3165 0.3210 0.3431 0.3473 2.7070 2.7173 2.7217 2.7314 3.1755 3.1775 3.1949 3.1970 3.5114 3.5182 3.5227 3.5290 4.6800 4.6805 4.6820 4.6823 k = 0.4531 0.3856 0.2472 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9167 -15.9163 -15.9032 -15.9031 -15.6731 -15.6730 -15.6621 -15.6618 -12.8103 -12.8103 -12.7979 -12.7979 -12.7075 -12.7074 -12.6783 -12.6782 -3.2926 -3.2910 -3.2908 -3.2888 -3.0993 -3.0967 -3.0960 -3.0940 -2.7777 -2.7771 -2.7691 -2.7688 -2.5279 -2.5260 -2.5214 -2.5197 -2.3101 -2.3081 -2.2930 -2.2907 -1.9741 -1.9639 -1.9521 -1.9415 -1.4879 -1.4867 -1.4693 -1.4682 -0.8226 -0.8118 -0.7574 -0.7506 -0.3964 -0.3880 -0.3658 -0.3604 -0.2536 -0.2491 -0.2448 -0.2369 0.1149 0.1219 0.1655 0.1707 0.3229 0.3274 0.3433 0.3476 2.7088 2.7191 2.7198 2.7297 3.1764 3.1784 3.1910 3.1931 3.5126 3.5195 3.5210 3.5274 4.6785 4.6790 4.6800 4.6803 k = 0.4688 0.3856 0.2472 ( 8586 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9134 -15.9130 -15.9044 -15.9041 -15.6720 -15.6719 -15.6646 -15.6644 -12.8082 -12.8082 -12.7999 -12.7999 -12.7027 -12.7026 -12.6832 -12.6831 -3.2968 -3.2958 -3.2950 -3.2937 -3.0991 -3.0969 -3.0966 -3.0948 -2.7789 -2.7783 -2.7732 -2.7729 -2.5271 -2.5252 -2.5228 -2.5210 -2.3078 -2.3058 -2.2964 -2.2942 -1.9712 -1.9609 -1.9565 -1.9458 -1.4850 -1.4842 -1.4726 -1.4718 -0.8110 -0.8007 -0.7674 -0.7597 -0.3876 -0.3793 -0.3670 -0.3606 -0.2525 -0.2468 -0.2466 -0.2386 0.1261 0.1328 0.1600 0.1655 0.3287 0.3332 0.3425 0.3468 2.7106 2.7180 2.7209 2.7280 3.1777 3.1797 3.1875 3.1896 3.5139 3.5194 3.5207 3.5259 4.6775 4.6780 4.6785 4.6789 k = 0.4844 0.3856 0.2472 ( 8584 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9105 -15.9102 -15.9059 -15.9057 -15.6707 -15.6705 -15.6669 -15.6667 -12.8062 -12.8061 -12.8020 -12.8020 -12.6978 -12.6977 -12.6881 -12.6880 -3.2993 -3.2988 -3.2974 -3.2968 -3.0987 -3.0976 -3.0964 -3.0954 -2.7791 -2.7786 -2.7763 -2.7758 -2.5262 -2.5243 -2.5240 -2.5222 -2.3053 -2.3033 -2.2996 -2.2975 -1.9680 -1.9606 -1.9575 -1.9499 -1.4820 -1.4816 -1.4757 -1.4753 -0.7997 -0.7899 -0.7779 -0.7694 -0.3802 -0.3722 -0.3699 -0.3627 -0.2512 -0.2482 -0.2446 -0.2405 0.1363 0.1427 0.1533 0.1591 0.3336 0.3380 0.3406 0.3449 2.7124 2.7161 2.7227 2.7262 3.1795 3.1815 3.1844 3.1865 3.5152 3.5179 3.5220 3.5245 4.6770 4.6775 4.6775 4.6779 k = 0.5000 0.3856 0.2472 ( 8584 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9080 -15.9080 -15.9077 -15.9077 -15.6690 -15.6690 -15.6688 -15.6688 -12.8041 -12.8041 -12.8041 -12.8041 -12.6930 -12.6930 -12.6928 -12.6928 -3.3000 -3.3000 -3.2980 -3.2980 -3.0982 -3.0982 -3.0959 -3.0959 -2.7782 -2.7782 -2.7777 -2.7777 -2.5251 -2.5251 -2.5233 -2.5233 -2.3026 -2.3026 -2.3005 -2.3005 -1.9644 -1.9644 -1.9538 -1.9538 -1.4787 -1.4787 -1.4787 -1.4787 -0.7886 -0.7886 -0.7794 -0.7794 -0.3743 -0.3743 -0.3666 -0.3666 -0.2498 -0.2498 -0.2425 -0.2425 0.1454 0.1454 0.1515 0.1515 0.3376 0.3376 0.3420 0.3420 2.7143 2.7143 2.7245 2.7245 3.1817 3.1817 3.1838 3.1838 3.5165 3.5165 3.5232 3.5232 4.6770 4.6770 4.6775 4.6775 k = 0.5000 0.3856 0.2472 ( 8584 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9080 -15.9080 -15.9077 -15.9077 -15.6690 -15.6690 -15.6688 -15.6688 -12.8041 -12.8041 -12.8041 -12.8041 -12.6930 -12.6930 -12.6928 -12.6928 -3.3000 -3.3000 -3.2980 -3.2980 -3.0982 -3.0982 -3.0959 -3.0959 -2.7782 -2.7782 -2.7777 -2.7777 -2.5251 -2.5251 -2.5233 -2.5233 -2.3026 -2.3026 -2.3005 -2.3005 -1.9644 -1.9644 -1.9538 -1.9538 -1.4787 -1.4787 -1.4787 -1.4787 -0.7886 -0.7886 -0.7794 -0.7794 -0.3743 -0.3743 -0.3666 -0.3666 -0.2498 -0.2498 -0.2425 -0.2425 0.1454 0.1454 0.1515 0.1515 0.3376 0.3376 0.3420 0.3420 2.7143 2.7143 2.7245 2.7245 3.1817 3.1817 3.1838 3.1838 3.5165 3.5165 3.5232 3.5232 4.6770 4.6770 4.6775 4.6775 k = 0.5000 0.3938 0.2345 ( 8590 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9080 -15.9080 -15.9077 -15.9077 -15.6690 -15.6690 -15.6688 -15.6688 -12.8043 -12.8043 -12.8042 -12.8042 -12.6928 -12.6928 -12.6927 -12.6927 -3.3001 -3.3001 -3.2981 -3.2981 -3.0984 -3.0984 -3.0961 -3.0961 -2.7781 -2.7781 -2.7770 -2.7770 -2.5250 -2.5250 -2.5231 -2.5231 -2.3027 -2.3027 -2.3006 -2.3006 -1.9647 -1.9647 -1.9541 -1.9541 -1.4792 -1.4792 -1.4784 -1.4784 -0.7893 -0.7893 -0.7800 -0.7800 -0.3753 -0.3753 -0.3672 -0.3672 -0.2489 -0.2489 -0.2408 -0.2408 0.1453 0.1453 0.1519 0.1519 0.3375 0.3375 0.3420 0.3420 2.7141 2.7141 2.7243 2.7243 3.1816 3.1816 3.1837 3.1837 3.5169 3.5169 3.5236 3.5236 4.6771 4.6771 4.6776 4.6776 k = 0.5000 0.4019 0.2218 ( 8592 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9080 -15.9080 -15.9077 -15.9077 -15.6690 -15.6690 -15.6688 -15.6688 -12.8048 -12.8048 -12.8047 -12.8047 -12.6923 -12.6923 -12.6921 -12.6921 -3.3003 -3.3003 -3.2983 -3.2983 -3.0990 -3.0990 -3.0966 -3.0966 -2.7774 -2.7774 -2.7754 -2.7754 -2.5246 -2.5246 -2.5224 -2.5224 -2.3031 -2.3031 -2.3008 -2.3008 -1.9655 -1.9655 -1.9550 -1.9550 -1.4797 -1.4797 -1.4780 -1.4780 -0.7912 -0.7912 -0.7815 -0.7815 -0.3779 -0.3779 -0.3690 -0.3690 -0.2462 -0.2462 -0.2362 -0.2362 0.1453 0.1453 0.1529 0.1529 0.3373 0.3373 0.3422 0.3422 2.7137 2.7137 2.7239 2.7239 3.1813 3.1813 3.1835 3.1835 3.5182 3.5182 3.5248 3.5248 4.6774 4.6774 4.6779 4.6779 k = 0.5000 0.4100 0.2092 ( 8594 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9080 -15.9080 -15.9077 -15.9077 -15.6690 -15.6690 -15.6688 -15.6688 -12.8056 -12.8056 -12.8055 -12.8055 -12.6914 -12.6914 -12.6913 -12.6913 -3.3006 -3.3006 -3.2985 -3.2985 -3.1000 -3.1000 -3.0974 -3.0974 -2.7759 -2.7759 -2.7731 -2.7731 -2.5238 -2.5238 -2.5212 -2.5212 -2.3038 -2.3038 -2.3012 -2.3012 -1.9669 -1.9669 -1.9564 -1.9564 -1.4802 -1.4802 -1.4777 -1.4777 -0.7944 -0.7944 -0.7841 -0.7841 -0.3818 -0.3818 -0.3719 -0.3719 -0.2416 -0.2416 -0.2294 -0.2294 0.1454 0.1454 0.1546 0.1546 0.3371 0.3371 0.3424 0.3424 2.7130 2.7130 2.7231 2.7231 3.1809 3.1809 3.1833 3.1833 3.5202 3.5202 3.5268 3.5268 4.6779 4.6779 4.6784 4.6784 k = 0.5000 0.4181 0.1965 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9081 -15.9081 -15.9078 -15.9078 -15.6689 -15.6689 -15.6687 -15.6687 -12.8066 -12.8066 -12.8065 -12.8065 -12.6903 -12.6903 -12.6901 -12.6901 -3.3010 -3.3010 -3.2989 -3.2989 -3.1013 -3.1013 -3.0984 -3.0984 -2.7738 -2.7738 -2.7701 -2.7701 -2.5226 -2.5226 -2.5196 -2.5196 -2.3047 -2.3047 -2.3019 -2.3019 -1.9689 -1.9689 -1.9584 -1.9584 -1.4808 -1.4808 -1.4775 -1.4775 -0.7988 -0.7988 -0.7876 -0.7876 -0.3863 -0.3863 -0.3756 -0.3756 -0.2353 -0.2353 -0.2212 -0.2212 0.1459 0.1459 0.1567 0.1567 0.3367 0.3367 0.3427 0.3427 2.7120 2.7120 2.7220 2.7220 3.1803 3.1803 3.1829 3.1829 3.5229 3.5229 3.5295 3.5295 4.6786 4.6786 4.6792 4.6792 k = 0.5000 0.4263 0.1838 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9081 -15.9081 -15.9078 -15.9078 -15.6689 -15.6689 -15.6687 -15.6687 -12.8080 -12.8080 -12.8078 -12.8078 -12.6888 -12.6888 -12.6887 -12.6887 -3.3015 -3.3015 -3.2994 -3.2994 -3.1028 -3.1028 -3.0997 -3.0997 -2.7711 -2.7711 -2.7666 -2.7666 -2.5210 -2.5210 -2.5175 -2.5175 -2.3058 -2.3058 -2.3027 -2.3027 -1.9714 -1.9714 -1.9611 -1.9611 -1.4813 -1.4813 -1.4772 -1.4772 -0.8042 -0.8042 -0.7921 -0.7921 -0.3911 -0.3911 -0.3799 -0.3799 -0.2276 -0.2276 -0.2119 -0.2119 0.1467 0.1467 0.1592 0.1592 0.3363 0.3363 0.3430 0.3430 2.7107 2.7107 2.7208 2.7208 3.1797 3.1797 3.1824 3.1824 3.5265 3.5265 3.5330 3.5330 4.6795 4.6795 4.6801 4.6801 k = 0.5000 0.4344 0.1711 ( 8594 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9082 -15.9082 -15.9078 -15.9078 -15.6689 -15.6689 -15.6687 -15.6687 -12.8096 -12.8096 -12.8094 -12.8094 -12.6871 -12.6871 -12.6869 -12.6869 -3.3020 -3.3020 -3.2999 -3.2999 -3.1045 -3.1045 -3.1012 -3.1012 -2.7680 -2.7680 -2.7627 -2.7627 -2.5189 -2.5189 -2.5148 -2.5148 -2.3072 -2.3072 -2.3038 -2.3038 -1.9746 -1.9746 -1.9644 -1.9644 -1.4818 -1.4818 -1.4768 -1.4768 -0.8105 -0.8105 -0.7975 -0.7975 -0.3959 -0.3959 -0.3843 -0.3843 -0.2190 -0.2190 -0.2020 -0.2020 0.1479 0.1479 0.1621 0.1621 0.3358 0.3358 0.3432 0.3432 2.7093 2.7093 2.7192 2.7192 3.1789 3.1789 3.1819 3.1819 3.5307 3.5307 3.5372 3.5372 4.6805 4.6805 4.6812 4.6812 k = 0.5000 0.4425 0.1585 ( 8586 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9082 -15.9082 -15.9079 -15.9079 -15.6689 -15.6689 -15.6687 -15.6687 -12.8113 -12.8113 -12.8111 -12.8111 -12.6852 -12.6852 -12.6850 -12.6850 -3.3026 -3.3026 -3.3004 -3.3004 -3.1063 -3.1063 -3.1028 -3.1028 -2.7646 -2.7646 -2.7587 -2.7587 -2.5161 -2.5161 -2.5116 -2.5116 -2.3088 -2.3088 -2.3052 -2.3052 -1.9784 -1.9784 -1.9683 -1.9683 -1.4822 -1.4822 -1.4763 -1.4763 -0.8176 -0.8176 -0.8036 -0.8036 -0.4006 -0.4006 -0.3888 -0.3888 -0.2099 -0.2099 -0.1918 -0.1918 0.1497 0.1497 0.1654 0.1654 0.3352 0.3352 0.3432 0.3432 2.7077 2.7077 2.7176 2.7176 3.1781 3.1781 3.1813 3.1813 3.5355 3.5355 3.5420 3.5420 4.6817 4.6817 4.6825 4.6825 k = 0.5000 0.4506 0.1458 ( 8582 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9083 -15.9083 -15.9080 -15.9080 -15.6689 -15.6689 -15.6686 -15.6686 -12.8132 -12.8132 -12.8130 -12.8130 -12.6831 -12.6831 -12.6829 -12.6829 -3.3032 -3.3032 -3.3010 -3.3010 -3.1081 -3.1081 -3.1045 -3.1045 -2.7612 -2.7612 -2.7546 -2.7546 -2.5128 -2.5128 -2.5078 -2.5078 -2.3106 -2.3106 -2.3068 -2.3068 -1.9828 -1.9828 -1.9730 -1.9730 -1.4825 -1.4825 -1.4757 -1.4757 -0.8254 -0.8254 -0.8104 -0.8104 -0.4050 -0.4050 -0.3931 -0.3931 -0.2003 -0.2003 -0.1815 -0.1815 0.1519 0.1519 0.1691 0.1691 0.3346 0.3346 0.3432 0.3432 2.7060 2.7060 2.7157 2.7157 3.1773 3.1773 3.1807 3.1807 3.5410 3.5410 3.5474 3.5474 4.6831 4.6831 4.6839 4.6839 k = 0.5000 0.4588 0.1331 ( 8580 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9084 -15.9084 -15.9080 -15.9080 -15.6688 -15.6688 -15.6686 -15.6686 -12.8153 -12.8153 -12.8151 -12.8151 -12.6808 -12.6808 -12.6806 -12.6806 -3.3038 -3.3038 -3.3016 -3.3016 -3.1100 -3.1100 -3.1062 -3.1062 -2.7577 -2.7577 -2.7506 -2.7506 -2.5088 -2.5088 -2.5033 -2.5033 -2.3127 -2.3127 -2.3086 -2.3086 -1.9879 -1.9879 -1.9784 -1.9784 -1.4826 -1.4826 -1.4749 -1.4749 -0.8337 -0.8337 -0.8177 -0.8177 -0.4091 -0.4091 -0.3972 -0.3972 -0.1906 -0.1906 -0.1713 -0.1713 0.1548 0.1548 0.1732 0.1732 0.3338 0.3338 0.3430 0.3430 2.7042 2.7042 2.7138 2.7138 3.1765 3.1765 3.1802 3.1802 3.5470 3.5470 3.5533 3.5533 4.6845 4.6845 4.6854 4.6854 k = 0.5000 0.4588 0.1331 ( 8580 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9084 -15.9084 -15.9080 -15.9080 -15.6688 -15.6688 -15.6686 -15.6686 -12.8153 -12.8153 -12.8151 -12.8151 -12.6808 -12.6808 -12.6806 -12.6806 -3.3038 -3.3038 -3.3016 -3.3016 -3.1100 -3.1100 -3.1062 -3.1062 -2.7577 -2.7577 -2.7506 -2.7506 -2.5088 -2.5088 -2.5033 -2.5033 -2.3127 -2.3127 -2.3086 -2.3086 -1.9879 -1.9879 -1.9784 -1.9784 -1.4826 -1.4826 -1.4749 -1.4749 -0.8337 -0.8337 -0.8177 -0.8177 -0.4091 -0.4091 -0.3972 -0.3972 -0.1906 -0.1906 -0.1713 -0.1713 0.1548 0.1548 0.1732 0.1732 0.3338 0.3338 0.3430 0.3430 2.7042 2.7042 2.7138 2.7138 3.1765 3.1765 3.1802 3.1802 3.5470 3.5470 3.5533 3.5533 4.6845 4.6845 4.6854 4.6854 k = 0.5000 0.4545 0.1186 ( 8574 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9084 -15.9084 -15.9081 -15.9081 -15.6687 -15.6687 -15.6685 -15.6685 -12.8187 -12.8187 -12.8185 -12.8185 -12.6773 -12.6773 -12.6771 -12.6771 -3.3038 -3.3038 -3.3016 -3.3016 -3.1126 -3.1126 -3.1086 -3.1086 -2.7569 -2.7569 -2.7493 -2.7493 -2.5046 -2.5046 -2.4987 -2.4987 -2.3156 -2.3156 -2.3112 -2.3112 -1.9962 -1.9962 -1.9868 -1.9868 -1.4760 -1.4760 -1.4672 -1.4672 -0.8379 -0.8379 -0.8211 -0.8211 -0.4100 -0.4100 -0.3981 -0.3981 -0.1861 -0.1861 -0.1670 -0.1670 0.1578 0.1578 0.1773 0.1773 0.3323 0.3323 0.3423 0.3423 2.7013 2.7013 2.7108 2.7108 3.1775 3.1775 3.1813 3.1813 3.5560 3.5560 3.5622 3.5622 4.6818 4.6818 4.6828 4.6828 k = 0.5000 0.4502 0.1040 ( 8588 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9085 -15.9085 -15.9082 -15.9082 -15.6686 -15.6686 -15.6684 -15.6684 -12.8223 -12.8223 -12.8221 -12.8221 -12.6735 -12.6735 -12.6733 -12.6733 -3.3037 -3.3037 -3.3016 -3.3016 -3.1150 -3.1150 -3.1110 -3.1110 -2.7564 -2.7564 -2.7484 -2.7484 -2.5000 -2.5000 -2.4937 -2.4937 -2.3187 -2.3187 -2.3141 -2.3141 -2.0056 -2.0056 -1.9964 -1.9964 -1.4682 -1.4682 -1.4583 -1.4583 -0.8425 -0.8425 -0.8249 -0.8249 -0.4109 -0.4109 -0.3990 -0.3990 -0.1813 -0.1813 -0.1625 -0.1625 0.1613 0.1613 0.1817 0.1817 0.3307 0.3307 0.3414 0.3414 2.6984 2.6984 2.7077 2.7077 3.1787 3.1787 3.1826 3.1826 3.5660 3.5660 3.5720 3.5720 4.6788 4.6788 4.6799 4.6799 k = 0.5000 0.4459 0.0895 ( 8580 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9086 -15.9086 -15.9083 -15.9083 -15.6685 -15.6685 -15.6682 -15.6682 -12.8260 -12.8260 -12.8257 -12.8257 -12.6697 -12.6697 -12.6695 -12.6695 -3.3036 -3.3036 -3.3015 -3.3015 -3.1172 -3.1172 -3.1131 -3.1131 -2.7563 -2.7563 -2.7481 -2.7481 -2.4949 -2.4949 -2.4882 -2.4882 -2.3220 -2.3220 -2.3170 -2.3170 -2.0161 -2.0161 -2.0071 -2.0071 -1.4594 -1.4594 -1.4485 -1.4485 -0.8473 -0.8473 -0.8290 -0.8290 -0.4118 -0.4118 -0.3999 -0.3999 -0.1762 -0.1762 -0.1580 -0.1580 0.1650 0.1650 0.1862 0.1862 0.3290 0.3290 0.3404 0.3404 2.6955 2.6955 2.7046 2.7046 3.1800 3.1800 3.1841 3.1841 3.5767 3.5767 3.5825 3.5825 4.6757 4.6757 4.6768 4.6768 k = 0.5000 0.4416 0.0749 ( 8576 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9087 -15.9087 -15.9084 -15.9084 -15.6684 -15.6684 -15.6681 -15.6681 -12.8296 -12.8296 -12.8294 -12.8294 -12.6658 -12.6658 -12.6656 -12.6656 -3.3035 -3.3035 -3.3014 -3.3014 -3.1191 -3.1191 -3.1150 -3.1150 -2.7566 -2.7566 -2.7482 -2.7482 -2.4893 -2.4893 -2.4823 -2.4823 -2.3252 -2.3252 -2.3200 -2.3200 -2.0274 -2.0274 -2.0187 -2.0187 -1.4499 -1.4499 -1.4381 -1.4381 -0.8522 -0.8522 -0.8333 -0.8333 -0.4128 -0.4128 -0.4010 -0.4010 -0.1710 -0.1710 -0.1536 -0.1536 0.1690 0.1690 0.1909 0.1909 0.3271 0.3271 0.3394 0.3394 2.6928 2.6928 2.7015 2.7015 3.1814 3.1814 3.1856 3.1856 3.5879 3.5879 3.5935 3.5935 4.6723 4.6723 4.6736 4.6736 k = 0.5000 0.4373 0.0604 ( 8586 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9088 -15.9088 -15.9085 -15.9085 -15.6682 -15.6682 -15.6680 -15.6680 -12.8332 -12.8332 -12.8330 -12.8330 -12.6620 -12.6620 -12.6618 -12.6618 -3.3033 -3.3033 -3.3013 -3.3013 -3.1208 -3.1208 -3.1167 -3.1167 -2.7574 -2.7574 -2.7489 -2.7489 -2.4833 -2.4833 -2.4760 -2.4760 -2.3283 -2.3283 -2.3230 -2.3230 -2.0394 -2.0394 -2.0310 -2.0310 -1.4400 -1.4400 -1.4274 -1.4274 -0.8571 -0.8571 -0.8376 -0.8376 -0.4139 -0.4139 -0.4022 -0.4022 -0.1657 -0.1657 -0.1492 -0.1492 0.1732 0.1732 0.1956 0.1956 0.3253 0.3253 0.3382 0.3382 2.6901 2.6901 2.6984 2.6984 3.1830 3.1830 3.1873 3.1873 3.5995 3.5995 3.6049 3.6049 4.6689 4.6689 4.6703 4.6703 k = 0.5000 0.4330 0.0459 ( 8580 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9090 -15.9090 -15.9086 -15.9086 -15.6681 -15.6681 -15.6678 -15.6678 -12.8367 -12.8367 -12.8365 -12.8365 -12.6584 -12.6584 -12.6582 -12.6582 -3.3031 -3.3031 -3.3012 -3.3012 -3.1222 -3.1222 -3.1182 -3.1182 -2.7586 -2.7586 -2.7501 -2.7501 -2.4767 -2.4767 -2.4692 -2.4692 -2.3311 -2.3311 -2.3258 -2.3258 -2.0519 -2.0519 -2.0438 -2.0438 -1.4299 -1.4299 -1.4165 -1.4165 -0.8618 -0.8618 -0.8418 -0.8418 -0.4152 -0.4152 -0.4036 -0.4036 -0.1604 -0.1604 -0.1451 -0.1451 0.1776 0.1776 0.2004 0.2004 0.3233 0.3233 0.3368 0.3368 2.6875 2.6875 2.6954 2.6954 3.1846 3.1846 3.1889 3.1889 3.6114 3.6114 3.6164 3.6164 4.6654 4.6654 4.6669 4.6669 k = 0.5000 0.4287 0.0313 ( 8588 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9091 -15.9091 -15.9087 -15.9087 -15.6680 -15.6680 -15.6677 -15.6677 -12.8400 -12.8400 -12.8398 -12.8398 -12.6548 -12.6548 -12.6547 -12.6547 -3.3030 -3.3030 -3.3012 -3.3012 -3.1233 -3.1233 -3.1193 -3.1193 -2.7602 -2.7602 -2.7518 -2.7518 -2.4699 -2.4699 -2.4623 -2.4623 -2.3336 -2.3336 -2.3283 -2.3283 -2.0647 -2.0647 -2.0569 -2.0569 -1.4199 -1.4199 -1.4057 -1.4057 -0.8661 -0.8661 -0.8458 -0.8458 -0.4165 -0.4165 -0.4051 -0.4051 -0.1553 -0.1553 -0.1411 -0.1411 0.1821 0.1821 0.2051 0.2051 0.3213 0.3213 0.3353 0.3353 2.6851 2.6851 2.6925 2.6925 3.1862 3.1862 3.1906 3.1906 3.6232 3.6232 3.6279 3.6279 4.6619 4.6619 4.6635 4.6635 k = 0.5000 0.4244 0.0168 ( 8596 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9092 -15.9092 -15.9088 -15.9088 -15.6678 -15.6678 -15.6675 -15.6675 -12.8431 -12.8431 -12.8429 -12.8429 -12.6515 -12.6515 -12.6514 -12.6514 -3.3029 -3.3029 -3.3012 -3.3012 -3.1241 -3.1241 -3.1202 -3.1202 -2.7622 -2.7622 -2.7539 -2.7539 -2.4627 -2.4627 -2.4551 -2.4551 -2.3357 -2.3357 -2.3304 -2.3304 -2.0776 -2.0776 -2.0702 -2.0702 -1.4102 -1.4102 -1.3953 -1.3953 -0.8702 -0.8702 -0.8496 -0.8496 -0.4180 -0.4180 -0.4068 -0.4068 -0.1503 -0.1503 -0.1374 -0.1374 0.1866 0.1866 0.2096 0.2096 0.3194 0.3194 0.3337 0.3337 2.6829 2.6829 2.6898 2.6898 3.1877 3.1877 3.1922 3.1922 3.6348 3.6348 3.6391 3.6391 4.6585 4.6585 4.6601 4.6601 k = 0.5000 0.4201 0.0022 ( 8592 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9093 -15.9093 -15.9089 -15.9089 -15.6677 -15.6677 -15.6674 -15.6674 -12.8459 -12.8459 -12.8457 -12.8457 -12.6485 -12.6485 -12.6483 -12.6483 -3.3027 -3.3027 -3.3012 -3.3012 -3.1247 -3.1247 -3.1209 -3.1209 -2.7644 -2.7644 -2.7563 -2.7563 -2.4555 -2.4555 -2.4480 -2.4480 -2.3372 -2.3372 -2.3320 -2.3320 -2.0904 -2.0904 -2.0833 -2.0833 -1.4009 -1.4009 -1.3854 -1.3854 -0.8738 -0.8738 -0.8530 -0.8530 -0.4195 -0.4195 -0.4087 -0.4087 -0.1455 -0.1455 -0.1339 -0.1339 0.1911 0.1911 0.2139 0.2139 0.3175 0.3175 0.3320 0.3320 2.6810 2.6810 2.6872 2.6872 3.1893 3.1893 3.1938 3.1938 3.6459 3.6459 3.6499 3.6499 4.6552 4.6552 4.6569 4.6569 k = 0.5000 0.4158-0.0123 ( 8586 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9094 -15.9094 -15.9090 -15.9090 -15.6676 -15.6676 -15.6673 -15.6673 -12.8485 -12.8485 -12.8483 -12.8483 -12.6457 -12.6457 -12.6455 -12.6455 -3.3026 -3.3026 -3.3012 -3.3012 -3.1250 -3.1250 -3.1214 -3.1214 -2.7667 -2.7667 -2.7588 -2.7588 -2.4485 -2.4485 -2.4412 -2.4412 -2.3380 -2.3380 -2.3331 -2.3331 -2.1029 -2.1029 -2.0962 -2.0962 -1.3923 -1.3923 -1.3763 -1.3763 -0.8770 -0.8770 -0.8560 -0.8560 -0.4210 -0.4210 -0.4106 -0.4106 -0.1410 -0.1410 -0.1308 -0.1308 0.1955 0.1955 0.2178 0.2178 0.3157 0.3157 0.3302 0.3302 2.6792 2.6792 2.6848 2.6848 3.1907 3.1907 3.1953 3.1953 3.6565 3.6565 3.6600 3.6600 4.6521 4.6521 4.6538 4.6538 k = 0.5000 0.4115-0.0268 ( 8584 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9095 -15.9095 -15.9091 -15.9091 -15.6675 -15.6675 -15.6671 -15.6671 -12.8507 -12.8507 -12.8506 -12.8506 -12.6432 -12.6432 -12.6431 -12.6431 -3.3025 -3.3025 -3.3013 -3.3013 -3.1251 -3.1251 -3.1217 -3.1217 -2.7691 -2.7691 -2.7614 -2.7614 -2.4418 -2.4418 -2.4348 -2.4348 -2.3382 -2.3382 -2.3335 -2.3335 -2.1148 -2.1148 -2.1086 -2.1086 -1.3846 -1.3846 -1.3680 -1.3680 -0.8797 -0.8797 -0.8586 -0.8586 -0.4225 -0.4225 -0.4125 -0.4125 -0.1370 -0.1370 -0.1281 -0.1281 0.1998 0.1998 0.2213 0.2213 0.3140 0.3140 0.3283 0.3283 2.6777 2.6777 2.6826 2.6826 3.1920 3.1920 3.1966 3.1966 3.6661 3.6661 3.6692 3.6692 4.6492 4.6492 4.6510 4.6510 k = 0.5000 0.4072-0.0414 ( 8590 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9096 -15.9096 -15.9092 -15.9092 -15.6674 -15.6674 -15.6670 -15.6670 -12.8527 -12.8527 -12.8526 -12.8526 -12.6411 -12.6411 -12.6410 -12.6410 -3.3024 -3.3024 -3.3014 -3.3014 -3.1251 -3.1251 -3.1218 -3.1218 -2.7713 -2.7713 -2.7639 -2.7639 -2.4357 -2.4357 -2.4292 -2.4292 -2.3376 -2.3376 -2.3334 -2.3334 -2.1257 -2.1257 -2.1201 -2.1201 -1.3778 -1.3778 -1.3609 -1.3609 -0.8819 -0.8819 -0.8608 -0.8608 -0.4239 -0.4239 -0.4143 -0.4143 -0.1333 -0.1333 -0.1258 -0.1258 0.2037 0.2037 0.2243 0.2243 0.3127 0.3127 0.3265 0.3265 2.6765 2.6765 2.6807 2.6807 3.1932 3.1932 3.1978 3.1978 3.6747 3.6747 3.6773 3.6773 4.6466 4.6466 4.6484 4.6484 k = 0.5000 0.4029-0.0559 ( 8582 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9097 -15.9097 -15.9093 -15.9093 -15.6673 -15.6673 -15.6670 -15.6670 -12.8543 -12.8543 -12.8542 -12.8542 -12.6393 -12.6393 -12.6392 -12.6392 -3.3023 -3.3023 -3.3015 -3.3015 -3.1250 -3.1250 -3.1219 -3.1219 -2.7733 -2.7733 -2.7661 -2.7661 -2.4304 -2.4304 -2.4245 -2.4245 -2.3365 -2.3365 -2.3328 -2.3328 -2.1355 -2.1355 -2.1305 -2.1305 -1.3721 -1.3721 -1.3548 -1.3548 -0.8837 -0.8837 -0.8625 -0.8625 -0.4252 -0.4252 -0.4159 -0.4159 -0.1301 -0.1301 -0.1239 -0.1239 0.2073 0.2073 0.2267 0.2267 0.3116 0.3116 0.3247 0.3247 2.6756 2.6756 2.6790 2.6790 3.1942 3.1942 3.1988 3.1988 3.6821 3.6821 3.6842 3.6842 4.6444 4.6444 4.6463 4.6463 k = 0.5000 0.3986-0.0705 ( 8588 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9097 -15.9097 -15.9093 -15.9093 -15.6672 -15.6672 -15.6669 -15.6669 -12.8556 -12.8556 -12.8555 -12.8555 -12.6379 -12.6379 -12.6379 -12.6379 -3.3022 -3.3022 -3.3016 -3.3016 -3.1248 -3.1248 -3.1219 -3.1219 -2.7751 -2.7751 -2.7680 -2.7680 -2.4261 -2.4261 -2.4209 -2.4209 -2.3350 -2.3350 -2.3318 -2.3318 -2.1436 -2.1436 -2.1392 -2.1392 -1.3676 -1.3676 -1.3500 -1.3500 -0.8850 -0.8850 -0.8639 -0.8639 -0.4262 -0.4262 -0.4173 -0.4173 -0.1275 -0.1275 -0.1225 -0.1225 0.2103 0.2103 0.2286 0.2286 0.3108 0.3108 0.3230 0.3230 2.6750 2.6750 2.6775 2.6775 3.1950 3.1950 3.1996 3.1996 3.6881 3.6881 3.6897 3.6897 4.6427 4.6427 4.6445 4.6445 k = 0.5000 0.3942-0.0850 ( 8586 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9098 -15.9098 -15.9094 -15.9094 -15.6672 -15.6672 -15.6668 -15.6668 -12.8565 -12.8565 -12.8564 -12.8564 -12.6369 -12.6369 -12.6369 -12.6369 -3.3022 -3.3022 -3.3017 -3.3017 -3.1247 -3.1247 -3.1219 -3.1219 -2.7763 -2.7763 -2.7694 -2.7694 -2.4230 -2.4230 -2.4184 -2.4184 -2.3336 -2.3336 -2.3307 -2.3307 -2.1497 -2.1497 -2.1460 -2.1460 -1.3643 -1.3643 -1.3466 -1.3466 -0.8859 -0.8859 -0.8649 -0.8649 -0.4269 -0.4269 -0.4184 -0.4184 -0.1255 -0.1255 -0.1216 -0.1216 0.2127 0.2127 0.2298 0.2298 0.3104 0.3104 0.3217 0.3217 2.6746 2.6746 2.6764 2.6764 3.1955 3.1955 3.2002 3.2002 3.6925 3.6925 3.6936 3.6936 4.6414 4.6414 4.6432 4.6432 k = 0.5000 0.3899-0.0995 ( 8594 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9098 -15.9098 -15.9094 -15.9094 -15.6672 -15.6672 -15.6668 -15.6668 -12.8570 -12.8570 -12.8570 -12.8570 -12.6363 -12.6363 -12.6363 -12.6363 -3.3021 -3.3021 -3.3018 -3.3018 -3.1246 -3.1246 -3.1219 -3.1219 -2.7771 -2.7771 -2.7703 -2.7703 -2.4211 -2.4211 -2.4169 -2.4169 -2.3325 -2.3325 -2.3300 -2.3300 -2.1535 -2.1535 -2.1503 -2.1503 -1.3623 -1.3623 -1.3445 -1.3445 -0.8865 -0.8865 -0.8654 -0.8654 -0.4274 -0.4274 -0.4191 -0.4191 -0.1242 -0.1242 -0.1212 -0.1212 0.2142 0.2142 0.2305 0.2305 0.3101 0.3101 0.3208 0.3208 2.6745 2.6745 2.6756 2.6756 3.1959 3.1959 3.2005 3.2005 3.6953 3.6953 3.6959 3.6959 4.6406 4.6406 4.6424 4.6424 k = 0.5000 0.3856-0.1141 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9098 -15.9098 -15.9094 -15.9094 -15.6672 -15.6672 -15.6668 -15.6668 -12.8572 -12.8572 -12.8572 -12.8572 -12.6361 -12.6361 -12.6361 -12.6361 -3.3020 -3.3020 -3.3020 -3.3020 -3.1245 -3.1245 -3.1219 -3.1219 -2.7774 -2.7774 -2.7706 -2.7706 -2.4204 -2.4204 -2.4164 -2.4164 -2.3321 -2.3321 -2.3297 -2.3297 -2.1547 -2.1547 -2.1518 -2.1518 -1.3616 -1.3616 -1.3438 -1.3438 -0.8867 -0.8867 -0.8656 -0.8656 -0.4276 -0.4276 -0.4193 -0.4193 -0.1237 -0.1237 -0.1211 -0.1211 0.2147 0.2147 0.2307 0.2307 0.3101 0.3101 0.3205 0.3205 2.6746 2.6746 2.6752 2.6752 3.1960 3.1960 3.2007 3.2007 3.6964 3.6964 3.6965 3.6965 4.6403 4.6403 4.6422 4.6422 k = 0.5000 0.3856-0.1141 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9098 -15.9098 -15.9094 -15.9094 -15.6672 -15.6672 -15.6668 -15.6668 -12.8572 -12.8572 -12.8572 -12.8572 -12.6361 -12.6361 -12.6361 -12.6361 -3.3020 -3.3020 -3.3020 -3.3020 -3.1245 -3.1245 -3.1219 -3.1219 -2.7774 -2.7774 -2.7706 -2.7706 -2.4204 -2.4204 -2.4164 -2.4164 -2.3321 -2.3321 -2.3297 -2.3297 -2.1547 -2.1547 -2.1518 -2.1518 -1.3616 -1.3616 -1.3438 -1.3438 -0.8867 -0.8867 -0.8656 -0.8656 -0.4276 -0.4276 -0.4193 -0.4193 -0.1237 -0.1237 -0.1211 -0.1211 0.2147 0.2147 0.2307 0.2307 0.3101 0.3101 0.3205 0.3205 2.6746 2.6746 2.6752 2.6752 3.1960 3.1960 3.2007 3.2007 3.6964 3.6964 3.6965 3.6965 4.6403 4.6403 4.6422 4.6422 k = 0.4844 0.3856-0.1141 ( 8602 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9130 -15.9126 -15.9070 -15.9066 -15.6692 -15.6689 -15.6648 -15.6644 -12.8621 -12.8621 -12.8523 -12.8523 -12.6364 -12.6363 -12.6359 -12.6358 -3.3033 -3.3033 -3.2987 -3.2987 -3.1287 -3.1261 -3.1197 -3.1170 -2.7774 -2.7769 -2.7706 -2.7701 -2.4236 -2.4196 -2.4176 -2.4137 -2.3360 -2.3337 -2.3281 -2.3256 -2.1574 -2.1543 -2.1511 -2.1483 -1.3651 -1.3581 -1.3482 -1.3394 -0.8938 -0.8796 -0.8718 -0.8596 -0.4330 -0.4245 -0.4240 -0.4160 -0.1257 -0.1232 -0.1215 -0.1187 0.2116 0.2161 0.2271 0.2323 0.3080 0.3121 0.3179 0.3228 2.6740 2.6746 2.6753 2.6759 3.1930 3.1976 3.1994 3.2041 3.6959 3.6961 3.6969 3.6970 4.6368 4.6387 4.6440 4.6459 k = 0.4688 0.3856-0.1141 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9166 -15.9161 -15.9047 -15.9043 -15.6710 -15.6707 -15.6621 -15.6617 -12.8670 -12.8670 -12.8475 -12.8474 -12.6366 -12.6366 -12.6356 -12.6355 -3.3028 -3.3028 -3.2936 -3.2936 -3.1323 -3.1298 -3.1144 -3.1115 -2.7769 -2.7758 -2.7700 -2.7690 -2.4273 -2.4233 -2.4153 -2.4114 -2.3398 -2.3376 -2.3240 -2.3214 -2.1590 -2.1559 -2.1465 -2.1438 -1.3687 -1.3546 -1.3527 -1.3351 -0.9010 -0.8782 -0.8726 -0.8536 -0.4403 -0.4315 -0.4223 -0.4146 -0.1274 -0.1251 -0.1190 -0.1160 0.2067 0.2158 0.2216 0.2320 0.3058 0.3139 0.3149 0.3246 2.6734 2.6741 2.6760 2.6766 3.1904 3.1951 3.2033 3.2080 3.6956 3.6958 3.6975 3.6976 4.6336 4.6355 4.6479 4.6498 k = 0.4531 0.3856-0.1141 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4502 -15.9206 -15.9201 -15.9028 -15.9025 -15.6725 -15.6722 -15.6593 -15.6588 -12.8718 -12.8718 -12.8426 -12.8426 -12.6369 -12.6368 -12.6353 -12.6353 -3.3004 -3.3004 -3.2867 -3.2867 -3.1352 -3.1329 -3.1084 -3.1055 -2.7759 -2.7742 -2.7690 -2.7675 -2.4312 -2.4273 -2.4134 -2.4095 -2.3434 -2.3413 -2.3198 -2.3173 -2.1597 -2.1564 -2.1409 -2.1382 -1.3723 -1.3572 -1.3512 -1.3308 -0.9083 -0.8847 -0.8657 -0.8477 -0.4493 -0.4404 -0.4226 -0.4152 -0.1288 -0.1268 -0.1162 -0.1132 0.2001 0.2140 0.2142 0.2300 0.3034 0.3117 0.3154 0.3261 2.6727 2.6734 2.6770 2.6776 3.1883 3.1929 3.2075 3.2122 3.6953 3.6956 3.6981 3.6982 4.6306 4.6325 4.6520 4.6539 k = 0.4375 0.3856-0.1141 ( 8588 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9248 -15.9243 -15.9013 -15.9011 -15.6736 -15.6734 -15.6562 -15.6558 -12.8766 -12.8766 -12.8378 -12.8378 -12.6371 -12.6371 -12.6351 -12.6350 -3.2963 -3.2962 -3.2779 -3.2779 -3.1375 -3.1353 -3.1019 -3.0990 -2.7744 -2.7720 -2.7675 -2.7654 -2.4354 -2.4316 -2.4119 -2.4082 -2.3467 -2.3448 -2.3157 -2.3132 -2.1594 -2.1561 -2.1343 -2.1317 -1.3760 -1.3619 -1.3476 -1.3265 -0.9158 -0.8914 -0.8589 -0.8420 -0.4600 -0.4509 -0.4248 -0.4178 -0.1300 -0.1283 -0.1132 -0.1102 0.1918 0.2050 0.2107 0.2263 0.3009 0.3082 0.3166 0.3270 2.6720 2.6727 2.6781 2.6787 3.1866 3.1912 3.2122 3.2169 3.6950 3.6954 3.6989 3.6989 4.6278 4.6297 4.6563 4.6582 k = 0.4219 0.3856-0.1141 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4502 -15.9293 -15.9288 -15.9004 -15.9002 -15.6743 -15.6742 -15.6530 -15.6526 -12.8814 -12.8814 -12.8331 -12.8330 -12.6373 -12.6373 -12.6348 -12.6348 -3.2905 -3.2904 -3.2674 -3.2674 -3.1390 -3.1370 -3.0949 -3.0919 -2.7724 -2.7693 -2.7655 -2.7628 -2.4398 -2.4361 -2.4109 -2.4073 -2.3499 -2.3482 -2.3116 -2.3091 -2.1584 -2.1549 -2.1268 -2.1243 -1.3798 -1.3666 -1.3441 -1.3223 -0.9234 -0.8984 -0.8521 -0.8364 -0.4723 -0.4631 -0.4289 -0.4222 -0.1309 -0.1295 -0.1099 -0.1071 0.1818 0.1941 0.2062 0.2213 0.2980 0.3043 0.3173 0.3274 2.6710 2.6719 2.6795 2.6801 3.1853 3.1899 3.2173 3.2220 3.6948 3.6953 3.6997 3.6997 4.6253 4.6271 4.6607 4.6626 k = 0.4062 0.3856-0.1141 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4502 -15.9341 -15.9336 -15.9000 -15.8998 -15.6747 -15.6746 -15.6497 -15.6492 -12.8861 -12.8861 -12.8284 -12.8283 -12.6375 -12.6375 -12.6346 -12.6345 -3.2831 -3.2830 -3.2553 -3.2553 -3.1398 -3.1379 -3.0873 -3.0842 -2.7700 -2.7660 -2.7631 -2.7597 -2.4443 -2.4407 -2.4102 -2.4067 -2.3527 -2.3512 -2.3076 -2.3052 -2.1566 -2.1530 -2.1184 -2.1161 -1.3836 -1.3714 -1.3405 -1.3179 -0.9313 -0.9056 -0.8455 -0.8309 -0.4861 -0.4768 -0.4349 -0.4285 -0.1316 -0.1305 -0.1065 -0.1038 0.1702 0.1817 0.2005 0.2150 0.2946 0.3000 0.3175 0.3272 2.6700 2.6708 2.6812 2.6819 3.1844 3.1890 3.2227 3.2274 3.6947 3.6952 3.7006 3.7006 4.6229 4.6248 4.6654 4.6672 k = 0.3906 0.3856-0.1141 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4502 -15.9390 -15.9385 -15.9000 -15.8998 -15.6748 -15.6747 -15.6463 -15.6458 -12.8906 -12.8906 -12.8238 -12.8238 -12.6376 -12.6376 -12.6344 -12.6343 -3.2744 -3.2741 -3.2416 -3.2416 -3.1397 -3.1379 -3.0791 -3.0760 -2.7672 -2.7623 -2.7603 -2.7561 -2.4488 -2.4454 -2.4099 -2.4066 -2.3554 -2.3541 -2.3037 -2.3014 -2.1540 -2.1504 -2.1093 -2.1070 -1.3876 -1.3763 -1.3368 -1.3136 -0.9394 -0.9131 -0.8390 -0.8256 -0.5013 -0.4919 -0.4427 -0.4366 -0.1322 -0.1313 -0.1029 -0.1004 0.1573 0.1680 0.1938 0.2077 0.2907 0.2952 0.3171 0.3264 2.6686 2.6695 2.6832 2.6839 3.1839 3.1884 3.2285 3.2331 3.6946 3.6952 3.7015 3.7016 4.6208 4.6226 4.6702 4.6720 k = 0.3750 0.3856-0.1141 ( 8602 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9441 -15.9436 -15.9004 -15.9003 -15.6745 -15.6745 -15.6428 -15.6423 -12.8951 -12.8951 -12.8194 -12.8193 -12.6378 -12.6377 -12.6341 -12.6341 -3.2645 -3.2641 -3.2266 -3.2265 -3.1385 -3.1370 -3.0703 -3.0672 -2.7641 -2.7581 -2.7572 -2.7521 -2.4532 -2.4499 -2.4099 -2.4067 -2.3577 -2.3566 -2.2999 -2.2977 -2.1508 -2.1470 -2.0995 -2.0973 -1.3916 -1.3813 -1.3330 -1.3092 -0.9477 -0.9210 -0.8327 -0.8206 -0.5177 -0.5082 -0.4523 -0.4465 -0.1325 -0.1319 -0.0991 -0.0969 0.1430 0.1531 0.1862 0.1996 0.2863 0.2900 0.3162 0.3250 2.6670 2.6680 2.6856 2.6863 3.1838 3.1883 3.2345 3.2392 3.6946 3.6952 3.7026 3.7027 4.6189 4.6207 4.6751 4.6769 k = 0.3594 0.3856-0.1141 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9493 -15.9488 -15.9013 -15.9012 -15.6739 -15.6739 -15.6393 -15.6388 -12.8995 -12.8995 -12.8150 -12.8150 -12.6378 -12.6378 -12.6339 -12.6339 -3.2537 -3.2532 -3.2103 -3.2102 -3.1361 -3.1348 -3.0608 -3.0578 -2.7606 -2.7537 -2.7534 -2.7476 -2.4574 -2.4544 -2.4101 -2.4071 -2.3598 -2.3589 -2.2962 -2.2941 -2.1470 -2.1431 -2.0891 -2.0870 -1.3957 -1.3863 -1.3291 -1.3047 -0.9564 -0.9292 -0.8268 -0.8159 -0.5353 -0.5256 -0.4635 -0.4580 -0.1328 -0.1323 -0.0953 -0.0935 0.1276 0.1372 0.1779 0.1906 0.2813 0.2843 0.3147 0.3230 2.6651 2.6661 2.6884 2.6892 3.1840 3.1884 3.2409 3.2455 3.6946 3.6953 3.7038 3.7039 4.6172 4.6189 4.6801 4.6819 k = 0.3438 0.3856-0.1141 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9546 -15.9540 -15.9025 -15.9025 -15.6731 -15.6731 -15.6358 -15.6353 -12.9038 -12.9038 -12.8108 -12.8107 -12.6379 -12.6379 -12.6338 -12.6337 -3.2425 -3.2419 -3.1930 -3.1928 -3.1320 -3.1310 -3.0507 -3.0477 -2.7569 -2.7500 -2.7482 -2.7427 -2.4615 -2.4586 -2.4106 -2.4078 -2.3616 -2.3609 -2.2927 -2.2906 -2.1427 -2.1387 -2.0782 -2.0762 -1.3998 -1.3914 -1.3250 -1.3001 -0.9654 -0.9379 -0.8212 -0.8117 -0.5538 -0.5439 -0.4762 -0.4710 -0.1330 -0.1327 -0.0915 -0.0901 0.1113 0.1205 0.1690 0.1811 0.2756 0.2781 0.3126 0.3205 2.6629 2.6639 2.6916 2.6924 3.1845 3.1889 3.2474 3.2520 3.6947 3.6954 3.7050 3.7052 4.6156 4.6173 4.6851 4.6869 k = 0.3281 0.3856-0.1141 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9599 -15.9593 -15.9041 -15.9041 -15.6721 -15.6720 -15.6323 -15.6318 -12.9079 -12.9079 -12.8068 -12.8067 -12.6379 -12.6379 -12.6336 -12.6335 -3.2315 -3.2307 -3.1750 -3.1748 -3.1260 -3.1253 -3.0398 -3.0368 -2.7529 -2.7461 -2.7427 -2.7374 -2.4652 -2.4626 -2.4113 -2.4086 -2.3631 -2.3626 -2.2893 -2.2873 -2.1378 -2.1338 -2.0669 -2.0650 -1.4041 -1.3965 -1.3209 -1.2955 -0.9748 -0.9470 -0.8163 -0.8081 -0.5730 -0.5629 -0.4904 -0.4853 -0.1331 -0.1329 -0.0877 -0.0868 0.0942 0.1031 0.1595 0.1711 0.2694 0.2714 0.3100 0.3175 2.6603 2.6614 2.6951 2.6960 3.1853 3.1896 3.2542 3.2587 3.6948 3.6956 3.7063 3.7065 4.6142 4.6159 4.6902 4.6920 k = 0.3125 0.3856-0.1141 ( 8596 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -15.9651 -15.9646 -15.9060 -15.9060 -15.6708 -15.6707 -15.6289 -15.6284 -12.9119 -12.9119 -12.8029 -12.8028 -12.6378 -12.6378 -12.6334 -12.6334 -3.2211 -3.2201 -3.1566 -3.1563 -3.1176 -3.1172 -3.0280 -3.0251 -2.7487 -2.7420 -2.7368 -2.7317 -2.4687 -2.4662 -2.4121 -2.4096 -2.3643 -2.3640 -2.2860 -2.2842 -2.1325 -2.1284 -2.0553 -2.0535 -1.4083 -1.4017 -1.3166 -1.2907 -0.9847 -0.9566 -0.8121 -0.8054 -0.5926 -0.5822 -0.5058 -0.5009 -0.1332 -0.1330 -0.0840 -0.0838 0.0766 0.0854 0.1497 0.1607 0.2625 0.2642 0.3069 0.3140 2.6573 2.6584 2.6992 2.7001 3.1864 3.1906 3.2611 3.2656 3.6949 3.6958 3.7077 3.7080 4.6129 4.6146 4.6954 4.6971 k = 0.2969 0.3856-0.1141 ( 8592 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -15.9704 -15.9699 -15.9081 -15.9081 -15.6693 -15.6692 -15.6255 -15.6250 -12.9157 -12.9157 -12.7992 -12.7991 -12.6377 -12.6377 -12.6333 -12.6333 -3.2119 -3.2107 -3.1381 -3.1378 -3.1065 -3.1063 -3.0151 -3.0124 -2.7443 -2.7378 -2.7307 -2.7258 -2.4717 -2.4696 -2.4131 -2.4107 -2.3652 -2.3651 -2.2829 -2.2811 -2.1269 -2.1227 -2.0435 -2.0418 -1.4126 -1.4068 -1.3122 -1.2859 -0.9950 -0.9667 -0.8091 -0.8040 -0.6122 -0.6013 -0.5222 -0.5175 -0.1332 -0.1332 -0.0811 -0.0807 0.0588 0.0676 0.1396 0.1501 0.2552 0.2565 0.3033 0.3100 2.6540 2.6552 2.7035 2.7045 3.1877 3.1919 3.2681 3.2725 3.6951 3.6961 3.7092 3.7095 4.6118 4.6134 4.7005 4.7022 k = 0.2812 0.3856-0.1141 ( 8588 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -15.9756 -15.9751 -15.9105 -15.9104 -15.6678 -15.6676 -15.6222 -15.6217 -12.9194 -12.9194 -12.7956 -12.7955 -12.6376 -12.6376 -12.6332 -12.6332 -3.2040 -3.2028 -3.1201 -3.1196 -3.0926 -3.0926 -3.0010 -2.9984 -2.7397 -2.7334 -2.7242 -2.7196 -2.4745 -2.4725 -2.4142 -2.4120 -2.3658 -2.3658 -2.2800 -2.2783 -2.1209 -2.1166 -2.0316 -2.0300 -1.4169 -1.4119 -1.3076 -1.2810 -1.0059 -0.9774 -0.8078 -0.8042 -0.6312 -0.6199 -0.5395 -0.5349 -0.1334 -0.1333 -0.0791 -0.0778 0.0411 0.0501 0.1294 0.1394 0.2473 0.2484 0.2994 0.3057 2.6504 2.6516 2.7083 2.7094 3.1892 3.1933 3.2752 3.2795 3.6954 3.6964 3.7108 3.7110 4.6108 4.6124 4.7056 4.7073 k = 0.2656 0.3856-0.1141 ( 8592 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -15.9807 -15.9802 -15.9130 -15.9129 -15.6661 -15.6659 -15.6190 -15.6185 -12.9229 -12.9229 -12.7923 -12.7922 -12.6374 -12.6374 -12.6331 -12.6331 -3.1976 -3.1963 -3.1030 -3.1023 -3.0762 -3.0760 -2.9854 -2.9830 -2.7350 -2.7289 -2.7176 -2.7132 -2.4768 -2.4751 -2.4154 -2.4133 -2.3661 -2.3660 -2.2772 -2.2756 -2.1146 -2.1103 -2.0197 -2.0182 -1.4212 -1.4169 -1.3030 -1.2759 -1.0173 -0.9886 -0.8087 -0.8067 -0.6491 -0.6372 -0.5574 -0.5529 -0.1335 -0.1334 -0.0782 -0.0759 0.0241 0.0334 0.1192 0.1286 0.2390 0.2399 0.2951 0.3011 2.6465 2.6477 2.7135 2.7145 3.1909 3.1948 3.2823 3.2864 3.6956 3.6967 3.7124 3.7127 4.6099 4.6114 4.7106 4.7123 k = 0.2500 0.3856-0.1141 ( 8594 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -15.9856 -15.9851 -15.9156 -15.9154 -15.6643 -15.6641 -15.6159 -15.6155 -12.9263 -12.9263 -12.7891 -12.7891 -12.6372 -12.6372 -12.6330 -12.6330 -3.1924 -3.1911 -3.0870 -3.0862 -3.0575 -3.0572 -2.9683 -2.9662 -2.7301 -2.7243 -2.7108 -2.7066 -2.4788 -2.4774 -2.4167 -2.4146 -2.3662 -2.3658 -2.2745 -2.2730 -2.1080 -2.1036 -2.0078 -2.0064 -1.4254 -1.4218 -1.2983 -1.2708 -1.0292 -1.0004 -0.8126 -0.8121 -0.6649 -0.6525 -0.5756 -0.5713 -0.1338 -0.1336 -0.0790 -0.0755 0.0086 0.0184 0.1091 0.1180 0.2302 0.2311 0.2906 0.2961 2.6423 2.6435 2.7189 2.7200 3.1927 3.1965 3.2893 3.2933 3.6959 3.6970 3.7140 3.7143 4.6092 4.6106 4.7156 4.7172 k = 0.2344 0.3856-0.1141 ( 8602 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -15.9904 -15.9900 -15.9182 -15.9181 -15.6625 -15.6623 -15.6130 -15.6125 -12.9295 -12.9295 -12.7862 -12.7861 -12.6369 -12.6369 -12.6329 -12.6329 -3.1882 -3.1870 -3.0724 -3.0715 -3.0371 -3.0367 -2.9498 -2.9480 -2.7250 -2.7195 -2.7040 -2.7000 -2.4804 -2.4794 -2.4180 -2.4160 -2.3658 -2.3654 -2.2721 -2.2707 -2.1012 -2.0968 -1.9960 -1.9947 -1.4295 -1.4266 -1.2935 -1.2657 -1.0417 -1.0127 -0.8209 -0.8202 -0.6778 -0.6652 -0.5938 -0.5897 -0.1343 -0.1338 -0.0822 -0.0776 -0.0041 0.0060 0.0992 0.1076 0.2212 0.2219 0.2859 0.2910 2.6379 2.6391 2.7246 2.7258 3.1946 3.1983 3.2962 3.3001 3.6962 3.6974 3.7157 3.7161 4.6086 4.6099 4.7205 4.7220 k = 0.2188 0.3856-0.1141 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -15.9950 -15.9946 -15.9209 -15.9207 -15.6607 -15.6605 -15.6102 -15.6098 -12.9325 -12.9325 -12.7835 -12.7834 -12.6366 -12.6366 -12.6329 -12.6328 -3.1847 -3.1835 -3.0594 -3.0583 -3.0153 -3.0149 -2.9301 -2.9286 -2.7198 -2.7146 -2.6971 -2.6934 -2.4817 -2.4810 -2.4194 -2.4175 -2.3652 -2.3646 -2.2698 -2.2684 -2.0942 -2.0899 -1.9845 -1.9832 -1.4335 -1.4313 -1.2887 -1.2605 -1.0547 -1.0256 -0.8334 -0.8318 -0.6876 -0.6751 -0.6118 -0.6079 -0.1350 -0.1342 -0.0885 -0.0833 -0.0129 -0.0029 0.0897 0.0975 0.2119 0.2126 0.2810 0.2858 2.6334 2.6345 2.7305 2.7317 3.1966 3.2001 3.3030 3.3067 3.6966 3.6977 3.7174 3.7178 4.6081 4.6094 4.7252 4.7266 k = 0.2031 0.3856-0.1141 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9994 -15.9990 -15.9235 -15.9234 -15.6589 -15.6588 -15.6075 -15.6071 -12.9353 -12.9353 -12.7810 -12.7809 -12.6363 -12.6363 -12.6328 -12.6328 -3.1818 -3.1806 -3.0478 -3.0467 -2.9927 -2.9923 -2.9096 -2.9083 -2.7143 -2.7096 -2.6903 -2.6868 -2.4827 -2.4823 -2.4208 -2.4189 -2.3642 -2.3635 -2.2677 -2.2664 -2.0870 -2.0828 -1.9732 -1.9720 -1.4374 -1.4357 -1.2840 -1.2554 -1.0682 -1.0389 -0.8492 -0.8472 -0.6945 -0.6824 -0.6291 -0.6254 -0.1361 -0.1348 -0.0979 -0.0925 -0.0175 -0.0083 0.0806 0.0879 0.2025 0.2031 0.2760 0.2805 2.6287 2.6298 2.7366 2.7377 3.1986 3.2020 3.3096 3.3131 3.6969 3.6981 3.7191 3.7195 4.6077 4.6089 4.7298 4.7311 k = 0.1875 0.3856-0.1141 ( 8596 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0036 -16.0032 -15.9261 -15.9259 -15.6572 -15.6570 -15.6050 -15.6046 -12.9379 -12.9379 -12.7786 -12.7786 -12.6359 -12.6359 -12.6328 -12.6328 -3.1792 -3.1782 -3.0376 -3.0364 -2.9696 -2.9692 -2.8887 -2.8877 -2.7087 -2.7044 -2.6836 -2.6804 -2.4835 -2.4834 -2.4222 -2.4204 -2.3629 -2.3622 -2.2658 -2.2646 -2.0798 -2.0756 -1.9622 -1.9611 -1.4410 -1.4399 -1.2793 -1.2503 -1.0821 -1.0527 -0.8676 -0.8655 -0.6995 -0.6880 -0.6452 -0.6418 -0.1380 -0.1357 -0.1096 -0.1039 -0.0188 -0.0106 0.0722 0.0790 0.1929 0.1936 0.2711 0.2753 2.6240 2.6250 2.7427 2.7439 3.2006 3.2039 3.3159 3.3192 3.6973 3.6985 3.7208 3.7212 4.6074 4.6086 4.7342 4.7355 k = 0.1719 0.3856-0.1141 ( 8596 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0075 -16.0071 -15.9286 -15.9284 -15.6555 -15.6553 -15.6027 -15.6023 -12.9403 -12.9403 -12.7765 -12.7765 -12.6356 -12.6355 -12.6328 -12.6327 -3.1770 -3.1760 -3.0287 -3.0275 -2.9464 -2.9461 -2.8679 -2.8672 -2.7027 -2.6990 -2.6771 -2.6741 -2.4842 -2.4840 -2.4236 -2.4218 -2.3614 -2.3606 -2.2640 -2.2629 -2.0726 -2.0685 -1.9516 -1.9506 -1.4445 -1.4438 -1.2748 -1.2454 -1.0962 -1.0666 -0.8878 -0.8857 -0.7040 -0.6933 -0.6592 -0.6560 -0.1414 -0.1375 -0.1218 -0.1153 -0.0181 -0.0109 0.0645 0.0708 0.1833 0.1840 0.2663 0.2701 2.6193 2.6203 2.7488 2.7499 3.2026 3.2057 3.3219 3.3250 3.6977 3.6988 3.7225 3.7229 4.6073 4.6083 4.7384 4.7396 k = 0.1562 0.3856-0.1141 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0111 -16.0108 -15.9310 -15.9308 -15.6539 -15.6538 -15.6006 -15.6002 -12.9426 -12.9425 -12.7746 -12.7745 -12.6352 -12.6352 -12.6327 -12.6327 -3.1750 -3.1742 -3.0209 -3.0197 -2.9236 -2.9233 -2.8479 -2.8475 -2.6965 -2.6933 -2.6708 -2.6681 -2.4848 -2.4843 -2.4249 -2.4233 -2.3598 -2.3589 -2.2625 -2.2614 -2.0653 -2.0614 -1.9415 -1.9406 -1.4477 -1.4474 -1.2704 -1.2407 -1.1104 -1.0807 -0.9089 -0.9069 -0.7095 -0.7000 -0.6700 -0.6667 -0.1478 -0.1431 -0.1309 -0.1241 -0.0163 -0.0099 0.0578 0.0635 0.1738 0.1745 0.2616 0.2650 2.6147 2.6156 2.7548 2.7559 3.2046 3.2074 3.3276 3.3305 3.6981 3.6992 3.7241 3.7245 4.6072 4.6082 4.7424 4.7435 k = 0.1406 0.3856-0.1141 ( 8604 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0144 -16.0142 -15.9332 -15.9331 -15.6525 -15.6523 -15.5986 -15.5983 -12.9446 -12.9446 -12.7729 -12.7728 -12.6348 -12.6348 -12.6327 -12.6327 -3.1733 -3.1725 -3.0141 -3.0129 -2.9014 -2.9012 -2.8290 -2.8289 -2.6899 -2.6874 -2.6649 -2.6624 -2.4852 -2.4844 -2.4263 -2.4247 -2.3580 -2.3570 -2.2611 -2.2601 -2.0582 -2.0545 -1.9320 -1.9312 -1.4507 -1.4507 -1.2664 -1.2364 -1.1244 -1.0946 -0.9304 -0.9285 -0.7172 -0.7091 -0.6767 -0.6732 -0.1576 -0.1543 -0.1342 -0.1293 -0.0140 -0.0084 0.0522 0.0572 0.1643 0.1651 0.2571 0.2602 2.6102 2.6111 2.7606 2.7617 3.2065 3.2091 3.3329 3.3355 3.6985 3.6995 3.7257 3.7261 4.6073 4.6081 4.7461 4.7471 k = 0.1250 0.3856-0.1141 ( 8604 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0175 -16.0172 -15.9352 -15.9351 -15.6511 -15.6509 -15.5968 -15.5966 -12.9464 -12.9464 -12.7714 -12.7713 -12.6344 -12.6344 -12.6327 -12.6327 -3.1717 -3.1711 -3.0081 -3.0071 -2.8803 -2.8801 -2.8119 -2.8117 -2.6832 -2.6812 -2.6593 -2.6572 -2.4853 -2.4843 -2.4276 -2.4260 -2.3561 -2.3552 -2.2599 -2.2590 -2.0513 -2.0479 -1.9231 -1.9224 -1.4537 -1.4534 -1.2627 -1.2326 -1.1379 -1.1081 -0.9514 -0.9496 -0.7266 -0.7199 -0.6801 -0.6764 -0.1690 -0.1667 -0.1358 -0.1322 -0.0118 -0.0067 0.0478 0.0522 0.1551 0.1559 0.2528 0.2556 2.6060 2.6068 2.7661 2.7671 3.2082 3.2106 3.3378 3.3401 3.6989 3.6999 3.7271 3.7275 4.6075 4.6082 4.7495 4.7504 k = 0.1094 0.3856-0.1141 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0202 -16.0200 -15.9371 -15.9370 -15.6498 -15.6497 -15.5953 -15.5950 -12.9480 -12.9480 -12.7701 -12.7700 -12.6341 -12.6341 -12.6327 -12.6327 -3.1704 -3.1698 -3.0031 -3.0021 -2.8605 -2.8603 -2.7969 -2.7964 -2.6762 -2.6748 -2.6541 -2.6523 -2.4853 -2.4841 -2.4288 -2.4274 -2.3542 -2.3533 -2.2589 -2.2581 -2.0447 -2.0416 -1.9150 -1.9143 -1.4563 -1.4558 -1.2594 -1.2296 -1.1504 -1.1209 -0.9714 -0.9698 -0.7365 -0.7309 -0.6813 -0.6778 -0.1802 -0.1786 -0.1369 -0.1342 -0.0098 -0.0054 0.0448 0.0487 0.1462 0.1471 0.2490 0.2514 2.6021 2.6028 2.7713 2.7722 3.2099 3.2120 3.3422 3.3443 3.6993 3.7001 3.7285 3.7288 4.6077 4.6083 4.7526 4.7534 k = 0.0938 0.3856-0.1141 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5523 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0226 -16.0224 -15.9388 -15.9387 -15.6487 -15.6486 -15.5939 -15.5937 -12.9494 -12.9494 -12.7690 -12.7689 -12.6338 -12.6337 -12.6327 -12.6327 -3.1692 -3.1687 -2.9987 -2.9979 -2.8424 -2.8423 -2.7840 -2.7833 -2.6694 -2.6684 -2.6495 -2.6480 -2.4851 -2.4838 -2.4299 -2.4286 -2.3525 -2.3516 -2.2580 -2.2573 -2.0386 -2.0357 -1.9076 -1.9071 -1.4584 -1.4578 -1.2566 -1.2276 -1.1614 -1.1328 -0.9901 -0.9886 -0.7459 -0.7412 -0.6816 -0.6784 -0.1906 -0.1893 -0.1379 -0.1358 -0.0084 -0.0045 0.0433 0.0466 0.1378 0.1386 0.2455 0.2476 2.5986 2.5993 2.7759 2.7768 3.2114 3.2132 3.3461 3.3479 3.6996 3.7004 3.7297 3.7300 4.6080 4.6085 4.7554 4.7561 k = 0.0781 0.3856-0.1141 ( 8624 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0246 -16.0244 -15.9402 -15.9401 -15.6478 -15.6477 -15.5927 -15.5926 -12.9506 -12.9506 -12.7680 -12.7680 -12.6335 -12.6334 -12.6327 -12.6327 -3.1682 -3.1678 -2.9952 -2.9944 -2.8264 -2.8263 -2.7733 -2.7725 -2.6629 -2.6623 -2.6454 -2.6442 -2.4847 -2.4834 -2.4310 -2.4298 -2.3508 -2.3500 -2.2573 -2.2567 -2.0330 -2.0305 -1.9012 -1.9007 -1.4602 -1.4596 -1.2541 -1.2272 -1.1701 -1.1434 -1.0067 -1.0054 -0.7543 -0.7504 -0.6813 -0.6786 -0.1997 -0.1987 -0.1388 -0.1372 -0.0076 -0.0042 0.0432 0.0460 0.1298 0.1307 0.2425 0.2443 2.5956 2.5961 2.7801 2.7808 3.2127 3.2143 3.3494 3.3510 3.6999 3.7006 3.7308 3.7310 4.6083 4.6088 4.7579 4.7584 k = 0.0625 0.3856-0.1141 ( 8622 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0263 -16.0261 -15.9414 -15.9413 -15.6470 -15.6469 -15.5918 -15.5916 -12.9516 -12.9516 -12.7672 -12.7672 -12.6332 -12.6332 -12.6327 -12.6327 -3.1674 -3.1671 -2.9923 -2.9917 -2.8128 -2.8127 -2.7647 -2.7639 -2.6570 -2.6567 -2.6418 -2.6410 -2.4843 -2.4830 -2.4318 -2.4308 -2.3493 -2.3487 -2.2568 -2.2562 -2.0281 -2.0260 -1.8957 -1.8953 -1.4617 -1.4610 -1.2521 -1.2285 -1.1760 -1.1527 -1.0210 -1.0199 -0.7613 -0.7581 -0.6809 -0.6786 -0.2074 -0.2066 -0.1395 -0.1383 -0.0072 -0.0044 0.0443 0.0465 0.1227 0.1235 0.2400 0.2414 2.5930 2.5934 2.7836 2.7842 3.2138 3.2151 3.3523 3.3535 3.7002 3.7008 3.7317 3.7319 4.6086 4.6090 4.7599 4.7604 k = 0.0469 0.3856-0.1141 ( 8628 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0276 -16.0275 -15.9423 -15.9422 -15.6464 -15.6463 -15.5910 -15.5909 -12.9523 -12.9523 -12.7667 -12.7666 -12.6330 -12.6330 -12.6327 -12.6327 -3.1667 -3.1665 -2.9901 -2.9896 -2.8018 -2.8018 -2.7583 -2.7575 -2.6522 -2.6519 -2.6389 -2.6385 -2.4837 -2.4827 -2.4325 -2.4317 -2.3481 -2.3476 -2.2563 -2.2559 -2.0240 -2.0224 -1.8913 -1.8910 -1.4627 -1.4622 -1.2501 -1.2314 -1.1790 -1.1605 -1.0325 -1.0316 -0.7668 -0.7644 -0.6804 -0.6787 -0.2135 -0.2129 -0.1401 -0.1392 -0.0070 -0.0049 0.0460 0.0478 0.1165 0.1173 0.2381 0.2392 2.5909 2.5913 2.7864 2.7869 3.2148 3.2157 3.3545 3.3555 3.7005 3.7009 3.7324 3.7326 4.6089 4.6092 4.7615 4.7619 k = 0.0312 0.3856-0.1141 ( 8636 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0285 -16.0284 -15.9430 -15.9429 -15.6460 -15.6459 -15.5905 -15.5904 -12.9529 -12.9529 -12.7662 -12.7662 -12.6329 -12.6329 -12.6327 -12.6327 -3.1663 -3.1661 -2.9885 -2.9882 -2.7938 -2.7938 -2.7537 -2.7531 -2.6486 -2.6484 -2.6367 -2.6365 -2.4832 -2.4824 -2.4329 -2.4324 -2.3472 -2.3469 -2.2560 -2.2557 -2.0209 -2.0199 -1.8881 -1.8879 -1.4634 -1.4630 -1.2481 -1.2353 -1.1796 -1.1669 -1.0409 -1.0403 -0.7707 -0.7690 -0.6799 -0.6788 -0.2178 -0.2174 -0.1406 -0.1400 -0.0070 -0.0056 0.0480 0.0492 0.1117 0.1123 0.2367 0.2375 2.5895 2.5897 2.7885 2.7888 3.2155 3.2161 3.3562 3.3568 3.7007 3.7010 3.7329 3.7331 4.6092 4.6094 4.7627 4.7630 k = 0.0156 0.3856-0.1141 ( 8638 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0291 -16.0290 -15.9434 -15.9433 -15.6457 -15.6457 -15.5901 -15.5901 -12.9532 -12.9532 -12.7660 -12.7660 -12.6328 -12.6328 -12.6327 -12.6327 -3.1659 -3.1659 -2.9875 -2.9873 -2.7889 -2.7889 -2.7509 -2.7506 -2.6464 -2.6463 -2.6354 -2.6353 -2.4828 -2.4824 -2.4332 -2.4329 -2.3466 -2.3464 -2.2558 -2.2556 -2.0189 -2.0184 -1.8862 -1.8861 -1.4637 -1.4635 -1.2458 -1.2393 -1.1783 -1.1719 -1.0460 -1.0457 -0.7728 -0.7720 -0.6795 -0.6789 -0.2204 -0.2202 -0.1408 -0.1405 -0.0069 -0.0062 0.0496 0.0503 0.1086 0.1090 0.2360 0.2363 2.5886 2.5887 2.7898 2.7899 3.2160 3.2163 3.3573 3.3576 3.7008 3.7010 3.7333 3.7333 4.6094 4.6095 4.7635 4.7636 k = 0.0000 0.3856-0.1141 ( 8636 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0292 -16.0292 -15.9435 -15.9435 -15.6456 -15.6456 -15.5900 -15.5900 -12.9533 -12.9533 -12.7659 -12.7659 -12.6328 -12.6328 -12.6327 -12.6327 -3.1658 -3.1658 -2.9871 -2.9871 -2.7873 -2.7873 -2.7499 -2.7499 -2.6456 -2.6456 -2.6349 -2.6349 -2.4825 -2.4825 -2.4331 -2.4331 -2.3464 -2.3464 -2.2557 -2.2557 -2.0181 -2.0181 -1.8855 -1.8855 -1.4638 -1.4638 -1.2429 -1.2429 -1.1757 -1.1757 -1.0476 -1.0476 -0.7733 -0.7733 -0.6792 -0.6792 -0.2212 -0.2212 -0.1407 -0.1407 -0.0066 -0.0066 0.0504 0.0504 0.1077 0.1077 0.2359 0.2359 2.5884 2.5884 2.7903 2.7903 3.2163 3.2163 3.3577 3.3577 3.7009 3.7009 3.7334 3.7334 4.6095 4.6095 4.7638 4.7638 k = 0.0000 0.3856-0.1141 ( 8636 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0292 -16.0292 -15.9435 -15.9435 -15.6456 -15.6456 -15.5900 -15.5900 -12.9533 -12.9533 -12.7659 -12.7659 -12.6328 -12.6328 -12.6327 -12.6327 -3.1658 -3.1658 -2.9871 -2.9871 -2.7873 -2.7873 -2.7499 -2.7499 -2.6456 -2.6456 -2.6349 -2.6349 -2.4825 -2.4825 -2.4331 -2.4331 -2.3464 -2.3464 -2.2557 -2.2557 -2.0181 -2.0181 -1.8855 -1.8855 -1.4638 -1.4638 -1.2429 -1.2429 -1.1757 -1.1757 -1.0476 -1.0476 -0.7733 -0.7733 -0.6792 -0.6792 -0.2212 -0.2212 -0.1407 -0.1407 -0.0066 -0.0066 0.0504 0.0504 0.1077 0.1077 0.2359 0.2359 2.5884 2.5884 2.7903 2.7903 3.2163 3.2163 3.3577 3.3577 3.7009 3.7009 3.7334 3.7334 4.6095 4.6095 4.7638 4.7638 k = 0.0000 0.3899-0.0995 ( 8637 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0292 -16.0292 -15.9435 -15.9435 -15.6456 -15.6455 -15.5901 -15.5900 -12.9530 -12.9530 -12.7658 -12.7658 -12.6381 -12.6380 -12.6278 -12.6277 -3.1659 -3.1656 -2.9874 -2.9872 -2.7874 -2.7872 -2.7501 -2.7495 -2.6481 -2.6432 -2.6363 -2.6326 -2.4826 -2.4820 -2.4341 -2.4327 -2.3459 -2.3451 -2.2581 -2.2565 -2.0169 -2.0155 -1.8857 -1.8854 -1.4651 -1.4632 -1.2439 -1.2411 -1.1765 -1.1760 -1.0482 -1.0465 -0.7744 -0.7724 -0.6797 -0.6773 -0.2272 -0.2220 -0.1410 -0.1348 -0.0090 -0.0054 0.0484 0.0511 0.1048 0.1099 0.2348 0.2380 2.5885 2.5890 2.7901 2.7902 3.2162 3.2164 3.3574 3.3577 3.6987 3.6993 3.7327 3.7336 4.6103 4.6106 4.7638 4.7641 k = 0.0000 0.3942-0.0850 ( 8637 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0290 -16.0290 -15.9437 -15.9437 -15.6455 -15.6455 -15.5902 -15.5901 -12.9522 -12.9522 -12.7656 -12.7656 -12.6438 -12.6437 -12.6232 -12.6231 -3.1660 -3.1653 -2.9882 -2.9878 -2.7874 -2.7870 -2.7501 -2.7489 -2.6504 -2.6419 -2.6358 -2.6300 -2.4823 -2.4812 -2.4355 -2.4329 -2.3437 -2.3423 -2.2634 -2.2604 -2.0123 -2.0095 -1.8861 -1.8856 -1.4672 -1.4634 -1.2442 -1.2388 -1.1783 -1.1773 -1.0481 -1.0449 -0.7757 -0.7717 -0.6791 -0.6743 -0.2380 -0.2293 -0.1359 -0.1252 -0.0124 -0.0052 0.0449 0.0504 0.1013 0.1111 0.2349 0.2412 2.5893 2.5904 2.7897 2.7900 3.2162 3.2167 3.3568 3.3575 3.6929 3.6939 3.7315 3.7329 4.6130 4.6135 4.7641 4.7646 k = 0.0000 0.3986-0.0705 ( 8639 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0287 -16.0287 -15.9440 -15.9440 -15.6454 -15.6453 -15.5903 -15.5902 -12.9509 -12.9508 -12.7652 -12.7652 -12.6499 -12.6498 -12.6190 -12.6189 -3.1659 -3.1650 -2.9893 -2.9888 -2.7874 -2.7869 -2.7500 -2.7481 -2.6521 -2.6421 -2.6332 -2.6270 -2.4817 -2.4800 -2.4372 -2.4335 -2.3400 -2.3380 -2.2712 -2.2669 -2.0045 -2.0006 -1.8866 -1.8858 -1.4699 -1.4644 -1.2443 -1.2366 -1.1805 -1.1789 -1.0476 -1.0428 -0.7771 -0.7714 -0.6771 -0.6702 -0.2517 -0.2411 -0.1273 -0.1139 -0.0169 -0.0059 0.0398 0.0487 0.0974 0.1113 0.2361 0.2450 2.5910 2.5925 2.7890 2.7895 3.2164 3.2171 3.3559 3.3569 3.6841 3.6853 3.7293 3.7311 4.6175 4.6183 4.7648 4.7655 k = 0.0000 0.4029-0.0559 ( 8638 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0283 -16.0283 -15.9444 -15.9444 -15.6453 -15.6452 -15.5905 -15.5903 -12.9490 -12.9489 -12.7647 -12.7647 -12.6564 -12.6562 -12.6152 -12.6151 -3.1657 -3.1645 -2.9910 -2.9903 -2.7873 -2.7867 -2.7498 -2.7474 -2.6532 -2.6423 -2.6299 -2.6239 -2.4809 -2.4786 -2.4389 -2.4344 -2.3350 -2.3325 -2.2809 -2.2756 -1.9945 -1.9896 -1.8871 -1.8861 -1.4731 -1.4662 -1.2448 -1.2355 -1.1824 -1.1799 -1.0465 -1.0402 -0.7786 -0.7714 -0.6739 -0.6651 -0.2670 -0.2554 -0.1174 -0.1023 -0.0225 -0.0074 0.0332 0.0460 0.0934 0.1106 0.2383 0.2494 2.5933 2.5954 2.7882 2.7888 3.2167 3.2176 3.3548 3.3561 3.6729 3.6741 3.7259 3.7279 4.6236 4.6246 4.7657 4.7666 k = 0.0000 0.4072-0.0414 ( 8638 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0279 -16.0278 -15.9449 -15.9449 -15.6451 -15.6450 -15.5907 -15.5905 -12.9466 -12.9464 -12.7641 -12.7640 -12.6631 -12.6630 -12.6117 -12.6117 -3.1654 -3.1640 -2.9931 -2.9922 -2.7872 -2.7865 -2.7496 -2.7467 -2.6535 -2.6421 -2.6262 -2.6205 -2.4799 -2.4772 -2.4403 -2.4351 -2.3288 -2.3260 -2.2918 -2.2856 -1.9829 -1.9773 -1.8876 -1.8862 -1.4766 -1.4685 -1.2468 -1.2368 -1.1831 -1.1791 -1.0449 -1.0372 -0.7800 -0.7716 -0.6695 -0.6590 -0.2833 -0.2712 -0.1072 -0.0911 -0.0291 -0.0093 0.0253 0.0426 0.0891 0.1091 0.2414 0.2541 2.5963 2.5989 2.7871 2.7879 3.2170 3.2182 3.3533 3.3550 3.6597 3.6608 3.7211 3.7233 4.6312 4.6324 4.7668 4.7680 k = 0.0000 0.4115-0.0268 ( 8624 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0273 -16.0272 -15.9455 -15.9455 -15.6449 -15.6447 -15.5910 -15.5907 -12.9436 -12.9435 -12.7633 -12.7633 -12.6702 -12.6701 -12.6086 -12.6086 -3.1649 -3.1632 -2.9956 -2.9946 -2.7870 -2.7862 -2.7495 -2.7462 -2.6530 -2.6414 -2.6224 -2.6170 -2.4790 -2.4759 -2.4410 -2.4356 -2.3219 -2.3187 -2.3032 -2.2963 -1.9706 -1.9644 -1.8877 -1.8859 -1.4804 -1.4714 -1.2512 -1.2414 -1.1816 -1.1753 -1.0429 -1.0339 -0.7814 -0.7721 -0.6640 -0.6521 -0.3001 -0.2877 -0.0975 -0.0810 -0.0363 -0.0115 0.0164 0.0385 0.0846 0.1068 0.2450 0.2589 2.6001 2.6031 2.7858 2.7868 3.2175 3.2189 3.3516 3.3536 3.6448 3.6457 3.7152 3.7173 4.6399 4.6413 4.7682 4.7696 k = 0.0000 0.4158-0.0123 ( 8627 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0266 -16.0266 -15.9462 -15.9462 -15.6446 -15.6444 -15.5913 -15.5910 -12.9402 -12.9400 -12.7625 -12.7624 -12.6776 -12.6774 -12.6059 -12.6058 -3.1643 -3.1624 -2.9986 -2.9975 -2.7867 -2.7860 -2.7497 -2.7461 -2.6518 -2.6400 -2.6184 -2.6133 -2.4782 -2.4749 -2.4409 -2.4356 -2.3180 -2.3125 -2.3106 -2.3062 -1.9585 -1.9518 -1.8870 -1.8847 -1.4844 -1.4747 -1.2584 -1.2493 -1.1773 -1.1688 -1.0406 -1.0303 -0.7828 -0.7729 -0.6575 -0.6444 -0.3173 -0.3045 -0.0890 -0.0728 -0.0438 -0.0138 0.0074 0.0339 0.0798 0.1042 0.2490 0.2637 2.6044 2.6078 2.7843 2.7854 3.2181 3.2197 3.3496 3.3520 3.6287 3.6294 3.7080 3.7101 4.6496 4.6511 4.7698 4.7714 k = 0.0000 0.4201 0.0022 ( 8624 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0259 -16.0258 -15.9470 -15.9470 -15.6443 -15.6441 -15.5916 -15.5913 -12.9362 -12.9360 -12.7615 -12.7614 -12.6853 -12.6851 -12.6035 -12.6034 -3.1634 -3.1613 -3.0019 -3.0007 -2.7864 -2.7856 -2.7502 -2.7464 -2.6498 -2.6380 -2.6144 -2.6094 -2.4777 -2.4745 -2.4398 -2.4349 -2.3282 -2.3199 -2.3041 -2.3012 -1.9474 -1.9405 -1.8849 -1.8821 -1.4885 -1.4782 -1.2682 -1.2597 -1.1706 -1.1600 -1.0380 -1.0264 -0.7841 -0.7738 -0.6502 -0.6361 -0.3345 -0.3214 -0.0829 -0.0673 -0.0508 -0.0168 -0.0000 0.0291 0.0747 0.1013 0.2532 0.2683 2.6092 2.6130 2.7826 2.7839 3.2188 3.2207 3.3474 3.3500 3.6117 3.6122 3.6999 3.7019 4.6600 4.6617 4.7716 4.7733 k = 0.0000 0.4244 0.0168 ( 8620 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0251 -16.0250 -15.9479 -15.9478 -15.6440 -15.6438 -15.5920 -15.5916 -12.9318 -12.9316 -12.7604 -12.7603 -12.6932 -12.6930 -12.6014 -12.6014 -3.1623 -3.1601 -3.0058 -3.0044 -2.7861 -2.7852 -2.7510 -2.7470 -2.6472 -2.6357 -2.6101 -2.6051 -2.4776 -2.4745 -2.4377 -2.4335 -2.3396 -2.3306 -2.2956 -2.2923 -1.9383 -1.9316 -1.8806 -1.8776 -1.4925 -1.4820 -1.2799 -1.2721 -1.1618 -1.1497 -1.0353 -1.0224 -0.7852 -0.7749 -0.6422 -0.6273 -0.3516 -0.3381 -0.0818 -0.0637 -0.0562 -0.0233 -0.0023 0.0242 0.0693 0.0983 0.2573 0.2726 2.6146 2.6187 2.7807 2.7821 3.2197 3.2217 3.3448 3.3479 3.5942 3.5945 3.6909 3.6928 4.6708 4.6726 4.7735 4.7753 k = 0.0000 0.4287 0.0313 ( 8623 PWs) bands (ev): -71.4674 -71.4674 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0242 -16.0241 -15.9488 -15.9487 -15.6436 -15.6434 -15.5924 -15.5920 -12.9269 -12.9267 -12.7593 -12.7592 -12.7014 -12.7012 -12.5996 -12.5996 -3.1610 -3.1586 -3.0099 -3.0085 -2.7857 -2.7848 -2.7521 -2.7481 -2.6443 -2.6332 -2.6054 -2.6005 -2.4777 -2.4750 -2.4350 -2.4316 -2.3505 -2.3408 -2.2866 -2.2831 -1.9315 -1.9255 -1.8738 -1.8708 -1.4966 -1.4860 -1.2932 -1.2859 -1.1516 -1.1382 -1.0325 -1.0183 -0.7862 -0.7760 -0.6336 -0.6180 -0.3683 -0.3544 -0.0868 -0.0610 -0.0605 -0.0325 0.0000 0.0197 0.0638 0.0955 0.2611 0.2765 2.6203 2.6248 2.7786 2.7802 3.2206 3.2228 3.3420 3.3454 3.5764 3.5768 3.6814 3.6832 4.6819 4.6838 4.7756 4.7774 k = 0.0000 0.4330 0.0459 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4502 -42.4502 -42.4502 -42.4502 -16.0233 -16.0232 -15.9498 -15.9497 -15.6433 -15.6431 -15.5928 -15.5924 -12.9216 -12.9213 -12.7581 -12.7580 -12.7098 -12.7096 -12.5981 -12.5981 -3.1594 -3.1569 -3.0145 -3.0130 -2.7852 -2.7842 -2.7535 -2.7495 -2.6412 -2.6308 -2.6003 -2.5953 -2.4782 -2.4759 -2.4321 -2.4294 -2.3604 -2.3499 -2.2777 -2.2740 -1.9269 -1.9216 -1.8652 -1.8621 -1.5006 -1.4900 -1.3074 -1.3006 -1.1403 -1.1261 -1.0298 -1.0142 -0.7870 -0.7772 -0.6246 -0.6083 -0.3844 -0.3702 -0.0951 -0.0663 -0.0592 -0.0414 0.0031 0.0167 0.0584 0.0932 0.2646 0.2799 2.6265 2.6311 2.7764 2.7781 3.2217 3.2241 3.3390 3.3428 3.5587 3.5593 3.6715 3.6731 4.6930 4.6950 4.7777 4.7796 k = 0.0000 0.4373 0.0604 ( 8619 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -16.0224 -16.0223 -15.9507 -15.9506 -15.6429 -15.6427 -15.5932 -15.5927 -12.9158 -12.9155 -12.7570 -12.7568 -12.7183 -12.7181 -12.5969 -12.5969 -3.1576 -3.1550 -3.0193 -3.0177 -2.7848 -2.7836 -2.7551 -2.7512 -2.6381 -2.6285 -2.5947 -2.5896 -2.4788 -2.4770 -2.4298 -2.4274 -2.3687 -2.3574 -2.2690 -2.2650 -1.9236 -1.9192 -1.8556 -1.8526 -1.5045 -1.4941 -1.3221 -1.3158 -1.1282 -1.1135 -1.0271 -1.0103 -0.7876 -0.7784 -0.6153 -0.5985 -0.3998 -0.3852 -0.1047 -0.0734 -0.0619 -0.0470 0.0033 0.0167 0.0539 0.0914 0.2677 0.2827 2.6328 2.6377 2.7740 2.7758 3.2229 3.2255 3.3357 3.3399 3.5415 3.5424 3.6615 3.6629 4.7040 4.7060 4.7798 4.7817 k = 0.0000 0.4416 0.0749 ( 8617 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4502 -42.4502 -42.4502 -16.0214 -16.0214 -15.9517 -15.9516 -15.6425 -15.6423 -15.5936 -15.5931 -12.9097 -12.9094 -12.7558 -12.7557 -12.7270 -12.7267 -12.5960 -12.5959 -3.1555 -3.1529 -3.0243 -3.0227 -2.7843 -2.7830 -2.7570 -2.7531 -2.6353 -2.6266 -2.5884 -2.5835 -2.4797 -2.4782 -2.4289 -2.4261 -2.3746 -2.3628 -2.2607 -2.2566 -1.9209 -1.9171 -1.8459 -1.8429 -1.5083 -1.4981 -1.3371 -1.3313 -1.1156 -1.1010 -1.0247 -1.0068 -0.7879 -0.7795 -0.6058 -0.5886 -0.4142 -0.3992 -0.1147 -0.0821 -0.0682 -0.0494 0.0005 0.0178 0.0517 0.0906 0.2702 0.2850 2.6394 2.6443 2.7715 2.7734 3.2241 3.2269 3.3323 3.3368 3.5250 3.5263 3.6514 3.6526 4.7147 4.7168 4.7818 4.7837 k = 0.0000 0.4459 0.0895 ( 8621 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0205 -16.0205 -15.9527 -15.9526 -15.6421 -15.6419 -15.5940 -15.5935 -12.9032 -12.9029 -12.7546 -12.7545 -12.7357 -12.7354 -12.5952 -12.5952 -3.1532 -3.1506 -3.0295 -3.0278 -2.7838 -2.7822 -2.7591 -2.7551 -2.6327 -2.6250 -2.5817 -2.5770 -2.4807 -2.4795 -2.4297 -2.4268 -2.3775 -2.3656 -2.2532 -2.2490 -1.9182 -1.9149 -1.8368 -1.8339 -1.5120 -1.5022 -1.3518 -1.3467 -1.1027 -1.0887 -1.0225 -1.0037 -0.7880 -0.7805 -0.5965 -0.5788 -0.4275 -0.4120 -0.1246 -0.0919 -0.0752 -0.0515 -0.0033 0.0160 0.0532 0.0907 0.2721 0.2866 2.6460 2.6510 2.7689 2.7709 3.2255 3.2285 3.3286 3.3335 3.5097 3.5113 3.6416 3.6426 4.7251 4.7271 4.7839 4.7857 k = 0.0000 0.4502 0.1040 ( 8625 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0197 -16.0196 -15.9536 -15.9535 -15.6418 -15.6416 -15.5943 -15.5939 -12.8964 -12.8961 -12.7536 -12.7536 -12.7444 -12.7441 -12.5947 -12.5946 -3.1507 -3.1481 -3.0348 -3.0331 -2.7833 -2.7815 -2.7613 -2.7573 -2.6304 -2.6236 -2.5747 -2.5701 -2.4820 -2.4810 -2.4322 -2.4296 -2.3769 -2.3658 -2.2466 -2.2424 -1.9151 -1.9121 -1.8285 -1.8257 -1.5156 -1.5061 -1.3662 -1.3617 -1.0900 -1.0773 -1.0205 -1.0014 -0.7877 -0.7812 -0.5874 -0.5692 -0.4393 -0.4235 -0.1340 -0.1021 -0.0818 -0.0542 -0.0076 0.0111 0.0580 0.0919 0.2732 0.2875 2.6526 2.6575 2.7663 2.7684 3.2268 3.2300 3.3248 3.3301 3.4956 3.4976 3.6322 3.6330 4.7349 4.7369 4.7858 4.7875 k = 0.0000 0.4545 0.1186 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0188 -16.0188 -15.9545 -15.9543 -15.6414 -15.6412 -15.5947 -15.5942 -12.8893 -12.8890 -12.7547 -12.7547 -12.7510 -12.7507 -12.5943 -12.5942 -3.1481 -3.1456 -3.0401 -3.0383 -2.7828 -2.7807 -2.7636 -2.7595 -2.6283 -2.6225 -2.5675 -2.5632 -2.4835 -2.4826 -2.4361 -2.4341 -2.3738 -2.3636 -2.2412 -2.2371 -1.9114 -1.9086 -1.8213 -1.8187 -1.5192 -1.5101 -1.3797 -1.3759 -1.0776 -1.0674 -1.0184 -0.9999 -0.7871 -0.7816 -0.5787 -0.5602 -0.4494 -0.4333 -0.1426 -0.1121 -0.0878 -0.0573 -0.0122 0.0041 0.0644 0.0940 0.2736 0.2877 2.6591 2.6638 2.7637 2.7659 3.2283 3.2317 3.3209 3.3267 3.4830 3.4854 3.6233 3.6239 4.7441 4.7461 4.7876 4.7892 k = 0.0000 0.4588 0.1331 ( 8611 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5857 -42.4503 -42.4502 -42.4502 -42.4502 -16.0181 -16.0181 -15.9553 -15.9551 -15.6411 -15.6409 -15.5950 -15.5946 -12.8821 -12.8817 -12.7626 -12.7623 -12.7509 -12.7507 -12.5941 -12.5940 -3.1454 -3.1429 -3.0451 -3.0434 -2.7823 -2.7798 -2.7659 -2.7618 -2.6264 -2.6215 -2.5602 -2.5562 -2.4853 -2.4844 -2.4407 -2.4393 -2.3690 -2.3599 -2.2372 -2.2332 -1.9071 -1.9043 -1.8152 -1.8127 -1.5227 -1.5139 -1.3922 -1.3892 -1.0658 -1.0598 -1.0161 -0.9993 -0.7863 -0.7815 -0.5706 -0.5518 -0.4575 -0.4414 -0.1503 -0.1214 -0.0929 -0.0605 -0.0173 -0.0038 0.0716 0.0970 0.2732 0.2872 2.6653 2.6697 2.7612 2.7634 3.2297 3.2334 3.3170 3.3232 3.4722 3.4749 3.6151 3.6156 4.7526 4.7545 4.7893 4.7908 k = 0.5000 0.3125 0.3612 ( 8580 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9084 -15.9084 -15.9080 -15.9080 -15.6688 -15.6688 -15.6686 -15.6686 -12.8153 -12.8153 -12.8151 -12.8151 -12.6808 -12.6808 -12.6806 -12.6806 -3.3038 -3.3038 -3.3016 -3.3016 -3.1100 -3.1100 -3.1062 -3.1062 -2.7577 -2.7577 -2.7506 -2.7506 -2.5088 -2.5088 -2.5033 -2.5033 -2.3127 -2.3127 -2.3086 -2.3086 -1.9879 -1.9879 -1.9784 -1.9784 -1.4826 -1.4826 -1.4749 -1.4749 -0.8337 -0.8337 -0.8177 -0.8177 -0.4091 -0.4091 -0.3972 -0.3972 -0.1906 -0.1906 -0.1713 -0.1713 0.1548 0.1548 0.1732 0.1732 0.3338 0.3338 0.3430 0.3430 2.7042 2.7042 2.7138 2.7138 3.1765 3.1765 3.1802 3.1802 3.5470 3.5470 3.5533 3.5533 4.6845 4.6845 4.6854 4.6854 k = 0.5000 0.2969 0.3612 ( 8578 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9084 -15.9084 -15.9081 -15.9081 -15.6689 -15.6689 -15.6687 -15.6687 -12.8143 -12.8143 -12.8140 -12.8140 -12.6817 -12.6817 -12.6815 -12.6815 -3.3046 -3.3046 -3.3023 -3.3023 -3.1091 -3.1091 -3.1053 -3.1053 -2.7543 -2.7543 -2.7470 -2.7470 -2.5077 -2.5077 -2.5022 -2.5022 -2.3125 -2.3125 -2.3085 -2.3085 -1.9867 -1.9867 -1.9773 -1.9773 -1.4891 -1.4891 -1.4815 -1.4815 -0.8411 -0.8411 -0.8247 -0.8247 -0.4131 -0.4131 -0.4013 -0.4013 -0.1825 -0.1825 -0.1626 -0.1626 0.1555 0.1555 0.1741 0.1741 0.3343 0.3343 0.3434 0.3434 2.7055 2.7055 2.7149 2.7149 3.1744 3.1744 3.1782 3.1782 3.5454 3.5454 3.5516 3.5516 4.6897 4.6897 4.6906 4.6906 k = 0.5000 0.2813 0.3612 ( 8582 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4502 -42.4502 -42.4502 -42.4502 -15.9084 -15.9084 -15.9081 -15.9081 -15.6690 -15.6690 -15.6687 -15.6687 -12.8132 -12.8132 -12.8130 -12.8130 -12.6825 -12.6825 -12.6823 -12.6823 -3.3053 -3.3053 -3.3031 -3.3031 -3.1078 -3.1078 -3.1039 -3.1039 -2.7507 -2.7507 -2.7433 -2.7433 -2.5069 -2.5069 -2.5013 -2.5013 -2.3122 -2.3122 -2.3085 -2.3085 -1.9859 -1.9859 -1.9767 -1.9767 -1.4954 -1.4954 -1.4877 -1.4877 -0.8498 -0.8498 -0.8331 -0.8331 -0.4167 -0.4167 -0.4052 -0.4052 -0.1737 -0.1737 -0.1535 -0.1535 0.1563 0.1563 0.1751 0.1751 0.3349 0.3349 0.3438 0.3438 2.7071 2.7071 2.7164 2.7164 3.1722 3.1722 3.1760 3.1760 3.5438 3.5438 3.5500 3.5500 4.6956 4.6956 4.6965 4.6965 k = 0.5000 0.2657 0.3612 ( 8590 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9085 -15.9085 -15.9082 -15.9082 -15.6691 -15.6691 -15.6688 -15.6688 -12.8122 -12.8122 -12.8119 -12.8119 -12.6833 -12.6833 -12.6831 -12.6831 -3.3060 -3.3060 -3.3038 -3.3038 -3.1060 -3.1060 -3.1021 -3.1021 -2.7469 -2.7469 -2.7395 -2.7395 -2.5064 -2.5064 -2.5007 -2.5007 -2.3120 -2.3120 -2.3084 -2.3084 -1.9857 -1.9857 -1.9768 -1.9768 -1.5012 -1.5012 -1.4934 -1.4934 -0.8597 -0.8597 -0.8428 -0.8428 -0.4199 -0.4199 -0.4087 -0.4087 -0.1645 -0.1645 -0.1441 -0.1441 0.1570 0.1570 0.1759 0.1759 0.3356 0.3356 0.3443 0.3443 2.7091 2.7091 2.7183 2.7183 3.1699 3.1699 3.1737 3.1737 3.5422 3.5422 3.5483 3.5483 4.7019 4.7019 4.7029 4.7029 k = 0.5000 0.2500 0.3612 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4502 -42.4502 -15.9086 -15.9086 -15.9082 -15.9082 -15.6692 -15.6692 -15.6689 -15.6689 -12.8111 -12.8111 -12.8109 -12.8109 -12.6841 -12.6841 -12.6839 -12.6839 -3.3067 -3.3067 -3.3045 -3.3045 -3.1038 -3.1038 -3.0999 -3.0999 -2.7432 -2.7432 -2.7358 -2.7358 -2.5061 -2.5061 -2.5003 -2.5003 -2.3118 -2.3118 -2.3084 -2.3084 -1.9860 -1.9860 -1.9773 -1.9773 -1.5066 -1.5066 -1.4986 -1.4986 -0.8706 -0.8706 -0.8534 -0.8534 -0.4227 -0.4227 -0.4120 -0.4120 -0.1551 -0.1551 -0.1346 -0.1346 0.1576 0.1576 0.1766 0.1766 0.3364 0.3364 0.3448 0.3448 2.7115 2.7115 2.7204 2.7204 3.1675 3.1675 3.1714 3.1714 3.5406 3.5406 3.5466 3.5466 4.7086 4.7086 4.7098 4.7098 k = 0.5000 0.2344 0.3612 ( 8602 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9086 -15.9086 -15.9083 -15.9083 -15.6692 -15.6692 -15.6690 -15.6690 -12.8101 -12.8101 -12.8098 -12.8098 -12.6848 -12.6848 -12.6846 -12.6846 -3.3074 -3.3074 -3.3052 -3.3052 -3.1013 -3.1013 -3.0973 -3.0973 -2.7395 -2.7395 -2.7321 -2.7321 -2.5060 -2.5060 -2.5001 -2.5001 -2.3115 -2.3115 -2.3082 -2.3082 -1.9869 -1.9869 -1.9785 -1.9785 -1.5115 -1.5115 -1.5033 -1.5033 -0.8822 -0.8822 -0.8648 -0.8648 -0.4251 -0.4251 -0.4149 -0.4149 -0.1454 -0.1454 -0.1250 -0.1250 0.1581 0.1581 0.1771 0.1771 0.3373 0.3373 0.3453 0.3453 2.7142 2.7142 2.7228 2.7228 3.1651 3.1651 3.1690 3.1690 3.5391 3.5391 3.5449 3.5449 4.7157 4.7157 4.7170 4.7170 k = 0.5000 0.2188 0.3612 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9087 -15.9087 -15.9084 -15.9084 -15.6693 -15.6693 -15.6690 -15.6690 -12.8091 -12.8091 -12.8088 -12.8088 -12.6855 -12.6855 -12.6853 -12.6853 -3.3081 -3.3081 -3.3059 -3.3059 -3.0984 -3.0984 -3.0943 -3.0943 -2.7360 -2.7360 -2.7286 -2.7286 -2.5060 -2.5060 -2.5001 -2.5001 -2.3110 -2.3110 -2.3080 -2.3080 -1.9884 -1.9884 -1.9803 -1.9803 -1.5159 -1.5159 -1.5074 -1.5074 -0.8942 -0.8942 -0.8768 -0.8768 -0.4272 -0.4272 -0.4176 -0.4176 -0.1357 -0.1357 -0.1154 -0.1154 0.1584 0.1584 0.1774 0.1774 0.3382 0.3382 0.3459 0.3459 2.7172 2.7172 2.7254 2.7254 3.1626 3.1626 3.1666 3.1666 3.5375 3.5375 3.5432 3.5432 4.7230 4.7230 4.7244 4.7244 k = 0.5000 0.2031 0.3612 ( 8598 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9088 -15.9088 -15.9085 -15.9085 -15.6694 -15.6694 -15.6691 -15.6691 -12.8081 -12.8081 -12.8078 -12.8078 -12.6861 -12.6861 -12.6859 -12.6859 -3.3087 -3.3087 -3.3065 -3.3065 -3.0953 -3.0953 -3.0911 -3.0911 -2.7326 -2.7326 -2.7253 -2.7253 -2.5062 -2.5062 -2.5002 -2.5002 -2.3105 -2.3105 -2.3076 -2.3076 -1.9905 -1.9905 -1.9827 -1.9827 -1.5197 -1.5197 -1.5108 -1.5108 -0.9065 -0.9065 -0.8890 -0.8890 -0.4291 -0.4291 -0.4201 -0.4201 -0.1259 -0.1259 -0.1058 -0.1058 0.1586 0.1586 0.1774 0.1774 0.3392 0.3392 0.3466 0.3466 2.7203 2.7203 2.7282 2.7282 3.1602 3.1602 3.1642 3.1642 3.5360 3.5360 3.5414 3.5414 4.7305 4.7305 4.7319 4.7319 k = 0.5000 0.1875 0.3612 ( 8602 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9089 -15.9089 -15.9086 -15.9086 -15.6695 -15.6695 -15.6692 -15.6692 -12.8071 -12.8071 -12.8068 -12.8068 -12.6867 -12.6867 -12.6865 -12.6865 -3.3094 -3.3094 -3.3072 -3.3072 -3.0919 -3.0919 -3.0876 -3.0876 -2.7294 -2.7294 -2.7223 -2.7223 -2.5064 -2.5064 -2.5004 -2.5004 -2.3097 -2.3097 -2.3070 -2.3070 -1.9931 -1.9931 -1.9856 -1.9856 -1.5229 -1.5229 -1.5137 -1.5137 -0.9188 -0.9188 -0.9013 -0.9013 -0.4308 -0.4308 -0.4225 -0.4225 -0.1162 -0.1162 -0.0965 -0.0965 0.1585 0.1585 0.1772 0.1772 0.3403 0.3403 0.3472 0.3472 2.7236 2.7236 2.7311 2.7311 3.1579 3.1579 3.1618 3.1618 3.5345 3.5345 3.5397 3.5397 4.7379 4.7379 4.7395 4.7395 k = 0.5000 0.1719 0.3612 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9090 -15.9090 -15.9087 -15.9087 -15.6695 -15.6695 -15.6693 -15.6693 -12.8062 -12.8062 -12.8059 -12.8059 -12.6873 -12.6873 -12.6871 -12.6871 -3.3100 -3.3100 -3.3078 -3.3078 -3.0883 -3.0883 -3.0840 -3.0840 -2.7266 -2.7266 -2.7196 -2.7196 -2.5066 -2.5066 -2.5007 -2.5007 -2.3088 -2.3088 -2.3062 -2.3062 -1.9962 -1.9962 -1.9890 -1.9890 -1.5255 -1.5255 -1.5160 -1.5160 -0.9307 -0.9307 -0.9134 -0.9134 -0.4325 -0.4325 -0.4247 -0.4247 -0.1066 -0.1066 -0.0874 -0.0874 0.1582 0.1582 0.1766 0.1766 0.3414 0.3414 0.3480 0.3480 2.7269 2.7269 2.7339 2.7339 3.1556 3.1556 3.1595 3.1595 3.5331 3.5331 3.5380 3.5380 4.7452 4.7452 4.7469 4.7469 k = 0.5000 0.1563 0.3612 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9091 -15.9091 -15.9088 -15.9088 -15.6696 -15.6696 -15.6693 -15.6693 -12.8053 -12.8053 -12.8051 -12.8051 -12.6878 -12.6878 -12.6876 -12.6876 -3.3106 -3.3106 -3.3084 -3.3084 -3.0846 -3.0846 -3.0802 -3.0802 -2.7241 -2.7241 -2.7173 -2.7173 -2.5068 -2.5068 -2.5010 -2.5010 -2.3077 -2.3077 -2.3052 -2.3052 -1.9997 -1.9997 -1.9928 -1.9928 -1.5276 -1.5276 -1.5179 -1.5179 -0.9422 -0.9422 -0.9251 -0.9251 -0.4341 -0.4341 -0.4269 -0.4269 -0.0972 -0.0972 -0.0786 -0.0786 0.1577 0.1577 0.1756 0.1756 0.3425 0.3425 0.3487 0.3487 2.7303 2.7303 2.7368 2.7368 3.1534 3.1534 3.1574 3.1574 3.5317 3.5317 3.5364 3.5364 4.7524 4.7524 4.7542 4.7542 k = 0.5000 0.1406 0.3612 ( 8630 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9092 -15.9092 -15.9089 -15.9089 -15.6697 -15.6697 -15.6694 -15.6694 -12.8045 -12.8045 -12.8043 -12.8043 -12.6883 -12.6883 -12.6881 -12.6881 -3.3111 -3.3111 -3.3090 -3.3090 -3.0809 -3.0809 -3.0764 -3.0764 -2.7219 -2.7219 -2.7154 -2.7154 -2.5070 -2.5070 -2.5014 -2.5014 -2.3064 -2.3064 -2.3039 -2.3039 -2.0036 -2.0036 -1.9969 -1.9969 -1.5292 -1.5292 -1.5193 -1.5193 -0.9531 -0.9531 -0.9363 -0.9363 -0.4356 -0.4356 -0.4291 -0.4291 -0.0880 -0.0880 -0.0703 -0.0703 0.1571 0.1571 0.1744 0.1744 0.3437 0.3437 0.3495 0.3495 2.7335 2.7335 2.7395 2.7395 3.1514 3.1514 3.1553 3.1553 3.5304 3.5304 3.5348 3.5348 4.7592 4.7592 4.7611 4.7611 k = 0.5000 0.1250 0.3612 ( 8634 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9093 -15.9093 -15.9090 -15.9090 -15.6697 -15.6697 -15.6695 -15.6695 -12.8038 -12.8038 -12.8035 -12.8035 -12.6887 -12.6887 -12.6886 -12.6886 -3.3116 -3.3116 -3.3095 -3.3095 -3.0773 -3.0773 -3.0727 -3.0727 -2.7200 -2.7200 -2.7139 -2.7139 -2.5072 -2.5072 -2.5018 -2.5018 -2.3049 -2.3049 -2.3025 -2.3025 -2.0076 -2.0076 -2.0012 -2.0012 -1.5304 -1.5304 -1.5204 -1.5204 -0.9631 -0.9631 -0.9467 -0.9467 -0.4371 -0.4371 -0.4311 -0.4311 -0.0792 -0.0792 -0.0625 -0.0625 0.1562 0.1562 0.1728 0.1728 0.3448 0.3448 0.3503 0.3503 2.7367 2.7367 2.7421 2.7421 3.1496 3.1496 3.1535 3.1535 3.5292 3.5292 3.5332 3.5332 4.7656 4.7656 4.7676 4.7676 k = 0.5000 0.1094 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9094 -15.9094 -15.9091 -15.9091 -15.6698 -15.6698 -15.6695 -15.6695 -12.8031 -12.8031 -12.8028 -12.8028 -12.6891 -12.6891 -12.6889 -12.6889 -3.3121 -3.3121 -3.3100 -3.3100 -3.0738 -3.0738 -3.0692 -3.0692 -2.7185 -2.7185 -2.7128 -2.7128 -2.5072 -2.5072 -2.5023 -2.5023 -2.3033 -2.3033 -2.3009 -2.3009 -2.0117 -2.0117 -2.0056 -2.0056 -1.5311 -1.5311 -1.5211 -1.5211 -0.9722 -0.9722 -0.9562 -0.9562 -0.4386 -0.4386 -0.4331 -0.4331 -0.0708 -0.0708 -0.0553 -0.0553 0.1553 0.1553 0.1710 0.1710 0.3459 0.3459 0.3511 0.3511 2.7396 2.7396 2.7445 2.7445 3.1479 3.1479 3.1518 3.1518 3.5281 3.5281 3.5318 3.5318 4.7715 4.7715 4.7736 4.7736 k = 0.5000 0.0938 0.3612 ( 8630 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9095 -15.9095 -15.9092 -15.9092 -15.6698 -15.6698 -15.6696 -15.6696 -12.8024 -12.8024 -12.8022 -12.8022 -12.6894 -12.6894 -12.6893 -12.6893 -3.3125 -3.3125 -3.3104 -3.3104 -3.0706 -3.0706 -3.0658 -3.0658 -2.7173 -2.7173 -2.7120 -2.7120 -2.5072 -2.5072 -2.5028 -2.5028 -2.3016 -2.3016 -2.2992 -2.2992 -2.0157 -2.0157 -2.0098 -2.0098 -1.5316 -1.5316 -1.5217 -1.5217 -0.9802 -0.9802 -0.9648 -0.9648 -0.4399 -0.4399 -0.4350 -0.4350 -0.0629 -0.0629 -0.0490 -0.0490 0.1544 0.1544 0.1690 0.1690 0.3469 0.3469 0.3519 0.3519 2.7424 2.7424 2.7466 2.7466 3.1464 3.1464 3.1503 3.1503 3.5272 3.5272 3.5305 3.5305 4.7768 4.7768 4.7790 4.7790 k = 0.5000 0.0781 0.3612 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9095 -15.9095 -15.9093 -15.9093 -15.6698 -15.6698 -15.6697 -15.6697 -12.8019 -12.8019 -12.8017 -12.8017 -12.6897 -12.6897 -12.6896 -12.6896 -3.3128 -3.3128 -3.3107 -3.3107 -3.0676 -3.0676 -3.0628 -3.0628 -2.7164 -2.7164 -2.7115 -2.7115 -2.5072 -2.5072 -2.5033 -2.5033 -2.2999 -2.2999 -2.2976 -2.2976 -2.0194 -2.0194 -2.0138 -2.0138 -1.5319 -1.5319 -1.5221 -1.5221 -0.9870 -0.9870 -0.9722 -0.9722 -0.4411 -0.4411 -0.4367 -0.4367 -0.0557 -0.0557 -0.0435 -0.0435 0.1536 0.1536 0.1668 0.1668 0.3479 0.3479 0.3526 0.3526 2.7448 2.7448 2.7485 2.7485 3.1451 3.1451 3.1490 3.1490 3.5264 3.5264 3.5293 3.5293 4.7814 4.7814 4.7837 4.7837 k = 0.5000 0.0625 0.3612 ( 8624 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9096 -15.9096 -15.9093 -15.9093 -15.6699 -15.6699 -15.6697 -15.6697 -12.8015 -12.8015 -12.8013 -12.8013 -12.6899 -12.6899 -12.6898 -12.6898 -3.3131 -3.3131 -3.3110 -3.3110 -3.0651 -3.0651 -3.0602 -3.0602 -2.7157 -2.7157 -2.7112 -2.7112 -2.5070 -2.5070 -2.5037 -2.5037 -2.2984 -2.2984 -2.2961 -2.2961 -2.0227 -2.0227 -2.0174 -2.0174 -1.5320 -1.5320 -1.5223 -1.5223 -0.9927 -0.9927 -0.9784 -0.9784 -0.4421 -0.4421 -0.4382 -0.4382 -0.0493 -0.0493 -0.0391 -0.0391 0.1529 0.1529 0.1647 0.1647 0.3487 0.3487 0.3532 0.3532 2.7469 2.7469 2.7500 2.7500 3.1441 3.1441 3.1479 3.1479 3.5257 3.5257 3.5283 3.5283 4.7853 4.7853 4.7876 4.7876 k = 0.5000 0.0469 0.3612 ( 8622 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9096 -15.9096 -15.9094 -15.9094 -15.6699 -15.6699 -15.6697 -15.6697 -12.8011 -12.8011 -12.8010 -12.8010 -12.6901 -12.6901 -12.6900 -12.6900 -3.3134 -3.3134 -3.3113 -3.3113 -3.0630 -3.0630 -3.0581 -3.0581 -2.7152 -2.7152 -2.7110 -2.7110 -2.5069 -2.5069 -2.5042 -2.5042 -2.2970 -2.2970 -2.2947 -2.2947 -2.0255 -2.0255 -2.0204 -2.0204 -1.5319 -1.5319 -1.5225 -1.5225 -0.9971 -0.9971 -0.9833 -0.9833 -0.4430 -0.4430 -0.4395 -0.4395 -0.0438 -0.0438 -0.0359 -0.0359 0.1524 0.1524 0.1628 0.1628 0.3493 0.3493 0.3537 0.3537 2.7486 2.7486 2.7511 2.7511 3.1432 3.1432 3.1471 3.1471 3.5252 3.5252 3.5275 3.5275 4.7884 4.7884 4.7907 4.7907 k = 0.5000 0.0313 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9094 -15.9094 -15.6699 -15.6699 -15.6698 -15.6698 -12.8008 -12.8008 -12.8007 -12.8007 -12.6902 -12.6902 -12.6902 -12.6902 -3.3135 -3.3135 -3.3115 -3.3115 -3.0615 -3.0615 -3.0566 -3.0566 -2.7149 -2.7149 -2.7110 -2.7110 -2.5066 -2.5066 -2.5046 -2.5046 -2.2959 -2.2959 -2.2937 -2.2937 -2.0275 -2.0275 -2.0226 -2.0226 -1.5319 -1.5319 -1.5226 -1.5226 -1.0002 -1.0002 -0.9868 -0.9868 -0.4436 -0.4436 -0.4404 -0.4404 -0.0394 -0.0394 -0.0339 -0.0339 0.1522 0.1522 0.1611 0.1611 0.3498 0.3498 0.3541 0.3541 2.7499 2.7499 2.7519 2.7519 3.1426 3.1426 3.1465 3.1465 3.5248 3.5248 3.5268 3.5268 4.7906 4.7906 4.7930 4.7930 k = 0.5000 0.0156 0.3612 ( 8634 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9094 -15.9094 -15.6699 -15.6699 -15.6698 -15.6698 -12.8007 -12.8007 -12.8006 -12.8006 -12.6903 -12.6903 -12.6903 -12.6903 -3.3136 -3.3136 -3.3116 -3.3116 -3.0606 -3.0606 -3.0556 -3.0556 -2.7147 -2.7147 -2.7110 -2.7110 -2.5064 -2.5064 -2.5049 -2.5049 -2.2953 -2.2953 -2.2931 -2.2931 -2.0288 -2.0288 -2.0240 -2.0240 -1.5318 -1.5318 -1.5227 -1.5227 -1.0021 -1.0021 -0.9890 -0.9890 -0.4439 -0.4439 -0.4410 -0.4410 -0.0362 -0.0362 -0.0332 -0.0332 0.1521 0.1521 0.1600 0.1600 0.3501 0.3501 0.3543 0.3543 2.7508 2.7508 2.7523 2.7523 3.1422 3.1422 3.1461 3.1461 3.5246 3.5246 3.5264 3.5264 4.7920 4.7920 4.7943 4.7943 k = 0.5000-0.0000 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9094 -15.9094 -15.6699 -15.6699 -15.6698 -15.6698 -12.8006 -12.8006 -12.8006 -12.8006 -12.6903 -12.6903 -12.6903 -12.6903 -3.3137 -3.3137 -3.3116 -3.3116 -3.0603 -3.0603 -3.0553 -3.0553 -2.7146 -2.7146 -2.7110 -2.7110 -2.5063 -2.5063 -2.5051 -2.5051 -2.2950 -2.2950 -2.2929 -2.2929 -2.0292 -2.0292 -2.0245 -2.0245 -1.5318 -1.5318 -1.5227 -1.5227 -1.0027 -1.0027 -0.9897 -0.9897 -0.4441 -0.4441 -0.4412 -0.4412 -0.0347 -0.0347 -0.0333 -0.0333 0.1521 0.1521 0.1596 0.1596 0.3502 0.3502 0.3544 0.3544 2.7511 2.7511 2.7525 2.7525 3.1421 3.1421 3.1460 3.1460 3.5246 3.5246 3.5263 3.5263 4.7924 4.7924 4.7948 4.7948 k = 0.5000-0.0000 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9094 -15.9094 -15.6699 -15.6699 -15.6698 -15.6698 -12.8006 -12.8006 -12.8006 -12.8006 -12.6903 -12.6903 -12.6903 -12.6903 -3.3137 -3.3137 -3.3116 -3.3116 -3.0603 -3.0603 -3.0553 -3.0553 -2.7146 -2.7146 -2.7110 -2.7110 -2.5063 -2.5063 -2.5051 -2.5051 -2.2950 -2.2950 -2.2929 -2.2929 -2.0292 -2.0292 -2.0245 -2.0245 -1.5318 -1.5318 -1.5227 -1.5227 -1.0027 -1.0027 -0.9897 -0.9897 -0.4441 -0.4441 -0.4412 -0.4412 -0.0347 -0.0347 -0.0333 -0.0333 0.1521 0.1521 0.1596 0.1596 0.3502 0.3502 0.3544 0.3544 2.7511 2.7511 2.7525 2.7525 3.1421 3.1421 3.1460 3.1460 3.5246 3.5246 3.5263 3.5263 4.7924 4.7924 4.7948 4.7948 k = 0.5000-0.0000 0.3455 ( 8624 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9094 -15.9094 -15.6699 -15.6699 -15.6698 -15.6698 -12.8010 -12.8010 -12.8009 -12.8009 -12.6900 -12.6900 -12.6899 -12.6899 -3.3135 -3.3135 -3.3114 -3.3114 -3.0602 -3.0602 -3.0553 -3.0553 -2.7151 -2.7151 -2.7114 -2.7114 -2.5061 -2.5061 -2.5047 -2.5047 -2.2955 -2.2955 -2.2933 -2.2933 -2.0302 -2.0302 -2.0254 -2.0254 -1.5309 -1.5309 -1.5217 -1.5217 -1.0025 -1.0025 -0.9893 -0.9893 -0.4446 -0.4446 -0.4414 -0.4414 -0.0348 -0.0348 -0.0328 -0.0328 0.1521 0.1521 0.1597 0.1597 0.3502 0.3502 0.3545 0.3545 2.7510 2.7510 2.7525 2.7525 3.1423 3.1423 3.1462 3.1462 3.5253 3.5253 3.5270 3.5270 4.7921 4.7921 4.7945 4.7945 k = 0.5000-0.0000 0.3298 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9095 -15.9095 -15.6698 -15.6698 -15.6697 -15.6697 -12.8020 -12.8020 -12.8019 -12.8019 -12.6889 -12.6889 -12.6888 -12.6888 -3.3130 -3.3130 -3.3110 -3.3110 -3.0601 -3.0601 -3.0551 -3.0551 -2.7165 -2.7165 -2.7126 -2.7126 -2.5053 -2.5053 -2.5036 -2.5036 -2.2968 -2.2968 -2.2945 -2.2945 -2.0330 -2.0330 -2.0281 -2.0281 -1.5281 -1.5281 -1.5187 -1.5187 -1.0017 -1.0017 -0.9884 -0.9884 -0.4460 -0.4460 -0.4420 -0.4420 -0.0348 -0.0348 -0.0315 -0.0315 0.1521 0.1521 0.1600 0.1600 0.3504 0.3504 0.3549 0.3549 2.7508 2.7508 2.7526 2.7526 3.1429 3.1429 3.1467 3.1467 3.5273 3.5273 3.5292 3.5292 4.7914 4.7914 4.7938 4.7938 k = 0.5000-0.0000 0.3141 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9098 -15.9098 -15.9095 -15.9095 -15.6698 -15.6698 -15.6697 -15.6697 -12.8037 -12.8037 -12.8036 -12.8036 -12.6871 -12.6871 -12.6870 -12.6870 -3.3122 -3.3122 -3.3102 -3.3102 -3.0599 -3.0599 -3.0548 -3.0548 -2.7188 -2.7188 -2.7145 -2.7145 -2.5039 -2.5039 -2.5018 -2.5018 -2.2989 -2.2989 -2.2965 -2.2965 -2.0375 -2.0375 -2.0325 -2.0325 -1.5234 -1.5234 -1.5138 -1.5138 -1.0004 -1.0004 -0.9868 -0.9868 -0.4482 -0.4482 -0.4432 -0.4432 -0.0344 -0.0344 -0.0298 -0.0298 0.1521 0.1521 0.1606 0.1606 0.3507 0.3507 0.3554 0.3554 2.7506 2.7506 2.7526 2.7526 3.1438 3.1438 3.1476 3.1476 3.5308 3.5308 3.5328 3.5328 4.7900 4.7900 4.7925 4.7925 k = 0.5000-0.0000 0.2984 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9099 -15.9099 -15.9096 -15.9096 -15.6697 -15.6697 -15.6696 -15.6696 -12.8060 -12.8060 -12.8058 -12.8058 -12.6848 -12.6848 -12.6846 -12.6846 -3.3111 -3.3111 -3.3091 -3.3091 -3.0595 -3.0595 -3.0545 -3.0545 -2.7219 -2.7219 -2.7173 -2.7173 -2.5020 -2.5020 -2.4996 -2.4996 -2.3018 -2.3018 -2.2992 -2.2992 -2.0436 -2.0436 -2.0385 -2.0385 -1.5172 -1.5172 -1.5072 -1.5072 -0.9985 -0.9985 -0.9847 -0.9847 -0.4511 -0.4511 -0.4450 -0.4450 -0.0336 -0.0336 -0.0278 -0.0278 0.1521 0.1521 0.1612 0.1612 0.3512 0.3512 0.3562 0.3562 2.7502 2.7502 2.7527 2.7527 3.1450 3.1450 3.1488 3.1488 3.5355 3.5355 3.5377 3.5377 4.7882 4.7882 4.7907 4.7907 k = 0.5000-0.0000 0.2827 ( 8620 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9100 -15.9100 -15.9097 -15.9097 -15.6696 -15.6696 -15.6695 -15.6695 -12.8087 -12.8087 -12.8085 -12.8085 -12.6820 -12.6820 -12.6818 -12.6818 -3.3097 -3.3097 -3.3077 -3.3077 -3.0591 -3.0591 -3.0540 -3.0540 -2.7257 -2.7257 -2.7207 -2.7207 -2.4996 -2.4996 -2.4968 -2.4968 -2.3053 -2.3053 -2.3026 -2.3026 -2.0512 -2.0512 -2.0459 -2.0459 -1.5093 -1.5093 -1.4990 -1.4990 -0.9963 -0.9963 -0.9821 -0.9821 -0.4544 -0.4544 -0.4474 -0.4474 -0.0325 -0.0325 -0.0256 -0.0256 0.1523 0.1523 0.1620 0.1620 0.3518 0.3518 0.3571 0.3571 2.7499 2.7499 2.7527 2.7527 3.1465 3.1465 3.1503 3.1503 3.5415 3.5415 3.5439 3.5439 4.7859 4.7859 4.7884 4.7884 k = 0.5000-0.0000 0.2670 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9101 -15.9101 -15.9098 -15.9098 -15.6695 -15.6695 -15.6693 -15.6693 -12.8117 -12.8117 -12.8115 -12.8115 -12.6788 -12.6788 -12.6786 -12.6786 -3.3081 -3.3081 -3.3061 -3.3061 -3.0585 -3.0585 -3.0534 -3.0534 -2.7302 -2.7302 -2.7249 -2.7249 -2.4968 -2.4968 -2.4937 -2.4937 -2.3093 -2.3093 -2.3064 -2.3064 -2.0600 -2.0600 -2.0545 -2.0545 -1.5002 -1.5002 -1.4895 -1.4895 -0.9936 -0.9936 -0.9791 -0.9791 -0.4583 -0.4583 -0.4504 -0.4504 -0.0311 -0.0311 -0.0233 -0.0233 0.1525 0.1525 0.1629 0.1629 0.3527 0.3527 0.3583 0.3583 2.7496 2.7496 2.7527 2.7527 3.1483 3.1483 3.1520 3.1520 3.5488 3.5488 3.5513 3.5513 4.7832 4.7832 4.7857 4.7857 k = 0.5000-0.0000 0.2513 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9103 -15.9103 -15.9099 -15.9099 -15.6694 -15.6694 -15.6692 -15.6692 -12.8149 -12.8149 -12.8147 -12.8147 -12.6754 -12.6754 -12.6751 -12.6751 -3.3062 -3.3062 -3.3042 -3.3042 -3.0578 -3.0578 -3.0527 -3.0527 -2.7352 -2.7352 -2.7296 -2.7296 -2.4936 -2.4936 -2.4903 -2.4903 -2.3138 -2.3138 -2.3106 -2.3106 -2.0699 -2.0699 -2.0642 -2.0642 -1.4900 -1.4900 -1.4789 -1.4789 -0.9906 -0.9906 -0.9757 -0.9757 -0.4626 -0.4626 -0.4539 -0.4539 -0.0295 -0.0295 -0.0209 -0.0209 0.1530 0.1530 0.1638 0.1638 0.3537 0.3537 0.3596 0.3596 2.7492 2.7492 2.7526 2.7526 3.1503 3.1503 3.1540 3.1540 3.5571 3.5571 3.5598 3.5598 4.7800 4.7800 4.7825 4.7825 k = 0.5000-0.0000 0.2356 ( 8606 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9104 -15.9104 -15.9101 -15.9101 -15.6693 -15.6693 -15.6690 -15.6690 -12.8184 -12.8184 -12.8181 -12.8181 -12.6717 -12.6717 -12.6715 -12.6715 -3.3040 -3.3040 -3.3021 -3.3021 -3.0570 -3.0570 -3.0519 -3.0519 -2.7407 -2.7407 -2.7349 -2.7349 -2.4903 -2.4903 -2.4867 -2.4867 -2.3184 -2.3184 -2.3151 -2.3151 -2.0806 -2.0806 -2.0747 -2.0747 -1.4788 -1.4788 -1.4674 -1.4674 -0.9873 -0.9873 -0.9722 -0.9722 -0.4671 -0.4671 -0.4578 -0.4578 -0.0279 -0.0279 -0.0186 -0.0186 0.1536 0.1536 0.1647 0.1647 0.3549 0.3549 0.3610 0.3610 2.7489 2.7489 2.7525 2.7525 3.1526 3.1526 3.1561 3.1561 3.5664 3.5664 3.5692 3.5692 4.7765 4.7765 4.7790 4.7790 k = 0.5000-0.0000 0.2199 ( 8614 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9106 -15.9106 -15.9102 -15.9102 -15.6691 -15.6691 -15.6688 -15.6688 -12.8218 -12.8218 -12.8216 -12.8216 -12.6680 -12.6680 -12.6678 -12.6678 -3.3017 -3.3017 -3.2999 -3.2999 -3.0560 -3.0560 -3.0509 -3.0509 -2.7466 -2.7466 -2.7407 -2.7407 -2.4868 -2.4868 -2.4831 -2.4831 -2.3232 -2.3232 -2.3196 -2.3196 -2.0920 -2.0920 -2.0859 -2.0859 -1.4670 -1.4670 -1.4554 -1.4554 -0.9838 -0.9838 -0.9685 -0.9685 -0.4718 -0.4718 -0.4621 -0.4621 -0.0262 -0.0262 -0.0165 -0.0165 0.1544 0.1544 0.1656 0.1656 0.3564 0.3564 0.3626 0.3626 2.7486 2.7486 2.7523 2.7523 3.1549 3.1549 3.1584 3.1584 3.5766 3.5766 3.5795 3.5795 4.7726 4.7726 4.7751 4.7751 k = 0.5000-0.0000 0.2042 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9107 -15.9107 -15.9104 -15.9104 -15.6689 -15.6689 -15.6686 -15.6686 -12.8253 -12.8253 -12.8251 -12.8251 -12.6643 -12.6643 -12.6640 -12.6640 -3.2993 -3.2993 -3.2975 -3.2975 -3.0549 -3.0549 -3.0497 -3.0497 -2.7529 -2.7529 -2.7469 -2.7469 -2.4834 -2.4834 -2.4795 -2.4795 -2.3278 -2.3278 -2.3241 -2.3241 -2.1037 -2.1037 -2.0974 -2.0974 -1.4547 -1.4547 -1.4429 -1.4429 -0.9802 -0.9802 -0.9648 -0.9648 -0.4767 -0.4767 -0.4667 -0.4667 -0.0246 -0.0246 -0.0146 -0.0146 0.1553 0.1553 0.1665 0.1665 0.3580 0.3580 0.3643 0.3643 2.7483 2.7483 2.7521 2.7521 3.1574 3.1574 3.1608 3.1608 3.5875 3.5875 3.5904 3.5904 4.7685 4.7685 4.7710 4.7710 k = 0.5000-0.0000 0.1885 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9109 -15.9109 -15.9106 -15.9106 -15.6688 -15.6688 -15.6685 -15.6685 -12.8287 -12.8287 -12.8285 -12.8285 -12.6606 -12.6606 -12.6603 -12.6603 -3.2967 -3.2967 -3.2950 -3.2950 -3.0536 -3.0536 -3.0485 -3.0485 -2.7593 -2.7593 -2.7533 -2.7533 -2.4800 -2.4800 -2.4761 -2.4761 -2.3321 -2.3321 -2.3282 -2.3282 -2.1157 -2.1157 -2.1093 -2.1093 -1.4421 -1.4421 -1.4303 -1.4303 -0.9764 -0.9764 -0.9611 -0.9611 -0.4815 -0.4815 -0.4714 -0.4714 -0.0231 -0.0231 -0.0129 -0.0129 0.1565 0.1565 0.1674 0.1674 0.3598 0.3598 0.3660 0.3660 2.7480 2.7480 2.7518 2.7518 3.1599 3.1599 3.1632 3.1632 3.5989 3.5989 3.6018 3.6018 4.7642 4.7642 4.7666 4.7666 k = 0.5000-0.0000 0.1728 ( 8596 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9111 -15.9111 -15.9107 -15.9107 -15.6686 -15.6686 -15.6683 -15.6683 -12.8320 -12.8320 -12.8318 -12.8318 -12.6570 -12.6570 -12.6568 -12.6568 -3.2941 -3.2941 -3.2924 -3.2924 -3.0522 -3.0522 -3.0471 -3.0471 -2.7659 -2.7659 -2.7600 -2.7600 -2.4770 -2.4770 -2.4729 -2.4729 -2.3359 -2.3359 -2.3318 -2.3318 -2.1278 -2.1278 -2.1212 -2.1212 -1.4295 -1.4295 -1.4178 -1.4178 -0.9727 -0.9727 -0.9576 -0.9576 -0.4864 -0.4864 -0.4763 -0.4763 -0.0219 -0.0219 -0.0116 -0.0116 0.1578 0.1578 0.1683 0.1683 0.3618 0.3618 0.3679 0.3679 2.7477 2.7477 2.7515 2.7515 3.1624 3.1624 3.1655 3.1655 3.6105 3.6105 3.6134 3.6134 4.7598 4.7598 4.7622 4.7622 k = 0.5000-0.0000 0.1571 ( 8596 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9113 -15.9113 -15.9109 -15.9109 -15.6684 -15.6684 -15.6681 -15.6681 -12.8352 -12.8352 -12.8350 -12.8350 -12.6536 -12.6536 -12.6533 -12.6533 -3.2915 -3.2915 -3.2899 -3.2899 -3.0507 -3.0507 -3.0456 -3.0456 -2.7725 -2.7725 -2.7667 -2.7667 -2.4743 -2.4743 -2.4702 -2.4702 -2.3391 -2.3391 -2.3347 -2.3347 -2.1398 -2.1398 -2.1330 -2.1330 -1.4171 -1.4171 -1.4055 -1.4055 -0.9690 -0.9690 -0.9543 -0.9543 -0.4910 -0.4910 -0.4811 -0.4811 -0.0208 -0.0208 -0.0105 -0.0105 0.1592 0.1592 0.1692 0.1692 0.3638 0.3638 0.3698 0.3698 2.7475 2.7475 2.7512 2.7512 3.1650 3.1650 3.1679 3.1679 3.6223 3.6223 3.6251 3.6251 4.7552 4.7552 4.7576 4.7576 k = 0.5000-0.0000 0.1414 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9115 -15.9115 -15.9111 -15.9111 -15.6683 -15.6683 -15.6679 -15.6679 -12.8381 -12.8381 -12.8379 -12.8379 -12.6503 -12.6503 -12.6501 -12.6501 -3.2889 -3.2889 -3.2874 -3.2874 -3.0490 -3.0490 -3.0440 -3.0440 -2.7790 -2.7790 -2.7735 -2.7735 -2.4721 -2.4721 -2.4679 -2.4679 -2.3414 -2.3414 -2.3369 -2.3369 -2.1516 -2.1516 -2.1447 -2.1447 -1.4051 -1.4051 -1.3937 -1.3937 -0.9655 -0.9655 -0.9513 -0.9513 -0.4954 -0.4954 -0.4859 -0.4859 -0.0201 -0.0201 -0.0097 -0.0097 0.1607 0.1607 0.1700 0.1700 0.3659 0.3659 0.3716 0.3716 2.7473 2.7473 2.7508 2.7508 3.1674 3.1674 3.1701 3.1701 3.6340 3.6340 3.6367 3.6367 4.7508 4.7508 4.7530 4.7530 k = 0.5000-0.0000 0.1257 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9116 -15.9116 -15.9112 -15.9112 -15.6681 -15.6681 -15.6677 -15.6677 -12.8408 -12.8408 -12.8407 -12.8407 -12.6474 -12.6474 -12.6472 -12.6472 -3.2864 -3.2864 -3.2850 -3.2850 -3.0473 -3.0473 -3.0423 -3.0423 -2.7853 -2.7853 -2.7801 -2.7801 -2.4704 -2.4704 -2.4662 -2.4662 -2.3429 -2.3429 -2.3382 -2.3382 -2.1629 -2.1629 -2.1559 -2.1559 -1.3936 -1.3936 -1.3826 -1.3826 -0.9620 -0.9620 -0.9486 -0.9486 -0.4995 -0.4995 -0.4904 -0.4904 -0.0195 -0.0195 -0.0092 -0.0092 0.1622 0.1622 0.1708 0.1708 0.3679 0.3679 0.3735 0.3735 2.7472 2.7472 2.7505 2.7505 3.1697 3.1697 3.1723 3.1723 3.6452 3.6452 3.6478 3.6478 4.7464 4.7464 4.7486 4.7486 k = 0.5000-0.0000 0.1099 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9118 -15.9118 -15.9114 -15.9114 -15.6680 -15.6680 -15.6676 -15.6676 -12.8433 -12.8433 -12.8431 -12.8431 -12.6447 -12.6447 -12.6445 -12.6445 -3.2841 -3.2841 -3.2827 -3.2827 -3.0455 -3.0455 -3.0406 -3.0406 -2.7913 -2.7913 -2.7865 -2.7865 -2.4692 -2.4692 -2.4649 -2.4649 -2.3434 -2.3434 -2.3387 -2.3387 -2.1737 -2.1737 -2.1666 -2.1666 -1.3829 -1.3829 -1.3723 -1.3723 -0.9588 -0.9588 -0.9464 -0.9464 -0.5033 -0.5033 -0.4947 -0.4947 -0.0192 -0.0192 -0.0089 -0.0089 0.1637 0.1637 0.1715 0.1715 0.3699 0.3699 0.3752 0.3752 2.7471 2.7471 2.7501 2.7501 3.1718 3.1718 3.1742 3.1742 3.6559 3.6559 3.6584 3.6584 4.7423 4.7423 4.7444 4.7444 k = 0.5000-0.0000 0.0942 ( 8608 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9119 -15.9119 -15.9115 -15.9115 -15.6678 -15.6678 -15.6674 -15.6674 -12.8455 -12.8455 -12.8453 -12.8453 -12.6423 -12.6423 -12.6421 -12.6421 -3.2819 -3.2819 -3.2806 -3.2806 -3.0437 -3.0437 -3.0390 -3.0390 -2.7968 -2.7968 -2.7925 -2.7925 -2.4685 -2.4685 -2.4642 -2.4642 -2.3431 -2.3431 -2.3384 -2.3384 -2.1837 -2.1837 -2.1767 -2.1767 -1.3732 -1.3732 -1.3631 -1.3631 -0.9559 -0.9559 -0.9445 -0.9445 -0.5066 -0.5066 -0.4987 -0.4987 -0.0191 -0.0191 -0.0088 -0.0088 0.1651 0.1651 0.1721 0.1721 0.3718 0.3718 0.3769 0.3769 2.7470 2.7470 2.7497 2.7497 3.1738 3.1738 3.1760 3.1760 3.6658 3.6658 3.6681 3.6681 4.7385 4.7385 4.7405 4.7405 k = 0.5000-0.0000 0.0785 ( 8612 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9120 -15.9120 -15.9116 -15.9116 -15.6677 -15.6677 -15.6673 -15.6673 -12.8473 -12.8473 -12.8472 -12.8472 -12.6402 -12.6402 -12.6401 -12.6401 -3.2800 -3.2800 -3.2788 -3.2788 -3.0419 -3.0419 -3.0374 -3.0374 -2.8017 -2.8017 -2.7979 -2.7979 -2.4682 -2.4682 -2.4638 -2.4638 -2.3420 -2.3420 -2.3376 -2.3376 -2.1927 -2.1927 -2.1858 -2.1858 -1.3645 -1.3645 -1.3550 -1.3550 -0.9532 -0.9532 -0.9431 -0.9431 -0.5093 -0.5093 -0.5023 -0.5023 -0.0191 -0.0191 -0.0088 -0.0088 0.1665 0.1665 0.1727 0.1727 0.3734 0.3734 0.3783 0.3783 2.7470 2.7470 2.7494 2.7494 3.1755 3.1755 3.1775 3.1775 3.6745 3.6745 3.6767 3.6767 4.7351 4.7351 4.7369 4.7369 k = 0.5000-0.0000 0.0628 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9121 -15.9121 -15.9117 -15.9117 -15.6676 -15.6676 -15.6672 -15.6672 -12.8489 -12.8489 -12.8488 -12.8488 -12.6385 -12.6385 -12.6384 -12.6384 -3.2783 -3.2783 -3.2773 -3.2773 -3.0404 -3.0404 -3.0361 -3.0361 -2.8059 -2.8059 -2.8027 -2.8027 -2.4682 -2.4682 -2.4637 -2.4637 -2.3404 -2.3404 -2.3364 -2.3364 -2.2006 -2.2006 -2.1939 -2.1939 -1.3572 -1.3572 -1.3483 -1.3483 -0.9508 -0.9508 -0.9421 -0.9421 -0.5116 -0.5116 -0.5054 -0.5054 -0.0192 -0.0192 -0.0089 -0.0089 0.1676 0.1676 0.1732 0.1732 0.3749 0.3749 0.3796 0.3796 2.7470 2.7470 2.7490 2.7490 3.1769 3.1769 3.1788 3.1788 3.6820 3.6820 3.6841 3.6841 4.7322 4.7322 4.7339 4.7339 k = 0.5000-0.0000 0.0471 ( 8610 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5860 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9122 -15.9122 -15.9118 -15.9118 -15.6675 -15.6675 -15.6671 -15.6671 -12.8501 -12.8501 -12.8500 -12.8500 -12.6371 -12.6371 -12.6370 -12.6370 -3.2770 -3.2770 -3.2760 -3.2760 -3.0390 -3.0390 -3.0349 -3.0349 -2.8091 -2.8091 -2.8067 -2.8067 -2.4684 -2.4684 -2.4638 -2.4638 -2.3385 -2.3385 -2.3351 -2.3351 -2.2070 -2.2070 -2.2006 -2.2006 -1.3513 -1.3513 -1.3429 -1.3429 -0.9487 -0.9487 -0.9416 -0.9416 -0.5133 -0.5133 -0.5079 -0.5079 -0.0194 -0.0194 -0.0090 -0.0090 0.1686 0.1686 0.1735 0.1735 0.3760 0.3760 0.3806 0.3806 2.7471 2.7471 2.7487 2.7487 3.1781 3.1781 3.1798 3.1798 3.6881 3.6881 3.6900 3.6900 4.7299 4.7299 4.7314 4.7314 k = 0.5000-0.0000 0.0314 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9123 -15.9123 -15.9118 -15.9118 -15.6675 -15.6675 -15.6670 -15.6670 -12.8510 -12.8510 -12.8509 -12.8509 -12.6361 -12.6361 -12.6361 -12.6361 -3.2760 -3.2760 -3.2752 -3.2752 -3.0380 -3.0380 -3.0340 -3.0340 -2.8115 -2.8115 -2.8098 -2.8098 -2.4686 -2.4686 -2.4640 -2.4640 -2.3366 -2.3366 -2.3342 -2.3342 -2.2118 -2.2118 -2.2057 -2.2057 -1.3469 -1.3469 -1.3390 -1.3390 -0.9471 -0.9471 -0.9414 -0.9414 -0.5145 -0.5145 -0.5098 -0.5098 -0.0195 -0.0195 -0.0091 -0.0091 0.1693 0.1693 0.1738 0.1738 0.3769 0.3769 0.3814 0.3814 2.7472 2.7472 2.7484 2.7484 3.1790 3.1790 3.1805 3.1805 3.6925 3.6925 3.6943 3.6943 4.7281 4.7281 4.7296 4.7296 k = 0.5000-0.0000 0.0157 ( 8604 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9123 -15.9123 -15.9119 -15.9119 -15.6674 -15.6674 -15.6670 -15.6670 -12.8515 -12.8515 -12.8514 -12.8514 -12.6355 -12.6355 -12.6355 -12.6355 -3.2754 -3.2754 -3.2746 -3.2746 -3.0373 -3.0373 -3.0335 -3.0335 -2.8127 -2.8127 -2.8119 -2.8119 -2.4688 -2.4688 -2.4641 -2.4641 -2.3351 -2.3351 -2.3337 -2.3337 -2.2147 -2.2147 -2.2090 -2.2090 -1.3443 -1.3443 -1.3367 -1.3367 -0.9460 -0.9460 -0.9414 -0.9414 -0.5152 -0.5152 -0.5110 -0.5110 -0.0196 -0.0196 -0.0092 -0.0092 0.1697 0.1697 0.1739 0.1739 0.3774 0.3774 0.3818 0.3818 2.7473 2.7473 2.7482 2.7482 3.1795 3.1795 3.1810 3.1810 3.6952 3.6952 3.6970 3.6970 4.7271 4.7271 4.7284 4.7284 k = 0.5000-0.0000-0.0000 ( 8600 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9123 -15.9123 -15.9119 -15.9119 -15.6674 -15.6674 -15.6670 -15.6670 -12.8517 -12.8517 -12.8516 -12.8516 -12.6353 -12.6353 -12.6353 -12.6353 -3.2752 -3.2752 -3.2744 -3.2744 -3.0371 -3.0371 -3.0333 -3.0333 -2.8129 -2.8129 -2.8128 -2.8128 -2.4688 -2.4688 -2.4642 -2.4642 -2.3344 -2.3344 -2.3337 -2.3337 -2.2157 -2.2157 -2.2101 -2.2101 -1.3434 -1.3434 -1.3359 -1.3359 -0.9455 -0.9455 -0.9414 -0.9414 -0.5154 -0.5154 -0.5114 -0.5114 -0.0196 -0.0196 -0.0093 -0.0093 0.1699 0.1699 0.1740 0.1740 0.3776 0.3776 0.3820 0.3820 2.7473 2.7473 2.7481 2.7481 3.1796 3.1796 3.1811 3.1811 3.6961 3.6961 3.6979 3.6979 4.7267 4.7267 4.7281 4.7281 k = 0.0000 0.0000 0.3612 ( 8620 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0165 -16.0165 -15.9626 -15.9626 -15.6393 -15.6393 -15.5957 -15.5957 -12.8581 -12.8581 -12.7883 -12.7883 -12.7294 -12.7294 -12.6016 -12.6016 -3.0209 -3.0209 -3.0169 -3.0169 -2.7967 -2.7967 -2.7793 -2.7793 -2.5958 -2.5958 -2.5855 -2.5855 -2.5084 -2.5084 -2.4768 -2.4768 -2.3248 -2.3248 -2.3106 -2.3106 -1.8863 -1.8863 -1.8198 -1.8198 -1.7253 -1.7253 -1.4709 -1.4709 -1.0991 -1.0991 -1.0120 -1.0120 -0.8540 -0.8540 -0.5112 -0.5112 -0.3013 -0.3013 -0.2003 -0.2003 -0.0721 -0.0721 0.1550 0.1550 0.1760 0.1760 0.2608 0.2608 2.7272 2.7272 2.7741 2.7741 3.1910 3.1910 3.3148 3.3148 3.4690 3.4690 3.5376 3.5376 4.8035 4.8035 4.8388 4.8388 k = 0.0156-0.0000 0.3612 ( 8618 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0164 -16.0163 -15.9625 -15.9625 -15.6394 -15.6394 -15.5959 -15.5958 -12.8581 -12.8581 -12.7882 -12.7882 -12.7294 -12.7294 -12.6017 -12.6017 -3.0212 -3.0210 -3.0173 -3.0170 -2.7980 -2.7979 -2.7815 -2.7807 -2.5966 -2.5965 -2.5855 -2.5854 -2.5088 -2.5085 -2.4769 -2.4769 -2.3244 -2.3243 -2.3103 -2.3099 -1.8872 -1.8869 -1.8203 -1.8202 -1.7256 -1.7251 -1.4714 -1.4708 -1.0973 -1.0972 -1.0122 -1.0106 -0.8545 -0.8529 -0.5123 -0.5117 -0.3002 -0.2997 -0.2000 -0.1991 -0.0721 -0.0715 0.1550 0.1554 0.1760 0.1763 0.2610 0.2611 2.7272 2.7273 2.7738 2.7742 3.1908 3.1909 3.3141 3.3144 3.4692 3.4695 3.5373 3.5377 4.8034 4.8036 4.8388 4.8390 k = 0.0312-0.0000 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0158 -16.0158 -15.9620 -15.9620 -15.6397 -15.6397 -15.5962 -15.5961 -12.8579 -12.8579 -12.7879 -12.7879 -12.7296 -12.7296 -12.6020 -12.6020 -3.0219 -3.0216 -3.0180 -3.0175 -2.8020 -2.8017 -2.7872 -2.7857 -2.5988 -2.5986 -2.5852 -2.5852 -2.5098 -2.5092 -2.4771 -2.4770 -2.3231 -2.3229 -2.3092 -2.3084 -1.8894 -1.8888 -1.8216 -1.8214 -1.7259 -1.7251 -1.4723 -1.4712 -1.0919 -1.0918 -1.0113 -1.0083 -0.8545 -0.8514 -0.5148 -0.5136 -0.2966 -0.2956 -0.1980 -0.1962 -0.0715 -0.0702 0.1555 0.1564 0.1762 0.1768 0.2616 0.2617 2.7274 2.7275 2.7734 2.7741 3.1904 3.1906 3.3124 3.3130 3.4700 3.4706 3.5368 3.5376 4.8034 4.8037 4.8390 4.8394 k = 0.0469-0.0000 0.3612 ( 8636 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0150 -16.0149 -15.9613 -15.9612 -15.6402 -15.6401 -15.5967 -15.5966 -12.8576 -12.8575 -12.7874 -12.7874 -12.7300 -12.7300 -12.6026 -12.6026 -3.0230 -3.0225 -3.0192 -3.0185 -2.8085 -2.8080 -2.7962 -2.7940 -2.6022 -2.6019 -2.5850 -2.5849 -2.5113 -2.5103 -2.4774 -2.4774 -2.3210 -2.3208 -2.3072 -2.3061 -1.8929 -1.8922 -1.8237 -1.8234 -1.7261 -1.7249 -1.4735 -1.4719 -1.0833 -1.0831 -1.0095 -1.0053 -0.8534 -0.8490 -0.5187 -0.5169 -0.2905 -0.2890 -0.1946 -0.1918 -0.0703 -0.0683 0.1565 0.1578 0.1767 0.1775 0.2626 0.2628 2.7277 2.7278 2.7728 2.7738 3.1897 3.1902 3.3096 3.3105 3.4715 3.4724 3.5362 3.5373 4.8033 4.8038 4.8395 4.8401 k = 0.0625-0.0000 0.3612 ( 8632 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0137 -16.0136 -15.9602 -15.9601 -15.6409 -15.6408 -15.5975 -15.5974 -12.8571 -12.8571 -12.7867 -12.7867 -12.7305 -12.7305 -12.6033 -12.6033 -3.0246 -3.0238 -3.0208 -3.0198 -2.8175 -2.8169 -2.8080 -2.8053 -2.6065 -2.6062 -2.5851 -2.5849 -2.5130 -2.5117 -2.4778 -2.4778 -2.3183 -2.3180 -2.3046 -2.3032 -1.8978 -1.8970 -1.8266 -1.8263 -1.7260 -1.7246 -1.4749 -1.4729 -1.0719 -1.0715 -1.0071 -1.0021 -0.8507 -0.8453 -0.5239 -0.5215 -0.2822 -0.2802 -0.1897 -0.1860 -0.0685 -0.0657 0.1580 0.1597 0.1774 0.1785 0.2641 0.2642 2.7281 2.7283 2.7721 2.7733 3.1888 3.1894 3.3060 3.3071 3.4735 3.4746 3.5353 3.5368 4.8033 4.8039 4.8401 4.8409 k = 0.0781-0.0000 0.3612 ( 8636 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4503 -42.4502 -16.0122 -16.0120 -15.9589 -15.9588 -15.6417 -15.6416 -15.5984 -15.5983 -12.8565 -12.8565 -12.7858 -12.7858 -12.7311 -12.7311 -12.6043 -12.6043 -3.0266 -3.0256 -3.0228 -3.0216 -2.8292 -2.8284 -2.8220 -2.8190 -2.6116 -2.6112 -2.5857 -2.5853 -2.5149 -2.5133 -2.4784 -2.4784 -2.3151 -2.3147 -2.3016 -2.2999 -1.9039 -1.9031 -1.8303 -1.8300 -1.7253 -1.7239 -1.4764 -1.4741 -1.0586 -1.0578 -1.0041 -0.9992 -0.8457 -0.8397 -0.5301 -0.5272 -0.2719 -0.2695 -0.1835 -0.1790 -0.0660 -0.0626 0.1600 0.1620 0.1784 0.1796 0.2659 0.2661 2.7287 2.7289 2.7712 2.7728 3.1877 3.1885 3.3015 3.3029 3.4761 3.4774 3.5344 3.5362 4.8032 4.8040 4.8408 4.8418 k = 0.0938-0.0000 0.3612 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0103 -16.0101 -15.9573 -15.9571 -15.6428 -15.6426 -15.5996 -15.5994 -12.8558 -12.8557 -12.7848 -12.7847 -12.7318 -12.7318 -12.6054 -12.6054 -3.0292 -3.0279 -3.0253 -3.0239 -2.8435 -2.8430 -2.8371 -2.8344 -2.6172 -2.6167 -2.5869 -2.5863 -2.5166 -2.5148 -2.4792 -2.4791 -2.3117 -2.3112 -2.2983 -2.2963 -1.9111 -1.9104 -1.8348 -1.8346 -1.7239 -1.7226 -1.4777 -1.4753 -1.0452 -1.0434 -0.9999 -0.9961 -0.8378 -0.8317 -0.5372 -0.5340 -0.2600 -0.2572 -0.1763 -0.1710 -0.0629 -0.0588 0.1625 0.1648 0.1796 0.1809 0.2682 0.2684 2.7294 2.7297 2.7703 2.7720 3.1864 3.1873 3.2964 3.2979 3.4789 3.4804 3.5333 3.5354 4.8032 4.8041 4.8415 4.8427 k = 0.1094-0.0000 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5858 -42.5858 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0080 -16.0078 -15.9554 -15.9552 -15.6440 -15.6438 -15.6009 -15.6007 -12.8549 -12.8549 -12.7835 -12.7835 -12.7327 -12.7327 -12.6068 -12.6068 -3.0324 -3.0309 -3.0283 -3.0266 -2.8607 -2.8604 -2.8527 -2.8510 -2.6230 -2.6226 -2.5888 -2.5880 -2.5182 -2.5161 -2.4802 -2.4800 -2.3082 -2.3076 -2.2948 -2.2926 -1.9193 -1.9187 -1.8401 -1.8400 -1.7217 -1.7206 -1.4788 -1.4764 -1.0347 -1.0314 -0.9920 -0.9906 -0.8268 -0.8210 -0.5451 -0.5415 -0.2469 -0.2438 -0.1682 -0.1621 -0.0592 -0.0544 0.1655 0.1679 0.1812 0.1824 0.2708 0.2711 2.7302 2.7305 2.7692 2.7712 3.1848 3.1859 3.2906 3.2923 3.4821 3.4837 3.5321 3.5346 4.8030 4.8041 4.8421 4.8435 k = 0.1250-0.0000 0.3612 ( 8630 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0055 -16.0052 -15.9532 -15.9531 -15.6453 -15.6451 -15.6025 -15.6023 -12.8540 -12.8539 -12.7821 -12.7821 -12.7336 -12.7336 -12.6083 -12.6083 -3.0364 -3.0346 -3.0317 -3.0300 -2.8802 -2.8794 -2.8691 -2.8683 -2.6291 -2.6287 -2.5916 -2.5906 -2.5194 -2.5172 -2.4812 -2.4810 -2.3047 -2.3040 -2.2914 -2.2891 -1.9283 -1.9279 -1.8462 -1.8461 -1.7187 -1.7178 -1.4796 -1.4772 -1.0302 -1.0257 -0.9790 -0.9781 -0.8128 -0.8077 -0.5535 -0.5497 -0.2329 -0.2295 -0.1594 -0.1526 -0.0549 -0.0494 0.1691 0.1712 0.1833 0.1841 0.2739 0.2742 2.7312 2.7314 2.7681 2.7702 3.1829 3.1842 3.2843 3.2863 3.4855 3.4872 3.5309 3.5336 4.8028 4.8040 4.8426 4.8441 k = 0.1406-0.0000 0.3612 ( 8634 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -16.0027 -16.0024 -15.9509 -15.9507 -15.6469 -15.6466 -15.6042 -15.6040 -12.8529 -12.8528 -12.7806 -12.7805 -12.7347 -12.7346 -12.6101 -12.6101 -3.0412 -3.0392 -3.0356 -3.0341 -2.9008 -2.8997 -2.8864 -2.8863 -2.6351 -2.6348 -2.5951 -2.5939 -2.5203 -2.5181 -2.4823 -2.4821 -2.3015 -2.3007 -2.2882 -2.2857 -1.9378 -1.9377 -1.8530 -1.8529 -1.7147 -1.7142 -1.4800 -1.4779 -1.0308 -1.0265 -0.9617 -0.9595 -0.7961 -0.7918 -0.5621 -0.5583 -0.2183 -0.2146 -0.1501 -0.1426 -0.0499 -0.0438 0.1732 0.1745 0.1859 0.1860 0.2774 0.2777 2.7321 2.7323 2.7670 2.7692 3.1809 3.1824 3.2777 3.2798 3.4889 3.4907 3.5296 3.5326 4.8025 4.8038 4.8428 4.8445 k = 0.1562-0.0000 0.3612 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9995 -15.9992 -15.9483 -15.9481 -15.6485 -15.6482 -15.6062 -15.6059 -12.8516 -12.8516 -12.7790 -12.7789 -12.7358 -12.7357 -12.6120 -12.6120 -3.0472 -3.0450 -3.0403 -3.0390 -2.9217 -2.9207 -2.9047 -2.9039 -2.6412 -2.6410 -2.5994 -2.5980 -2.5209 -2.5186 -2.4835 -2.4833 -2.2985 -2.2976 -2.2852 -2.2826 -1.9478 -1.9476 -1.8605 -1.8602 -1.7099 -1.7099 -1.4800 -1.4782 -1.0343 -1.0308 -0.9415 -0.9385 -0.7774 -0.7738 -0.5708 -0.5669 -0.2034 -0.1996 -0.1406 -0.1324 -0.0442 -0.0375 0.1774 0.1776 0.1880 0.1897 0.2813 0.2815 2.7332 2.7333 2.7658 2.7682 3.1786 3.1803 3.2708 3.2729 3.4924 3.4943 3.5283 3.5315 4.8021 4.8035 4.8428 4.8446 k = 0.1719-0.0000 0.3612 ( 8624 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9961 -15.9958 -15.9455 -15.9453 -15.6502 -15.6499 -15.6083 -15.6080 -12.8503 -12.8502 -12.7772 -12.7771 -12.7369 -12.7368 -12.6142 -12.6142 -3.0545 -3.0521 -3.0461 -3.0452 -2.9424 -2.9416 -2.9230 -2.9215 -2.6472 -2.6471 -2.6044 -2.6027 -2.5212 -2.5189 -2.4848 -2.4845 -2.2958 -2.2948 -2.2826 -2.2800 -1.9581 -1.9575 -1.8685 -1.8680 -1.7048 -1.7044 -1.4796 -1.4782 -1.0394 -1.0370 -0.9204 -0.9168 -0.7569 -0.7541 -0.5790 -0.5754 -0.1885 -0.1846 -0.1309 -0.1222 -0.0377 -0.0306 0.1798 0.1821 0.1907 0.1946 0.2856 0.2857 2.7343 2.7344 2.7647 2.7671 3.1761 3.1780 3.2636 3.2659 3.4959 3.4978 3.5270 3.5304 4.8017 4.8031 4.8424 4.8444 k = 0.1875-0.0000 0.3612 ( 8624 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9925 -15.9921 -15.9426 -15.9424 -15.6521 -15.6518 -15.6106 -15.6103 -12.8488 -12.8487 -12.7755 -12.7754 -12.7380 -12.7379 -12.6165 -12.6165 -3.0634 -3.0608 -3.0533 -3.0531 -2.9619 -2.9617 -2.9407 -2.9384 -2.6532 -2.6531 -2.6098 -2.6080 -2.5212 -2.5189 -2.4860 -2.4858 -2.2935 -2.2924 -2.2803 -2.2777 -1.9683 -1.9674 -1.8771 -1.8763 -1.6991 -1.6981 -1.4788 -1.4779 -1.0453 -1.0440 -0.8997 -0.8953 -0.7354 -0.7333 -0.5865 -0.5832 -0.1739 -0.1700 -0.1214 -0.1122 -0.0305 -0.0231 0.1818 0.1859 0.1946 0.2004 0.2902 0.2903 2.7355 2.7355 2.7636 2.7659 3.1734 3.1756 3.2562 3.2587 3.4992 3.5012 3.5258 3.5293 4.8011 4.8026 4.8417 4.8437 k = 0.2031-0.0000 0.3612 ( 8624 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5524 -43.5524 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4502 -42.4502 -15.9886 -15.9882 -15.9395 -15.9393 -15.6541 -15.6537 -15.6131 -15.6127 -12.8472 -12.8472 -12.7737 -12.7736 -12.7390 -12.7390 -12.6190 -12.6190 -3.0742 -3.0714 -3.0634 -3.0628 -2.9799 -2.9793 -2.9570 -2.9540 -2.6591 -2.6590 -2.6157 -2.6137 -2.5210 -2.5188 -2.4872 -2.4870 -2.2917 -2.2905 -2.2785 -2.2759 -1.9782 -1.9770 -1.8860 -1.8849 -1.6927 -1.6913 -1.4777 -1.4774 -1.0516 -1.0512 -0.8802 -0.8749 -0.7132 -0.7116 -0.5925 -0.5899 -0.1598 -0.1560 -0.1121 -0.1026 -0.0224 -0.0149 0.1833 0.1887 0.2001 0.2070 0.2951 0.2951 2.7365 2.7367 2.7625 2.7648 3.1706 3.1729 3.2488 3.2513 3.5025 3.5045 3.5247 3.5283 4.8004 4.8020 4.8405 4.8427 k = 0.2188-0.0000 0.3612 ( 8634 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5858 -42.5858 -42.4503 -42.4503 -42.4503 -42.4503 -15.9845 -15.9841 -15.9364 -15.9361 -15.6561 -15.6557 -15.6157 -15.6153 -12.8456 -12.8455 -12.7721 -12.7720 -12.7399 -12.7398 -12.6217 -12.6217 -3.0871 -3.0842 -3.0765 -3.0749 -2.9954 -2.9940 -2.9717 -2.9681 -2.6650 -2.6646 -2.6219 -2.6197 -2.5207 -2.5186 -2.4885 -2.4883 -2.2902 -2.2889 -2.2772 -2.2746 -1.9876 -1.9861 -1.8951 -1.8937 -1.6859 -1.6838 -1.4767 -1.4764 -1.0585 -1.0577 -0.8630 -0.8566 -0.6909 -0.6897 -0.5965 -0.5947 -0.1463 -0.1427 -0.1032 -0.0936 -0.0135 -0.0061 0.1846 0.1906 0.2069 0.2144 0.3002 0.3003 2.7376 2.7379 2.7614 2.7637 3.1676 3.1702 3.2413 3.2439 3.5056 3.5076 3.5236 3.5273 4.7996 4.8012 4.8390 4.8413 k = 0.2344-0.0000 0.3612 ( 8638 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5858 -42.4503 -42.4503 -42.4503 -42.4503 -15.9802 -15.9798 -15.9331 -15.9329 -15.6581 -15.6578 -15.6185 -15.6181 -12.8438 -12.8437 -12.7707 -12.7706 -12.7405 -12.7404 -12.6245 -12.6245 -3.1020 -3.0990 -3.0923 -3.0899 -3.0079 -3.0057 -2.9844 -2.9803 -2.6707 -2.6701 -2.6284 -2.6260 -2.5203 -2.5182 -2.4897 -2.4896 -2.2892 -2.2877 -2.2763 -2.2738 -1.9965 -1.9947 -1.9044 -1.9028 -1.6785 -1.6760 -1.4760 -1.4750 -1.0653 -1.0636 -0.8489 -0.8413 -0.6688 -0.6681 -0.5975 -0.5967 -0.1335 -0.1303 -0.0948 -0.0852 -0.0038 0.0032 0.1857 0.1921 0.2146 0.2224 0.3055 0.3057 2.7387 2.7391 2.7605 2.7626 3.1646 3.1673 3.2338 3.2365 3.5085 3.5105 3.5228 3.5264 4.7987 4.8004 4.8371 4.8394 k = 0.2500-0.0000 0.3612 ( 8636 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5858 -42.4503 -42.4503 -42.4503 -42.4502 -15.9758 -15.9754 -15.9299 -15.9297 -15.6602 -15.6599 -15.6214 -15.6210 -12.8418 -12.8417 -12.7696 -12.7695 -12.7407 -12.7406 -12.6275 -12.6275 -3.1185 -3.1157 -3.1103 -3.1073 -3.0176 -3.0148 -2.9952 -2.9908 -2.6763 -2.6755 -2.6350 -2.6325 -2.5197 -2.5177 -2.4908 -2.4908 -2.2885 -2.2870 -2.2759 -2.2734 -2.0048 -2.0027 -1.9138 -1.9118 -1.6708 -1.6677 -1.4753 -1.4736 -1.0715 -1.0688 -0.8388 -0.8298 -0.6477 -0.6473 -0.5949 -0.5946 -0.1216 -0.1189 -0.0870 -0.0775 0.0066 0.0129 0.1864 0.1932 0.2229 0.2308 0.3109 0.3113 2.7397 2.7403 2.7596 2.7616 3.1615 3.1644 3.2263 3.2292 3.5111 3.5132 3.5221 3.5256 4.7977 4.7995 4.8349 4.8373 k = 0.2656-0.0000 0.3612 ( 8648 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5524 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9712 -15.9708 -15.9267 -15.9264 -15.6623 -15.6619 -15.6244 -15.6240 -12.8398 -12.8397 -12.7690 -12.7689 -12.7403 -12.7403 -12.6307 -12.6307 -3.1362 -3.1337 -3.1296 -3.1262 -3.0252 -3.0219 -3.0044 -2.9997 -2.6816 -2.6806 -2.6417 -2.6390 -2.5191 -2.5172 -2.4920 -2.4919 -2.2882 -2.2866 -2.2759 -2.2735 -2.0122 -2.0099 -1.9232 -1.9209 -1.6628 -1.6591 -1.4748 -1.4723 -1.0768 -1.0732 -0.8331 -0.8228 -0.6281 -0.6280 -0.5885 -0.5873 -0.1106 -0.1084 -0.0796 -0.0705 0.0175 0.0231 0.1869 0.1940 0.2317 0.2397 0.3164 0.3169 2.7407 2.7414 2.7588 2.7606 3.1584 3.1615 3.2190 3.2219 3.5134 3.5157 3.5216 3.5249 4.7967 4.7985 4.8324 4.8348 k = 0.2812-0.0000 0.3612 ( 8648 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5524 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9665 -15.9661 -15.9235 -15.9233 -15.6643 -15.6640 -15.6276 -15.6272 -12.8377 -12.8376 -12.7690 -12.7689 -12.7394 -12.7394 -12.6340 -12.6340 -3.1546 -3.1523 -3.1493 -3.1457 -3.0313 -3.0277 -3.0121 -3.0073 -2.6867 -2.6854 -2.6484 -2.6456 -2.5185 -2.5166 -2.4932 -2.4930 -2.2882 -2.2865 -2.2763 -2.2739 -2.0189 -2.0163 -1.9325 -1.9299 -1.6544 -1.6502 -1.4745 -1.4713 -1.0811 -1.0766 -0.8319 -0.8205 -0.6108 -0.6101 -0.5772 -0.5754 -0.1005 -0.0989 -0.0729 -0.0643 0.0288 0.0334 0.1872 0.1946 0.2409 0.2489 0.3218 0.3226 2.7417 2.7425 2.7581 2.7597 3.1553 3.1586 3.2118 3.2148 3.5153 3.5178 3.5214 3.5243 4.7957 4.7975 4.8296 4.8321 k = 0.2969-0.0000 0.3612 ( 8648 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9618 -15.9613 -15.9204 -15.9202 -15.6663 -15.6659 -15.6308 -15.6304 -12.8355 -12.8354 -12.7695 -12.7694 -12.7378 -12.7378 -12.6374 -12.6374 -3.1733 -3.1712 -3.1689 -3.1652 -3.0364 -3.0326 -3.0189 -3.0140 -2.6915 -2.6900 -2.6551 -2.6521 -2.5177 -2.5160 -2.4943 -2.4940 -2.2885 -2.2866 -2.2770 -2.2747 -2.0248 -2.0219 -1.9416 -1.9387 -1.6459 -1.6412 -1.4746 -1.4707 -1.0843 -1.0788 -0.8347 -0.8224 -0.5949 -0.5935 -0.5622 -0.5602 -0.0913 -0.0904 -0.0667 -0.0586 0.0402 0.0438 0.1871 0.1948 0.2505 0.2583 0.3272 0.3281 2.7427 2.7436 2.7574 2.7589 3.1524 3.1558 3.2047 3.2078 3.5168 3.5197 3.5216 3.5240 4.7946 4.7965 4.8267 4.8292 k = 0.3125-0.0000 0.3612 ( 8646 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9570 -15.9565 -15.9175 -15.9173 -15.6681 -15.6678 -15.6341 -15.6337 -12.8332 -12.8331 -12.7706 -12.7705 -12.7357 -12.7357 -12.6410 -12.6410 -3.1917 -3.1898 -3.1880 -3.1843 -3.0407 -3.0368 -3.0248 -3.0198 -2.6960 -2.6942 -2.6616 -2.6585 -2.5170 -2.5153 -2.4954 -2.4950 -2.2890 -2.2871 -2.2781 -2.2758 -2.0297 -2.0267 -1.9506 -1.9474 -1.6371 -1.6319 -1.4752 -1.4705 -1.0862 -1.0798 -0.8410 -0.8281 -0.5794 -0.5773 -0.5456 -0.5436 -0.0830 -0.0827 -0.0609 -0.0536 0.0517 0.0542 0.1867 0.1946 0.2601 0.2679 0.3323 0.3335 2.7435 2.7446 2.7568 2.7580 3.1496 3.1531 3.1979 3.2011 3.5177 3.5212 3.5222 3.5239 4.7936 4.7956 4.8236 4.8261 k = 0.3281-0.0000 0.3612 ( 8646 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9522 -15.9517 -15.9147 -15.9146 -15.6698 -15.6695 -15.6375 -15.6371 -12.8308 -12.8307 -12.7721 -12.7720 -12.7331 -12.7331 -12.6447 -12.6447 -3.2096 -3.2078 -3.2063 -3.2027 -3.0445 -3.0405 -3.0300 -3.0250 -2.7001 -2.6981 -2.6680 -2.6648 -2.5161 -2.5145 -2.4965 -2.4960 -2.2897 -2.2877 -2.2794 -2.2772 -2.0339 -2.0306 -1.9592 -1.9558 -1.6283 -1.6225 -1.4764 -1.4709 -1.0868 -1.0795 -0.8499 -0.8366 -0.5637 -0.5613 -0.5288 -0.5269 -0.0758 -0.0755 -0.0557 -0.0491 0.0630 0.0644 0.1860 0.1941 0.2699 0.2774 0.3372 0.3386 2.7444 2.7456 2.7563 2.7573 3.1470 3.1506 3.1913 3.1946 3.5182 3.5221 3.5232 3.5243 4.7926 4.7946 4.8205 4.8230 k = 0.3438-0.0000 0.3612 ( 8644 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9474 -15.9469 -15.9123 -15.9121 -15.6713 -15.6710 -15.6409 -15.6405 -12.8284 -12.8283 -12.7740 -12.7739 -12.7301 -12.7301 -12.6485 -12.6484 -3.2265 -3.2248 -3.2235 -3.2201 -3.0479 -3.0437 -3.0348 -3.0297 -2.7038 -2.7016 -2.6741 -2.6708 -2.5153 -2.5137 -2.4975 -2.4969 -2.2905 -2.2884 -2.2810 -2.2788 -2.0371 -2.0336 -1.9676 -1.9639 -1.6193 -1.6131 -1.4782 -1.4721 -1.0858 -1.0778 -0.8608 -0.8472 -0.5481 -0.5453 -0.5128 -0.5108 -0.0695 -0.0688 -0.0510 -0.0452 0.0741 0.0744 0.1849 0.1933 0.2795 0.2868 0.3417 0.3434 2.7452 2.7465 2.7558 2.7566 3.1446 3.1483 3.1850 3.1883 3.5186 3.5224 3.5241 3.5251 4.7917 4.7937 4.8173 4.8198 k = 0.3594-0.0000 0.3612 ( 8636 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9427 -15.9422 -15.9101 -15.9100 -15.6726 -15.6723 -15.6443 -15.6439 -12.8258 -12.8257 -12.7761 -12.7760 -12.7268 -12.7267 -12.6524 -12.6523 -3.2424 -3.2407 -3.2396 -3.2363 -3.0508 -3.0465 -3.0391 -3.0340 -2.7072 -2.7048 -2.6800 -2.6766 -2.5144 -2.5129 -2.4985 -2.4978 -2.2914 -2.2893 -2.2826 -2.2805 -2.0395 -2.0358 -1.9756 -1.9717 -1.6103 -1.6036 -1.4807 -1.4739 -1.0834 -1.0746 -0.8732 -0.8595 -0.5326 -0.5297 -0.4980 -0.4959 -0.0640 -0.0628 -0.0467 -0.0418 0.0841 0.0848 0.1835 0.1920 0.2890 0.2960 0.3458 0.3477 2.7459 2.7474 2.7554 2.7559 3.1425 3.1463 3.1790 3.1824 3.5190 3.5226 3.5249 3.5259 4.7909 4.7930 4.8141 4.8166 k = 0.3750-0.0000 0.3612 ( 8640 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9380 -15.9376 -15.9082 -15.9082 -15.6736 -15.6734 -15.6477 -15.6473 -12.8232 -12.8231 -12.7784 -12.7784 -12.7232 -12.7232 -12.6564 -12.6563 -3.2570 -3.2552 -3.2543 -3.2512 -3.0533 -3.0490 -3.0429 -3.0378 -2.7101 -2.7074 -2.6856 -2.6821 -2.5135 -2.5120 -2.4994 -2.4986 -2.2923 -2.2901 -2.2844 -2.2823 -2.0412 -2.0373 -1.9833 -1.9792 -1.6012 -1.5941 -1.4839 -1.4765 -1.0796 -1.0700 -0.8866 -0.8728 -0.5178 -0.5147 -0.4846 -0.4825 -0.0590 -0.0575 -0.0430 -0.0390 0.0934 0.0951 0.1817 0.1903 0.2982 0.3049 0.3493 0.3514 2.7466 2.7481 2.7551 2.7553 3.1408 3.1446 3.1733 3.1767 3.5194 3.5228 3.5256 3.5266 4.7902 4.7923 4.8109 4.8135 k = 0.3906-0.0000 0.3612 ( 8634 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9336 -15.9331 -15.9068 -15.9067 -15.6743 -15.6741 -15.6510 -15.6507 -12.8205 -12.8204 -12.7809 -12.7809 -12.7195 -12.7194 -12.6604 -12.6604 -3.2700 -3.2683 -3.2676 -3.2647 -3.0555 -3.0510 -3.0464 -3.0413 -2.7125 -2.7097 -2.6908 -2.6872 -2.5126 -2.5111 -2.5003 -2.4995 -2.2932 -2.2910 -2.2861 -2.2840 -2.0420 -2.0379 -1.9906 -1.9862 -1.5921 -1.5847 -1.4878 -1.4800 -1.0742 -1.0640 -0.9008 -0.8870 -0.5038 -0.5006 -0.4729 -0.4707 -0.0545 -0.0528 -0.0398 -0.0366 0.1024 0.1050 0.1795 0.1882 0.3070 0.3133 0.3522 0.3546 2.7473 2.7489 2.7547 2.7547 3.1394 3.1433 3.1679 3.1714 3.5199 3.5231 3.5260 3.5271 4.7897 4.7919 4.8079 4.8104 k = 0.4062-0.0000 0.3612 ( 8640 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9293 -15.9288 -15.9057 -15.9057 -15.6747 -15.6746 -15.6542 -15.6539 -12.8178 -12.8177 -12.7836 -12.7835 -12.7156 -12.7155 -12.6646 -12.6645 -3.2816 -3.2798 -3.2794 -3.2767 -3.0573 -3.0528 -3.0495 -3.0444 -2.7144 -2.7114 -2.6956 -2.6920 -2.5117 -2.5103 -2.5012 -2.5003 -2.2940 -2.2917 -2.2879 -2.2858 -2.0421 -2.0379 -1.9974 -1.9930 -1.5831 -1.5753 -1.4924 -1.4841 -1.0675 -1.0567 -0.9154 -0.9016 -0.4909 -0.4877 -0.4629 -0.4607 -0.0504 -0.0486 -0.0371 -0.0348 0.1109 0.1144 0.1769 0.1856 0.3152 0.3213 0.3544 0.3570 2.7479 2.7495 2.7541 2.7544 3.1384 3.1423 3.1629 3.1665 3.5205 3.5234 3.5263 3.5274 4.7894 4.7916 4.8050 4.8075 k = 0.4219-0.0000 0.3612 ( 8632 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9252 -15.9248 -15.9052 -15.9051 -15.6748 -15.6747 -15.6573 -15.6571 -12.8150 -12.8149 -12.7863 -12.7862 -12.7116 -12.7115 -12.6688 -12.6687 -3.2914 -3.2896 -3.2895 -3.2870 -3.0588 -3.0541 -3.0522 -3.0471 -2.7158 -2.7126 -2.7000 -2.6963 -2.5108 -2.5094 -2.5021 -2.5011 -2.2946 -2.2924 -2.2895 -2.2874 -2.0415 -2.0371 -2.0039 -1.9993 -1.5742 -1.5660 -1.4976 -1.4890 -1.0594 -1.0481 -0.9303 -0.9165 -0.4792 -0.4760 -0.4549 -0.4526 -0.0468 -0.0449 -0.0350 -0.0336 0.1189 0.1233 0.1739 0.1825 0.3229 0.3287 0.3558 0.3587 2.7485 2.7501 2.7536 2.7541 3.1379 3.1418 3.1584 3.1620 3.5211 3.5238 3.5263 3.5275 4.7892 4.7915 4.8023 4.8048 k = 0.4375-0.0000 0.3612 ( 8618 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9214 -15.9210 -15.9051 -15.9050 -15.6745 -15.6745 -15.6603 -15.6601 -12.8122 -12.8121 -12.7891 -12.7890 -12.7074 -12.7074 -12.6730 -12.6730 -3.2995 -3.2980 -3.2977 -3.2955 -3.0598 -3.0551 -3.0546 -3.0495 -2.7166 -2.7134 -2.7039 -2.7002 -2.5099 -2.5085 -2.5029 -2.5019 -2.2951 -2.2929 -2.2910 -2.2889 -2.0402 -2.0358 -2.0099 -2.0052 -1.5653 -1.5569 -1.5035 -1.4946 -1.0501 -1.0383 -0.9453 -0.9316 -0.4689 -0.4657 -0.4488 -0.4464 -0.0436 -0.0416 -0.0335 -0.0328 0.1265 0.1316 0.1704 0.1790 0.3300 0.3354 0.3564 0.3595 2.7490 2.7507 2.7531 2.7538 3.1378 3.1417 3.1542 3.1579 3.5218 3.5243 3.5263 3.5275 4.7894 4.7916 4.7999 4.8023 k = 0.4531-0.0000 0.3612 ( 8616 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9179 -15.9175 -15.9055 -15.9054 -15.6739 -15.6738 -15.6631 -15.6629 -12.8093 -12.8093 -12.7919 -12.7919 -12.7032 -12.7032 -12.6773 -12.6773 -3.3058 -3.3046 -3.3039 -3.3023 -3.0605 -3.0566 -3.0557 -3.0515 -2.7170 -2.7136 -2.7074 -2.7037 -2.5090 -2.5076 -2.5038 -2.5027 -2.2955 -2.2932 -2.2924 -2.2902 -2.0384 -2.0338 -2.0154 -2.0107 -1.5566 -1.5480 -1.5099 -1.5009 -1.0396 -1.0275 -0.9601 -0.9465 -0.4601 -0.4570 -0.4447 -0.4421 -0.0408 -0.0388 -0.0326 -0.0326 0.1336 0.1394 0.1665 0.1749 0.3362 0.3413 0.3562 0.3596 2.7496 2.7512 2.7526 2.7535 3.1382 3.1421 3.1505 3.1542 3.5225 3.5248 3.5260 3.5274 4.7897 4.7920 4.7976 4.8001 k = 0.4688-0.0000 0.3612 ( 8618 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9148 -15.9144 -15.9064 -15.9062 -15.6729 -15.6729 -15.6656 -15.6654 -12.8064 -12.8064 -12.7948 -12.7947 -12.6990 -12.6989 -12.6817 -12.6816 -3.3103 -3.3095 -3.3084 -3.3073 -3.0608 -3.0582 -3.0560 -3.0531 -2.7167 -2.7132 -2.7103 -2.7066 -2.5081 -2.5067 -2.5046 -2.5034 -2.2956 -2.2935 -2.2933 -2.2914 -2.0359 -2.0312 -2.0205 -2.0157 -1.5481 -1.5392 -1.5168 -1.5077 -1.0282 -1.0157 -0.9748 -0.9613 -0.4530 -0.4500 -0.4425 -0.4399 -0.0383 -0.0365 -0.0328 -0.0323 0.1403 0.1467 0.1622 0.1703 0.3417 0.3465 0.3551 0.3587 2.7501 2.7517 2.7521 2.7532 3.1390 3.1429 3.1472 3.1510 3.5233 3.5253 3.5256 3.5271 4.7903 4.7927 4.7956 4.7980 k = 0.4844-0.0000 0.3612 ( 8626 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5860 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9120 -15.9117 -15.9078 -15.9076 -15.6716 -15.6715 -15.6679 -15.6678 -12.8035 -12.8035 -12.7977 -12.7976 -12.6947 -12.6946 -12.6860 -12.6859 -3.3129 -3.3125 -3.3109 -3.3104 -3.0608 -3.0594 -3.0558 -3.0544 -2.7160 -2.7128 -2.7124 -2.7091 -2.5072 -2.5059 -2.5055 -2.5043 -2.2954 -2.2944 -2.2932 -2.2922 -2.0328 -2.0281 -2.0251 -2.0203 -1.5398 -1.5308 -1.5241 -1.5150 -1.0158 -1.0030 -0.9890 -0.9757 -0.4476 -0.4447 -0.4423 -0.4396 -0.0363 -0.0347 -0.0335 -0.0325 0.1464 0.1534 0.1574 0.1652 0.3464 0.3509 0.3531 0.3570 2.7506 2.7516 2.7521 2.7528 3.1403 3.1442 3.1444 3.1483 3.5239 3.5251 3.5258 3.5267 4.7912 4.7936 4.7939 4.7963 k = 0.5000-0.0000 0.3612 ( 8628 PWs) bands (ev): -71.4673 -71.4673 -71.4673 -71.4673 -43.5525 -43.5525 -43.5525 -43.5525 -42.5859 -42.5859 -42.5859 -42.5859 -42.4503 -42.4503 -42.4503 -42.4503 -15.9097 -15.9097 -15.9094 -15.9094 -15.6699 -15.6699 -15.6698 -15.6698 -12.8006 -12.8006 -12.8006 -12.8006 -12.6903 -12.6903 -12.6903 -12.6903 -3.3137 -3.3137 -3.3116 -3.3116 -3.0603 -3.0603 -3.0553 -3.0553 -2.7146 -2.7146 -2.7110 -2.7110 -2.5063 -2.5063 -2.5051 -2.5051 -2.2950 -2.2950 -2.2929 -2.2929 -2.0292 -2.0292 -2.0245 -2.0245 -1.5318 -1.5318 -1.5227 -1.5227 -1.0027 -1.0027 -0.9897 -0.9897 -0.4441 -0.4441 -0.4412 -0.4412 -0.0347 -0.0347 -0.0333 -0.0333 0.1521 0.1521 0.1596 0.1596 0.3502 0.3502 0.3544 0.3544 2.7511 2.7511 2.7525 2.7525 3.1421 3.1421 3.1460 3.1460 3.5246 3.5246 3.5263 3.5263 4.7924 4.7924 4.7948 4.7948 Writing output data file CrxClOx2.save init_run : 5.11s CPU 13.26s WALL ( 1 calls) electrons : 2513.45s CPU 2532.45s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.36s CPU 1.70s WALL ( 1 calls) Called by electrons: c_bands : 2513.34s CPU 2531.40s WALL ( 1 calls) v_of_rho : 0.16s CPU 1.00s WALL ( 1 calls) v_h : 0.06s CPU 0.06s WALL ( 1 calls) v_xc : 0.10s CPU 0.62s WALL ( 1 calls) newd : 1.19s CPU 1.37s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.26s WALL ( 245 calls) cegterg : 2410.67s CPU 2425.95s WALL ( 490 calls) Called by sum_band: Called by *egterg: h_psi : 963.70s CPU 974.23s WALL ( 9578 calls) s_psi : 120.67s CPU 120.99s WALL ( 9578 calls) g_psi : 2.33s CPU 2.33s WALL ( 8843 calls) cdiaghg : 940.92s CPU 941.13s WALL ( 9088 calls) cegterg:over : 218.28s CPU 217.71s WALL ( 8843 calls) cegterg:upda : 78.66s CPU 80.19s WALL ( 8843 calls) cegterg:last : 61.40s CPU 61.99s WALL ( 1715 calls) Called by h_psi: h_psi:vloc : 725.00s CPU 732.17s WALL ( 9578 calls) h_psi:vnl : 235.71s CPU 237.86s WALL ( 9578 calls) add_vuspsi : 95.63s CPU 97.88s WALL ( 9578 calls) General routines calbec : 140.01s CPU 139.89s WALL ( 9578 calls) fft : 0.29s CPU 1.32s WALL ( 19 calls) ffts : 0.01s CPU 0.00s WALL ( 4 calls) fftw : 679.41s CPU 684.07s WALL ( 2056476 calls) interpolate : 0.03s CPU 0.04s WALL ( 4 calls) davcio : 0.03s CPU 2.93s WALL ( 490 calls) Parallel routines fft_scatter : 399.32s CPU 393.03s WALL ( 2056499 calls) PWSCF : 43m34.83s CPU 47m11.04s WALL This run was terminated on: 22:15:21 28Nov2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=