Program PWSCF v.5.1.1 starts on 11Oct2015 at 23:14:41 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: ./KNbO3.save/ file Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 4P renormalized file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 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 30 18 5 890 403 66 Max 31 19 7 897 421 72 Sum 1485 885 277 42983 19609 3271 bravais-lattice index = 14 lattice parameter (alat) = 7.6239 a.u. unit-cell volume = 436.1656 (a.u.)^3 number of atoms/cell = 5 number of atomic types = 3 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.623928 celldm(2)= 1.000000 celldm(3)= 0.984283 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.004732 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.004732 0.999989 0.000000 ) a(3) = ( 0.000000 0.000000 0.984283 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.004732 -0.000000 ) b(2) = ( 0.000000 1.000011 -0.000000 ) b(3) = ( 0.000000 0.000000 1.015968 ) PseudoPot. # 1 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. # 2 for Nb read from file: /home/autes/Pseudo/Nb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: c1e153ab096482f446ae869583c6ae55 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1227 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. # 3 for K read from file: /home/autes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Nb 13.00 92.90640 Nb( 1.00) K 9.00 39.09830 K( 1.00) 2 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 2) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s 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 s 2 -E -1 -s -2 Cartesian axes number of k points= 472 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 2) = ( 0.0090481 0.0090910 -0.0000000), wk = 0.0021186 k( 3) = ( 0.0180962 0.0181820 -0.0000000), wk = 0.0021186 k( 4) = ( 0.0271443 0.0272730 -0.0000000), wk = 0.0021186 k( 5) = ( 0.0361924 0.0363640 -0.0000000), wk = 0.0021186 k( 6) = ( 0.0452405 0.0454551 -0.0000000), wk = 0.0021186 k( 7) = ( 0.0542885 0.0545461 -0.0000000), wk = 0.0021186 k( 8) = ( 0.0633366 0.0636371 -0.0000000), wk = 0.0021186 k( 9) = ( 0.0723847 0.0727281 -0.0000000), wk = 0.0021186 k( 10) = ( 0.0814328 0.0818191 -0.0000000), wk = 0.0021186 k( 11) = ( 0.0904809 0.0909101 -0.0000000), wk = 0.0021186 k( 12) = ( 0.0995290 0.1000011 -0.0000000), wk = 0.0021186 k( 13) = ( 0.1085771 0.1090921 -0.0000000), wk = 0.0021186 k( 14) = ( 0.1176252 0.1181831 -0.0000000), wk = 0.0021186 k( 15) = ( 0.1266733 0.1272742 -0.0000000), wk = 0.0021186 k( 16) = ( 0.1357214 0.1363652 -0.0000000), wk = 0.0021186 k( 17) = ( 0.1447695 0.1454562 -0.0000000), wk = 0.0021186 k( 18) = ( 0.1538175 0.1545472 -0.0000000), wk = 0.0021186 k( 19) = ( 0.1628656 0.1636382 -0.0000000), wk = 0.0021186 k( 20) = ( 0.1719137 0.1727292 -0.0000000), wk = 0.0021186 k( 21) = ( 0.1809618 0.1818202 -0.0000000), wk = 0.0021186 k( 22) = ( 0.1900099 0.1909112 -0.0000000), wk = 0.0021186 k( 23) = ( 0.1990580 0.2000022 -0.0000000), wk = 0.0021186 k( 24) = ( 0.2081061 0.2090933 -0.0000000), wk = 0.0021186 k( 25) = ( 0.2171542 0.2181843 -0.0000000), wk = 0.0021186 k( 26) = ( 0.2262023 0.2272753 -0.0000000), wk = 0.0021186 k( 27) = ( 0.2352504 0.2363663 -0.0000000), wk = 0.0021186 k( 28) = ( 0.2442985 0.2454573 -0.0000000), wk = 0.0021186 k( 29) = ( 0.2533466 0.2545483 -0.0000000), wk = 0.0021186 k( 30) = ( 0.2623947 0.2636393 -0.0000000), wk = 0.0021186 k( 31) = ( 0.2714427 0.2727303 -0.0000000), wk = 0.0021186 k( 32) = ( 0.2804908 0.2818213 -0.0000000), wk = 0.0021186 k( 33) = ( 0.2895389 0.2909123 -0.0000000), wk = 0.0021186 k( 34) = ( 0.2985870 0.3000034 -0.0000000), wk = 0.0021186 k( 35) = ( 0.3076351 0.3090944 -0.0000000), wk = 0.0021186 k( 36) = ( 0.3166832 0.3181854 -0.0000000), wk = 0.0021186 k( 37) = ( 0.3257313 0.3272764 -0.0000000), wk = 0.0021186 k( 38) = ( 0.3347794 0.3363674 -0.0000000), wk = 0.0021186 k( 39) = ( 0.3438275 0.3454584 -0.0000000), wk = 0.0021186 k( 40) = ( 0.3528756 0.3545494 -0.0000000), wk = 0.0021186 k( 41) = ( 0.3619236 0.3636404 -0.0000000), wk = 0.0021186 k( 42) = ( 0.3709717 0.3727314 -0.0000000), wk = 0.0021186 k( 43) = ( 0.3800198 0.3818225 -0.0000000), wk = 0.0021186 k( 44) = ( 0.3890679 0.3909135 -0.0000000), wk = 0.0021186 k( 45) = ( 0.3981160 0.4000045 -0.0000000), wk = 0.0021186 k( 46) = ( 0.4071641 0.4090955 -0.0000000), wk = 0.0021186 k( 47) = ( 0.4162122 0.4181865 -0.0000000), wk = 0.0021186 k( 48) = ( 0.4252603 0.4272775 -0.0000000), wk = 0.0021186 k( 49) = ( 0.4343084 0.4363685 -0.0000000), wk = 0.0021186 k( 50) = ( 0.4433565 0.4454595 -0.0000000), wk = 0.0021186 k( 51) = ( 0.4524046 0.4545505 -0.0000000), wk = 0.0021186 k( 52) = ( 0.4614527 0.4636416 -0.0000000), wk = 0.0021186 k( 53) = ( 0.4705008 0.4727326 -0.0000000), wk = 0.0021186 k( 54) = ( 0.4795488 0.4818236 -0.0000000), wk = 0.0021186 k( 55) = ( 0.4885969 0.4909146 -0.0000000), wk = 0.0021186 k( 56) = ( 0.4976450 0.5000056 -0.0000000), wk = 0.0021186 k( 57) = ( 0.4976450 0.5000056 -0.0000000), wk = 0.0021186 k( 58) = ( 0.4848849 0.5000056 -0.0000000), wk = 0.0021186 k( 59) = ( 0.4721248 0.5000056 -0.0000000), wk = 0.0021186 k( 60) = ( 0.4593646 0.5000056 -0.0000000), wk = 0.0021186 k( 61) = ( 0.4466045 0.5000056 -0.0000000), wk = 0.0021186 k( 62) = ( 0.4338444 0.5000056 -0.0000000), wk = 0.0021186 k( 63) = ( 0.4210842 0.5000056 -0.0000000), wk = 0.0021186 k( 64) = ( 0.4083241 0.5000056 -0.0000000), wk = 0.0021186 k( 65) = ( 0.3955640 0.5000056 -0.0000000), wk = 0.0021186 k( 66) = ( 0.3828039 0.5000056 -0.0000000), wk = 0.0021186 k( 67) = ( 0.3700437 0.5000056 -0.0000000), wk = 0.0021186 k( 68) = ( 0.3572836 0.5000056 -0.0000000), wk = 0.0021186 k( 69) = ( 0.3445235 0.5000056 -0.0000000), wk = 0.0021186 k( 70) = ( 0.3317634 0.5000056 -0.0000000), wk = 0.0021186 k( 71) = ( 0.3190032 0.5000056 -0.0000000), wk = 0.0021186 k( 72) = ( 0.3062431 0.5000056 -0.0000000), wk = 0.0021186 k( 73) = ( 0.2934830 0.5000056 -0.0000000), wk = 0.0021186 k( 74) = ( 0.2807228 0.5000056 -0.0000000), wk = 0.0021186 k( 75) = ( 0.2679627 0.5000056 -0.0000000), wk = 0.0021186 k( 76) = ( 0.2552026 0.5000056 -0.0000000), wk = 0.0021186 k( 77) = ( 0.2424425 0.5000056 -0.0000000), wk = 0.0021186 k( 78) = ( 0.2296823 0.5000056 -0.0000000), wk = 0.0021186 k( 79) = ( 0.2169222 0.5000056 -0.0000000), wk = 0.0021186 k( 80) = ( 0.2041621 0.5000056 -0.0000000), wk = 0.0021186 k( 81) = ( 0.1914019 0.5000056 -0.0000000), wk = 0.0021186 k( 82) = ( 0.1786418 0.5000056 -0.0000000), wk = 0.0021186 k( 83) = ( 0.1658817 0.5000056 -0.0000000), wk = 0.0021186 k( 84) = ( 0.1531215 0.5000056 -0.0000000), wk = 0.0021186 k( 85) = ( 0.1403614 0.5000056 -0.0000000), wk = 0.0021186 k( 86) = ( 0.1276013 0.5000056 -0.0000000), wk = 0.0021186 k( 87) = ( 0.1148412 0.5000056 -0.0000000), wk = 0.0021186 k( 88) = ( 0.1020810 0.5000056 -0.0000000), wk = 0.0021186 k( 89) = ( 0.0893209 0.5000056 -0.0000000), wk = 0.0021186 k( 90) = ( 0.0765608 0.5000056 -0.0000000), wk = 0.0021186 k( 91) = ( 0.0638006 0.5000056 -0.0000000), wk = 0.0021186 k( 92) = ( 0.0510405 0.5000056 -0.0000000), wk = 0.0021186 k( 93) = ( 0.0382804 0.5000056 -0.0000000), wk = 0.0021186 k( 94) = ( 0.0255203 0.5000056 -0.0000000), wk = 0.0021186 k( 95) = ( 0.0127601 0.5000056 -0.0000000), wk = 0.0021186 k( 96) = ( 0.0000000 0.5000056 -0.0000000), wk = 0.0021186 k( 97) = ( 0.0000000 0.5000056 -0.0000000), wk = 0.0021186 k( 98) = ( 0.0000000 0.5000056 0.0126996), wk = 0.0021186 k( 99) = ( 0.0000000 0.5000056 0.0253992), wk = 0.0021186 k( 100) = ( 0.0000000 0.5000056 0.0380988), wk = 0.0021186 k( 101) = ( 0.0000000 0.5000056 0.0507984), wk = 0.0021186 k( 102) = ( 0.0000000 0.5000056 0.0634980), wk = 0.0021186 k( 103) = ( 0.0000000 0.5000056 0.0761976), wk = 0.0021186 k( 104) = ( 0.0000000 0.5000056 0.0888972), wk = 0.0021186 k( 105) = ( 0.0000000 0.5000056 0.1015968), wk = 0.0021186 k( 106) = ( 0.0000000 0.5000056 0.1142964), wk = 0.0021186 k( 107) = ( 0.0000000 0.5000056 0.1269960), wk = 0.0021186 k( 108) = ( 0.0000000 0.5000056 0.1396956), wk = 0.0021186 k( 109) = ( 0.0000000 0.5000056 0.1523952), wk = 0.0021186 k( 110) = ( 0.0000000 0.5000056 0.1650948), wk = 0.0021186 k( 111) = ( 0.0000000 0.5000056 0.1777944), wk = 0.0021186 k( 112) = ( 0.0000000 0.5000056 0.1904940), wk = 0.0021186 k( 113) = ( 0.0000000 0.5000056 0.2031936), wk = 0.0021186 k( 114) = ( 0.0000000 0.5000056 0.2158932), wk = 0.0021186 k( 115) = ( 0.0000000 0.5000056 0.2285928), wk = 0.0021186 k( 116) = ( 0.0000000 0.5000056 0.2412924), wk = 0.0021186 k( 117) = ( 0.0000000 0.5000056 0.2539920), wk = 0.0021186 k( 118) = ( 0.0000000 0.5000056 0.2666916), wk = 0.0021186 k( 119) = ( 0.0000000 0.5000056 0.2793912), wk = 0.0021186 k( 120) = ( 0.0000000 0.5000056 0.2920908), wk = 0.0021186 k( 121) = ( 0.0000000 0.5000056 0.3047904), wk = 0.0021186 k( 122) = ( 0.0000000 0.5000056 0.3174900), wk = 0.0021186 k( 123) = ( 0.0000000 0.5000056 0.3301896), wk = 0.0021186 k( 124) = ( 0.0000000 0.5000056 0.3428892), wk = 0.0021186 k( 125) = ( 0.0000000 0.5000056 0.3555888), wk = 0.0021186 k( 126) = ( 0.0000000 0.5000056 0.3682884), wk = 0.0021186 k( 127) = ( 0.0000000 0.5000056 0.3809880), wk = 0.0021186 k( 128) = ( 0.0000000 0.5000056 0.3936876), wk = 0.0021186 k( 129) = ( 0.0000000 0.5000056 0.4063872), wk = 0.0021186 k( 130) = ( 0.0000000 0.5000056 0.4190868), wk = 0.0021186 k( 131) = ( 0.0000000 0.5000056 0.4317864), wk = 0.0021186 k( 132) = ( 0.0000000 0.5000056 0.4444860), wk = 0.0021186 k( 133) = ( 0.0000000 0.5000056 0.4571856), wk = 0.0021186 k( 134) = ( 0.0000000 0.5000056 0.4698852), wk = 0.0021186 k( 135) = ( 0.0000000 0.5000056 0.4825848), wk = 0.0021186 k( 136) = ( 0.0000000 0.5000056 0.4952844), wk = 0.0021186 k( 137) = ( 0.0000000 0.5000056 0.5079840), wk = 0.0021186 k( 138) = ( 0.0000000 0.5000056 0.5079840), wk = 0.0021186 k( 139) = ( 0.0127601 0.5000056 0.5079840), wk = 0.0021186 k( 140) = ( 0.0255203 0.5000056 0.5079840), wk = 0.0021186 k( 141) = ( 0.0382804 0.5000056 0.5079840), wk = 0.0021186 k( 142) = ( 0.0510405 0.5000056 0.5079840), wk = 0.0021186 k( 143) = ( 0.0638006 0.5000056 0.5079840), wk = 0.0021186 k( 144) = ( 0.0765608 0.5000056 0.5079840), wk = 0.0021186 k( 145) = ( 0.0893209 0.5000056 0.5079840), wk = 0.0021186 k( 146) = ( 0.1020810 0.5000056 0.5079840), wk = 0.0021186 k( 147) = ( 0.1148412 0.5000056 0.5079840), wk = 0.0021186 k( 148) = ( 0.1276013 0.5000056 0.5079840), wk = 0.0021186 k( 149) = ( 0.1403614 0.5000056 0.5079840), wk = 0.0021186 k( 150) = ( 0.1531215 0.5000056 0.5079840), wk = 0.0021186 k( 151) = ( 0.1658817 0.5000056 0.5079840), wk = 0.0021186 k( 152) = ( 0.1786418 0.5000056 0.5079840), wk = 0.0021186 k( 153) = ( 0.1914019 0.5000056 0.5079840), wk = 0.0021186 k( 154) = ( 0.2041621 0.5000056 0.5079840), wk = 0.0021186 k( 155) = ( 0.2169222 0.5000056 0.5079840), wk = 0.0021186 k( 156) = ( 0.2296823 0.5000056 0.5079840), wk = 0.0021186 k( 157) = ( 0.2424425 0.5000056 0.5079840), wk = 0.0021186 k( 158) = ( 0.2552026 0.5000056 0.5079840), wk = 0.0021186 k( 159) = ( 0.2679627 0.5000056 0.5079840), wk = 0.0021186 k( 160) = ( 0.2807228 0.5000056 0.5079840), wk = 0.0021186 k( 161) = ( 0.2934830 0.5000056 0.5079840), wk = 0.0021186 k( 162) = ( 0.3062431 0.5000056 0.5079840), wk = 0.0021186 k( 163) = ( 0.3190032 0.5000056 0.5079840), wk = 0.0021186 k( 164) = ( 0.3317634 0.5000056 0.5079840), wk = 0.0021186 k( 165) = ( 0.3445235 0.5000056 0.5079840), wk = 0.0021186 k( 166) = ( 0.3572836 0.5000056 0.5079840), wk = 0.0021186 k( 167) = ( 0.3700437 0.5000056 0.5079840), wk = 0.0021186 k( 168) = ( 0.3828039 0.5000056 0.5079840), wk = 0.0021186 k( 169) = ( 0.3955640 0.5000056 0.5079840), wk = 0.0021186 k( 170) = ( 0.4083241 0.5000056 0.5079840), wk = 0.0021186 k( 171) = ( 0.4210842 0.5000056 0.5079840), wk = 0.0021186 k( 172) = ( 0.4338444 0.5000056 0.5079840), wk = 0.0021186 k( 173) = ( 0.4466045 0.5000056 0.5079840), wk = 0.0021186 k( 174) = ( 0.4593646 0.5000056 0.5079840), wk = 0.0021186 k( 175) = ( 0.4721248 0.5000056 0.5079840), wk = 0.0021186 k( 176) = ( 0.4848849 0.5000056 0.5079840), wk = 0.0021186 k( 177) = ( 0.4976450 0.5000056 0.5079840), wk = 0.0021186 k( 178) = ( 0.4976450 0.5000056 0.5079840), wk = 0.0021186 k( 179) = ( 0.4885969 0.4909146 0.5079840), wk = 0.0021186 k( 180) = ( 0.4795488 0.4818236 0.5079840), wk = 0.0021186 k( 181) = ( 0.4705008 0.4727326 0.5079840), wk = 0.0021186 k( 182) = ( 0.4614527 0.4636416 0.5079840), wk = 0.0021186 k( 183) = ( 0.4524046 0.4545505 0.5079840), wk = 0.0021186 k( 184) = ( 0.4433565 0.4454595 0.5079840), wk = 0.0021186 k( 185) = ( 0.4343084 0.4363685 0.5079840), wk = 0.0021186 k( 186) = ( 0.4252603 0.4272775 0.5079840), wk = 0.0021186 k( 187) = ( 0.4162122 0.4181865 0.5079840), wk = 0.0021186 k( 188) = ( 0.4071641 0.4090955 0.5079840), wk = 0.0021186 k( 189) = ( 0.3981160 0.4000045 0.5079840), wk = 0.0021186 k( 190) = ( 0.3890679 0.3909135 0.5079840), wk = 0.0021186 k( 191) = ( 0.3800198 0.3818225 0.5079840), wk = 0.0021186 k( 192) = ( 0.3709717 0.3727314 0.5079840), wk = 0.0021186 k( 193) = ( 0.3619236 0.3636404 0.5079840), wk = 0.0021186 k( 194) = ( 0.3528756 0.3545494 0.5079840), wk = 0.0021186 k( 195) = ( 0.3438275 0.3454584 0.5079840), wk = 0.0021186 k( 196) = ( 0.3347794 0.3363674 0.5079840), wk = 0.0021186 k( 197) = ( 0.3257313 0.3272764 0.5079840), wk = 0.0021186 k( 198) = ( 0.3166832 0.3181854 0.5079840), wk = 0.0021186 k( 199) = ( 0.3076351 0.3090944 0.5079840), wk = 0.0021186 k( 200) = ( 0.2985870 0.3000034 0.5079840), wk = 0.0021186 k( 201) = ( 0.2895389 0.2909123 0.5079840), wk = 0.0021186 k( 202) = ( 0.2804908 0.2818213 0.5079840), wk = 0.0021186 k( 203) = ( 0.2714427 0.2727303 0.5079840), wk = 0.0021186 k( 204) = ( 0.2623947 0.2636393 0.5079840), wk = 0.0021186 k( 205) = ( 0.2533466 0.2545483 0.5079840), wk = 0.0021186 k( 206) = ( 0.2442985 0.2454573 0.5079840), wk = 0.0021186 k( 207) = ( 0.2352504 0.2363663 0.5079840), wk = 0.0021186 k( 208) = ( 0.2262023 0.2272753 0.5079840), wk = 0.0021186 k( 209) = ( 0.2171542 0.2181843 0.5079840), wk = 0.0021186 k( 210) = ( 0.2081061 0.2090933 0.5079840), wk = 0.0021186 k( 211) = ( 0.1990580 0.2000022 0.5079840), wk = 0.0021186 k( 212) = ( 0.1900099 0.1909112 0.5079840), wk = 0.0021186 k( 213) = ( 0.1809618 0.1818202 0.5079840), wk = 0.0021186 k( 214) = ( 0.1719137 0.1727292 0.5079840), wk = 0.0021186 k( 215) = ( 0.1628656 0.1636382 0.5079840), wk = 0.0021186 k( 216) = ( 0.1538175 0.1545472 0.5079840), wk = 0.0021186 k( 217) = ( 0.1447695 0.1454562 0.5079840), wk = 0.0021186 k( 218) = ( 0.1357214 0.1363652 0.5079840), wk = 0.0021186 k( 219) = ( 0.1266733 0.1272742 0.5079840), wk = 0.0021186 k( 220) = ( 0.1176252 0.1181831 0.5079840), wk = 0.0021186 k( 221) = ( 0.1085771 0.1090921 0.5079840), wk = 0.0021186 k( 222) = ( 0.0995290 0.1000011 0.5079840), wk = 0.0021186 k( 223) = ( 0.0904809 0.0909101 0.5079840), wk = 0.0021186 k( 224) = ( 0.0814328 0.0818191 0.5079840), wk = 0.0021186 k( 225) = ( 0.0723847 0.0727281 0.5079840), wk = 0.0021186 k( 226) = ( 0.0633366 0.0636371 0.5079840), wk = 0.0021186 k( 227) = ( 0.0542885 0.0545461 0.5079840), wk = 0.0021186 k( 228) = ( 0.0452405 0.0454551 0.5079840), wk = 0.0021186 k( 229) = ( 0.0361924 0.0363640 0.5079840), wk = 0.0021186 k( 230) = ( 0.0271443 0.0272730 0.5079840), wk = 0.0021186 k( 231) = ( 0.0180962 0.0181820 0.5079840), wk = 0.0021186 k( 232) = ( 0.0090481 0.0090910 0.5079840), wk = 0.0021186 k( 233) = ( 0.0000000 0.0000000 0.5079840), wk = 0.0021186 k( 234) = ( 0.0000000 0.0000000 0.5079840), wk = 0.0021186 k( 235) = ( 0.0000000 0.0000000 0.4952844), wk = 0.0021186 k( 236) = ( 0.0000000 0.0000000 0.4825848), wk = 0.0021186 k( 237) = ( 0.0000000 0.0000000 0.4698852), wk = 0.0021186 k( 238) = ( 0.0000000 0.0000000 0.4571856), wk = 0.0021186 k( 239) = ( 0.0000000 0.0000000 0.4444860), wk = 0.0021186 k( 240) = ( 0.0000000 0.0000000 0.4317864), wk = 0.0021186 k( 241) = ( 0.0000000 0.0000000 0.4190868), wk = 0.0021186 k( 242) = ( 0.0000000 0.0000000 0.4063872), wk = 0.0021186 k( 243) = ( 0.0000000 0.0000000 0.3936876), wk = 0.0021186 k( 244) = ( 0.0000000 0.0000000 0.3809880), wk = 0.0021186 k( 245) = ( 0.0000000 0.0000000 0.3682884), wk = 0.0021186 k( 246) = ( 0.0000000 0.0000000 0.3555888), wk = 0.0021186 k( 247) = ( 0.0000000 0.0000000 0.3428892), wk = 0.0021186 k( 248) = ( 0.0000000 0.0000000 0.3301896), wk = 0.0021186 k( 249) = ( 0.0000000 0.0000000 0.3174900), wk = 0.0021186 k( 250) = ( 0.0000000 0.0000000 0.3047904), wk = 0.0021186 k( 251) = ( 0.0000000 0.0000000 0.2920908), wk = 0.0021186 k( 252) = ( 0.0000000 0.0000000 0.2793912), wk = 0.0021186 k( 253) = ( 0.0000000 0.0000000 0.2666916), wk = 0.0021186 k( 254) = ( 0.0000000 0.0000000 0.2539920), wk = 0.0021186 k( 255) = ( 0.0000000 0.0000000 0.2412924), wk = 0.0021186 k( 256) = ( 0.0000000 0.0000000 0.2285928), wk = 0.0021186 k( 257) = ( 0.0000000 0.0000000 0.2158932), wk = 0.0021186 k( 258) = ( 0.0000000 0.0000000 0.2031936), wk = 0.0021186 k( 259) = ( 0.0000000 0.0000000 0.1904940), wk = 0.0021186 k( 260) = ( 0.0000000 0.0000000 0.1777944), wk = 0.0021186 k( 261) = ( 0.0000000 0.0000000 0.1650948), wk = 0.0021186 k( 262) = ( 0.0000000 0.0000000 0.1523952), wk = 0.0021186 k( 263) = ( 0.0000000 0.0000000 0.1396956), wk = 0.0021186 k( 264) = ( 0.0000000 0.0000000 0.1269960), wk = 0.0021186 k( 265) = ( 0.0000000 0.0000000 0.1142964), wk = 0.0021186 k( 266) = ( 0.0000000 0.0000000 0.1015968), wk = 0.0021186 k( 267) = ( 0.0000000 0.0000000 0.0888972), wk = 0.0021186 k( 268) = ( 0.0000000 0.0000000 0.0761976), wk = 0.0021186 k( 269) = ( 0.0000000 0.0000000 0.0634980), wk = 0.0021186 k( 270) = ( 0.0000000 0.0000000 0.0507984), wk = 0.0021186 k( 271) = ( 0.0000000 0.0000000 0.0380988), wk = 0.0021186 k( 272) = ( 0.0000000 0.0000000 0.0253992), wk = 0.0021186 k( 273) = ( 0.0000000 0.0000000 0.0126996), wk = 0.0021186 k( 274) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 275) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 276) = ( -0.0090909 0.0090480 0.0000000), wk = 0.0021186 k( 277) = ( -0.0181818 0.0180960 0.0000000), wk = 0.0021186 k( 278) = ( -0.0272727 0.0271440 0.0000000), wk = 0.0021186 k( 279) = ( -0.0363636 0.0361920 0.0000000), wk = 0.0021186 k( 280) = ( -0.0454546 0.0452400 0.0000000), wk = 0.0021186 k( 281) = ( -0.0545455 0.0542879 -0.0000000), wk = 0.0021186 k( 282) = ( -0.0636364 0.0633359 -0.0000000), wk = 0.0021186 k( 283) = ( -0.0727273 0.0723839 0.0000000), wk = 0.0021186 k( 284) = ( -0.0818182 0.0814319 -0.0000000), wk = 0.0021186 k( 285) = ( -0.0909091 0.0904799 -0.0000000), wk = 0.0021186 k( 286) = ( -0.1000000 0.0995279 -0.0000000), wk = 0.0021186 k( 287) = ( -0.1090909 0.1085759 -0.0000000), wk = 0.0021186 k( 288) = ( -0.1181818 0.1176239 -0.0000000), wk = 0.0021186 k( 289) = ( -0.1272727 0.1266719 -0.0000000), wk = 0.0021186 k( 290) = ( -0.1363636 0.1357199 -0.0000000), wk = 0.0021186 k( 291) = ( -0.1454545 0.1447678 0.0000000), wk = 0.0021186 k( 292) = ( -0.1545455 0.1538158 -0.0000000), wk = 0.0021186 k( 293) = ( -0.1636364 0.1628638 -0.0000000), wk = 0.0021186 k( 294) = ( -0.1727273 0.1719118 -0.0000000), wk = 0.0021186 k( 295) = ( -0.1818182 0.1809598 -0.0000000), wk = 0.0021186 k( 296) = ( -0.1909091 0.1900078 -0.0000000), wk = 0.0021186 k( 297) = ( -0.2000000 0.1990558 -0.0000000), wk = 0.0021186 k( 298) = ( -0.2090909 0.2081038 -0.0000000), wk = 0.0021186 k( 299) = ( -0.2181818 0.2171518 -0.0000000), wk = 0.0021186 k( 300) = ( -0.2272727 0.2261998 -0.0000000), wk = 0.0021186 k( 301) = ( -0.2363636 0.2352477 -0.0000000), wk = 0.0021186 k( 302) = ( -0.2454545 0.2442957 -0.0000000), wk = 0.0021186 k( 303) = ( -0.2545455 0.2533437 -0.0000000), wk = 0.0021186 k( 304) = ( -0.2636364 0.2623917 -0.0000000), wk = 0.0021186 k( 305) = ( -0.2727273 0.2714397 -0.0000000), wk = 0.0021186 k( 306) = ( -0.2818182 0.2804877 -0.0000000), wk = 0.0021186 k( 307) = ( -0.2909091 0.2895357 0.0000000), wk = 0.0021186 k( 308) = ( -0.3000000 0.2985837 0.0000000), wk = 0.0021186 k( 309) = ( -0.3090909 0.3076317 -0.0000000), wk = 0.0021186 k( 310) = ( -0.3181818 0.3166797 -0.0000000), wk = 0.0021186 k( 311) = ( -0.3272727 0.3257276 -0.0000000), wk = 0.0021186 k( 312) = ( -0.3363636 0.3347756 0.0000000), wk = 0.0021186 k( 313) = ( -0.3454546 0.3438236 -0.0000000), wk = 0.0021186 k( 314) = ( -0.3545454 0.3528716 -0.0000000), wk = 0.0021186 k( 315) = ( -0.3636364 0.3619196 -0.0000000), wk = 0.0021186 k( 316) = ( -0.3727273 0.3709676 0.0000000), wk = 0.0021186 k( 317) = ( -0.3818182 0.3800156 -0.0000000), wk = 0.0021186 k( 318) = ( -0.3909091 0.3890636 -0.0000000), wk = 0.0021186 k( 319) = ( -0.4000000 0.3981116 -0.0000000), wk = 0.0021186 k( 320) = ( -0.4090909 0.4071595 -0.0000000), wk = 0.0021186 k( 321) = ( -0.4181818 0.4162075 -0.0000000), wk = 0.0021186 k( 322) = ( -0.4272727 0.4252555 -0.0000000), wk = 0.0021186 k( 323) = ( -0.4363636 0.4343035 -0.0000000), wk = 0.0021186 k( 324) = ( -0.4454546 0.4433515 0.0000000), wk = 0.0021186 k( 325) = ( -0.4545455 0.4523995 -0.0000000), wk = 0.0021186 k( 326) = ( -0.4636364 0.4614475 -0.0000000), wk = 0.0021186 k( 327) = ( -0.4727273 0.4704955 -0.0000000), wk = 0.0021186 k( 328) = ( -0.4818182 0.4795435 -0.0000000), wk = 0.0021186 k( 329) = ( -0.4909091 0.4885915 -0.0000000), wk = 0.0021186 k( 330) = ( -0.5000000 0.4976394 -0.0000000), wk = 0.0021186 k( 331) = ( -0.5000000 0.4976394 -0.0000000), wk = 0.0021186 k( 332) = ( -0.4976450 0.5000056 -0.0000000), wk = 0.0021186 k( 333) = ( -0.4976450 0.5000056 -0.0000000), wk = 0.0021186 k( 334) = ( -0.4976450 0.5000056 0.0126996), wk = 0.0021186 k( 335) = ( -0.4976450 0.5000056 0.0253992), wk = 0.0021186 k( 336) = ( -0.4976450 0.5000056 0.0380988), wk = 0.0021186 k( 337) = ( -0.4976450 0.5000056 0.0507984), wk = 0.0021186 k( 338) = ( -0.4976450 0.5000056 0.0634980), wk = 0.0021186 k( 339) = ( -0.4976450 0.5000056 0.0761976), wk = 0.0021186 k( 340) = ( -0.4976450 0.5000056 0.0888972), wk = 0.0021186 k( 341) = ( -0.4976450 0.5000056 0.1015968), wk = 0.0021186 k( 342) = ( -0.4976450 0.5000056 0.1142964), wk = 0.0021186 k( 343) = ( -0.4976450 0.5000056 0.1269960), wk = 0.0021186 k( 344) = ( -0.4976450 0.5000056 0.1396956), wk = 0.0021186 k( 345) = ( -0.4976450 0.5000056 0.1523952), wk = 0.0021186 k( 346) = ( -0.4976450 0.5000056 0.1650948), wk = 0.0021186 k( 347) = ( -0.4976450 0.5000056 0.1777944), wk = 0.0021186 k( 348) = ( -0.4976450 0.5000056 0.1904940), wk = 0.0021186 k( 349) = ( -0.4976450 0.5000056 0.2031936), wk = 0.0021186 k( 350) = ( -0.4976450 0.5000056 0.2158932), wk = 0.0021186 k( 351) = ( -0.4976450 0.5000056 0.2285928), wk = 0.0021186 k( 352) = ( -0.4976450 0.5000056 0.2412924), wk = 0.0021186 k( 353) = ( -0.4976450 0.5000056 0.2539920), wk = 0.0021186 k( 354) = ( -0.4976450 0.5000056 0.2666916), wk = 0.0021186 k( 355) = ( -0.4976450 0.5000056 0.2793912), wk = 0.0021186 k( 356) = ( -0.4976450 0.5000056 0.2920908), wk = 0.0021186 k( 357) = ( -0.4976450 0.5000056 0.3047904), wk = 0.0021186 k( 358) = ( -0.4976450 0.5000056 0.3174900), wk = 0.0021186 k( 359) = ( -0.4976450 0.5000056 0.3301896), wk = 0.0021186 k( 360) = ( -0.4976450 0.5000056 0.3428892), wk = 0.0021186 k( 361) = ( -0.4976450 0.5000056 0.3555888), wk = 0.0021186 k( 362) = ( -0.4976450 0.5000056 0.3682884), wk = 0.0021186 k( 363) = ( -0.4976450 0.5000056 0.3809880), wk = 0.0021186 k( 364) = ( -0.4976450 0.5000056 0.3936876), wk = 0.0021186 k( 365) = ( -0.4976450 0.5000056 0.4063872), wk = 0.0021186 k( 366) = ( -0.4976450 0.5000056 0.4190868), wk = 0.0021186 k( 367) = ( -0.4976450 0.5000056 0.4317864), wk = 0.0021186 k( 368) = ( -0.4976450 0.5000056 0.4444860), wk = 0.0021186 k( 369) = ( -0.4976450 0.5000056 0.4571856), wk = 0.0021186 k( 370) = ( -0.4976450 0.5000056 0.4698852), wk = 0.0021186 k( 371) = ( -0.4976450 0.5000056 0.4825848), wk = 0.0021186 k( 372) = ( -0.4976450 0.5000056 0.4952844), wk = 0.0021186 k( 373) = ( -0.4976450 0.5000056 0.5079840), wk = 0.0021186 k( 374) = ( -0.4976450 0.5000056 0.5079840), wk = 0.0021186 k( 375) = ( -0.5000000 0.4976394 0.5079840), wk = 0.0021186 k( 376) = ( -0.5000000 0.4976394 0.5079840), wk = 0.0021186 k( 377) = ( -0.5000000 0.4976394 0.4952844), wk = 0.0021186 k( 378) = ( -0.5000000 0.4976394 0.4825848), wk = 0.0021186 k( 379) = ( -0.5000000 0.4976394 0.4698852), wk = 0.0021186 k( 380) = ( -0.5000000 0.4976394 0.4571856), wk = 0.0021186 k( 381) = ( -0.5000000 0.4976394 0.4444860), wk = 0.0021186 k( 382) = ( -0.5000000 0.4976394 0.4317864), wk = 0.0021186 k( 383) = ( -0.5000000 0.4976394 0.4190868), wk = 0.0021186 k( 384) = ( -0.5000000 0.4976394 0.4063872), wk = 0.0021186 k( 385) = ( -0.5000000 0.4976394 0.3936876), wk = 0.0021186 k( 386) = ( -0.5000000 0.4976394 0.3809880), wk = 0.0021186 k( 387) = ( -0.5000000 0.4976394 0.3682884), wk = 0.0021186 k( 388) = ( -0.5000000 0.4976394 0.3555888), wk = 0.0021186 k( 389) = ( -0.5000000 0.4976394 0.3428892), wk = 0.0021186 k( 390) = ( -0.5000000 0.4976394 0.3301896), wk = 0.0021186 k( 391) = ( -0.5000000 0.4976394 0.3174900), wk = 0.0021186 k( 392) = ( -0.5000000 0.4976394 0.3047904), wk = 0.0021186 k( 393) = ( -0.5000000 0.4976394 0.2920908), wk = 0.0021186 k( 394) = ( -0.5000000 0.4976394 0.2793912), wk = 0.0021186 k( 395) = ( -0.5000000 0.4976394 0.2666916), wk = 0.0021186 k( 396) = ( -0.5000000 0.4976394 0.2539920), wk = 0.0021186 k( 397) = ( -0.5000000 0.4976394 0.2412924), wk = 0.0021186 k( 398) = ( -0.5000000 0.4976394 0.2285928), wk = 0.0021186 k( 399) = ( -0.5000000 0.4976394 0.2158932), wk = 0.0021186 k( 400) = ( -0.5000000 0.4976394 0.2031936), wk = 0.0021186 k( 401) = ( -0.5000000 0.4976394 0.1904940), wk = 0.0021186 k( 402) = ( -0.5000000 0.4976394 0.1777944), wk = 0.0021186 k( 403) = ( -0.5000000 0.4976394 0.1650948), wk = 0.0021186 k( 404) = ( -0.5000000 0.4976394 0.1523952), wk = 0.0021186 k( 405) = ( -0.5000000 0.4976394 0.1396956), wk = 0.0021186 k( 406) = ( -0.5000000 0.4976394 0.1269960), wk = 0.0021186 k( 407) = ( -0.5000000 0.4976394 0.1142964), wk = 0.0021186 k( 408) = ( -0.5000000 0.4976394 0.1015968), wk = 0.0021186 k( 409) = ( -0.5000000 0.4976394 0.0888972), wk = 0.0021186 k( 410) = ( -0.5000000 0.4976394 0.0761976), wk = 0.0021186 k( 411) = ( -0.5000000 0.4976394 0.0634980), wk = 0.0021186 k( 412) = ( -0.5000000 0.4976394 0.0507984), wk = 0.0021186 k( 413) = ( -0.5000000 0.4976394 0.0380988), wk = 0.0021186 k( 414) = ( -0.5000000 0.4976394 0.0253992), wk = 0.0021186 k( 415) = ( -0.5000000 0.4976394 0.0126996), wk = 0.0021186 k( 416) = ( -0.5000000 0.4976394 -0.0000000), wk = 0.0021186 k( 417) = ( 0.0000000 0.0000000 0.5079840), wk = 0.0021186 k( 418) = ( -0.0090909 0.0090480 0.5079840), wk = 0.0021186 k( 419) = ( -0.0181818 0.0180960 0.5079840), wk = 0.0021186 k( 420) = ( -0.0272727 0.0271440 0.5079840), wk = 0.0021186 k( 421) = ( -0.0363636 0.0361920 0.5079840), wk = 0.0021186 k( 422) = ( -0.0454546 0.0452400 0.5079840), wk = 0.0021186 k( 423) = ( -0.0545455 0.0542879 0.5079840), wk = 0.0021186 k( 424) = ( -0.0636364 0.0633359 0.5079840), wk = 0.0021186 k( 425) = ( -0.0727273 0.0723839 0.5079840), wk = 0.0021186 k( 426) = ( -0.0818182 0.0814319 0.5079840), wk = 0.0021186 k( 427) = ( -0.0909091 0.0904799 0.5079840), wk = 0.0021186 k( 428) = ( -0.1000000 0.0995279 0.5079840), wk = 0.0021186 k( 429) = ( -0.1090909 0.1085759 0.5079840), wk = 0.0021186 k( 430) = ( -0.1181818 0.1176239 0.5079840), wk = 0.0021186 k( 431) = ( -0.1272727 0.1266719 0.5079840), wk = 0.0021186 k( 432) = ( -0.1363636 0.1357199 0.5079840), wk = 0.0021186 k( 433) = ( -0.1454545 0.1447678 0.5079840), wk = 0.0021186 k( 434) = ( -0.1545455 0.1538158 0.5079840), wk = 0.0021186 k( 435) = ( -0.1636364 0.1628638 0.5079840), wk = 0.0021186 k( 436) = ( -0.1727273 0.1719118 0.5079840), wk = 0.0021186 k( 437) = ( -0.1818182 0.1809598 0.5079840), wk = 0.0021186 k( 438) = ( -0.1909091 0.1900078 0.5079840), wk = 0.0021186 k( 439) = ( -0.2000000 0.1990558 0.5079840), wk = 0.0021186 k( 440) = ( -0.2090909 0.2081038 0.5079840), wk = 0.0021186 k( 441) = ( -0.2181818 0.2171518 0.5079840), wk = 0.0021186 k( 442) = ( -0.2272727 0.2261998 0.5079840), wk = 0.0021186 k( 443) = ( -0.2363636 0.2352477 0.5079840), wk = 0.0021186 k( 444) = ( -0.2454545 0.2442957 0.5079840), wk = 0.0021186 k( 445) = ( -0.2545455 0.2533437 0.5079840), wk = 0.0021186 k( 446) = ( -0.2636364 0.2623917 0.5079840), wk = 0.0021186 k( 447) = ( -0.2727273 0.2714397 0.5079840), wk = 0.0021186 k( 448) = ( -0.2818182 0.2804877 0.5079840), wk = 0.0021186 k( 449) = ( -0.2909091 0.2895357 0.5079840), wk = 0.0021186 k( 450) = ( -0.3000000 0.2985837 0.5079840), wk = 0.0021186 k( 451) = ( -0.3090909 0.3076317 0.5079840), wk = 0.0021186 k( 452) = ( -0.3181818 0.3166797 0.5079840), wk = 0.0021186 k( 453) = ( -0.3272727 0.3257276 0.5079840), wk = 0.0021186 k( 454) = ( -0.3363636 0.3347756 0.5079840), wk = 0.0021186 k( 455) = ( -0.3454546 0.3438236 0.5079840), wk = 0.0021186 k( 456) = ( -0.3545454 0.3528716 0.5079840), wk = 0.0021186 k( 457) = ( -0.3636364 0.3619196 0.5079840), wk = 0.0021186 k( 458) = ( -0.3727273 0.3709676 0.5079840), wk = 0.0021186 k( 459) = ( -0.3818182 0.3800156 0.5079840), wk = 0.0021186 k( 460) = ( -0.3909091 0.3890636 0.5079840), wk = 0.0021186 k( 461) = ( -0.4000000 0.3981116 0.5079840), wk = 0.0021186 k( 462) = ( -0.4090909 0.4071595 0.5079840), wk = 0.0021186 k( 463) = ( -0.4181818 0.4162075 0.5079840), wk = 0.0021186 k( 464) = ( -0.4272727 0.4252555 0.5079840), wk = 0.0021186 k( 465) = ( -0.4363636 0.4343035 0.5079840), wk = 0.0021186 k( 466) = ( -0.4454546 0.4433515 0.5079840), wk = 0.0021186 k( 467) = ( -0.4545455 0.4523995 0.5079840), wk = 0.0021186 k( 468) = ( -0.4636364 0.4614475 0.5079840), wk = 0.0021186 k( 469) = ( -0.4727273 0.4704955 0.5079840), wk = 0.0021186 k( 470) = ( -0.4818182 0.4795435 0.5079840), wk = 0.0021186 k( 471) = ( -0.4909091 0.4885915 0.5079840), wk = 0.0021186 k( 472) = ( -0.5000000 0.4976394 0.5079840), wk = 0.0021186 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 2) = ( 0.0090481 0.0090481 0.0000000), wk = 0.0021186 k( 3) = ( 0.0180962 0.0180962 0.0000000), wk = 0.0021186 k( 4) = ( 0.0271443 0.0271443 -0.0000000), wk = 0.0021186 k( 5) = ( 0.0361924 0.0361924 0.0000000), wk = 0.0021186 k( 6) = ( 0.0452405 0.0452405 0.0000000), wk = 0.0021186 k( 7) = ( 0.0542885 0.0542885 0.0000000), wk = 0.0021186 k( 8) = ( 0.0633366 0.0633366 0.0000000), wk = 0.0021186 k( 9) = ( 0.0723847 0.0723847 0.0000000), wk = 0.0021186 k( 10) = ( 0.0814328 0.0814328 -0.0000000), wk = 0.0021186 k( 11) = ( 0.0904809 0.0904809 0.0000000), wk = 0.0021186 k( 12) = ( 0.0995290 0.0995290 0.0000000), wk = 0.0021186 k( 13) = ( 0.1085771 0.1085771 0.0000000), wk = 0.0021186 k( 14) = ( 0.1176252 0.1176252 0.0000000), wk = 0.0021186 k( 15) = ( 0.1266733 0.1266733 0.0000000), wk = 0.0021186 k( 16) = ( 0.1357214 0.1357214 0.0000000), wk = 0.0021186 k( 17) = ( 0.1447695 0.1447695 0.0000000), wk = 0.0021186 k( 18) = ( 0.1538175 0.1538175 0.0000000), wk = 0.0021186 k( 19) = ( 0.1628656 0.1628656 -0.0000000), wk = 0.0021186 k( 20) = ( 0.1719137 0.1719137 0.0000000), wk = 0.0021186 k( 21) = ( 0.1809618 0.1809618 0.0000000), wk = 0.0021186 k( 22) = ( 0.1900099 0.1900099 0.0000000), wk = 0.0021186 k( 23) = ( 0.1990580 0.1990580 0.0000000), wk = 0.0021186 k( 24) = ( 0.2081061 0.2081061 0.0000000), wk = 0.0021186 k( 25) = ( 0.2171542 0.2171542 0.0000000), wk = 0.0021186 k( 26) = ( 0.2262023 0.2262023 0.0000000), wk = 0.0021186 k( 27) = ( 0.2352504 0.2352504 0.0000000), wk = 0.0021186 k( 28) = ( 0.2442985 0.2442985 0.0000000), wk = 0.0021186 k( 29) = ( 0.2533466 0.2533466 0.0000000), wk = 0.0021186 k( 30) = ( 0.2623947 0.2623947 0.0000000), wk = 0.0021186 k( 31) = ( 0.2714427 0.2714427 0.0000000), wk = 0.0021186 k( 32) = ( 0.2804908 0.2804908 -0.0000000), wk = 0.0021186 k( 33) = ( 0.2895389 0.2895389 0.0000000), wk = 0.0021186 k( 34) = ( 0.2985870 0.2985870 0.0000000), wk = 0.0021186 k( 35) = ( 0.3076351 0.3076351 0.0000000), wk = 0.0021186 k( 36) = ( 0.3166832 0.3166832 0.0000000), wk = 0.0021186 k( 37) = ( 0.3257313 0.3257313 0.0000000), wk = 0.0021186 k( 38) = ( 0.3347794 0.3347794 -0.0000000), wk = 0.0021186 k( 39) = ( 0.3438275 0.3438275 0.0000000), wk = 0.0021186 k( 40) = ( 0.3528756 0.3528756 0.0000000), wk = 0.0021186 k( 41) = ( 0.3619236 0.3619237 0.0000000), wk = 0.0021186 k( 42) = ( 0.3709717 0.3709717 0.0000000), wk = 0.0021186 k( 43) = ( 0.3800198 0.3800198 0.0000000), wk = 0.0021186 k( 44) = ( 0.3890679 0.3890679 0.0000000), wk = 0.0021186 k( 45) = ( 0.3981160 0.3981160 0.0000000), wk = 0.0021186 k( 46) = ( 0.4071641 0.4071641 0.0000000), wk = 0.0021186 k( 47) = ( 0.4162122 0.4162122 0.0000000), wk = 0.0021186 k( 48) = ( 0.4252603 0.4252603 0.0000000), wk = 0.0021186 k( 49) = ( 0.4343084 0.4343084 0.0000000), wk = 0.0021186 k( 50) = ( 0.4433565 0.4433565 0.0000000), wk = 0.0021186 k( 51) = ( 0.4524046 0.4524046 0.0000000), wk = 0.0021186 k( 52) = ( 0.4614527 0.4614527 0.0000000), wk = 0.0021186 k( 53) = ( 0.4705008 0.4705008 0.0000000), wk = 0.0021186 k( 54) = ( 0.4795488 0.4795488 0.0000000), wk = 0.0021186 k( 55) = ( 0.4885969 0.4885969 0.0000000), wk = 0.0021186 k( 56) = ( 0.4976450 0.4976450 0.0000000), wk = 0.0021186 k( 57) = ( 0.4976450 0.4976450 0.0000000), wk = 0.0021186 k( 58) = ( 0.4848849 0.4977054 0.0000000), wk = 0.0021186 k( 59) = ( 0.4721248 0.4977658 0.0000000), wk = 0.0021186 k( 60) = ( 0.4593646 0.4978262 0.0000000), wk = 0.0021186 k( 61) = ( 0.4466045 0.4978866 0.0000000), wk = 0.0021186 k( 62) = ( 0.4338444 0.4979469 0.0000000), wk = 0.0021186 k( 63) = ( 0.4210842 0.4980073 0.0000000), wk = 0.0021186 k( 64) = ( 0.4083241 0.4980677 0.0000000), wk = 0.0021186 k( 65) = ( 0.3955640 0.4981281 0.0000000), wk = 0.0021186 k( 66) = ( 0.3828039 0.4981885 0.0000000), wk = 0.0021186 k( 67) = ( 0.3700437 0.4982489 0.0000000), wk = 0.0021186 k( 68) = ( 0.3572836 0.4983092 0.0000000), wk = 0.0021186 k( 69) = ( 0.3445235 0.4983696 0.0000000), wk = 0.0021186 k( 70) = ( 0.3317634 0.4984300 0.0000000), wk = 0.0021186 k( 71) = ( 0.3190032 0.4984904 0.0000000), wk = 0.0021186 k( 72) = ( 0.3062431 0.4985508 0.0000000), wk = 0.0021186 k( 73) = ( 0.2934830 0.4986112 -0.0000000), wk = 0.0021186 k( 74) = ( 0.2807228 0.4986716 0.0000000), wk = 0.0021186 k( 75) = ( 0.2679627 0.4987319 0.0000000), wk = 0.0021186 k( 76) = ( 0.2552026 0.4987923 0.0000000), wk = 0.0021186 k( 77) = ( 0.2424425 0.4988527 0.0000000), wk = 0.0021186 k( 78) = ( 0.2296823 0.4989131 0.0000000), wk = 0.0021186 k( 79) = ( 0.2169222 0.4989735 0.0000000), wk = 0.0021186 k( 80) = ( 0.2041621 0.4990339 0.0000000), wk = 0.0021186 k( 81) = ( 0.1914019 0.4990942 0.0000000), wk = 0.0021186 k( 82) = ( 0.1786418 0.4991546 0.0000000), wk = 0.0021186 k( 83) = ( 0.1658817 0.4992150 -0.0000000), wk = 0.0021186 k( 84) = ( 0.1531215 0.4992754 0.0000000), wk = 0.0021186 k( 85) = ( 0.1403614 0.4993358 0.0000000), wk = 0.0021186 k( 86) = ( 0.1276013 0.4993962 0.0000000), wk = 0.0021186 k( 87) = ( 0.1148412 0.4994565 0.0000000), wk = 0.0021186 k( 88) = ( 0.1020810 0.4995169 0.0000000), wk = 0.0021186 k( 89) = ( 0.0893209 0.4995773 0.0000000), wk = 0.0021186 k( 90) = ( 0.0765608 0.4996377 0.0000000), wk = 0.0021186 k( 91) = ( 0.0638006 0.4996981 -0.0000000), wk = 0.0021186 k( 92) = ( 0.0510405 0.4997585 0.0000000), wk = 0.0021186 k( 93) = ( 0.0382804 0.4998188 0.0000000), wk = 0.0021186 k( 94) = ( 0.0255203 0.4998792 0.0000000), wk = 0.0021186 k( 95) = ( 0.0127601 0.4999396 0.0000000), wk = 0.0021186 k( 96) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021186 k( 97) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021186 k( 98) = ( 0.0000000 0.5000000 0.0125000), wk = 0.0021186 k( 99) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0021186 k( 100) = ( 0.0000000 0.5000000 0.0375000), wk = 0.0021186 k( 101) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0021186 k( 102) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0021186 k( 103) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0021186 k( 104) = ( 0.0000000 0.5000000 0.0875000), wk = 0.0021186 k( 105) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0021186 k( 106) = ( 0.0000000 0.5000000 0.1125000), wk = 0.0021186 k( 107) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0021186 k( 108) = ( 0.0000000 0.5000000 0.1375000), wk = 0.0021186 k( 109) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0021186 k( 110) = ( 0.0000000 0.5000000 0.1625000), wk = 0.0021186 k( 111) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0021186 k( 112) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0021186 k( 113) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0021186 k( 114) = ( 0.0000000 0.5000000 0.2125000), wk = 0.0021186 k( 115) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0021186 k( 116) = ( 0.0000000 0.5000000 0.2375000), wk = 0.0021186 k( 117) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0021186 k( 118) = ( 0.0000000 0.5000000 0.2625000), wk = 0.0021186 k( 119) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0021186 k( 120) = ( 0.0000000 0.5000000 0.2875000), wk = 0.0021186 k( 121) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0021186 k( 122) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0021186 k( 123) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0021186 k( 124) = ( 0.0000000 0.5000000 0.3375000), wk = 0.0021186 k( 125) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0021186 k( 126) = ( 0.0000000 0.5000000 0.3625000), wk = 0.0021186 k( 127) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0021186 k( 128) = ( 0.0000000 0.5000000 0.3875000), wk = 0.0021186 k( 129) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0021186 k( 130) = ( 0.0000000 0.5000000 0.4125000), wk = 0.0021186 k( 131) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0021186 k( 132) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0021186 k( 133) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0021186 k( 134) = ( 0.0000000 0.5000000 0.4625000), wk = 0.0021186 k( 135) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0021186 k( 136) = ( 0.0000000 0.5000000 0.4875000), wk = 0.0021186 k( 137) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021186 k( 138) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021186 k( 139) = ( 0.0127601 0.4999396 0.5000000), wk = 0.0021186 k( 140) = ( 0.0255203 0.4998792 0.5000000), wk = 0.0021186 k( 141) = ( 0.0382804 0.4998188 0.5000000), wk = 0.0021186 k( 142) = ( 0.0510405 0.4997585 0.5000000), wk = 0.0021186 k( 143) = ( 0.0638006 0.4996981 0.5000000), wk = 0.0021186 k( 144) = ( 0.0765608 0.4996377 0.5000000), wk = 0.0021186 k( 145) = ( 0.0893209 0.4995773 0.5000000), wk = 0.0021186 k( 146) = ( 0.1020810 0.4995169 0.5000000), wk = 0.0021186 k( 147) = ( 0.1148412 0.4994565 0.5000000), wk = 0.0021186 k( 148) = ( 0.1276013 0.4993962 0.5000000), wk = 0.0021186 k( 149) = ( 0.1403614 0.4993358 0.5000000), wk = 0.0021186 k( 150) = ( 0.1531215 0.4992754 0.5000000), wk = 0.0021186 k( 151) = ( 0.1658817 0.4992150 0.5000000), wk = 0.0021186 k( 152) = ( 0.1786418 0.4991546 0.5000000), wk = 0.0021186 k( 153) = ( 0.1914019 0.4990942 0.5000000), wk = 0.0021186 k( 154) = ( 0.2041621 0.4990339 0.5000000), wk = 0.0021186 k( 155) = ( 0.2169222 0.4989735 0.5000000), wk = 0.0021186 k( 156) = ( 0.2296823 0.4989131 0.5000000), wk = 0.0021186 k( 157) = ( 0.2424425 0.4988527 0.5000000), wk = 0.0021186 k( 158) = ( 0.2552026 0.4987923 0.5000000), wk = 0.0021186 k( 159) = ( 0.2679627 0.4987319 0.5000000), wk = 0.0021186 k( 160) = ( 0.2807228 0.4986716 0.5000000), wk = 0.0021186 k( 161) = ( 0.2934830 0.4986112 0.5000000), wk = 0.0021186 k( 162) = ( 0.3062431 0.4985508 0.5000000), wk = 0.0021186 k( 163) = ( 0.3190032 0.4984904 0.5000000), wk = 0.0021186 k( 164) = ( 0.3317634 0.4984300 0.5000000), wk = 0.0021186 k( 165) = ( 0.3445235 0.4983696 0.5000000), wk = 0.0021186 k( 166) = ( 0.3572836 0.4983092 0.5000000), wk = 0.0021186 k( 167) = ( 0.3700437 0.4982489 0.5000000), wk = 0.0021186 k( 168) = ( 0.3828039 0.4981885 0.5000000), wk = 0.0021186 k( 169) = ( 0.3955640 0.4981281 0.5000000), wk = 0.0021186 k( 170) = ( 0.4083241 0.4980677 0.5000000), wk = 0.0021186 k( 171) = ( 0.4210842 0.4980073 0.5000000), wk = 0.0021186 k( 172) = ( 0.4338444 0.4979469 0.5000000), wk = 0.0021186 k( 173) = ( 0.4466045 0.4978866 0.5000000), wk = 0.0021186 k( 174) = ( 0.4593646 0.4978262 0.5000000), wk = 0.0021186 k( 175) = ( 0.4721248 0.4977658 0.5000000), wk = 0.0021186 k( 176) = ( 0.4848849 0.4977054 0.5000000), wk = 0.0021186 k( 177) = ( 0.4976450 0.4976450 0.5000000), wk = 0.0021186 k( 178) = ( 0.4976450 0.4976450 0.5000000), wk = 0.0021186 k( 179) = ( 0.4885969 0.4885969 0.5000000), wk = 0.0021186 k( 180) = ( 0.4795488 0.4795488 0.5000000), wk = 0.0021186 k( 181) = ( 0.4705008 0.4705008 0.5000000), wk = 0.0021186 k( 182) = ( 0.4614527 0.4614527 0.5000000), wk = 0.0021186 k( 183) = ( 0.4524046 0.4524046 0.5000000), wk = 0.0021186 k( 184) = ( 0.4433565 0.4433565 0.5000000), wk = 0.0021186 k( 185) = ( 0.4343084 0.4343084 0.5000000), wk = 0.0021186 k( 186) = ( 0.4252603 0.4252603 0.5000000), wk = 0.0021186 k( 187) = ( 0.4162122 0.4162122 0.5000000), wk = 0.0021186 k( 188) = ( 0.4071641 0.4071641 0.5000000), wk = 0.0021186 k( 189) = ( 0.3981160 0.3981160 0.5000000), wk = 0.0021186 k( 190) = ( 0.3890679 0.3890679 0.5000000), wk = 0.0021186 k( 191) = ( 0.3800198 0.3800198 0.5000000), wk = 0.0021186 k( 192) = ( 0.3709717 0.3709717 0.5000000), wk = 0.0021186 k( 193) = ( 0.3619236 0.3619237 0.5000000), wk = 0.0021186 k( 194) = ( 0.3528756 0.3528756 0.5000000), wk = 0.0021186 k( 195) = ( 0.3438275 0.3438275 0.5000000), wk = 0.0021186 k( 196) = ( 0.3347794 0.3347794 0.5000000), wk = 0.0021186 k( 197) = ( 0.3257313 0.3257313 0.5000000), wk = 0.0021186 k( 198) = ( 0.3166832 0.3166832 0.5000000), wk = 0.0021186 k( 199) = ( 0.3076351 0.3076351 0.5000000), wk = 0.0021186 k( 200) = ( 0.2985870 0.2985870 0.5000000), wk = 0.0021186 k( 201) = ( 0.2895389 0.2895389 0.5000000), wk = 0.0021186 k( 202) = ( 0.2804908 0.2804908 0.5000000), wk = 0.0021186 k( 203) = ( 0.2714427 0.2714427 0.5000000), wk = 0.0021186 k( 204) = ( 0.2623947 0.2623947 0.5000000), wk = 0.0021186 k( 205) = ( 0.2533466 0.2533466 0.5000000), wk = 0.0021186 k( 206) = ( 0.2442985 0.2442985 0.5000000), wk = 0.0021186 k( 207) = ( 0.2352504 0.2352504 0.5000000), wk = 0.0021186 k( 208) = ( 0.2262023 0.2262023 0.5000000), wk = 0.0021186 k( 209) = ( 0.2171542 0.2171542 0.5000000), wk = 0.0021186 k( 210) = ( 0.2081061 0.2081061 0.5000000), wk = 0.0021186 k( 211) = ( 0.1990580 0.1990580 0.5000000), wk = 0.0021186 k( 212) = ( 0.1900099 0.1900099 0.5000000), wk = 0.0021186 k( 213) = ( 0.1809618 0.1809618 0.5000000), wk = 0.0021186 k( 214) = ( 0.1719137 0.1719137 0.5000000), wk = 0.0021186 k( 215) = ( 0.1628656 0.1628656 0.5000000), wk = 0.0021186 k( 216) = ( 0.1538175 0.1538175 0.5000000), wk = 0.0021186 k( 217) = ( 0.1447695 0.1447695 0.5000000), wk = 0.0021186 k( 218) = ( 0.1357214 0.1357214 0.5000000), wk = 0.0021186 k( 219) = ( 0.1266733 0.1266733 0.5000000), wk = 0.0021186 k( 220) = ( 0.1176252 0.1176252 0.5000000), wk = 0.0021186 k( 221) = ( 0.1085771 0.1085771 0.5000000), wk = 0.0021186 k( 222) = ( 0.0995290 0.0995290 0.5000000), wk = 0.0021186 k( 223) = ( 0.0904809 0.0904809 0.5000000), wk = 0.0021186 k( 224) = ( 0.0814328 0.0814328 0.5000000), wk = 0.0021186 k( 225) = ( 0.0723847 0.0723847 0.5000000), wk = 0.0021186 k( 226) = ( 0.0633366 0.0633366 0.5000000), wk = 0.0021186 k( 227) = ( 0.0542885 0.0542885 0.5000000), wk = 0.0021186 k( 228) = ( 0.0452405 0.0452405 0.5000000), wk = 0.0021186 k( 229) = ( 0.0361924 0.0361924 0.5000000), wk = 0.0021186 k( 230) = ( 0.0271443 0.0271443 0.5000000), wk = 0.0021186 k( 231) = ( 0.0180962 0.0180962 0.5000000), wk = 0.0021186 k( 232) = ( 0.0090481 0.0090481 0.5000000), wk = 0.0021186 k( 233) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021186 k( 234) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021186 k( 235) = ( 0.0000000 0.0000000 0.4875000), wk = 0.0021186 k( 236) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0021186 k( 237) = ( 0.0000000 0.0000000 0.4625000), wk = 0.0021186 k( 238) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0021186 k( 239) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0021186 k( 240) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0021186 k( 241) = ( 0.0000000 0.0000000 0.4125000), wk = 0.0021186 k( 242) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0021186 k( 243) = ( 0.0000000 0.0000000 0.3875000), wk = 0.0021186 k( 244) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0021186 k( 245) = ( 0.0000000 0.0000000 0.3625000), wk = 0.0021186 k( 246) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0021186 k( 247) = ( 0.0000000 0.0000000 0.3375000), wk = 0.0021186 k( 248) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0021186 k( 249) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0021186 k( 250) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0021186 k( 251) = ( 0.0000000 0.0000000 0.2875000), wk = 0.0021186 k( 252) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0021186 k( 253) = ( 0.0000000 0.0000000 0.2625000), wk = 0.0021186 k( 254) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0021186 k( 255) = ( 0.0000000 0.0000000 0.2375000), wk = 0.0021186 k( 256) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0021186 k( 257) = ( 0.0000000 0.0000000 0.2125000), wk = 0.0021186 k( 258) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0021186 k( 259) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0021186 k( 260) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0021186 k( 261) = ( 0.0000000 0.0000000 0.1625000), wk = 0.0021186 k( 262) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0021186 k( 263) = ( 0.0000000 0.0000000 0.1375000), wk = 0.0021186 k( 264) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0021186 k( 265) = ( 0.0000000 0.0000000 0.1125000), wk = 0.0021186 k( 266) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0021186 k( 267) = ( 0.0000000 0.0000000 0.0875000), wk = 0.0021186 k( 268) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0021186 k( 269) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0021186 k( 270) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0021186 k( 271) = ( 0.0000000 0.0000000 0.0375000), wk = 0.0021186 k( 272) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0021186 k( 273) = ( 0.0000000 0.0000000 0.0125000), wk = 0.0021186 k( 274) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 275) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021186 k( 276) = ( -0.0090909 0.0090909 0.0000000), wk = 0.0021186 k( 277) = ( -0.0181818 0.0181818 0.0000000), wk = 0.0021186 k( 278) = ( -0.0272727 0.0272727 0.0000000), wk = 0.0021186 k( 279) = ( -0.0363636 0.0363636 0.0000000), wk = 0.0021186 k( 280) = ( -0.0454546 0.0454546 0.0000000), wk = 0.0021186 k( 281) = ( -0.0545455 0.0545455 0.0000000), wk = 0.0021186 k( 282) = ( -0.0636364 0.0636364 0.0000000), wk = 0.0021186 k( 283) = ( -0.0727273 0.0727273 0.0000000), wk = 0.0021186 k( 284) = ( -0.0818182 0.0818182 0.0000000), wk = 0.0021186 k( 285) = ( -0.0909091 0.0909091 0.0000000), wk = 0.0021186 k( 286) = ( -0.1000000 0.1000000 0.0000000), wk = 0.0021186 k( 287) = ( -0.1090909 0.1090909 0.0000000), wk = 0.0021186 k( 288) = ( -0.1181818 0.1181818 0.0000000), wk = 0.0021186 k( 289) = ( -0.1272727 0.1272727 0.0000000), wk = 0.0021186 k( 290) = ( -0.1363636 0.1363636 0.0000000), wk = 0.0021186 k( 291) = ( -0.1454545 0.1454546 0.0000000), wk = 0.0021186 k( 292) = ( -0.1545455 0.1545455 0.0000000), wk = 0.0021186 k( 293) = ( -0.1636364 0.1636364 0.0000000), wk = 0.0021186 k( 294) = ( -0.1727273 0.1727273 0.0000000), wk = 0.0021186 k( 295) = ( -0.1818182 0.1818182 0.0000000), wk = 0.0021186 k( 296) = ( -0.1909091 0.1909091 0.0000000), wk = 0.0021186 k( 297) = ( -0.2000000 0.2000000 0.0000000), wk = 0.0021186 k( 298) = ( -0.2090909 0.2090909 0.0000000), wk = 0.0021186 k( 299) = ( -0.2181818 0.2181818 0.0000000), wk = 0.0021186 k( 300) = ( -0.2272727 0.2272727 0.0000000), wk = 0.0021186 k( 301) = ( -0.2363636 0.2363636 0.0000000), wk = 0.0021186 k( 302) = ( -0.2454545 0.2454545 0.0000000), wk = 0.0021186 k( 303) = ( -0.2545455 0.2545454 -0.0000000), wk = 0.0021186 k( 304) = ( -0.2636364 0.2636364 -0.0000000), wk = 0.0021186 k( 305) = ( -0.2727273 0.2727273 0.0000000), wk = 0.0021186 k( 306) = ( -0.2818182 0.2818182 0.0000000), wk = 0.0021186 k( 307) = ( -0.2909091 0.2909091 0.0000000), wk = 0.0021186 k( 308) = ( -0.3000000 0.3000000 0.0000000), wk = 0.0021186 k( 309) = ( -0.3090909 0.3090909 0.0000000), wk = 0.0021186 k( 310) = ( -0.3181818 0.3181818 -0.0000000), wk = 0.0021186 k( 311) = ( -0.3272727 0.3272727 0.0000000), wk = 0.0021186 k( 312) = ( -0.3363636 0.3363636 0.0000000), wk = 0.0021186 k( 313) = ( -0.3454546 0.3454546 0.0000000), wk = 0.0021186 k( 314) = ( -0.3545454 0.3545455 0.0000000), wk = 0.0021186 k( 315) = ( -0.3636364 0.3636364 0.0000000), wk = 0.0021186 k( 316) = ( -0.3727273 0.3727273 0.0000000), wk = 0.0021186 k( 317) = ( -0.3818182 0.3818182 0.0000000), wk = 0.0021186 k( 318) = ( -0.3909091 0.3909091 0.0000000), wk = 0.0021186 k( 319) = ( -0.4000000 0.4000000 0.0000000), wk = 0.0021186 k( 320) = ( -0.4090909 0.4090909 0.0000000), wk = 0.0021186 k( 321) = ( -0.4181818 0.4181818 0.0000000), wk = 0.0021186 k( 322) = ( -0.4272727 0.4272727 0.0000000), wk = 0.0021186 k( 323) = ( -0.4363636 0.4363636 0.0000000), wk = 0.0021186 k( 324) = ( -0.4454546 0.4454546 0.0000000), wk = 0.0021186 k( 325) = ( -0.4545455 0.4545455 0.0000000), wk = 0.0021186 k( 326) = ( -0.4636364 0.4636364 0.0000000), wk = 0.0021186 k( 327) = ( -0.4727273 0.4727273 0.0000000), wk = 0.0021186 k( 328) = ( -0.4818182 0.4818182 0.0000000), wk = 0.0021186 k( 329) = ( -0.4909091 0.4909091 0.0000000), wk = 0.0021186 k( 330) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0021186 k( 331) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0021186 k( 332) = ( -0.4976450 0.5023550 -0.0000000), wk = 0.0021186 k( 333) = ( -0.4976450 0.5023550 -0.0000000), wk = 0.0021186 k( 334) = ( -0.4976450 0.5023550 0.0125000), wk = 0.0021186 k( 335) = ( -0.4976450 0.5023550 0.0250000), wk = 0.0021186 k( 336) = ( -0.4976450 0.5023550 0.0375000), wk = 0.0021186 k( 337) = ( -0.4976450 0.5023550 0.0500000), wk = 0.0021186 k( 338) = ( -0.4976450 0.5023550 0.0625000), wk = 0.0021186 k( 339) = ( -0.4976450 0.5023550 0.0750000), wk = 0.0021186 k( 340) = ( -0.4976450 0.5023550 0.0875000), wk = 0.0021186 k( 341) = ( -0.4976450 0.5023550 0.1000000), wk = 0.0021186 k( 342) = ( -0.4976450 0.5023550 0.1125000), wk = 0.0021186 k( 343) = ( -0.4976450 0.5023550 0.1250000), wk = 0.0021186 k( 344) = ( -0.4976450 0.5023550 0.1375000), wk = 0.0021186 k( 345) = ( -0.4976450 0.5023550 0.1500000), wk = 0.0021186 k( 346) = ( -0.4976450 0.5023550 0.1625000), wk = 0.0021186 k( 347) = ( -0.4976450 0.5023550 0.1750000), wk = 0.0021186 k( 348) = ( -0.4976450 0.5023550 0.1875000), wk = 0.0021186 k( 349) = ( -0.4976450 0.5023550 0.2000000), wk = 0.0021186 k( 350) = ( -0.4976450 0.5023550 0.2125000), wk = 0.0021186 k( 351) = ( -0.4976450 0.5023550 0.2250000), wk = 0.0021186 k( 352) = ( -0.4976450 0.5023550 0.2375000), wk = 0.0021186 k( 353) = ( -0.4976450 0.5023550 0.2500000), wk = 0.0021186 k( 354) = ( -0.4976450 0.5023550 0.2625000), wk = 0.0021186 k( 355) = ( -0.4976450 0.5023550 0.2750000), wk = 0.0021186 k( 356) = ( -0.4976450 0.5023550 0.2875000), wk = 0.0021186 k( 357) = ( -0.4976450 0.5023550 0.3000000), wk = 0.0021186 k( 358) = ( -0.4976450 0.5023550 0.3125000), wk = 0.0021186 k( 359) = ( -0.4976450 0.5023550 0.3250000), wk = 0.0021186 k( 360) = ( -0.4976450 0.5023550 0.3375000), wk = 0.0021186 k( 361) = ( -0.4976450 0.5023550 0.3500000), wk = 0.0021186 k( 362) = ( -0.4976450 0.5023550 0.3625000), wk = 0.0021186 k( 363) = ( -0.4976450 0.5023550 0.3750000), wk = 0.0021186 k( 364) = ( -0.4976450 0.5023550 0.3875000), wk = 0.0021186 k( 365) = ( -0.4976450 0.5023550 0.4000000), wk = 0.0021186 k( 366) = ( -0.4976450 0.5023550 0.4125000), wk = 0.0021186 k( 367) = ( -0.4976450 0.5023550 0.4250000), wk = 0.0021186 k( 368) = ( -0.4976450 0.5023550 0.4375000), wk = 0.0021186 k( 369) = ( -0.4976450 0.5023550 0.4500000), wk = 0.0021186 k( 370) = ( -0.4976450 0.5023550 0.4625000), wk = 0.0021186 k( 371) = ( -0.4976450 0.5023550 0.4750000), wk = 0.0021186 k( 372) = ( -0.4976450 0.5023550 0.4875000), wk = 0.0021186 k( 373) = ( -0.4976450 0.5023550 0.5000000), wk = 0.0021186 k( 374) = ( -0.4976450 0.5023550 0.5000000), wk = 0.0021186 k( 375) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021186 k( 376) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021186 k( 377) = ( -0.5000000 0.5000000 0.4875000), wk = 0.0021186 k( 378) = ( -0.5000000 0.5000000 0.4750000), wk = 0.0021186 k( 379) = ( -0.5000000 0.5000000 0.4625000), wk = 0.0021186 k( 380) = ( -0.5000000 0.5000000 0.4500000), wk = 0.0021186 k( 381) = ( -0.5000000 0.5000000 0.4375000), wk = 0.0021186 k( 382) = ( -0.5000000 0.5000000 0.4250000), wk = 0.0021186 k( 383) = ( -0.5000000 0.5000000 0.4125000), wk = 0.0021186 k( 384) = ( -0.5000000 0.5000000 0.4000000), wk = 0.0021186 k( 385) = ( -0.5000000 0.5000000 0.3875000), wk = 0.0021186 k( 386) = ( -0.5000000 0.5000000 0.3750000), wk = 0.0021186 k( 387) = ( -0.5000000 0.5000000 0.3625000), wk = 0.0021186 k( 388) = ( -0.5000000 0.5000000 0.3500000), wk = 0.0021186 k( 389) = ( -0.5000000 0.5000000 0.3375000), wk = 0.0021186 k( 390) = ( -0.5000000 0.5000000 0.3250000), wk = 0.0021186 k( 391) = ( -0.5000000 0.5000000 0.3125000), wk = 0.0021186 k( 392) = ( -0.5000000 0.5000000 0.3000000), wk = 0.0021186 k( 393) = ( -0.5000000 0.5000000 0.2875000), wk = 0.0021186 k( 394) = ( -0.5000000 0.5000000 0.2750000), wk = 0.0021186 k( 395) = ( -0.5000000 0.5000000 0.2625000), wk = 0.0021186 k( 396) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0021186 k( 397) = ( -0.5000000 0.5000000 0.2375000), wk = 0.0021186 k( 398) = ( -0.5000000 0.5000000 0.2250000), wk = 0.0021186 k( 399) = ( -0.5000000 0.5000000 0.2125000), wk = 0.0021186 k( 400) = ( -0.5000000 0.5000000 0.2000000), wk = 0.0021186 k( 401) = ( -0.5000000 0.5000000 0.1875000), wk = 0.0021186 k( 402) = ( -0.5000000 0.5000000 0.1750000), wk = 0.0021186 k( 403) = ( -0.5000000 0.5000000 0.1625000), wk = 0.0021186 k( 404) = ( -0.5000000 0.5000000 0.1500000), wk = 0.0021186 k( 405) = ( -0.5000000 0.5000000 0.1375000), wk = 0.0021186 k( 406) = ( -0.5000000 0.5000000 0.1250000), wk = 0.0021186 k( 407) = ( -0.5000000 0.5000000 0.1125000), wk = 0.0021186 k( 408) = ( -0.5000000 0.5000000 0.1000000), wk = 0.0021186 k( 409) = ( -0.5000000 0.5000000 0.0875000), wk = 0.0021186 k( 410) = ( -0.5000000 0.5000000 0.0750000), wk = 0.0021186 k( 411) = ( -0.5000000 0.5000000 0.0625000), wk = 0.0021186 k( 412) = ( -0.5000000 0.5000000 0.0500000), wk = 0.0021186 k( 413) = ( -0.5000000 0.5000000 0.0375000), wk = 0.0021186 k( 414) = ( -0.5000000 0.5000000 0.0250000), wk = 0.0021186 k( 415) = ( -0.5000000 0.5000000 0.0125000), wk = 0.0021186 k( 416) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0021186 k( 417) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021186 k( 418) = ( -0.0090909 0.0090909 0.5000000), wk = 0.0021186 k( 419) = ( -0.0181818 0.0181818 0.5000000), wk = 0.0021186 k( 420) = ( -0.0272727 0.0272727 0.5000000), wk = 0.0021186 k( 421) = ( -0.0363636 0.0363636 0.5000000), wk = 0.0021186 k( 422) = ( -0.0454546 0.0454546 0.5000000), wk = 0.0021186 k( 423) = ( -0.0545455 0.0545455 0.5000000), wk = 0.0021186 k( 424) = ( -0.0636364 0.0636364 0.5000000), wk = 0.0021186 k( 425) = ( -0.0727273 0.0727273 0.5000000), wk = 0.0021186 k( 426) = ( -0.0818182 0.0818182 0.5000000), wk = 0.0021186 k( 427) = ( -0.0909091 0.0909091 0.5000000), wk = 0.0021186 k( 428) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0021186 k( 429) = ( -0.1090909 0.1090909 0.5000000), wk = 0.0021186 k( 430) = ( -0.1181818 0.1181818 0.5000000), wk = 0.0021186 k( 431) = ( -0.1272727 0.1272727 0.5000000), wk = 0.0021186 k( 432) = ( -0.1363636 0.1363636 0.5000000), wk = 0.0021186 k( 433) = ( -0.1454545 0.1454546 0.5000000), wk = 0.0021186 k( 434) = ( -0.1545455 0.1545455 0.5000000), wk = 0.0021186 k( 435) = ( -0.1636364 0.1636364 0.5000000), wk = 0.0021186 k( 436) = ( -0.1727273 0.1727273 0.5000000), wk = 0.0021186 k( 437) = ( -0.1818182 0.1818182 0.5000000), wk = 0.0021186 k( 438) = ( -0.1909091 0.1909091 0.5000000), wk = 0.0021186 k( 439) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0021186 k( 440) = ( -0.2090909 0.2090909 0.5000000), wk = 0.0021186 k( 441) = ( -0.2181818 0.2181818 0.5000000), wk = 0.0021186 k( 442) = ( -0.2272727 0.2272727 0.5000000), wk = 0.0021186 k( 443) = ( -0.2363636 0.2363636 0.5000000), wk = 0.0021186 k( 444) = ( -0.2454545 0.2454545 0.5000000), wk = 0.0021186 k( 445) = ( -0.2545455 0.2545454 0.5000000), wk = 0.0021186 k( 446) = ( -0.2636364 0.2636364 0.5000000), wk = 0.0021186 k( 447) = ( -0.2727273 0.2727273 0.5000000), wk = 0.0021186 k( 448) = ( -0.2818182 0.2818182 0.5000000), wk = 0.0021186 k( 449) = ( -0.2909091 0.2909091 0.5000000), wk = 0.0021186 k( 450) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0021186 k( 451) = ( -0.3090909 0.3090909 0.5000000), wk = 0.0021186 k( 452) = ( -0.3181818 0.3181818 0.5000000), wk = 0.0021186 k( 453) = ( -0.3272727 0.3272727 0.5000000), wk = 0.0021186 k( 454) = ( -0.3363636 0.3363636 0.5000000), wk = 0.0021186 k( 455) = ( -0.3454546 0.3454546 0.5000000), wk = 0.0021186 k( 456) = ( -0.3545454 0.3545455 0.5000000), wk = 0.0021186 k( 457) = ( -0.3636364 0.3636364 0.5000000), wk = 0.0021186 k( 458) = ( -0.3727273 0.3727273 0.5000000), wk = 0.0021186 k( 459) = ( -0.3818182 0.3818182 0.5000000), wk = 0.0021186 k( 460) = ( -0.3909091 0.3909091 0.5000000), wk = 0.0021186 k( 461) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0021186 k( 462) = ( -0.4090909 0.4090909 0.5000000), wk = 0.0021186 k( 463) = ( -0.4181818 0.4181818 0.5000000), wk = 0.0021186 k( 464) = ( -0.4272727 0.4272727 0.5000000), wk = 0.0021186 k( 465) = ( -0.4363636 0.4363636 0.5000000), wk = 0.0021186 k( 466) = ( -0.4454546 0.4454546 0.5000000), wk = 0.0021186 k( 467) = ( -0.4545455 0.4545455 0.5000000), wk = 0.0021186 k( 468) = ( -0.4636364 0.4636364 0.5000000), wk = 0.0021186 k( 469) = ( -0.4727273 0.4727273 0.5000000), wk = 0.0021186 k( 470) = ( -0.4818182 0.4818182 0.5000000), wk = 0.0021186 k( 471) = ( -0.4909091 0.4909091 0.5000000), wk = 0.0021186 k( 472) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021186 Dense grid: 42983 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 19609 G-vectors FFT dimensions: ( 36, 36, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.08 Mb ( 104, 48) NL pseudopotentials 0.09 Mb ( 52, 110) Each V/rho on FFT grid 0.03 Mb ( 2025) Each G-vector array 0.01 Mb ( 897) G-vector shells 0.00 Mb ( 464) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.30 Mb ( 104, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.16 Mb ( 110, 2, 48) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./KNbO3.save/charge-density.dat Starting wfc are 66 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 45.9 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 49.1 secs Computing kpt #: 3 total cpu time spent up to now is 51.6 secs Computing kpt #: 4 total cpu time spent up to now is 54.5 secs Computing kpt #: 5 total cpu time spent up to now is 56.9 secs Computing kpt #: 6 total cpu time spent up to now is 59.6 secs Computing kpt #: 7 total cpu time spent up to now is 62.1 secs Computing kpt #: 8 total cpu time spent up to now is 63.9 secs Computing kpt #: 9 total cpu time spent up to now is 65.6 secs Computing kpt #: 10 total cpu time spent up to now is 67.2 secs Computing kpt #: 11 total cpu time spent up to now is 68.8 secs Computing kpt #: 12 total cpu time spent up to now is 70.3 secs Computing kpt #: 13 total cpu time spent up to now is 71.9 secs Computing kpt #: 14 total cpu time spent up to now is 73.4 secs Computing kpt #: 15 total cpu time spent up to now is 75.1 secs Computing kpt #: 16 total cpu time spent up to now is 76.7 secs Computing kpt #: 17 total cpu time spent up to now is 78.3 secs Computing kpt #: 18 total cpu time spent up to now is 79.7 secs Computing kpt #: 19 total cpu time spent up to now is 81.1 secs Computing kpt #: 20 total cpu time spent up to now is 82.6 secs Computing kpt #: 21 total cpu time spent up to now is 84.1 secs Computing kpt #: 22 total cpu time spent up to now is 85.4 secs Computing kpt #: 23 total cpu time spent up to now is 86.7 secs Computing kpt #: 24 total cpu time spent up to now is 88.1 secs Computing kpt #: 25 total cpu time spent up to now is 89.4 secs Computing kpt #: 26 total cpu time spent up to now is 90.9 secs Computing kpt #: 27 total cpu time spent up to now is 92.2 secs Computing kpt #: 28 total cpu time spent up to now is 93.4 secs Computing kpt #: 29 total cpu time spent up to now is 94.4 secs Computing kpt #: 30 total cpu time spent up to now is 95.7 secs Computing kpt #: 31 total cpu time spent up to now is 96.9 secs Computing kpt #: 32 total cpu time spent up to now is 97.8 secs Computing kpt #: 33 total cpu time spent up to now is 98.9 secs Computing kpt #: 34 total cpu time spent up to now is 100.0 secs Computing kpt #: 35 total cpu time spent up to now is 101.1 secs Computing kpt #: 36 total cpu time spent up to now is 102.1 secs Computing kpt #: 37 total cpu time spent up to now is 103.1 secs Computing kpt #: 38 total cpu time spent up to now is 104.1 secs Computing kpt #: 39 total cpu time spent up to now is 105.1 secs Computing kpt #: 40 total cpu time spent up to now is 106.1 secs Computing kpt #: 41 total cpu time spent up to now is 107.2 secs Computing kpt #: 42 total cpu time spent up to now is 108.2 secs Computing kpt #: 43 total cpu time spent up to now is 109.3 secs Computing kpt #: 44 total cpu time spent up to now is 110.3 secs Computing kpt #: 45 total cpu time spent up to now is 111.4 secs Computing kpt #: 46 total cpu time spent up to now is 112.5 secs Computing kpt #: 47 total cpu time spent up to now is 113.6 secs Computing kpt #: 48 total cpu time spent up to now is 114.8 secs Computing kpt #: 49 total cpu time spent up to now is 115.9 secs Computing kpt #: 50 total cpu time spent up to now is 117.0 secs Computing kpt #: 51 total cpu time spent up to now is 118.1 secs Computing kpt #: 52 total cpu time spent up to now is 119.1 secs Computing kpt #: 53 total cpu time spent up to now is 120.3 secs Computing kpt #: 54 total cpu time spent up to now is 121.4 secs Computing kpt #: 55 total cpu time spent up to now is 122.4 secs Computing kpt #: 56 total cpu time spent up to now is 123.5 secs Computing kpt #: 57 total cpu time spent up to now is 124.5 secs Computing kpt #: 58 total cpu time spent up to now is 125.5 secs Computing kpt #: 59 total cpu time spent up to now is 126.6 secs Computing kpt #: 60 total cpu time spent up to now is 127.6 secs Computing kpt #: 61 total cpu time spent up to now is 128.6 secs Computing kpt #: 62 total cpu time spent up to now is 129.6 secs Computing kpt #: 63 total cpu time spent up to now is 130.6 secs Computing kpt #: 64 total cpu time spent up to now is 131.7 secs Computing kpt #: 65 total cpu time spent up to now is 132.7 secs Computing kpt #: 66 total cpu time spent up to now is 133.7 secs Computing kpt #: 67 total cpu time spent up to now is 134.7 secs Computing kpt #: 68 total cpu time spent up to now is 135.7 secs Computing kpt #: 69 total cpu time spent up to now is 136.7 secs Computing kpt #: 70 total cpu time spent up to now is 137.8 secs Computing kpt #: 71 total cpu time spent up to now is 138.8 secs Computing kpt #: 72 total cpu time spent up to now is 139.8 secs Computing kpt #: 73 total cpu time spent up to now is 140.9 secs Computing kpt #: 74 total cpu time spent up to now is 141.9 secs Computing kpt #: 75 total cpu time spent up to now is 142.9 secs Computing kpt #: 76 total cpu time spent up to now is 143.9 secs Computing kpt #: 77 total cpu time spent up to now is 144.9 secs Computing kpt #: 78 total cpu time spent up to now is 145.9 secs Computing kpt #: 79 total cpu time spent up to now is 147.1 secs Computing kpt #: 80 total cpu time spent up to now is 148.1 secs Computing kpt #: 81 total cpu time spent up to now is 149.0 secs Computing kpt #: 82 total cpu time spent up to now is 150.0 secs Computing kpt #: 83 total cpu time spent up to now is 151.2 secs Computing kpt #: 84 total cpu time spent up to now is 152.1 secs Computing kpt #: 85 total cpu time spent up to now is 153.2 secs Computing kpt #: 86 total cpu time spent up to now is 154.4 secs Computing kpt #: 87 total cpu time spent up to now is 155.4 secs Computing kpt #: 88 total cpu time spent up to now is 156.6 secs Computing kpt #: 89 total cpu time spent up to now is 157.5 secs Computing kpt #: 90 total cpu time spent up to now is 158.5 secs Computing kpt #: 91 total cpu time spent up to now is 159.4 secs Computing kpt #: 92 total cpu time spent up to now is 160.4 secs Computing kpt #: 93 total cpu time spent up to now is 161.6 secs Computing kpt #: 94 total cpu time spent up to now is 162.8 secs Computing kpt #: 95 total cpu time spent up to now is 163.9 secs Computing kpt #: 96 total cpu time spent up to now is 165.0 secs Computing kpt #: 97 total cpu time spent up to now is 165.9 secs Computing kpt #: 98 total cpu time spent up to now is 167.0 secs Computing kpt #: 99 total cpu time spent up to now is 168.0 secs Computing kpt #: 100 total cpu time spent up to now is 169.1 secs Computing kpt #: 101 total cpu time spent up to now is 170.1 secs Computing kpt #: 102 total cpu time spent up to now is 171.3 secs Computing kpt #: 103 total cpu time spent up to now is 172.3 secs Computing kpt #: 104 total cpu time spent up to now is 173.4 secs Computing kpt #: 105 total cpu time spent up to now is 174.5 secs Computing kpt #: 106 total cpu time spent up to now is 175.6 secs Computing kpt #: 107 total cpu time spent up to now is 176.6 secs Computing kpt #: 108 total cpu time spent up to now is 177.5 secs Computing kpt #: 109 total cpu time spent up to now is 178.5 secs Computing kpt #: 110 total cpu time spent up to now is 179.6 secs Computing kpt #: 111 total cpu time spent up to now is 180.6 secs Computing kpt #: 112 total cpu time spent up to now is 181.7 secs Computing kpt #: 113 total cpu time spent up to now is 182.6 secs Computing kpt #: 114 total cpu time spent up to now is 183.6 secs Computing kpt #: 115 total cpu time spent up to now is 184.5 secs Computing kpt #: 116 total cpu time spent up to now is 185.5 secs Computing kpt #: 117 total cpu time spent up to now is 186.6 secs Computing kpt #: 118 total cpu time spent up to now is 187.6 secs Computing kpt #: 119 total cpu time spent up to now is 188.8 secs Computing kpt #: 120 total cpu time spent up to now is 190.3 secs Computing kpt #: 121 total cpu time spent up to now is 191.3 secs Computing kpt #: 122 total cpu time spent up to now is 192.3 secs Computing kpt #: 123 total cpu time spent up to now is 193.3 secs Computing kpt #: 124 total cpu time spent up to now is 194.5 secs Computing kpt #: 125 total cpu time spent up to now is 195.5 secs Computing kpt #: 126 total cpu time spent up to now is 196.5 secs Computing kpt #: 127 total cpu time spent up to now is 197.5 secs Computing kpt #: 128 total cpu time spent up to now is 198.5 secs Computing kpt #: 129 total cpu time spent up to now is 199.5 secs Computing kpt #: 130 total cpu time spent up to now is 200.5 secs Computing kpt #: 131 total cpu time spent up to now is 201.5 secs Computing kpt #: 132 total cpu time spent up to now is 202.5 secs Computing kpt #: 133 total cpu time spent up to now is 203.5 secs Computing kpt #: 134 total cpu time spent up to now is 204.5 secs Computing kpt #: 135 total cpu time spent up to now is 205.5 secs Computing kpt #: 136 total cpu time spent up to now is 206.5 secs Computing kpt #: 137 total cpu time spent up to now is 207.4 secs Computing kpt #: 138 total cpu time spent up to now is 208.4 secs Computing kpt #: 139 total cpu time spent up to now is 209.5 secs Computing kpt #: 140 total cpu time spent up to now is 210.5 secs Computing kpt #: 141 total cpu time spent up to now is 211.5 secs Computing kpt #: 142 total cpu time spent up to now is 212.6 secs Computing kpt #: 143 total cpu time spent up to now is 213.5 secs Computing kpt #: 144 total cpu time spent up to now is 214.5 secs Computing kpt #: 145 total cpu time spent up to now is 215.6 secs Computing kpt #: 146 total cpu time spent up to now is 216.7 secs Computing kpt #: 147 total cpu time spent up to now is 217.7 secs Computing kpt #: 148 total cpu time spent up to now is 218.8 secs Computing kpt #: 149 total cpu time spent up to now is 219.8 secs Computing kpt #: 150 total cpu time spent up to now is 220.9 secs Computing kpt #: 151 total cpu time spent up to now is 222.0 secs Computing kpt #: 152 total cpu time spent up to now is 223.2 secs Computing kpt #: 153 total cpu time spent up to now is 224.3 secs Computing kpt #: 154 total cpu time spent up to now is 225.5 secs Computing kpt #: 155 total cpu time spent up to now is 226.7 secs Computing kpt #: 156 total cpu time spent up to now is 227.9 secs Computing kpt #: 157 total cpu time spent up to now is 229.1 secs Computing kpt #: 158 total cpu time spent up to now is 230.3 secs Computing kpt #: 159 total cpu time spent up to now is 231.5 secs Computing kpt #: 160 total cpu time spent up to now is 232.8 secs Computing kpt #: 161 total cpu time spent up to now is 234.1 secs Computing kpt #: 162 total cpu time spent up to now is 235.4 secs Computing kpt #: 163 total cpu time spent up to now is 236.8 secs Computing kpt #: 164 total cpu time spent up to now is 238.3 secs Computing kpt #: 165 total cpu time spent up to now is 239.7 secs Computing kpt #: 166 total cpu time spent up to now is 241.2 secs Computing kpt #: 167 total cpu time spent up to now is 242.7 secs Computing kpt #: 168 total cpu time spent up to now is 244.2 secs Computing kpt #: 169 total cpu time spent up to now is 246.0 secs Computing kpt #: 170 total cpu time spent up to now is 247.5 secs Computing kpt #: 171 total cpu time spent up to now is 249.2 secs Computing kpt #: 172 total cpu time spent up to now is 250.8 secs Computing kpt #: 173 total cpu time spent up to now is 252.5 secs Computing kpt #: 174 total cpu time spent up to now is 254.3 secs Computing kpt #: 175 total cpu time spent up to now is 256.3 secs Computing kpt #: 176 total cpu time spent up to now is 257.8 secs Computing kpt #: 177 total cpu time spent up to now is 259.4 secs Computing kpt #: 178 total cpu time spent up to now is 260.9 secs Computing kpt #: 179 total cpu time spent up to now is 262.4 secs Computing kpt #: 180 total cpu time spent up to now is 264.2 secs Computing kpt #: 181 total cpu time spent up to now is 265.8 secs Computing kpt #: 182 total cpu time spent up to now is 267.5 secs Computing kpt #: 183 total cpu time spent up to now is 269.2 secs Computing kpt #: 184 total cpu time spent up to now is 270.8 secs Computing kpt #: 185 total cpu time spent up to now is 272.4 secs Computing kpt #: 186 total cpu time spent up to now is 273.9 secs Computing kpt #: 187 total cpu time spent up to now is 275.4 secs Computing kpt #: 188 total cpu time spent up to now is 276.8 secs Computing kpt #: 189 total cpu time spent up to now is 278.1 secs Computing kpt #: 190 total cpu time spent up to now is 279.5 secs Computing kpt #: 191 total cpu time spent up to now is 281.0 secs Computing kpt #: 192 total cpu time spent up to now is 282.6 secs Computing kpt #: 193 total cpu time spent up to now is 284.0 secs Computing kpt #: 194 total cpu time spent up to now is 285.4 secs Computing kpt #: 195 total cpu time spent up to now is 286.8 secs Computing kpt #: 196 total cpu time spent up to now is 288.3 secs Computing kpt #: 197 total cpu time spent up to now is 289.7 secs Computing kpt #: 198 total cpu time spent up to now is 291.1 secs Computing kpt #: 199 total cpu time spent up to now is 292.5 secs Computing kpt #: 200 total cpu time spent up to now is 293.8 secs Computing kpt #: 201 total cpu time spent up to now is 295.2 secs Computing kpt #: 202 total cpu time spent up to now is 296.4 secs Computing kpt #: 203 total cpu time spent up to now is 297.7 secs Computing kpt #: 204 total cpu time spent up to now is 298.9 secs Computing kpt #: 205 total cpu time spent up to now is 300.1 secs Computing kpt #: 206 total cpu time spent up to now is 301.3 secs Computing kpt #: 207 total cpu time spent up to now is 302.5 secs Computing kpt #: 208 total cpu time spent up to now is 303.6 secs Computing kpt #: 209 total cpu time spent up to now is 305.0 secs Computing kpt #: 210 total cpu time spent up to now is 306.3 secs Computing kpt #: 211 total cpu time spent up to now is 307.7 secs Computing kpt #: 212 total cpu time spent up to now is 308.8 secs Computing kpt #: 213 total cpu time spent up to now is 309.9 secs Computing kpt #: 214 total cpu time spent up to now is 310.9 secs Computing kpt #: 215 total cpu time spent up to now is 312.0 secs Computing kpt #: 216 total cpu time spent up to now is 313.1 secs Computing kpt #: 217 total cpu time spent up to now is 314.1 secs Computing kpt #: 218 total cpu time spent up to now is 315.2 secs Computing kpt #: 219 total cpu time spent up to now is 316.2 secs Computing kpt #: 220 total cpu time spent up to now is 317.5 secs Computing kpt #: 221 total cpu time spent up to now is 318.5 secs Computing kpt #: 222 total cpu time spent up to now is 319.5 secs Computing kpt #: 223 total cpu time spent up to now is 320.5 secs Computing kpt #: 224 total cpu time spent up to now is 321.6 secs Computing kpt #: 225 total cpu time spent up to now is 322.5 secs Computing kpt #: 226 total cpu time spent up to now is 323.5 secs Computing kpt #: 227 total cpu time spent up to now is 324.5 secs Computing kpt #: 228 total cpu time spent up to now is 325.5 secs Computing kpt #: 229 total cpu time spent up to now is 326.4 secs Computing kpt #: 230 total cpu time spent up to now is 327.3 secs Computing kpt #: 231 total cpu time spent up to now is 328.3 secs Computing kpt #: 232 total cpu time spent up to now is 329.3 secs Computing kpt #: 233 total cpu time spent up to now is 330.4 secs Computing kpt #: 234 total cpu time spent up to now is 331.4 secs Computing kpt #: 235 total cpu time spent up to now is 332.4 secs Computing kpt #: 236 total cpu time spent up to now is 333.4 secs Computing kpt #: 237 total cpu time spent up to now is 334.3 secs Computing kpt #: 238 total cpu time spent up to now is 335.4 secs Computing kpt #: 239 total cpu time spent up to now is 336.4 secs Computing kpt #: 240 total cpu time spent up to now is 337.3 secs Computing kpt #: 241 total cpu time spent up to now is 338.3 secs Computing kpt #: 242 total cpu time spent up to now is 339.2 secs Computing kpt #: 243 total cpu time spent up to now is 340.2 secs Computing kpt #: 244 total cpu time spent up to now is 341.2 secs Computing kpt #: 245 total cpu time spent up to now is 342.2 secs Computing kpt #: 246 total cpu time spent up to now is 343.1 secs Computing kpt #: 247 total cpu time spent up to now is 344.3 secs Computing kpt #: 248 total cpu time spent up to now is 345.3 secs Computing kpt #: 249 total cpu time spent up to now is 346.2 secs Computing kpt #: 250 total cpu time spent up to now is 347.2 secs Computing kpt #: 251 total cpu time spent up to now is 348.4 secs Computing kpt #: 252 total cpu time spent up to now is 349.8 secs Computing kpt #: 253 total cpu time spent up to now is 351.0 secs Computing kpt #: 254 total cpu time spent up to now is 352.1 secs Computing kpt #: 255 total cpu time spent up to now is 353.4 secs Computing kpt #: 256 total cpu time spent up to now is 354.8 secs Computing kpt #: 257 total cpu time spent up to now is 356.1 secs Computing kpt #: 258 total cpu time spent up to now is 357.5 secs Computing kpt #: 259 total cpu time spent up to now is 359.0 secs Computing kpt #: 260 total cpu time spent up to now is 360.4 secs Computing kpt #: 261 total cpu time spent up to now is 361.8 secs Computing kpt #: 262 total cpu time spent up to now is 363.2 secs Computing kpt #: 263 total cpu time spent up to now is 364.7 secs Computing kpt #: 264 total cpu time spent up to now is 366.3 secs Computing kpt #: 265 total cpu time spent up to now is 367.8 secs Computing kpt #: 266 total cpu time spent up to now is 369.4 secs Computing kpt #: 267 total cpu time spent up to now is 371.1 secs Computing kpt #: 268 total cpu time spent up to now is 372.8 secs Computing kpt #: 269 total cpu time spent up to now is 374.8 secs Computing kpt #: 270 total cpu time spent up to now is 377.2 secs Computing kpt #: 271 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 380.3 secs Computing kpt #: 272 total cpu time spent up to now is 382.8 secs Computing kpt #: 273 total cpu time spent up to now is 385.4 secs Computing kpt #: 274 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 388.3 secs Computing kpt #: 275 total cpu time spent up to now is 390.8 secs Computing kpt #: 276 total cpu time spent up to now is 392.7 secs Computing kpt #: 277 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 395.7 secs Computing kpt #: 278 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 398.6 secs Computing kpt #: 279 total cpu time spent up to now is 401.1 secs Computing kpt #: 280 total cpu time spent up to now is 403.0 secs Computing kpt #: 281 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 406.1 secs Computing kpt #: 282 total cpu time spent up to now is 408.0 secs Computing kpt #: 283 total cpu time spent up to now is 410.8 secs Computing kpt #: 284 total cpu time spent up to now is 412.4 secs Computing kpt #: 285 total cpu time spent up to now is 414.1 secs Computing kpt #: 286 total cpu time spent up to now is 415.6 secs Computing kpt #: 287 total cpu time spent up to now is 417.1 secs Computing kpt #: 288 total cpu time spent up to now is 418.6 secs Computing kpt #: 289 total cpu time spent up to now is 420.2 secs Computing kpt #: 290 total cpu time spent up to now is 421.6 secs Computing kpt #: 291 total cpu time spent up to now is 422.9 secs Computing kpt #: 292 total cpu time spent up to now is 424.4 secs Computing kpt #: 293 total cpu time spent up to now is 425.8 secs Computing kpt #: 294 total cpu time spent up to now is 427.7 secs Computing kpt #: 295 total cpu time spent up to now is 429.0 secs Computing kpt #: 296 total cpu time spent up to now is 430.5 secs Computing kpt #: 297 total cpu time spent up to now is 431.9 secs Computing kpt #: 298 total cpu time spent up to now is 433.4 secs Computing kpt #: 299 total cpu time spent up to now is 434.7 secs Computing kpt #: 300 total cpu time spent up to now is 436.0 secs Computing kpt #: 301 total cpu time spent up to now is 437.2 secs Computing kpt #: 302 total cpu time spent up to now is 438.6 secs Computing kpt #: 303 total cpu time spent up to now is 439.6 secs Computing kpt #: 304 total cpu time spent up to now is 440.8 secs Computing kpt #: 305 total cpu time spent up to now is 441.9 secs Computing kpt #: 306 total cpu time spent up to now is 443.2 secs Computing kpt #: 307 total cpu time spent up to now is 444.3 secs Computing kpt #: 308 total cpu time spent up to now is 445.3 secs Computing kpt #: 309 total cpu time spent up to now is 446.2 secs Computing kpt #: 310 total cpu time spent up to now is 447.2 secs Computing kpt #: 311 total cpu time spent up to now is 448.2 secs Computing kpt #: 312 total cpu time spent up to now is 449.2 secs Computing kpt #: 313 total cpu time spent up to now is 450.2 secs Computing kpt #: 314 total cpu time spent up to now is 451.3 secs Computing kpt #: 315 total cpu time spent up to now is 452.3 secs Computing kpt #: 316 total cpu time spent up to now is 453.3 secs Computing kpt #: 317 total cpu time spent up to now is 454.3 secs Computing kpt #: 318 total cpu time spent up to now is 455.4 secs Computing kpt #: 319 total cpu time spent up to now is 456.6 secs Computing kpt #: 320 total cpu time spent up to now is 457.6 secs Computing kpt #: 321 total cpu time spent up to now is 458.5 secs Computing kpt #: 322 total cpu time spent up to now is 459.5 secs Computing kpt #: 323 total cpu time spent up to now is 460.5 secs Computing kpt #: 324 total cpu time spent up to now is 461.6 secs Computing kpt #: 325 total cpu time spent up to now is 462.6 secs Computing kpt #: 326 total cpu time spent up to now is 463.6 secs Computing kpt #: 327 total cpu time spent up to now is 464.6 secs Computing kpt #: 328 total cpu time spent up to now is 465.7 secs Computing kpt #: 329 total cpu time spent up to now is 466.6 secs Computing kpt #: 330 total cpu time spent up to now is 467.7 secs Computing kpt #: 331 total cpu time spent up to now is 468.8 secs Computing kpt #: 332 total cpu time spent up to now is 469.8 secs Computing kpt #: 333 total cpu time spent up to now is 470.8 secs Computing kpt #: 334 total cpu time spent up to now is 471.8 secs Computing kpt #: 335 total cpu time spent up to now is 472.8 secs Computing kpt #: 336 total cpu time spent up to now is 474.0 secs Computing kpt #: 337 total cpu time spent up to now is 475.0 secs Computing kpt #: 338 total cpu time spent up to now is 476.0 secs Computing kpt #: 339 total cpu time spent up to now is 477.0 secs Computing kpt #: 340 total cpu time spent up to now is 478.1 secs Computing kpt #: 341 total cpu time spent up to now is 479.1 secs Computing kpt #: 342 total cpu time spent up to now is 480.3 secs Computing kpt #: 343 total cpu time spent up to now is 481.5 secs Computing kpt #: 344 total cpu time spent up to now is 482.6 secs Computing kpt #: 345 total cpu time spent up to now is 483.8 secs Computing kpt #: 346 total cpu time spent up to now is 485.0 secs Computing kpt #: 347 total cpu time spent up to now is 486.2 secs Computing kpt #: 348 total cpu time spent up to now is 487.3 secs Computing kpt #: 349 total cpu time spent up to now is 488.7 secs Computing kpt #: 350 total cpu time spent up to now is 490.4 secs Computing kpt #: 351 total cpu time spent up to now is 491.8 secs Computing kpt #: 352 total cpu time spent up to now is 493.0 secs Computing kpt #: 353 total cpu time spent up to now is 494.2 secs Computing kpt #: 354 total cpu time spent up to now is 495.6 secs Computing kpt #: 355 total cpu time spent up to now is 497.0 secs Computing kpt #: 356 total cpu time spent up to now is 498.3 secs Computing kpt #: 357 total cpu time spent up to now is 499.7 secs Computing kpt #: 358 total cpu time spent up to now is 501.3 secs Computing kpt #: 359 total cpu time spent up to now is 502.9 secs Computing kpt #: 360 total cpu time spent up to now is 504.6 secs Computing kpt #: 361 total cpu time spent up to now is 506.2 secs Computing kpt #: 362 total cpu time spent up to now is 508.1 secs Computing kpt #: 363 total cpu time spent up to now is 509.7 secs Computing kpt #: 364 total cpu time spent up to now is 511.6 secs Computing kpt #: 365 total cpu time spent up to now is 513.6 secs Computing kpt #: 366 total cpu time spent up to now is 515.3 secs Computing kpt #: 367 total cpu time spent up to now is 517.0 secs Computing kpt #: 368 total cpu time spent up to now is 518.8 secs Computing kpt #: 369 total cpu time spent up to now is 520.4 secs Computing kpt #: 370 total cpu time spent up to now is 522.2 secs Computing kpt #: 371 total cpu time spent up to now is 523.5 secs Computing kpt #: 372 total cpu time spent up to now is 524.8 secs Computing kpt #: 373 total cpu time spent up to now is 526.1 secs Computing kpt #: 374 total cpu time spent up to now is 527.9 secs Computing kpt #: 375 total cpu time spent up to now is 529.6 secs Computing kpt #: 376 total cpu time spent up to now is 531.0 secs Computing kpt #: 377 total cpu time spent up to now is 532.4 secs Computing kpt #: 378 total cpu time spent up to now is 534.1 secs Computing kpt #: 379 total cpu time spent up to now is 536.2 secs Computing kpt #: 380 total cpu time spent up to now is 537.8 secs Computing kpt #: 381 total cpu time spent up to now is 540.0 secs Computing kpt #: 382 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 543.2 secs Computing kpt #: 383 total cpu time spent up to now is 545.9 secs Computing kpt #: 384 total cpu time spent up to now is 548.0 secs Computing kpt #: 385 total cpu time spent up to now is 550.2 secs Computing kpt #: 386 total cpu time spent up to now is 552.2 secs Computing kpt #: 387 total cpu time spent up to now is 553.9 secs Computing kpt #: 388 total cpu time spent up to now is 555.6 secs Computing kpt #: 389 total cpu time spent up to now is 557.1 secs Computing kpt #: 390 total cpu time spent up to now is 558.6 secs Computing kpt #: 391 total cpu time spent up to now is 559.9 secs Computing kpt #: 392 total cpu time spent up to now is 561.3 secs Computing kpt #: 393 total cpu time spent up to now is 562.6 secs Computing kpt #: 394 total cpu time spent up to now is 563.9 secs Computing kpt #: 395 total cpu time spent up to now is 565.2 secs Computing kpt #: 396 total cpu time spent up to now is 566.5 secs Computing kpt #: 397 total cpu time spent up to now is 567.8 secs Computing kpt #: 398 total cpu time spent up to now is 569.1 secs Computing kpt #: 399 total cpu time spent up to now is 570.3 secs Computing kpt #: 400 total cpu time spent up to now is 571.4 secs Computing kpt #: 401 total cpu time spent up to now is 572.6 secs Computing kpt #: 402 total cpu time spent up to now is 573.8 secs Computing kpt #: 403 total cpu time spent up to now is 575.0 secs Computing kpt #: 404 total cpu time spent up to now is 576.2 secs Computing kpt #: 405 total cpu time spent up to now is 577.3 secs Computing kpt #: 406 total cpu time spent up to now is 578.5 secs Computing kpt #: 407 total cpu time spent up to now is 579.6 secs Computing kpt #: 408 total cpu time spent up to now is 580.7 secs Computing kpt #: 409 total cpu time spent up to now is 581.7 secs Computing kpt #: 410 total cpu time spent up to now is 582.9 secs Computing kpt #: 411 total cpu time spent up to now is 584.0 secs Computing kpt #: 412 total cpu time spent up to now is 585.0 secs Computing kpt #: 413 total cpu time spent up to now is 586.0 secs Computing kpt #: 414 total cpu time spent up to now is 587.0 secs Computing kpt #: 415 total cpu time spent up to now is 588.1 secs Computing kpt #: 416 total cpu time spent up to now is 589.1 secs Computing kpt #: 417 total cpu time spent up to now is 590.1 secs Computing kpt #: 418 total cpu time spent up to now is 591.0 secs Computing kpt #: 419 total cpu time spent up to now is 592.0 secs Computing kpt #: 420 total cpu time spent up to now is 593.0 secs Computing kpt #: 421 total cpu time spent up to now is 594.1 secs Computing kpt #: 422 total cpu time spent up to now is 595.1 secs Computing kpt #: 423 total cpu time spent up to now is 596.1 secs Computing kpt #: 424 total cpu time spent up to now is 597.1 secs Computing kpt #: 425 total cpu time spent up to now is 598.0 secs Computing kpt #: 426 total cpu time spent up to now is 599.0 secs Computing kpt #: 427 total cpu time spent up to now is 600.0 secs Computing kpt #: 428 total cpu time spent up to now is 601.0 secs Computing kpt #: 429 total cpu time spent up to now is 602.0 secs Computing kpt #: 430 total cpu time spent up to now is 603.0 secs Computing kpt #: 431 total cpu time spent up to now is 604.0 secs Computing kpt #: 432 total cpu time spent up to now is 605.1 secs Computing kpt #: 433 total cpu time spent up to now is 606.1 secs Computing kpt #: 434 total cpu time spent up to now is 607.2 secs Computing kpt #: 435 total cpu time spent up to now is 608.2 secs Computing kpt #: 436 total cpu time spent up to now is 609.2 secs Computing kpt #: 437 total cpu time spent up to now is 610.3 secs Computing kpt #: 438 total cpu time spent up to now is 611.4 secs Computing kpt #: 439 total cpu time spent up to now is 612.5 secs Computing kpt #: 440 total cpu time spent up to now is 613.6 secs Computing kpt #: 441 total cpu time spent up to now is 614.6 secs Computing kpt #: 442 total cpu time spent up to now is 615.8 secs Computing kpt #: 443 total cpu time spent up to now is 616.9 secs Computing kpt #: 444 total cpu time spent up to now is 618.1 secs Computing kpt #: 445 total cpu time spent up to now is 619.3 secs Computing kpt #: 446 total cpu time spent up to now is 620.5 secs Computing kpt #: 447 total cpu time spent up to now is 621.6 secs Computing kpt #: 448 total cpu time spent up to now is 622.8 secs Computing kpt #: 449 total cpu time spent up to now is 624.1 secs Computing kpt #: 450 total cpu time spent up to now is 625.4 secs Computing kpt #: 451 total cpu time spent up to now is 626.6 secs Computing kpt #: 452 total cpu time spent up to now is 627.9 secs Computing kpt #: 453 total cpu time spent up to now is 629.3 secs Computing kpt #: 454 total cpu time spent up to now is 630.8 secs Computing kpt #: 455 total cpu time spent up to now is 632.2 secs Computing kpt #: 456 total cpu time spent up to now is 633.8 secs Computing kpt #: 457 total cpu time spent up to now is 635.3 secs Computing kpt #: 458 total cpu time spent up to now is 636.7 secs Computing kpt #: 459 total cpu time spent up to now is 637.9 secs Computing kpt #: 460 total cpu time spent up to now is 639.4 secs Computing kpt #: 461 total cpu time spent up to now is 640.7 secs Computing kpt #: 462 total cpu time spent up to now is 642.2 secs Computing kpt #: 463 total cpu time spent up to now is 643.7 secs Computing kpt #: 464 total cpu time spent up to now is 645.3 secs Computing kpt #: 465 total cpu time spent up to now is 646.7 secs Computing kpt #: 466 total cpu time spent up to now is 648.3 secs Computing kpt #: 467 total cpu time spent up to now is 650.1 secs Computing kpt #: 468 total cpu time spent up to now is 651.8 secs Computing kpt #: 469 total cpu time spent up to now is 653.2 secs Computing kpt #: 470 total cpu time spent up to now is 654.8 secs Computing kpt #: 471 total cpu time spent up to now is 656.6 secs Computing kpt #: 472 total cpu time spent up to now is 658.7 secs ethr = 2.50E-11, avg # of iterations = 31.6 total cpu time spent up to now is 658.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2477 PWs) bands (ev): -46.2610 -46.2610 -23.8712 -23.8712 -21.8235 -21.8235 -21.7558 -21.7558 -18.9839 -18.9839 -8.7433 -8.7433 -8.2927 -8.2927 -8.2809 -8.2809 -2.7003 -2.7003 -2.4416 -2.4416 -2.4362 -2.4362 6.0339 6.0339 6.2303 6.2303 6.2484 6.2484 6.7817 6.7817 6.9733 6.9733 7.1795 7.1795 7.2044 7.2044 7.3758 7.3758 7.5218 7.5218 10.4381 10.4381 10.8181 10.8181 10.9420 10.9420 14.1801 14.1801 k = 0.0090 0.0091-0.0000 ( 2465 PWs) bands (ev): -46.2608 -46.2608 -23.8714 -23.8712 -21.8238 -21.8233 -21.7559 -21.7557 -18.9838 -18.9838 -8.7432 -8.7424 -8.2930 -8.2917 -8.2804 -8.2803 -2.7005 -2.6999 -2.4420 -2.4410 -2.4363 -2.4359 6.0300 6.0332 6.2224 6.2316 6.2462 6.2477 6.7791 6.7799 6.9704 6.9725 7.1779 7.1811 7.2024 7.2046 7.3768 7.3776 7.5189 7.5220 10.4395 10.4406 10.8185 10.8215 10.9404 10.9459 14.1823 14.1856 k = 0.0181 0.0182-0.0000 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8717 -23.8712 -21.8244 -21.8234 -21.7560 -21.7558 -18.9837 -18.9837 -8.7422 -8.7405 -8.2926 -8.2903 -8.2792 -8.2785 -2.7005 -2.6992 -2.4421 -2.4401 -2.4362 -2.4355 6.0212 6.0283 6.2074 6.2270 6.2407 6.2442 6.7727 6.7737 6.9638 6.9678 7.1765 7.1826 7.1991 7.2032 7.3800 7.3812 7.5134 7.5198 10.4445 10.4467 10.8228 10.8288 10.9413 10.9520 14.1871 14.1902 k = 0.0271 0.0273-0.0000 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8720 -23.8713 -21.8252 -21.8238 -21.7563 -21.7559 -18.9835 -18.9834 -8.7402 -8.7378 -8.2914 -8.2886 -8.2772 -8.2754 -2.7002 -2.6984 -2.4420 -2.4390 -2.4358 -2.4349 6.0068 6.0192 6.1848 6.2172 6.2321 6.2381 6.7633 6.7634 6.9538 6.9594 7.1750 7.1838 7.1953 7.2008 7.3844 7.3853 7.5054 7.5154 10.4533 10.4566 10.8308 10.8399 10.9448 10.9606 14.1965 14.2007 k = 0.0362 0.0364-0.0000 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8725 -23.8716 -21.8263 -21.8243 -21.7566 -21.7560 -18.9833 -18.9831 -8.7373 -8.7342 -8.2893 -8.2868 -8.2745 -8.2708 -2.6998 -2.6974 -2.4417 -2.4381 -2.4349 -2.4340 5.9863 6.0058 6.1547 6.2023 6.2208 6.2296 6.7499 6.7519 6.9407 6.9474 7.1734 7.1845 7.1918 7.1980 7.3881 7.3884 7.4950 7.5092 10.4657 10.4700 10.8426 10.8547 10.9514 10.9719 14.2095 14.2147 k = 0.0452 0.0455-0.0000 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8730 -23.8719 -21.8275 -21.8251 -21.7570 -21.7563 -18.9829 -18.9827 -8.7335 -8.7297 -8.2863 -8.2848 -8.2709 -8.2650 -2.6991 -2.6961 -2.4413 -2.4374 -2.4333 -2.4329 5.9590 5.9877 6.1173 6.1825 6.2074 6.2189 6.7343 6.7396 6.9246 6.9320 7.1717 7.1844 7.1888 7.1955 7.3880 7.3905 7.4826 7.5015 10.4817 10.4871 10.8580 10.8733 10.9614 10.9862 14.2259 14.2321 k = 0.0543 0.0545-0.0000 ( 2469 PWs) bands (ev): -46.2607 -46.2607 -23.8737 -23.8723 -21.8290 -21.8260 -21.7574 -21.7566 -18.9824 -18.9822 -8.7288 -8.7244 -8.2824 -8.2824 -8.2665 -8.2578 -2.6982 -2.6947 -2.4408 -2.4370 -2.4314 -2.4312 5.9243 5.9642 6.0737 6.1579 6.1927 6.2063 6.7173 6.7269 6.9058 6.9136 7.1701 7.1834 7.1864 7.1936 7.3839 7.3891 7.4687 7.4924 10.5013 10.5076 10.8771 10.8955 10.9752 11.0037 14.2455 14.2525 k = 0.0633 0.0636-0.0000 ( 2461 PWs) bands (ev): -46.2606 -46.2606 -23.8744 -23.8728 -21.8306 -21.8272 -21.7579 -21.7569 -18.9819 -18.9816 -8.7233 -8.7184 -8.2794 -8.2778 -8.2611 -8.2496 -2.6972 -2.6931 -2.4403 -2.4366 -2.4295 -2.4285 5.8821 5.9338 6.0258 6.1285 6.1772 6.1919 6.6996 6.7140 6.8845 6.8925 7.1685 7.1816 7.1844 7.1922 7.3756 7.3835 7.4537 7.4818 10.5244 10.5316 10.8998 10.9212 10.9931 11.0250 14.2681 14.2759 k = 0.0724 0.0727-0.0000 ( 2466 PWs) bands (ev): -46.2606 -46.2606 -23.8753 -23.8735 -21.8325 -21.8286 -21.7584 -21.7573 -18.9813 -18.9810 -8.7170 -8.7117 -8.2760 -8.2724 -8.2547 -8.2402 -2.6960 -2.6915 -2.4398 -2.4363 -2.4273 -2.4256 5.8325 5.8938 5.9768 6.0945 6.1611 6.1762 6.6815 6.7008 6.8611 6.8688 7.1673 7.1794 7.1826 7.1910 7.3633 7.3733 7.4377 7.4690 10.5508 10.5589 10.9261 10.9504 11.0154 11.0501 14.2932 14.3016 k = 0.0814 0.0818-0.0000 ( 2462 PWs) bands (ev): -46.2605 -46.2605 -23.8762 -23.8742 -21.8345 -21.8302 -21.7591 -21.7578 -18.9806 -18.9803 -8.7100 -8.7044 -8.2719 -8.2663 -8.2473 -8.2298 -2.6947 -2.6897 -2.4393 -2.4359 -2.4247 -2.4223 5.7762 5.8418 5.9302 6.0564 6.1444 6.1591 6.6630 6.6871 6.8356 6.8429 7.1664 7.1770 7.1807 7.1896 7.3478 7.3589 7.4205 7.4537 10.5805 10.5894 10.9561 10.9829 11.0420 11.0794 14.3207 14.3297 k = 0.0905 0.0909-0.0000 ( 2464 PWs) bands (ev): -46.2604 -46.2604 -23.8772 -23.8750 -21.8368 -21.8320 -21.7597 -21.7584 -18.9799 -18.9795 -8.7024 -8.6966 -8.2671 -8.2594 -8.2387 -8.2183 -2.6933 -2.6878 -2.4388 -2.4355 -2.4218 -2.4189 5.7136 5.7786 5.8858 6.0142 6.1273 6.1410 6.6436 6.6721 6.8083 6.8150 7.1657 7.1745 7.1786 7.1881 7.3301 7.3413 7.4018 7.4355 10.6134 10.6231 10.9898 11.0186 11.0730 11.1130 14.3502 14.3597 k = 0.0995 0.1000-0.0000 ( 2460 PWs) bands (ev): -46.2603 -46.2603 -23.8783 -23.8759 -21.8392 -21.8340 -21.7605 -21.7589 -18.9791 -18.9787 -8.6942 -8.6883 -8.2615 -8.2518 -8.2290 -8.2059 -2.6918 -2.6859 -2.4383 -2.4350 -2.4186 -2.4152 5.6458 5.7073 5.8416 5.9682 6.1096 6.1220 6.6228 6.6551 6.7793 6.7852 7.1650 7.1715 7.1762 7.1863 7.3110 7.3216 7.3815 7.4147 10.6493 10.6598 11.0272 11.0575 11.1083 11.1509 14.3814 14.3913 k = 0.1086 0.1091-0.0000 ( 2460 PWs) bands (ev): -46.2602 -46.2602 -23.8794 -23.8768 -21.8418 -21.8362 -21.7612 -21.7596 -18.9783 -18.9778 -8.6855 -8.6797 -8.2551 -8.2434 -8.2182 -8.1926 -2.6902 -2.6839 -2.4377 -2.4345 -2.4152 -2.4113 5.5735 5.6305 5.7958 5.9187 6.0912 6.1020 6.5998 6.6354 6.7489 6.7539 7.1639 7.1679 7.1734 7.1844 7.2910 7.3005 7.3604 7.3922 10.6881 10.6992 11.0683 11.0993 11.1477 11.1930 14.4142 14.4243 k = 0.1176 0.1182-0.0000 ( 2464 PWs) bands (ev): -46.2602 -46.2602 -23.8807 -23.8779 -21.8446 -21.8386 -21.7620 -21.7603 -18.9774 -18.9769 -8.6764 -8.6708 -8.2477 -8.2340 -8.2063 -8.1783 -2.6885 -2.6819 -2.4372 -2.4339 -2.4116 -2.4073 5.4974 5.5498 5.7476 5.8659 6.0722 6.0813 6.5739 6.6120 6.7171 6.7211 7.1618 7.1634 7.1703 7.1823 7.2702 7.2784 7.3400 7.3695 10.7296 10.7414 11.1127 11.1437 11.1913 11.2394 14.4481 14.4584 k = 0.1267 0.1273-0.0000 ( 2458 PWs) bands (ev): -46.2601 -46.2601 -23.8820 -23.8790 -21.8475 -21.8411 -21.7629 -21.7610 -18.9764 -18.9760 -8.6670 -8.6617 -8.2394 -8.2238 -8.1933 -8.1632 -2.6868 -2.6799 -2.4366 -2.4333 -2.4079 -2.4033 5.4185 5.4664 5.6968 5.8100 6.0525 6.0599 6.5441 6.5840 6.6842 6.6870 7.1575 7.1576 7.1669 7.1798 7.2482 7.2549 7.3226 7.3490 10.7737 10.7862 11.1602 11.1906 11.2389 11.2901 14.4830 14.4934 k = 0.1357 0.1364-0.0000 ( 2458 PWs) bands (ev): -46.2600 -46.2600 -23.8834 -23.8802 -21.8506 -21.8438 -21.7638 -21.7618 -18.9754 -18.9749 -8.6574 -8.6525 -8.2300 -8.2125 -8.1793 -8.1473 -2.6851 -2.6779 -2.4359 -2.4327 -2.4041 -2.3992 5.3372 5.3809 5.6433 5.7512 6.0320 6.0378 6.5099 6.5508 6.6503 6.6518 7.1503 7.1505 7.1631 7.1767 7.2241 7.2301 7.3107 7.3334 10.8203 10.8335 11.2101 11.2395 11.2906 11.3447 14.5187 14.5292 k = 0.1448 0.1455-0.0000 ( 2454 PWs) bands (ev): -46.2598 -46.2598 -23.8848 -23.8815 -21.8537 -21.8466 -21.7647 -21.7626 -18.9744 -18.9739 -8.6477 -8.6434 -8.2195 -8.2002 -8.1644 -8.1306 -2.6834 -2.6760 -2.4352 -2.4319 -2.4002 -2.3951 5.2543 5.2942 5.5871 5.6898 6.0109 6.0150 6.4705 6.5116 6.6154 6.6155 7.1403 7.1417 7.1579 7.1727 7.1976 7.2053 7.3054 7.3245 10.8693 10.8830 11.2619 11.2902 11.3464 11.4031 14.5550 14.5654 k = 0.1538 0.1545-0.0000 ( 2450 PWs) bands (ev): -46.2597 -46.2597 -23.8863 -23.8828 -21.8570 -21.8496 -21.7657 -21.7635 -18.9733 -18.9728 -8.6380 -8.6343 -8.2079 -8.1868 -8.1484 -8.1131 -2.6816 -2.6741 -2.4345 -2.4311 -2.3964 -2.3911 5.1702 5.2065 5.5286 5.6261 5.9890 5.9917 6.4255 6.4663 6.5784 6.5796 7.1263 7.1321 7.1496 7.1626 7.1748 7.1842 7.3065 7.3226 10.9203 10.9347 11.3153 11.3424 11.4061 11.4652 14.5916 14.6020 k = 0.1629 0.1636-0.0000 ( 2442 PWs) bands (ev): -46.2595 -46.2595 -23.8878 -23.8842 -21.8604 -21.8526 -21.7667 -21.7644 -18.9723 -18.9718 -8.6283 -8.6253 -8.1950 -8.1723 -8.1316 -8.0950 -2.6799 -2.6722 -2.4337 -2.4303 -2.3926 -2.3872 5.0853 5.1185 5.4678 5.5602 5.9665 5.9678 6.3746 6.4145 6.5406 6.5431 7.1077 7.1210 7.1362 7.1368 7.1677 7.1707 7.3131 7.3267 10.9734 10.9883 11.3696 11.3958 11.4697 11.5305 14.6285 14.6387 k = 0.1719 0.1727-0.0000 ( 2450 PWs) bands (ev): -46.2595 -46.2595 -23.8894 -23.8857 -21.8639 -21.8559 -21.7677 -21.7653 -18.9712 -18.9707 -8.6188 -8.6165 -8.1809 -8.1568 -8.1139 -8.0762 -2.6783 -2.6705 -2.4329 -2.4294 -2.3890 -2.3836 5.0001 5.0304 5.4051 5.4924 5.9434 5.9435 6.3179 6.3563 6.5023 6.5060 7.0846 7.1016 7.1155 7.1227 7.1631 7.1632 7.3240 7.3357 11.0283 11.0437 11.4248 11.4502 11.5368 11.5988 14.6654 14.6754 k = 0.1810 0.1818-0.0000 ( 2454 PWs) bands (ev): -46.2594 -46.2594 -23.8910 -23.8872 -21.8675 -21.8592 -21.7687 -21.7662 -18.9701 -18.9696 -8.6094 -8.6079 -8.1656 -8.1402 -8.0953 -8.0568 -2.6766 -2.6688 -2.4321 -2.4285 -2.3855 -2.3801 4.9150 4.9426 5.3406 5.4230 5.9187 5.9198 6.2556 6.2921 6.4636 6.4685 7.0594 7.0735 7.1044 7.1097 7.1580 7.1590 7.3386 7.3488 11.0849 11.1008 11.4805 11.5054 11.6070 11.6697 14.7022 14.7121 k = 0.1900 0.1909-0.0000 ( 2454 PWs) bands (ev): -46.2593 -46.2593 -23.8927 -23.8888 -21.8712 -21.8626 -21.7698 -21.7672 -18.9690 -18.9685 -8.6003 -8.5995 -8.1490 -8.1226 -8.0759 -8.0369 -2.6750 -2.6672 -2.4312 -2.4275 -2.3822 -2.3769 4.8301 4.8553 5.2746 5.3523 5.8937 5.8957 6.1880 6.2222 6.4246 6.4306 7.0341 7.0459 7.0948 7.0980 7.1537 7.1550 7.3563 7.3652 11.1430 11.1594 11.5367 11.5613 11.6799 11.7428 14.7389 14.7485 k = 0.1991 0.2000-0.0000 ( 2448 PWs) bands (ev): -46.2591 -46.2591 -23.8944 -23.8904 -21.8749 -21.8661 -21.7708 -21.7682 -18.9679 -18.9674 -8.5915 -8.5914 -8.1313 -8.1041 -8.0557 -8.0165 -2.6735 -2.6657 -2.4302 -2.4265 -2.3792 -2.3740 4.7460 4.7689 5.2074 5.2804 5.8683 5.8712 6.1157 6.1474 6.3856 6.3925 7.0100 7.0199 7.0860 7.0875 7.1499 7.1511 7.3765 7.3844 11.2025 11.2193 11.5932 11.6176 11.7551 11.8179 14.7752 14.7845 k = 0.2081 0.2091-0.0000 ( 2452 PWs) bands (ev): -46.2590 -46.2590 -23.8961 -23.8920 -21.8787 -21.8697 -21.7719 -21.7692 -18.9668 -18.9663 -8.5836 -8.5829 -8.1124 -8.0847 -8.0347 -7.9956 -2.6720 -2.6643 -2.4293 -2.4255 -2.3765 -2.3714 4.6627 4.6836 5.1393 5.2076 5.8428 5.8463 6.0393 6.0683 6.3465 6.3543 6.9876 6.9962 7.0776 7.0779 7.1464 7.1473 7.3990 7.4060 11.2632 11.2803 11.6500 11.6743 11.8321 11.8945 14.8110 14.8201 k = 0.2172 0.2182-0.0000 ( 2460 PWs) bands (ev): -46.2590 -46.2590 -23.8978 -23.8937 -21.8825 -21.8733 -21.7730 -21.7702 -18.9657 -18.9652 -8.5761 -8.5747 -8.0924 -8.0646 -8.0131 -7.9743 -2.6707 -2.6630 -2.4283 -2.4244 -2.3741 -2.3692 4.5806 4.5995 5.0704 5.1343 5.8171 5.8208 5.9598 5.9855 6.3075 6.3161 6.9672 6.9748 7.0691 7.0698 7.1430 7.1437 7.4234 7.4297 11.3248 11.3423 11.7068 11.7310 11.9105 11.9724 14.8463 14.8551 k = 0.2262 0.2273-0.0000 ( 2460 PWs) bands (ev): -46.2589 -46.2589 -23.8996 -23.8954 -21.8863 -21.8770 -21.7740 -21.7713 -18.9647 -18.9642 -8.5688 -8.5668 -8.0714 -8.0438 -7.9907 -7.9527 -2.6693 -2.6618 -2.4272 -2.4232 -2.3720 -2.3673 4.4998 4.5170 5.0010 5.0606 5.7913 5.7940 5.8786 5.9000 6.2686 6.2780 6.9489 6.9558 7.0610 7.0625 7.1398 7.1402 7.4495 7.4552 11.3874 11.4051 11.7636 11.7878 11.9901 12.0511 14.8810 14.8894 k = 0.2353 0.2364-0.0000 ( 2456 PWs) bands (ev): -46.2587 -46.2587 -23.9013 -23.8971 -21.8901 -21.8807 -21.7751 -21.7723 -18.9636 -18.9632 -8.5618 -8.5592 -8.0495 -8.0224 -7.9678 -7.9308 -2.6681 -2.6607 -2.4261 -2.4221 -2.3702 -2.3658 4.4205 4.4362 4.9315 4.9867 5.7601 5.7646 5.8022 5.8131 6.2300 6.2400 6.9330 6.9393 7.0536 7.0556 7.1367 7.1369 7.4770 7.4822 11.4505 11.4685 11.8202 11.8443 12.0705 12.1306 14.9149 14.9230 k = 0.2443 0.2455-0.0000 ( 2458 PWs) bands (ev): -46.2586 -46.2586 -23.9031 -23.8988 -21.8939 -21.8844 -21.7762 -21.7733 -18.9626 -18.9622 -8.5550 -8.5518 -8.0267 -8.0006 -7.9443 -7.9087 -2.6669 -2.6597 -2.4251 -2.4209 -2.3689 -2.3648 4.3430 4.3572 4.8619 4.9130 5.6936 5.7163 5.7461 5.7569 6.1917 6.2023 6.9193 6.9252 7.0468 7.0490 7.1337 7.1338 7.5059 7.5106 11.5142 11.5324 11.8764 11.9005 12.1514 12.2103 14.9479 14.9557 k = 0.2533 0.2545-0.0000 ( 2452 PWs) bands (ev): -46.2584 -46.2584 -23.9048 -23.9005 -21.8976 -21.8881 -21.7772 -21.7744 -18.9616 -18.9612 -8.5484 -8.5448 -8.0033 -7.9785 -7.9202 -7.8864 -2.6658 -2.6589 -2.4240 -2.4197 -2.3679 -2.3641 4.2675 4.2803 4.7925 4.8397 5.6085 5.6281 5.7181 5.7289 6.1538 6.1648 6.9078 6.9135 7.0405 7.0428 7.1307 7.1310 7.5358 7.5400 11.5781 11.5965 11.9323 11.9563 12.2325 12.2902 14.9801 14.9876 k = 0.2624 0.2636-0.0000 ( 2456 PWs) bands (ev): -46.2584 -46.2584 -23.9066 -23.9022 -21.9014 -21.8919 -21.7783 -21.7754 -18.9607 -18.9602 -8.5420 -8.5380 -7.9794 -7.9561 -7.8957 -7.8641 -2.6649 -2.6581 -2.4229 -2.4186 -2.3672 -2.3638 4.1939 4.2055 4.7236 4.7669 5.5203 5.5366 5.6930 5.7036 6.1163 6.1278 6.8985 6.9042 7.0347 7.0369 7.1279 7.1283 7.5666 7.5705 11.6422 11.6607 11.9875 12.0114 12.3135 12.3698 15.0114 15.0184 k = 0.2714 0.2727-0.0000 ( 2456 PWs) bands (ev): -46.2582 -46.2582 -23.9083 -23.9040 -21.9051 -21.8956 -21.7793 -21.7764 -18.9597 -18.9593 -8.5357 -8.5315 -7.9550 -7.9337 -7.8709 -7.8416 -2.6640 -2.6575 -2.4219 -2.4175 -2.3669 -2.3639 4.1226 4.1331 4.6553 4.6948 5.4311 5.4445 5.6687 5.6794 6.0793 6.0913 6.8914 6.8971 7.0293 7.0313 7.1252 7.1257 7.5981 7.6016 11.7061 11.7247 12.0419 12.0658 12.3942 12.4490 15.0416 15.0483 k = 0.2805 0.2818-0.0000 ( 2454 PWs) bands (ev): -46.2581 -46.2581 -23.9100 -23.9057 -21.9087 -21.8993 -21.7803 -21.7775 -18.9588 -18.9584 -8.5297 -8.5251 -7.9302 -7.9112 -7.8458 -7.8192 -2.6632 -2.6571 -2.4209 -2.4165 -2.3669 -2.3644 4.0537 4.0632 4.5879 4.6238 5.3417 5.3525 5.6450 5.6559 6.0430 6.0553 6.8864 6.8921 7.0244 7.0260 7.1226 7.1233 7.6302 7.6334 11.7698 11.7884 12.0956 12.1193 12.4743 12.5275 15.0707 15.0771 k = 0.2895 0.2909-0.0000 ( 2446 PWs) bands (ev): -46.2579 -46.2579 -23.9116 -23.9074 -21.9123 -21.9029 -21.7813 -21.7784 -18.9580 -18.9576 -8.5238 -8.5190 -7.9054 -7.8888 -7.8206 -7.7968 -2.6625 -2.6567 -2.4200 -2.4155 -2.3672 -2.3650 3.9872 3.9958 4.5215 4.5540 5.2527 5.2610 5.6219 5.6330 6.0073 6.0198 6.8833 6.8893 7.0198 7.0210 7.1203 7.1210 7.6627 7.6656 11.8330 11.8517 12.1482 12.1718 12.5535 12.6051 15.0987 15.1048 k = 0.2986 0.3000-0.0000 ( 2446 PWs) bands (ev): -46.2578 -46.2578 -23.9132 -23.9091 -21.9158 -21.9066 -21.7822 -21.7794 -18.9572 -18.9568 -8.5180 -8.5131 -7.8805 -7.8666 -7.7953 -7.7746 -2.6619 -2.6565 -2.4192 -2.4147 -2.3676 -2.3660 3.9233 3.9311 4.4564 4.4856 5.1645 5.1704 5.5996 5.6109 5.9723 5.9851 6.8820 6.8883 7.0156 7.0162 7.1180 7.1188 7.6953 7.6979 11.8955 11.9142 12.1997 12.2231 12.6316 12.6815 15.1256 15.1313 k = 0.3076 0.3091-0.0000 ( 2444 PWs) bands (ev): -46.2576 -46.2576 -23.9148 -23.9107 -21.9192 -21.9101 -21.7831 -21.7804 -18.9564 -18.9560 -8.5124 -8.5074 -7.8558 -7.8446 -7.7700 -7.7525 -2.6614 -2.6564 -2.4185 -2.4141 -2.3683 -2.3671 3.8621 3.8692 4.3927 4.4187 5.0774 5.0811 5.5780 5.5895 5.9381 5.9511 6.8824 6.8892 7.0116 7.0118 7.1160 7.1168 7.7280 7.7304 11.9571 11.9757 12.2500 12.2730 12.7085 12.7566 15.1513 15.1566 k = 0.3167 0.3182-0.0000 ( 2448 PWs) bands (ev): -46.2576 -46.2576 -23.9164 -23.9124 -21.9225 -21.9136 -21.7840 -21.7814 -18.9557 -18.9553 -8.5069 -8.5019 -7.8313 -7.8229 -7.7450 -7.7306 -2.6611 -2.6565 -2.4181 -2.4136 -2.3691 -2.3683 3.8037 3.8102 4.3305 4.3535 4.9917 4.9933 5.5572 5.5689 5.9048 5.9179 6.8844 6.8917 7.0073 7.0083 7.1140 7.1149 7.7607 7.7628 12.0176 12.0362 12.2989 12.3217 12.7837 12.8299 15.1757 15.1807 k = 0.3257 0.3273-0.0000 ( 2444 PWs) bands (ev): -46.2574 -46.2574 -23.9179 -23.9140 -21.9257 -21.9170 -21.7849 -21.7823 -18.9550 -18.9547 -8.5016 -8.4965 -7.8072 -7.8017 -7.7202 -7.7090 -2.6608 -2.6566 -2.4178 -2.4135 -2.3699 -2.3695 3.7482 3.7543 4.2701 4.2903 4.9075 4.9077 5.5373 5.5491 5.8723 5.8856 6.8878 6.8957 7.0032 7.0052 7.1122 7.1131 7.7930 7.7949 12.0769 12.0953 12.3464 12.3688 12.8572 12.9015 15.1990 15.2036 k = 0.3348 0.3364-0.0000 ( 2452 PWs) bands (ev): -46.2574 -46.2574 -23.9194 -23.9155 -21.9288 -21.9203 -21.7857 -21.7832 -18.9543 -18.9540 -8.4964 -8.4913 -7.7837 -7.7809 -7.6959 -7.6877 -2.6607 -2.6570 -2.4178 -2.4137 -2.3707 -2.3706 3.6957 3.7013 4.2115 4.2291 4.8238 4.8259 5.5184 5.5303 5.8409 5.8542 6.8923 6.9011 6.9994 7.0025 7.1106 7.1114 7.8249 7.8266 12.1346 12.1528 12.3922 12.4142 12.9285 12.9708 15.2209 15.2252 k = 0.3438 0.3455-0.0000 ( 2452 PWs) bands (ev): -46.2573 -46.2573 -23.9208 -23.9171 -21.9317 -21.9236 -21.7865 -21.7841 -18.9537 -18.9534 -8.4913 -8.4863 -7.7609 -7.7606 -7.6721 -7.6668 -2.6607 -2.6574 -2.4181 -2.4142 -2.3715 -2.3714 3.6462 3.6515 4.1550 4.1701 4.7426 4.7463 5.5005 5.5124 5.8105 5.8238 6.8979 6.9076 6.9958 7.0003 7.1091 7.1098 7.8562 7.8577 12.1906 12.2086 12.4364 12.4579 12.9977 13.0380 15.2417 15.2457 k = 0.3529 0.3545-0.0000 ( 2452 PWs) bands (ev): -46.2572 -46.2572 -23.9221 -23.9185 -21.9345 -21.9267 -21.7873 -21.7849 -18.9532 -18.9529 -8.4864 -8.4815 -7.7410 -7.7389 -7.6490 -7.6464 -2.6608 -2.6579 -2.4186 -2.4150 -2.3723 -2.3720 3.5998 3.6048 4.1006 4.1134 4.6642 4.6693 5.4835 5.4955 5.7812 5.7945 6.9042 6.9152 6.9924 6.9985 7.1077 7.1084 7.8868 7.8882 12.2448 12.2625 12.4788 12.4998 13.0645 13.1026 15.2611 15.2648 k = 0.3619 0.3636-0.0000 ( 2452 PWs) bands (ev): -46.2571 -46.2571 -23.9234 -23.9200 -21.9372 -21.9297 -21.7880 -21.7857 -18.9526 -18.9524 -8.4817 -8.4769 -7.7220 -7.7179 -7.6267 -7.6264 -2.6610 -2.6586 -2.4194 -2.4162 -2.3728 -2.3724 3.5566 3.5614 4.0484 4.0592 4.5888 4.5952 5.4677 5.4796 5.7531 5.7663 6.9110 6.9235 6.9892 6.9972 7.1064 7.1070 7.9165 7.9177 12.2969 12.3142 12.5194 12.5398 13.1285 13.1645 15.2794 15.2827 k = 0.3710 0.3727-0.0000 ( 2452 PWs) bands (ev): -46.2570 -46.2570 -23.9246 -23.9213 -21.9397 -21.9325 -21.7886 -21.7865 -18.9522 -18.9519 -8.4771 -8.4725 -7.7038 -7.6979 -7.6070 -7.6052 -2.6614 -2.6593 -2.4205 -2.4178 -2.3731 -2.3727 3.5166 3.5212 3.9987 4.0076 4.5167 4.5242 5.4530 5.4648 5.7263 5.7393 6.9181 6.9325 6.9863 6.9965 7.1052 7.1058 7.9452 7.9462 12.3468 12.3636 12.5579 12.5777 13.1897 13.2235 15.2964 15.2995 k = 0.3800 0.3818-0.0000 ( 2456 PWs) bands (ev): -46.2570 -46.2570 -23.9257 -23.9226 -21.9420 -21.9353 -21.7893 -21.7872 -18.9517 -18.9515 -8.4727 -8.4684 -7.6864 -7.6791 -7.5883 -7.5848 -2.6618 -2.6601 -2.4219 -2.4195 -2.3731 -2.3727 3.4797 3.4842 3.9515 3.9587 4.4481 4.4565 5.4394 5.4510 5.7008 5.7135 6.9251 6.9418 6.9837 6.9965 7.1042 7.1047 7.9726 7.9735 12.3941 12.4105 12.5944 12.6134 13.2477 13.2793 15.3121 15.3149 k = 0.3891 0.3909-0.0000 ( 2458 PWs) bands (ev): -46.2569 -46.2569 -23.9267 -23.9238 -21.9442 -21.9378 -21.7899 -21.7879 -18.9513 -18.9511 -8.4686 -8.4644 -7.6698 -7.6615 -7.5704 -7.5654 -2.6623 -2.6610 -2.4234 -2.4215 -2.3730 -2.3726 3.4461 3.4505 3.9068 3.9126 4.3834 4.3925 5.4270 5.4384 5.6766 5.6891 6.9318 6.9513 6.9813 6.9973 7.1032 7.1036 7.9988 7.9995 12.4389 12.4547 12.6287 12.6469 13.3025 13.3317 15.3267 15.3292 k = 0.3981 0.4000-0.0000 ( 2456 PWs) bands (ev): -46.2568 -46.2568 -23.9277 -23.9250 -21.9462 -21.9403 -21.7904 -21.7886 -18.9509 -18.9508 -8.4647 -8.4607 -7.6542 -7.6452 -7.5533 -7.5473 -2.6629 -2.6619 -2.4250 -2.4235 -2.3727 -2.3724 3.4157 3.4200 3.8649 3.8694 4.3227 4.3322 5.4157 5.4268 5.6540 5.6661 6.9378 6.9605 6.9795 6.9991 7.1024 7.1027 8.0235 8.0241 12.4809 12.4960 12.6609 12.6781 13.3537 13.3807 15.3401 15.3423 k = 0.4072 0.4091-0.0000 ( 2448 PWs) bands (ev): -46.2566 -46.2566 -23.9286 -23.9261 -21.9480 -21.9425 -21.7909 -21.7892 -18.9506 -18.9505 -8.4610 -8.4573 -7.6396 -7.6302 -7.5371 -7.5304 -2.6636 -2.6628 -2.4267 -2.4256 -2.3722 -2.3720 3.3885 3.3927 3.8258 3.8292 4.2663 4.2760 5.4056 5.4164 5.6329 5.6445 6.9430 6.9682 6.9793 7.0018 7.1017 7.1019 8.0466 8.0471 12.5200 12.5342 12.6907 12.7070 13.4013 13.4260 15.3522 15.3542 k = 0.4162 0.4182-0.0000 ( 2448 PWs) bands (ev): -46.2566 -46.2566 -23.9293 -23.9271 -21.9497 -21.9447 -21.7913 -21.7898 -18.9503 -18.9502 -8.4575 -8.4542 -7.6261 -7.6166 -7.5219 -7.5149 -2.6643 -2.6638 -2.4284 -2.4277 -2.3717 -2.3716 3.3644 3.3685 3.7896 3.7922 4.2144 4.2241 5.3968 5.4070 5.6134 5.6245 6.9471 6.9710 6.9839 7.0053 7.1011 7.1012 8.0679 8.0684 12.5559 12.5692 12.7182 12.7333 13.4451 13.4674 15.3632 15.3650 k = 0.4253 0.4273-0.0000 ( 2448 PWs) bands (ev): -46.2565 -46.2565 -23.9300 -23.9280 -21.9511 -21.9466 -21.7917 -21.7903 -18.9501 -18.9499 -8.4544 -8.4513 -7.6137 -7.6044 -7.5079 -7.5009 -2.6650 -2.6647 -2.4301 -2.4296 -2.3712 -2.3711 3.3433 3.3473 3.7565 3.7583 4.1673 4.1768 5.3891 5.3988 5.5956 5.6060 6.9503 6.9703 6.9916 7.0096 7.1006 7.1006 8.0874 8.0878 12.5886 12.6010 12.7432 12.7571 13.4849 13.5048 15.3731 15.3746 k = 0.4343 0.4364-0.0000 ( 2452 PWs) bands (ev): -46.2565 -46.2565 -23.9307 -23.9289 -21.9524 -21.9484 -21.7920 -21.7908 -18.9498 -18.9497 -8.4515 -8.4488 -7.6025 -7.5937 -7.4952 -7.4884 -2.6657 -2.6656 -2.4317 -2.4315 -2.3707 -2.3707 3.3252 3.3290 3.7266 3.7279 4.1251 4.1341 5.3825 5.3915 5.5796 5.5893 6.9528 6.9690 6.9997 7.0142 7.1001 7.1001 8.1050 8.1053 12.6180 12.6292 12.7657 12.7782 13.5207 13.5382 15.3818 15.3831 k = 0.4434 0.4455-0.0000 ( 2444 PWs) bands (ev): -46.2564 -46.2564 -23.9312 -23.9296 -21.9535 -21.9500 -21.7923 -21.7912 -18.9496 -18.9495 -8.4489 -8.4466 -7.5925 -7.5845 -7.4838 -7.4774 -2.6664 -2.6664 -2.4331 -2.4331 -2.3702 -2.3702 3.3100 3.3134 3.7001 3.7009 4.0881 4.0964 5.3771 5.3853 5.5656 5.5743 6.9546 6.9676 7.0072 7.0188 7.0996 7.0998 8.1205 8.1208 12.6440 12.6539 12.7856 12.7967 13.5522 13.5673 15.3893 15.3904 k = 0.4524 0.4546-0.0000 ( 2444 PWs) bands (ev): -46.2563 -46.2563 -23.9316 -23.9303 -21.9543 -21.9514 -21.7925 -21.7916 -18.9495 -18.9494 -8.4467 -8.4447 -7.5838 -7.5767 -7.4738 -7.4681 -2.6671 -2.6671 -2.4345 -2.4344 -2.3697 -2.3697 3.2974 3.3006 3.6770 3.6776 4.0564 4.0637 5.3727 5.3799 5.5535 5.5612 6.9559 6.9663 7.0140 7.0232 7.0993 7.0995 8.1339 8.1341 12.6664 12.6749 12.8028 12.8124 13.5794 13.5921 15.3958 15.3967 k = 0.4615 0.4636-0.0000 ( 2448 PWs) bands (ev): -46.2564 -46.2564 -23.9319 -23.9309 -21.9550 -21.9526 -21.7926 -21.7919 -18.9493 -18.9493 -8.4448 -8.4432 -7.5763 -7.5704 -7.4653 -7.4605 -2.6678 -2.6677 -2.4357 -2.4356 -2.3693 -2.3693 3.2874 3.2901 3.6576 3.6580 4.0301 4.0364 5.3694 5.3755 5.5435 5.5500 6.9570 6.9650 7.0199 7.0270 7.0991 7.0993 8.1451 8.1453 12.6852 12.6922 12.8174 12.8252 13.6022 13.6125 15.4011 15.4018 k = 0.4705 0.4727-0.0000 ( 2448 PWs) bands (ev): -46.2564 -46.2564 -23.9322 -23.9313 -21.9555 -21.9536 -21.7927 -21.7922 -18.9492 -18.9492 -8.4432 -8.4420 -7.5703 -7.5656 -7.4584 -7.4545 -2.6683 -2.6682 -2.4367 -2.4365 -2.3690 -2.3690 3.2799 3.2820 3.6420 3.6423 4.0095 4.0144 5.3671 5.3719 5.5357 5.5408 6.9580 6.9638 7.0248 7.0300 7.0989 7.0991 8.1540 8.1542 12.7002 12.7057 12.8291 12.8352 13.6205 13.6284 15.4053 15.4059 k = 0.4795 0.4818-0.0000 ( 2442 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9317 -21.9558 -21.9545 -21.7928 -21.7924 -18.9491 -18.9491 -8.4420 -8.4411 -7.5656 -7.5623 -7.4531 -7.4503 -2.6686 -2.6685 -2.4374 -2.4372 -2.3688 -2.3687 3.2746 3.2761 3.6305 3.6306 3.9945 3.9979 5.3656 5.3691 5.5301 5.5338 6.9588 6.9628 7.0286 7.0322 7.0989 7.0990 8.1606 8.1607 12.7116 12.7155 12.8381 12.8424 13.6344 13.6398 15.4084 15.4088 k = 0.4886 0.4909-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9324 -23.9320 -21.9558 -21.9551 -21.7928 -21.7926 -18.9491 -18.9491 -8.4412 -8.4407 -7.5623 -7.5604 -7.4494 -7.4479 -2.6689 -2.6688 -2.4378 -2.4377 -2.3686 -2.3686 3.2714 3.2723 3.6230 3.6231 3.9851 3.9871 5.3650 5.3670 5.5269 5.5289 6.9596 6.9618 7.0314 7.0333 7.0988 7.0989 8.1649 8.1649 12.7192 12.7214 12.8442 12.8466 13.6436 13.6467 15.4104 15.4106 k = 0.4976 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9322 -21.9557 -21.9556 -21.7928 -21.7927 -18.9491 -18.9491 -8.4407 -8.4406 -7.5604 -7.5601 -7.4475 -7.4472 -2.6690 -2.6689 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2704 3.6198 3.6198 3.9816 3.9820 5.3652 5.3657 5.5259 5.5263 6.9605 6.9609 7.0330 7.0334 7.0988 7.0988 8.1667 8.1667 12.7230 12.7234 12.8474 12.8479 13.6483 13.6490 15.4113 15.4114 k = 0.4976 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9322 -21.9557 -21.9556 -21.7928 -21.7927 -18.9491 -18.9491 -8.4407 -8.4406 -7.5604 -7.5601 -7.4475 -7.4472 -2.6690 -2.6689 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2704 3.6198 3.6198 3.9816 3.9820 5.3652 5.3657 5.5259 5.5263 6.9605 6.9609 7.0330 7.0334 7.0988 7.0988 8.1667 8.1667 12.7230 12.7234 12.8474 12.8479 13.6483 13.6490 15.4113 15.4114 k = 0.4849 0.5000-0.0000 ( 2450 PWs) bands (ev): -46.2564 -46.2564 -23.9323 -23.9321 -21.9558 -21.9552 -21.7928 -21.7926 -18.9491 -18.9491 -8.4411 -8.4407 -7.5620 -7.5606 -7.4491 -7.4479 -2.6689 -2.6688 -2.4378 -2.4378 -2.3686 -2.3686 3.2719 3.2726 3.6226 3.6227 3.9843 3.9858 5.3654 5.3669 5.5267 5.5283 6.9596 6.9612 7.0320 7.0335 7.0988 7.0989 8.1651 8.1651 12.7199 12.7215 12.8446 12.8464 13.6444 13.6467 15.4106 15.4108 k = 0.4721 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9318 -21.9556 -21.9547 -21.7928 -21.7925 -18.9491 -18.9491 -8.4419 -8.4412 -7.5651 -7.5627 -7.4522 -7.4501 -2.6687 -2.6686 -2.4374 -2.4373 -2.3688 -2.3687 3.2766 3.2777 3.6297 3.6298 3.9916 3.9943 5.3665 5.3691 5.5296 5.5323 6.9581 6.9609 7.0306 7.0331 7.0989 7.0990 8.1612 8.1613 12.7130 12.7158 12.8391 12.8422 13.6359 13.6399 15.4090 15.4093 k = 0.4594 0.5000-0.0000 ( 2446 PWs) bands (ev): -46.2563 -46.2563 -23.9321 -23.9315 -21.9553 -21.9540 -21.7927 -21.7923 -18.9492 -18.9492 -8.4430 -8.4421 -7.5701 -7.5666 -7.4566 -7.4536 -2.6683 -2.6682 -2.4368 -2.4367 -2.3690 -2.3690 3.2837 3.2854 3.6413 3.6414 4.0035 4.0073 5.3687 5.3723 5.5344 5.5382 6.9560 6.9600 7.0287 7.0323 7.0990 7.0991 8.1551 8.1551 12.7017 12.7055 12.8318 12.8360 13.6230 13.6287 15.4065 15.4069 k = 0.4466 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2564 -46.2564 -23.9318 -23.9310 -21.9548 -21.9530 -21.7926 -21.7920 -18.9493 -18.9493 -8.4445 -8.4433 -7.5773 -7.5728 -7.4617 -7.4579 -2.6678 -2.6677 -2.4359 -2.4358 -2.3694 -2.3693 3.2927 3.2949 3.6579 3.6579 4.0201 4.0251 5.3719 5.3764 5.5413 5.5461 6.9532 6.9585 7.0265 7.0312 7.0991 7.0993 8.1466 8.1467 12.6850 12.6895 12.8236 12.8286 13.6059 13.6132 15.4030 15.4036 k = 0.4338 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2564 -46.2564 -23.9315 -23.9305 -21.9540 -21.9519 -21.7924 -21.7917 -18.9494 -18.9494 -8.4464 -8.4449 -7.5871 -7.5817 -7.4670 -7.4625 -2.6672 -2.6671 -2.4348 -2.4347 -2.3698 -2.3698 3.3028 3.3055 3.6798 3.6799 4.0416 4.0478 5.3760 5.3814 5.5502 5.5559 6.9498 6.9562 7.0240 7.0297 7.0993 7.0996 8.1357 8.1358 12.6622 12.6670 12.8158 12.8213 13.5848 13.5937 15.3985 15.3992 k = 0.4211 0.5000-0.0000 ( 2450 PWs) bands (ev): -46.2565 -46.2565 -23.9310 -23.9299 -21.9531 -21.9507 -21.7921 -21.7914 -18.9496 -18.9496 -8.4486 -8.4469 -7.5997 -7.5938 -7.4719 -7.4670 -2.6665 -2.6664 -2.4335 -2.4333 -2.3703 -2.3703 3.3133 3.3163 3.7072 3.7076 4.0681 4.0756 5.3810 5.3871 5.5613 5.5678 6.9455 6.9531 7.0214 7.0281 7.0996 7.0999 8.1225 8.1226 12.6327 12.6374 12.8091 12.8145 13.5599 13.5705 15.3930 15.3939 k = 0.4083 0.5000-0.0000 ( 2450 PWs) bands (ev): -46.2565 -46.2565 -23.9305 -23.9292 -21.9520 -21.9492 -21.7918 -21.7910 -18.9498 -18.9497 -8.4513 -8.4492 -7.6155 -7.6092 -7.4760 -7.4708 -2.6657 -2.6656 -2.4319 -2.4318 -2.3709 -2.3708 3.3234 3.3268 3.7403 3.7412 4.1001 4.1089 5.3868 5.3936 5.5744 5.5817 6.9405 6.9491 7.0188 7.0263 7.1000 7.1002 8.1068 8.1069 12.5966 12.6010 12.8035 12.8087 13.5317 13.5439 15.3863 15.3874 k = 0.3956 0.5000-0.0000 ( 2446 PWs) bands (ev): -46.2565 -46.2565 -23.9299 -23.9285 -21.9508 -21.9477 -21.7914 -21.7905 -18.9500 -18.9499 -8.4543 -8.4520 -7.6345 -7.6280 -7.4792 -7.4738 -2.6647 -2.6647 -2.4302 -2.4301 -2.3715 -2.3714 3.3327 3.3364 3.7789 3.7803 4.1378 4.1480 5.3933 5.4006 5.5897 5.5976 6.9347 6.9441 7.0163 7.0246 7.1004 7.1006 8.0887 8.0888 12.5542 12.5581 12.7989 12.8038 13.5005 13.5143 15.3785 15.3798 k = 0.3828 0.5000-0.0000 ( 2450 PWs) bands (ev): -46.2566 -46.2566 -23.9292 -23.9276 -21.9494 -21.9459 -21.7910 -21.7900 -18.9502 -18.9501 -8.4578 -8.4552 -7.6563 -7.6499 -7.4813 -7.4761 -2.6637 -2.6637 -2.4282 -2.4282 -2.3721 -2.3721 3.3410 3.3449 3.8223 3.8246 4.1817 4.1934 5.4005 5.4082 5.6071 5.6154 6.9279 6.9382 7.0141 7.0229 7.1009 7.1011 8.0680 8.0681 12.5058 12.5093 12.7952 12.7996 13.4667 13.4819 15.3692 15.3708 k = 0.3700 0.5000-0.0000 ( 2444 PWs) bands (ev): -46.2566 -46.2566 -23.9284 -23.9267 -21.9478 -21.9441 -21.7905 -21.7894 -18.9505 -18.9504 -8.4617 -8.4588 -7.6808 -7.6746 -7.4826 -7.4775 -2.6626 -2.6626 -2.4261 -2.4260 -2.3727 -2.3727 3.3482 3.3522 3.8699 3.8730 4.2322 4.2455 5.4083 5.4162 5.6266 5.6352 6.9204 6.9312 7.0123 7.0215 7.1015 7.1017 8.0447 8.0449 12.4521 12.4551 12.7920 12.7959 13.4307 13.4474 15.3586 15.3605 k = 0.3573 0.5000-0.0000 ( 2445 PWs) bands (ev): -46.2567 -46.2567 -23.9276 -23.9258 -21.9461 -21.9421 -21.7899 -21.7887 -18.9507 -18.9506 -8.4660 -8.4628 -7.7077 -7.7017 -7.4831 -7.4782 -2.6615 -2.6614 -2.4238 -2.4237 -2.3734 -2.3734 3.3542 3.3583 3.9207 3.9248 4.2899 4.3047 5.4165 5.4246 5.6481 5.6570 6.9119 6.9231 7.0108 7.0203 7.1022 7.1024 8.0188 8.0190 12.3936 12.3961 12.7892 12.7927 13.3929 13.4111 15.3464 15.3487 k = 0.3445 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2568 -46.2568 -23.9267 -23.9248 -21.9443 -21.9401 -21.7893 -21.7880 -18.9510 -18.9509 -8.4708 -8.4673 -7.7364 -7.7308 -7.4830 -7.4784 -2.6604 -2.6602 -2.4215 -2.4213 -2.3740 -2.3739 3.3593 3.3633 3.9739 3.9789 4.3550 4.3711 5.4252 5.4334 5.6715 5.6806 6.9026 6.9142 7.0099 7.0195 7.1029 7.1031 7.9903 7.9904 12.3308 12.3329 12.7866 12.7897 13.3538 13.3734 15.3325 15.3351 k = 0.3318 0.5000-0.0000 ( 2451 PWs) bands (ev): -46.2569 -46.2569 -23.9257 -23.9237 -21.9424 -21.9380 -21.7885 -21.7872 -18.9513 -18.9512 -8.4761 -8.4722 -7.7667 -7.7615 -7.4825 -7.4781 -2.6592 -2.6590 -2.4191 -2.4188 -2.3745 -2.3744 3.3635 3.3675 4.0289 4.0347 4.4275 4.4449 5.4343 5.4424 5.6968 5.7060 6.8925 6.9043 7.0095 7.0191 7.1038 7.1040 7.9590 7.9592 12.2641 12.2658 12.7843 12.7870 13.3139 13.3348 15.3167 15.3197 k = 0.3190 0.5000-0.0000 ( 2451 PWs) bands (ev): -46.2570 -46.2570 -23.9247 -23.9226 -21.9405 -21.9359 -21.7878 -21.7864 -18.9516 -18.9515 -8.4819 -8.4777 -7.7982 -7.7933 -7.4815 -7.4775 -2.6580 -2.6577 -2.4167 -2.4163 -2.3748 -2.3748 3.3670 3.3709 4.0851 4.0916 4.5073 4.5257 5.4437 5.4517 5.7239 5.7331 6.8817 6.8936 7.0097 7.0191 7.1047 7.1049 7.9251 7.9252 12.1941 12.1955 12.7820 12.7844 13.2735 13.2958 15.2988 15.3023 k = 0.3062 0.5000-0.0000 ( 2445 PWs) bands (ev): -46.2570 -46.2570 -23.9236 -23.9215 -21.9384 -21.9337 -21.7869 -21.7855 -18.9519 -18.9518 -8.4882 -8.4837 -7.8304 -7.8260 -7.4803 -7.4765 -2.6567 -2.6564 -2.4143 -2.4138 -2.3750 -2.3749 3.3700 3.3737 4.1423 4.1494 4.5939 4.6131 5.4533 5.4612 5.7527 5.7618 6.8702 6.8822 7.0106 7.0198 7.1058 7.1059 7.8884 7.8885 12.1213 12.1224 12.7798 12.7818 13.2331 13.2567 15.2785 15.2825 k = 0.2935 0.5000-0.0000 ( 2446 PWs) bands (ev): -46.2571 -46.2571 -23.9225 -23.9203 -21.9363 -21.9315 -21.7859 -21.7845 -18.9523 -18.9522 -8.4951 -8.4903 -7.8631 -7.8592 -7.4788 -7.4752 -2.6555 -2.6551 -2.4120 -2.4114 -2.3749 -2.3748 3.3724 3.3760 4.2005 4.2080 4.6865 4.7063 5.4632 5.4708 5.7830 5.7920 6.8582 6.8702 7.0121 7.0211 7.1070 7.1071 7.8491 7.8491 12.0461 12.0469 12.7776 12.7793 13.1932 13.2179 15.2556 15.2602 k = 0.2807 0.5000-0.0000 ( 2444 PWs) bands (ev): -46.2571 -46.2571 -23.9214 -23.9192 -21.9342 -21.9293 -21.7849 -21.7835 -18.9526 -18.9525 -8.5025 -8.4974 -7.8959 -7.8924 -7.4771 -7.4738 -2.6543 -2.6538 -2.4099 -2.4093 -2.3745 -2.3744 3.3744 3.3779 4.2596 4.2674 4.7842 4.8046 5.4732 5.4806 5.8146 5.8235 6.8455 6.8576 7.0144 7.0232 7.1082 7.1083 7.8071 7.8071 11.9689 11.9696 12.7755 12.7768 13.1539 13.1798 15.2298 15.2352 k = 0.2680 0.5000-0.0000 ( 2443 PWs) bands (ev): -46.2572 -46.2572 -23.9203 -23.9180 -21.9321 -21.9271 -21.7838 -21.7824 -18.9529 -18.9528 -8.5106 -8.5052 -7.9284 -7.9254 -7.4753 -7.4721 -2.6531 -2.6525 -2.4080 -2.4074 -2.3737 -2.3736 3.3762 3.3794 4.3198 4.3278 4.8860 4.9070 5.4833 5.4903 5.8475 5.8562 6.8324 6.8446 7.0176 7.0261 7.1096 7.1097 7.7625 7.7625 11.8903 11.8908 12.7733 12.7744 13.1158 13.1429 15.2009 15.2070 k = 0.2552 0.5000-0.0000 ( 2444 PWs) bands (ev): -46.2573 -46.2573 -23.9191 -23.9168 -21.9299 -21.9249 -21.7827 -21.7813 -18.9533 -18.9532 -8.5194 -8.5137 -7.9604 -7.9579 -7.4734 -7.4704 -2.6520 -2.6513 -2.4065 -2.4058 -2.3724 -2.3724 3.3776 3.3807 4.3811 4.3892 4.9910 5.0124 5.4934 5.5001 5.8815 5.8900 6.8189 6.8311 7.0218 7.0299 7.1111 7.1112 7.7155 7.7155 11.8107 11.8110 12.7711 12.7719 13.0791 13.1072 15.1684 15.1754 k = 0.2424 0.5000-0.0000 ( 2444 PWs) bands (ev): -46.2574 -46.2574 -23.9179 -23.9157 -21.9278 -21.9228 -21.7815 -21.7801 -18.9536 -18.9535 -8.5288 -8.5228 -7.9915 -7.9895 -7.4714 -7.4686 -2.6508 -2.6502 -2.4053 -2.4046 -2.3707 -2.3707 3.3789 3.3818 4.4435 4.4518 5.0981 5.1200 5.5036 5.5099 5.9163 5.9246 6.8050 6.8173 7.0270 7.0348 7.1127 7.1128 7.6661 7.6662 11.7307 11.7308 12.7689 12.7694 13.0442 13.0733 15.1322 15.1401 k = 0.2297 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2575 -46.2575 -23.9168 -23.9145 -21.9257 -21.9208 -21.7802 -21.7789 -18.9540 -18.9539 -8.5389 -8.5327 -8.0215 -8.0200 -7.4693 -7.4667 -2.6498 -2.6490 -2.4045 -2.4039 -2.3687 -2.3685 3.3800 3.3827 4.5072 4.5156 5.2062 5.2285 5.5137 5.5196 5.9517 5.9599 6.7907 6.8031 7.0334 7.0409 7.1145 7.1147 7.6147 7.6148 11.6505 11.6506 12.7666 12.7668 13.0113 13.0413 15.0919 15.1008 k = 0.2169 0.5000-0.0000 ( 2443 PWs) bands (ev): -46.2575 -46.2575 -23.9156 -23.9134 -21.9236 -21.9188 -21.7789 -21.7776 -18.9543 -18.9542 -8.5497 -8.5433 -8.0501 -8.0491 -7.4672 -7.4648 -2.6488 -2.6480 -2.4039 -2.4034 -2.3662 -2.3660 3.3809 3.3835 4.5722 4.5806 5.3139 5.3370 5.5241 5.5293 5.9876 5.9956 6.7762 6.7887 7.0411 7.0482 7.1164 7.1166 7.5616 7.5617 11.5708 11.5709 12.7642 12.7643 12.9806 13.0114 15.0474 15.0574 k = 0.2042 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2576 -46.2576 -23.9145 -23.9123 -21.9217 -21.9170 -21.7776 -21.7763 -18.9547 -18.9545 -8.5611 -8.5546 -8.0771 -8.0765 -7.4652 -7.4629 -2.6478 -2.6470 -2.4037 -2.4032 -2.3634 -2.3631 3.3817 3.3841 4.6383 4.6468 5.4194 5.4438 5.5352 5.5393 6.0237 6.0316 6.7613 6.7740 7.0500 7.0567 7.1185 7.1188 7.5072 7.5073 11.4919 11.4921 12.7615 12.7618 12.9524 12.9839 14.9984 15.0095 k = 0.1914 0.5000-0.0000 ( 2453 PWs) bands (ev): -46.2578 -46.2578 -23.9134 -23.9112 -21.9198 -21.9152 -21.7762 -21.7750 -18.9550 -18.9549 -8.5731 -8.5665 -8.1024 -8.1022 -7.4631 -7.4610 -2.6469 -2.6461 -2.4037 -2.4032 -2.3605 -2.3601 3.3824 3.3847 4.7054 4.7141 5.5135 5.5367 5.5553 5.5607 6.0598 6.0676 6.7461 6.7589 7.0601 7.0663 7.1209 7.1213 7.4523 7.4523 11.4145 11.4147 12.7587 12.7593 12.9268 12.9588 14.9450 14.9573 k = 0.1786 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2578 -46.2578 -23.9122 -23.9102 -21.9179 -21.9136 -21.7748 -21.7737 -18.9553 -18.9552 -8.5855 -8.5789 -8.1259 -8.1258 -7.4611 -7.4591 -2.6460 -2.6452 -2.4037 -2.4034 -2.3574 -2.3569 3.3831 3.3851 4.7736 4.7823 5.5453 5.5540 5.6337 5.6540 6.0957 6.1034 6.7304 6.7435 7.0708 7.0764 7.1235 7.1242 7.3979 7.3979 11.3389 11.3392 12.7559 12.7566 12.9040 12.9363 14.8873 14.9008 k = 0.1659 0.5000-0.0000 ( 2447 PWs) bands (ev): -46.2579 -46.2579 -23.9112 -23.9092 -21.9162 -21.9120 -21.7735 -21.7724 -18.9556 -18.9555 -8.5984 -8.5918 -8.1476 -8.1472 -7.4591 -7.4573 -2.6453 -2.6444 -2.4039 -2.4036 -2.3542 -2.3537 3.3836 3.3855 4.8426 4.8514 5.5563 5.5630 5.7279 5.7506 6.1310 6.1387 6.7141 6.7276 7.0808 7.0857 7.1263 7.1274 7.3460 7.3462 11.2658 11.2661 12.7530 12.7538 12.8840 12.9165 14.8258 14.8404 k = 0.1531 0.5000-0.0000 ( 2442 PWs) bands (ev): -46.2579 -46.2579 -23.9102 -23.9083 -21.9145 -21.9106 -21.7721 -21.7711 -18.9559 -18.9558 -8.6114 -8.6050 -8.1673 -8.1666 -7.4572 -7.4556 -2.6445 -2.6437 -2.4042 -2.4039 -2.3511 -2.3505 3.3841 3.3859 4.9122 4.9211 5.5653 5.5712 5.8179 5.8420 6.1655 6.1732 6.6971 6.7109 7.0874 7.0913 7.1287 7.1304 7.3009 7.3011 11.1954 11.1958 12.7502 12.7508 12.8669 12.8992 14.7609 14.7766 k = 0.1404 0.5000-0.0000 ( 2442 PWs) bands (ev): -46.2579 -46.2579 -23.9092 -23.9075 -21.9130 -21.9093 -21.7708 -21.7699 -18.9562 -18.9561 -8.6244 -8.6183 -8.1849 -8.1840 -7.4554 -7.4539 -2.6439 -2.6431 -2.4045 -2.4042 -2.3480 -2.3474 3.3846 3.3862 4.9821 4.9911 5.5735 5.5788 5.9013 5.9266 6.1990 6.2068 6.6790 6.6932 7.0852 7.0881 7.1297 7.1318 7.2699 7.2700 11.1284 11.1288 12.7473 12.7478 12.8527 12.8845 14.6935 14.7101 k = 0.1276 0.5000-0.0000 ( 2442 PWs) bands (ev): -46.2580 -46.2580 -23.9083 -23.9067 -21.9115 -21.9082 -21.7695 -21.7687 -18.9564 -18.9563 -8.6373 -8.6314 -8.2005 -8.1995 -7.4537 -7.4523 -2.6433 -2.6425 -2.4048 -2.4046 -2.3450 -2.3445 3.3850 3.3864 5.0520 5.0611 5.5810 5.5859 5.9770 6.0037 6.2311 6.2391 6.6593 6.6740 7.0669 7.0690 7.1297 7.1317 7.2603 7.2606 11.0652 11.0656 12.7446 12.7447 12.8414 12.8721 14.6247 14.6420 k = 0.1148 0.5000-0.0000 ( 2443 PWs) bands (ev): -46.2581 -46.2581 -23.9074 -23.9059 -21.9102 -21.9071 -21.7682 -21.7675 -18.9567 -18.9566 -8.6497 -8.6442 -8.2142 -8.2132 -7.4521 -7.4509 -2.6427 -2.6420 -2.4051 -2.4049 -2.3422 -2.3417 3.3854 3.3866 5.1214 5.1305 5.5880 5.5924 6.0443 6.0725 6.2615 6.2699 6.6376 6.6529 7.0336 7.0352 7.1308 7.1324 7.2698 7.2705 11.0062 11.0066 12.7418 12.7420 12.8326 12.8620 14.5558 14.5734 k = 0.1021 0.5000-0.0000 ( 2441 PWs) bands (ev): -46.2581 -46.2581 -23.9067 -23.9053 -21.9090 -21.9062 -21.7671 -21.7665 -18.9569 -18.9568 -8.6615 -8.6564 -8.2261 -8.2251 -7.4507 -7.4496 -2.6422 -2.6416 -2.4054 -2.4053 -2.3396 -2.3391 3.3857 3.3868 5.1898 5.1989 5.5943 5.5984 6.1029 6.1327 6.2899 6.2988 6.6132 6.6293 6.9938 6.9951 7.1326 7.1340 7.2907 7.2915 10.9519 10.9523 12.7391 12.7396 12.8261 12.8539 14.4881 14.5058 k = 0.0893 0.5000-0.0000 ( 2441 PWs) bands (ev): -46.2582 -46.2582 -23.9059 -23.9047 -21.9079 -21.9055 -21.7660 -21.7655 -18.9571 -18.9570 -8.6724 -8.6679 -8.2363 -8.2353 -7.4493 -7.4484 -2.6418 -2.6412 -2.4057 -2.4056 -2.3372 -2.3367 3.3860 3.3870 5.2563 5.2654 5.6001 5.6039 6.1526 6.1842 6.3160 6.3255 6.5859 6.6027 6.9542 6.9552 7.1347 7.1358 7.3172 7.3179 10.9029 10.9032 12.7369 12.7376 12.8218 12.8475 14.4233 14.4405 k = 0.0766 0.5000-0.0000 ( 2442 PWs) bands (ev): -46.2582 -46.2582 -23.9053 -23.9042 -21.9070 -21.9048 -21.7651 -21.7646 -18.9572 -18.9572 -8.6822 -8.6783 -8.2448 -8.2439 -7.4482 -7.4474 -2.6415 -2.6410 -2.4059 -2.4058 -2.3351 -2.3346 3.3862 3.3871 5.3200 5.3290 5.6052 5.6088 6.1940 6.2275 6.3391 6.3496 6.5556 6.5732 6.9185 6.9192 7.1368 7.1377 7.3457 7.3463 10.8594 10.8597 12.7351 12.7360 12.8193 12.8425 14.3629 14.3792 k = 0.0638 0.5000-0.0000 ( 2440 PWs) bands (ev): -46.2582 -46.2582 -23.9047 -23.9038 -21.9061 -21.9043 -21.7643 -21.7639 -18.9574 -18.9573 -8.6908 -8.6875 -8.2519 -8.2511 -7.4472 -7.4465 -2.6411 -2.6407 -2.4061 -2.4061 -2.3332 -2.3328 3.3865 3.3872 5.3797 5.3883 5.6099 5.6131 6.2276 6.2630 6.3588 6.3706 6.5233 6.5413 6.8883 6.8889 7.1387 7.1395 7.3738 7.3743 10.8218 10.8221 12.7338 12.7347 12.8182 12.8386 14.3087 14.3235 k = 0.0510 0.5000-0.0000 ( 2438 PWs) bands (ev): -46.2582 -46.2582 -23.9042 -23.9035 -21.9054 -21.9039 -21.7636 -21.7633 -18.9575 -18.9574 -8.6980 -8.6953 -8.2575 -8.2568 -7.4463 -7.4458 -2.6409 -2.6405 -2.4063 -2.4062 -2.3317 -2.3314 3.3867 3.3872 5.4335 5.4415 5.6140 5.6170 6.2543 6.2913 6.3739 6.3881 6.4912 6.5089 6.8644 6.8647 7.1404 7.1410 7.3996 7.4000 10.7906 10.7909 12.7329 12.7338 12.8184 12.8355 14.2622 14.2749 k = 0.0383 0.5000-0.0000 ( 2438 PWs) bands (ev): -46.2583 -46.2583 -23.9038 -23.9033 -21.9048 -21.9037 -21.7630 -21.7628 -18.9576 -18.9575 -8.7037 -8.7016 -8.2618 -8.2613 -7.4456 -7.4452 -2.6407 -2.6404 -2.4064 -2.4064 -2.3304 -2.3302 3.3868 3.3872 5.4794 5.4863 5.6178 5.6204 6.2753 6.3127 6.3832 6.4014 6.4636 6.4782 6.8465 6.8467 7.1418 7.1423 7.4214 7.4217 10.7660 10.7662 12.7324 12.7331 12.8195 12.8328 14.2248 14.2349 k = 0.0255 0.5000-0.0000 ( 2439 PWs) bands (ev): -46.2583 -46.2583 -23.9035 -23.9032 -21.9043 -21.9036 -21.7626 -21.7624 -18.9576 -18.9576 -8.7077 -8.7063 -8.2647 -8.2644 -7.4451 -7.4448 -2.6405 -2.6403 -2.4065 -2.4065 -2.3295 -2.3294 3.3870 3.3872 5.5148 5.5201 5.6214 5.6234 6.2920 6.3258 6.3859 6.4092 6.4457 6.4528 6.8343 6.8343 7.1429 7.1432 7.4379 7.4381 10.7483 10.7484 12.7321 12.7326 12.8213 12.8304 14.1977 14.2047 k = 0.0128 0.5000-0.0000 ( 2440 PWs) bands (ev): -46.2583 -46.2583 -23.9033 -23.9031 -21.9039 -21.9036 -21.7623 -21.7622 -18.9577 -18.9577 -8.7100 -8.7093 -8.2665 -8.2663 -7.4448 -7.4446 -2.6404 -2.6403 -2.4066 -2.4066 -2.3290 -2.3289 3.3871 3.3872 5.5376 5.5405 5.6244 5.6255 6.3062 6.3274 6.3882 6.4073 6.4384 6.4387 6.8272 6.8272 7.1436 7.1437 7.4483 7.4484 10.7376 10.7376 12.7321 12.7323 12.8234 12.8281 14.1817 14.1854 k = 0.0000 0.5000-0.0000 ( 2440 PWs) bands (ev): -46.2583 -46.2583 -23.9032 -23.9032 -21.9037 -21.9037 -21.7622 -21.7622 -18.9577 -18.9577 -8.7105 -8.7105 -8.2670 -8.2670 -7.4446 -7.4446 -2.6403 -2.6403 -2.4066 -2.4066 -2.3287 -2.3287 3.3872 3.3872 5.5463 5.5463 5.6260 5.6260 6.3188 6.3188 6.3967 6.3967 6.4364 6.4364 6.8248 6.8248 7.1439 7.1439 7.4518 7.4518 10.7340 10.7340 12.7321 12.7321 12.8258 12.8258 14.1776 14.1776 k = 0.0000 0.5000-0.0000 ( 2440 PWs) bands (ev): -46.2583 -46.2583 -23.9032 -23.9032 -21.9037 -21.9037 -21.7622 -21.7622 -18.9577 -18.9577 -8.7105 -8.7105 -8.2670 -8.2670 -7.4446 -7.4446 -2.6403 -2.6403 -2.4066 -2.4066 -2.3287 -2.3287 3.3872 3.3872 5.5463 5.5463 5.6260 5.6260 6.3188 6.3188 6.3967 6.3967 6.4364 6.4364 6.8248 6.8248 7.1439 7.1439 7.4518 7.4518 10.7340 10.7340 12.7321 12.7321 12.8258 12.8258 14.1776 14.1776 k = 0.0000 0.5000 0.0127 ( 2444 PWs) bands (ev): -46.2584 -46.2584 -23.9034 -23.9031 -21.9038 -21.9035 -21.7627 -21.7621 -18.9577 -18.9577 -8.7103 -8.7089 -8.2673 -8.2654 -7.4448 -7.4445 -2.6410 -2.6397 -2.4075 -2.4057 -2.3291 -2.3288 3.3871 3.3872 5.5418 5.5483 5.6151 5.6219 6.3064 6.3296 6.3823 6.4129 6.4282 6.4471 6.8282 6.8290 7.1265 7.1449 7.4470 7.4662 10.7320 10.7389 12.7272 12.7366 12.8213 12.8302 14.1810 14.1847 k = 0.0000 0.5000 0.0254 ( 2444 PWs) bands (ev): -46.2583 -46.2583 -23.9037 -23.9031 -21.9040 -21.9034 -21.7634 -21.7622 -18.9576 -18.9576 -8.7081 -8.7055 -8.2662 -8.2626 -7.4452 -7.4446 -2.6419 -2.6391 -2.4084 -2.4049 -2.3299 -2.3292 3.3869 3.3872 5.5323 5.5485 5.5898 5.6062 6.2941 6.3346 6.3707 6.4175 6.4334 6.4623 6.8394 6.8408 7.0970 7.1294 7.4522 7.4864 10.7331 10.7467 12.7219 12.7404 12.8172 12.8347 14.1948 14.2020 k = 0.0000 0.5000 0.0381 ( 2444 PWs) bands (ev): -46.2583 -46.2583 -23.9041 -23.9031 -21.9042 -21.9033 -21.7645 -21.7627 -18.9575 -18.9575 -8.7041 -8.7002 -8.2639 -8.2584 -7.4458 -7.4449 -2.6427 -2.6387 -2.4093 -2.4041 -2.3310 -2.3299 3.3867 3.3872 5.5119 5.5439 5.5555 5.5867 6.2812 6.3286 6.3630 6.4061 6.4547 6.4820 6.8586 6.8601 7.0607 7.1014 7.4639 7.5081 10.7376 10.7577 12.7167 12.7437 12.8135 12.8392 14.2183 14.2287 k = 0.0000 0.5000 0.0508 ( 2440 PWs) bands (ev): -46.2582 -46.2582 -23.9045 -23.9033 -21.9044 -21.9032 -21.7659 -21.7635 -18.9574 -18.9574 -8.6984 -8.6931 -8.2602 -8.2528 -7.4464 -7.4453 -2.6437 -2.6383 -2.4101 -2.4033 -2.3325 -2.3311 3.3865 3.3872 5.4750 5.5010 5.5483 5.5722 6.2660 6.3125 6.3564 6.3903 6.4784 6.5040 6.8851 6.8863 7.0231 7.0667 7.4776 7.5281 10.7459 10.7723 12.7120 12.7467 12.8106 12.8437 14.2505 14.2637 k = 0.0000 0.5000 0.0635 ( 2442 PWs) bands (ev): -46.2582 -46.2582 -23.9051 -23.9036 -21.9046 -21.9032 -21.7675 -21.7646 -18.9573 -18.9572 -8.6911 -8.6845 -8.2550 -8.2458 -7.4473 -7.4458 -2.6447 -2.6380 -2.4110 -2.4025 -2.3343 -2.3326 3.3862 3.3871 5.4238 5.4446 5.5459 5.5632 6.2467 6.2894 6.3475 6.3697 6.5022 6.5260 6.9117 6.9180 6.9936 7.0322 7.4900 7.5444 10.7587 10.7909 12.7080 12.7496 12.8083 12.8483 14.2899 14.3053 k = 0.0000 0.5000 0.0762 ( 2446 PWs) bands (ev): -46.2583 -46.2583 -23.9057 -23.9039 -21.9048 -21.9031 -21.7695 -21.7660 -18.9571 -18.9571 -8.6823 -8.6744 -8.2483 -8.2372 -7.4483 -7.4465 -2.6458 -2.6379 -2.4119 -2.4018 -2.3365 -2.3344 3.3859 3.3869 5.3639 5.3821 5.5430 5.5567 6.2207 6.2596 6.3343 6.3461 6.5245 6.5466 6.9135 6.9422 6.9991 7.0138 7.4991 7.5558 10.7765 10.8141 12.7053 12.7531 12.8069 12.8532 14.3350 14.3521 k = 0.0000 0.5000 0.0889 ( 2446 PWs) bands (ev): -46.2582 -46.2582 -23.9065 -23.9044 -21.9051 -21.9031 -21.7716 -21.7676 -18.9569 -18.9568 -8.6722 -8.6630 -8.2400 -8.2271 -7.4494 -7.4473 -2.6470 -2.6379 -2.4128 -2.4012 -2.3390 -2.3366 3.3856 3.3867 5.2984 5.3153 5.5396 5.5511 6.1851 6.2220 6.3116 6.3267 6.5446 6.5653 6.8908 6.9302 7.0401 7.0410 7.5036 7.5617 10.7998 10.8422 12.7040 12.7575 12.8062 12.8586 14.3842 14.4024 k = 0.0000 0.5000 0.1016 ( 2452 PWs) bands (ev): -46.2582 -46.2582 -23.9073 -23.9049 -21.9054 -21.9032 -21.7741 -21.7695 -18.9567 -18.9566 -8.6610 -8.6505 -8.2299 -8.2152 -7.4507 -7.4482 -2.6482 -2.6381 -2.4136 -2.4005 -2.3418 -2.3390 3.3852 3.3865 5.2296 5.2456 5.5356 5.5458 6.1383 6.1741 6.2844 6.3100 6.5626 6.5822 6.8666 6.9037 7.0918 7.0939 7.5033 7.5618 10.8291 10.8758 12.7043 12.7633 12.8061 12.8647 14.4357 14.4547 k = 0.0000 0.5000 0.1143 ( 2456 PWs) bands (ev): -46.2582 -46.2582 -23.9082 -23.9056 -21.9057 -21.9032 -21.7767 -21.7717 -18.9564 -18.9563 -8.6489 -8.6373 -8.2180 -8.2014 -7.4520 -7.4493 -2.6495 -2.6383 -2.4144 -2.4000 -2.3449 -2.3417 3.3847 3.3862 5.1586 5.1740 5.5310 5.5404 6.0805 6.1146 6.2583 6.2920 6.5789 6.5977 6.8465 6.8787 7.1500 7.1529 7.4982 7.5565 10.8645 10.9149 12.7063 12.7710 12.8068 12.8718 14.4882 14.5076 k = 0.0000 0.5000 0.1270 ( 2460 PWs) bands (ev): -46.2582 -46.2582 -23.9091 -23.9063 -21.9061 -21.9033 -21.7795 -21.7740 -18.9561 -18.9560 -8.6361 -8.6234 -8.2040 -8.1858 -7.4535 -7.4504 -2.6508 -2.6387 -2.4151 -2.3995 -2.3482 -2.3446 3.3842 3.3859 5.0864 5.1014 5.5259 5.5348 6.0126 6.0439 6.2336 6.2722 6.5938 6.6121 6.8313 6.8577 7.2114 7.2147 7.4888 7.5462 10.9062 10.9599 12.7100 12.7804 12.8083 12.8801 14.5402 14.5599 k = 0.0000 0.5000 0.1397 ( 2458 PWs) bands (ev): -46.2581 -46.2581 -23.9101 -23.9071 -21.9065 -21.9034 -21.7825 -21.7766 -18.9558 -18.9557 -8.6230 -8.6092 -8.1879 -8.1680 -7.4552 -7.4517 -2.6522 -2.6393 -2.4158 -2.3990 -2.3516 -2.3478 3.3836 3.3855 5.0136 5.0283 5.5202 5.5289 5.9358 5.9641 6.2094 6.2508 6.6079 6.6258 6.8203 6.8414 7.2734 7.2776 7.4764 7.5318 10.9542 11.0105 12.7151 12.7909 12.8117 12.8900 14.5907 14.6104 k = 0.0000 0.5000 0.1524 ( 2456 PWs) bands (ev): -46.2580 -46.2580 -23.9111 -23.9079 -21.9069 -21.9036 -21.7857 -21.7794 -18.9554 -18.9554 -8.6096 -8.5950 -8.1695 -8.1482 -7.4569 -7.4530 -2.6536 -2.6400 -2.4165 -2.3987 -2.3552 -2.3511 3.3830 3.3851 4.9408 4.9552 5.5138 5.5226 5.8516 5.8771 6.1851 6.2277 6.6214 6.6391 6.8130 6.8292 7.3327 7.3396 7.4638 7.5150 11.0081 11.0666 12.7215 12.7992 12.8202 12.9018 14.6389 14.6586 k = 0.0000 0.5000 0.1651 ( 2460 PWs) bands (ev): -46.2580 -46.2579 -23.9122 -23.9089 -21.9073 -21.9038 -21.7889 -21.7823 -18.9551 -18.9550 -8.5963 -8.5809 -8.1489 -8.1262 -7.4587 -7.4544 -2.6551 -2.6409 -2.4171 -2.3985 -2.3588 -2.3545 3.3823 3.3845 4.8683 4.8825 5.5066 5.5159 5.7615 5.7844 6.1603 6.2031 6.6345 6.6522 6.8085 6.8208 7.3778 7.3957 7.4624 7.5006 11.0676 11.1278 12.7288 12.8036 12.8358 12.9157 14.6839 14.7036 k = 0.0000 0.5000 0.1778 ( 2462 PWs) bands (ev): -46.2579 -46.2579 -23.9134 -23.9098 -21.9078 -21.9041 -21.7923 -21.7853 -18.9547 -18.9546 -8.5831 -8.5673 -8.1259 -8.1020 -7.4605 -7.4559 -2.6567 -2.6419 -2.4178 -2.3985 -2.3625 -2.3580 3.3814 3.3839 4.7964 4.8105 5.4976 5.5086 5.6675 5.6877 6.1347 6.1770 6.6474 6.6651 6.8061 6.8156 7.3846 7.4255 7.4961 7.5092 11.1322 11.1939 12.7366 12.8061 12.8564 12.9322 14.7255 14.7452 k = 0.0000 0.5000 0.1905 ( 2458 PWs) bands (ev): -46.2577 -46.2577 -23.9146 -23.9109 -21.9084 -21.9044 -21.7956 -21.7884 -18.9543 -18.9542 -8.5703 -8.5542 -8.1005 -8.0757 -7.4625 -7.4574 -2.6582 -2.6430 -2.4184 -2.3987 -2.3660 -2.3615 3.3805 3.3832 4.7254 4.7393 5.4826 5.4997 5.5741 5.5903 6.1082 6.1495 6.6602 6.6780 6.8052 6.8131 7.3679 7.4152 7.5507 7.5550 11.2015 11.2642 12.7445 12.8079 12.8807 12.9516 14.7634 14.7832 k = 0.0000 0.5000 0.2032 ( 2454 PWs) bands (ev): -46.2576 -46.2576 -23.9158 -23.9120 -21.9090 -21.9048 -21.7991 -21.7916 -18.9539 -18.9538 -8.5580 -8.5417 -8.0730 -8.0473 -7.4644 -7.4589 -2.6598 -2.6443 -2.4190 -2.3992 -2.3692 -2.3649 3.3795 3.3824 4.6554 4.6692 5.4351 5.4687 5.5035 5.5190 6.0809 6.1208 6.6728 6.6909 6.8055 6.8130 7.3449 7.3913 7.6090 7.6115 11.2748 11.3382 12.7523 12.8096 12.9082 12.9740 14.7976 14.8175 k = 0.0000 0.5000 0.2159 ( 2452 PWs) bands (ev): -46.2575 -46.2575 -23.9170 -23.9131 -21.9097 -21.9053 -21.8025 -21.7948 -18.9535 -18.9534 -8.5463 -8.5301 -8.0433 -8.0170 -7.4664 -7.4604 -2.6614 -2.6458 -2.4197 -2.4003 -2.3721 -2.3682 3.3784 3.3815 4.5866 4.6004 5.3432 5.3723 5.4888 5.4978 6.0529 6.0911 6.6854 6.7038 6.8067 6.8148 7.3199 7.3639 7.6670 7.6690 11.3515 11.4154 12.7597 12.8112 12.9386 12.9995 14.8280 14.8482 k = 0.0000 0.5000 0.2286 ( 2454 PWs) bands (ev): -46.2574 -46.2574 -23.9182 -23.9143 -21.9104 -21.9058 -21.8058 -21.7981 -18.9530 -18.9529 -8.5352 -8.5192 -8.0117 -7.9850 -7.4685 -7.4619 -2.6631 -2.6474 -2.4205 -2.4018 -2.3745 -2.3714 3.3771 3.3805 4.5191 4.5328 5.2407 5.2679 5.4799 5.4874 6.0242 6.0605 6.6979 6.7166 6.8090 6.8178 7.2943 7.3354 7.7235 7.7252 11.4310 11.4951 12.7666 12.8128 12.9718 13.0280 14.8548 14.8753 k = 0.0000 0.5000 0.2413 ( 2458 PWs) bands (ev): -46.2574 -46.2574 -23.9195 -23.9155 -21.9112 -21.9065 -21.8092 -21.8013 -18.9526 -18.9525 -8.5248 -8.5091 -7.9785 -7.9515 -7.4705 -7.4633 -2.6648 -2.6491 -2.4215 -2.4040 -2.3763 -2.3743 3.3756 3.3792 4.4530 4.4667 5.1362 5.1628 5.4718 5.4790 5.9949 6.0293 6.7102 6.7294 6.8121 6.8219 7.2688 7.3068 7.7779 7.7794 11.5127 11.5768 12.7730 12.8143 13.0075 13.0595 14.8781 14.8989 k = 0.0000 0.5000 0.2540 ( 2456 PWs) bands (ev): -46.2572 -46.2572 -23.9207 -23.9167 -21.9120 -21.9072 -21.8124 -21.8045 -18.9522 -18.9521 -8.5150 -8.4998 -7.9440 -7.9168 -7.4724 -7.4647 -2.6665 -2.6509 -2.4227 -2.4067 -2.3778 -2.3766 3.3739 3.3777 4.3883 4.4020 5.0319 5.0581 5.4640 5.4712 5.9653 5.9976 6.7223 6.7420 6.8161 6.8268 7.2439 7.2787 7.8299 7.8313 11.5960 11.6599 12.7788 12.8159 13.0456 13.0937 14.8983 14.9195 k = 0.0000 0.5000 0.2667 ( 2446 PWs) bands (ev): -46.2570 -46.2570 -23.9220 -23.9180 -21.9129 -21.9080 -21.8155 -21.8076 -18.9517 -18.9516 -8.5059 -8.4912 -7.9083 -7.8810 -7.4744 -7.4659 -2.6681 -2.6528 -2.4240 -2.4098 -2.3795 -2.3779 3.3720 3.3760 4.3251 4.3388 4.9290 4.9550 5.4565 5.4638 5.9354 5.9657 6.7342 6.7544 6.8209 6.8323 7.2198 7.2513 7.8794 7.8806 11.6803 11.7438 12.7840 12.8175 13.0857 13.1302 14.9155 14.9370 k = 0.0000 0.5000 0.2794 ( 2446 PWs) bands (ev): -46.2569 -46.2569 -23.9232 -23.9192 -21.9139 -21.9089 -21.8184 -21.8107 -18.9513 -18.9512 -8.4974 -8.4833 -7.8720 -7.8447 -7.4762 -7.4669 -2.6698 -2.6548 -2.4256 -2.4133 -2.3812 -2.3783 3.3697 3.3740 4.2633 4.2770 4.8286 4.8542 5.4491 5.4565 5.9056 5.9338 6.7458 6.7665 6.8263 6.8383 7.1967 7.2250 7.9261 7.9272 11.7650 11.8280 12.7887 12.8191 13.1275 13.1688 14.9300 14.9518 k = 0.0000 0.5000 0.2921 ( 2450 PWs) bands (ev): -46.2568 -46.2568 -23.9244 -23.9205 -21.9149 -21.9099 -21.8212 -21.8136 -18.9509 -18.9508 -8.4894 -8.4761 -7.8354 -7.8080 -7.4779 -7.4678 -2.6714 -2.6569 -2.4275 -2.4169 -2.3826 -2.3784 3.3671 3.3716 4.2030 4.2166 4.7315 4.7566 5.4420 5.4496 5.8759 5.9021 6.7571 6.7783 6.8322 6.8447 7.1747 7.1998 7.9700 7.9710 11.8496 11.9117 12.7930 12.8207 13.1706 13.2090 14.9420 14.9640 k = 0.0000 0.5000 0.3048 ( 2454 PWs) bands (ev): -46.2568 -46.2568 -23.9256 -23.9218 -21.9160 -21.9110 -21.8239 -21.8164 -18.9504 -18.9503 -8.4821 -8.4696 -7.7988 -7.7713 -7.4794 -7.4683 -2.6730 -2.6590 -2.4296 -2.4206 -2.3836 -2.3783 3.3640 3.3687 4.1441 4.1577 4.6384 4.6630 5.4352 5.4428 5.8466 5.8708 6.7679 6.7897 6.8387 6.8515 7.1539 7.1759 8.0110 8.0120 11.9334 11.9946 12.7968 12.8223 13.2148 13.2505 14.9517 14.9739 k = 0.0000 0.5000 0.3175 ( 2456 PWs) bands (ev): -46.2567 -46.2567 -23.9267 -23.9230 -21.9170 -21.9121 -21.8263 -21.8191 -18.9500 -18.9499 -8.4753 -8.4635 -7.7626 -7.7351 -7.4807 -7.4684 -2.6746 -2.6611 -2.4319 -2.4243 -2.3842 -2.3780 3.3603 3.3652 4.0867 4.1002 4.5503 4.5740 5.4287 5.4364 5.8179 5.8403 6.7784 6.8006 6.8455 6.8586 7.1343 7.1533 8.0492 8.0501 12.0159 12.0761 12.8003 12.8240 13.2596 13.2927 14.9595 14.9817 k = 0.0000 0.5000 0.3302 ( 2454 PWs) bands (ev): -46.2566 -46.2566 -23.9278 -23.9242 -21.9182 -21.9133 -21.8285 -21.8217 -18.9496 -18.9495 -8.4690 -8.4581 -7.7274 -7.6996 -7.4816 -7.4680 -2.6761 -2.6632 -2.4343 -2.4279 -2.3845 -2.3777 3.3560 3.3611 4.0309 4.0441 4.4679 4.4904 5.4226 5.4303 5.7899 5.8106 6.7886 6.8110 6.8527 6.8658 7.1159 7.1320 8.0845 8.0853 12.0966 12.1556 12.8034 12.8257 13.3047 13.3353 14.9654 14.9875 k = 0.0000 0.5000 0.3429 ( 2448 PWs) bands (ev): -46.2564 -46.2564 -23.9288 -23.9254 -21.9193 -21.9146 -21.8306 -21.8240 -18.9492 -18.9491 -8.4633 -8.4531 -7.6936 -7.6655 -7.4820 -7.4668 -2.6775 -2.6653 -2.4367 -2.4313 -2.3845 -2.3773 3.3509 3.3561 3.9768 3.9898 4.3915 4.4127 5.4168 5.4246 5.7629 5.7819 6.7983 6.8210 6.8600 6.8732 7.0987 7.1120 8.1170 8.1178 12.1750 12.2326 12.8062 12.8275 13.3495 13.3777 14.9697 14.9916 k = 0.0000 0.5000 0.3556 ( 2446 PWs) bands (ev): -46.2563 -46.2563 -23.9298 -23.9265 -21.9204 -21.9159 -21.8324 -21.8262 -18.9489 -18.9488 -8.4579 -8.4486 -7.6618 -7.6333 -7.4816 -7.4647 -2.6788 -2.6674 -2.4392 -2.4346 -2.3842 -2.3769 3.3449 3.3502 3.9248 3.9374 4.3218 4.3414 5.4116 5.4193 5.7371 5.7545 6.8077 6.8305 6.8673 6.8805 7.0825 7.0932 8.1467 8.1474 12.2505 12.3065 12.8086 12.8293 13.3936 13.4195 14.9727 14.9941 k = 0.0000 0.5000 0.3683 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9307 -23.9276 -21.9215 -21.9172 -21.8340 -21.8283 -18.9485 -18.9484 -8.4531 -8.4445 -7.6326 -7.6037 -7.4800 -7.4613 -2.6800 -2.6694 -2.4417 -2.4378 -2.3838 -2.3766 3.3378 3.3431 3.8753 3.8874 4.2588 4.2767 5.4068 5.4145 5.7125 5.7284 6.8168 6.8395 6.8745 6.8878 7.0674 7.0757 8.1736 8.1743 12.3226 12.3768 12.8107 12.8312 13.4364 13.4602 14.9745 14.9953 k = 0.0000 0.5000 0.3810 ( 2452 PWs) bands (ev): -46.2562 -46.2562 -23.9315 -23.9287 -21.9225 -21.9186 -21.8354 -21.8301 -18.9482 -18.9481 -8.4487 -8.4409 -7.6067 -7.5777 -7.4763 -7.4562 -2.6811 -2.6714 -2.4441 -2.4407 -2.3832 -2.3762 3.3295 3.3347 3.8291 3.8405 4.2026 4.2187 5.4026 5.4101 5.6894 5.7039 6.8257 6.8481 6.8815 6.8948 7.0532 7.0592 8.1980 8.1986 12.3906 12.4429 12.8125 12.8332 13.4777 13.4993 14.9753 14.9953 k = 0.0000 0.5000 0.3937 ( 2454 PWs) bands (ev): -46.2562 -46.2562 -23.9323 -23.9297 -21.9235 -21.9199 -21.8366 -21.8318 -18.9479 -18.9478 -8.4446 -8.4376 -7.5849 -7.5568 -7.4696 -7.4490 -2.6821 -2.6732 -2.4463 -2.4434 -2.3825 -2.3759 3.3200 3.3249 3.7867 3.7973 4.1530 4.1672 5.3989 5.4062 5.6679 5.6811 6.8343 6.8564 6.8881 6.9015 7.0400 7.0440 8.2197 8.2203 12.4542 12.5045 12.8140 12.8352 13.5168 13.5362 14.9753 14.9943 k = 0.0000 0.5000 0.4064 ( 2456 PWs) bands (ev): -46.2561 -46.2561 -23.9330 -23.9306 -21.9245 -21.9211 -21.8377 -21.8334 -18.9476 -18.9476 -8.4410 -8.4348 -7.5674 -7.5418 -7.4591 -7.4397 -2.6830 -2.6750 -2.4483 -2.4458 -2.3818 -2.3756 3.3093 3.3139 3.7488 3.7585 4.1098 4.1221 5.3958 5.4028 5.6482 5.6601 6.8427 6.8644 6.8940 6.9077 7.0276 7.0299 8.2389 8.2394 12.5127 12.5609 12.8153 12.8374 13.5534 13.5707 14.9748 14.9925 k = 0.0000 0.5000 0.4191 ( 2460 PWs) bands (ev): -46.2562 -46.2561 -23.9335 -23.9315 -21.9253 -21.9223 -21.8385 -21.8347 -18.9474 -18.9473 -8.4378 -8.4324 -7.5542 -7.5325 -7.4452 -7.4285 -2.6837 -2.6767 -2.4502 -2.4480 -2.3810 -2.3755 3.2976 3.3018 3.7159 3.7246 4.0725 4.0831 5.3933 5.3999 5.6304 5.6410 6.8510 6.8722 6.8993 6.9134 7.0156 7.0174 8.2556 8.2561 12.5657 12.6117 12.8164 12.8396 13.5870 13.6021 14.9739 14.9902 k = 0.0000 0.5000 0.4318 ( 2460 PWs) bands (ev): -46.2561 -46.2561 -23.9340 -23.9322 -21.9260 -21.9234 -21.8392 -21.8359 -18.9472 -18.9471 -8.4350 -8.4304 -7.5447 -7.5273 -7.4299 -7.4165 -2.6843 -2.6782 -2.4518 -2.4500 -2.3802 -2.3753 3.2854 3.2891 3.6883 3.6958 4.0410 4.0498 5.3914 5.3974 5.6147 5.6240 6.8591 6.8797 6.9037 6.9184 7.0039 7.0065 8.2700 8.2704 12.6127 12.6563 12.8176 12.8418 13.6171 13.6301 14.9729 14.9874 k = 0.0000 0.5000 0.4445 ( 2458 PWs) bands (ev): -46.2560 -46.2560 -23.9344 -23.9329 -21.9266 -21.9244 -21.8397 -21.8370 -18.9470 -18.9469 -8.4326 -8.4287 -7.5379 -7.5245 -7.4150 -7.4045 -2.6847 -2.6796 -2.4532 -2.4516 -2.3795 -2.3753 3.2733 3.2763 3.6659 3.6722 4.0148 4.0221 5.3900 5.3954 5.6012 5.6092 6.8670 6.8870 6.9072 6.9226 6.9932 6.9969 8.2820 8.2824 12.6534 12.6940 12.8190 12.8440 13.6435 13.6544 14.9719 14.9844 k = 0.0000 0.5000 0.4572 ( 2462 PWs) bands (ev): -46.2560 -46.2560 -23.9347 -23.9335 -21.9271 -21.9253 -21.8401 -21.8379 -18.9468 -18.9468 -8.4305 -8.4274 -7.5332 -7.5232 -7.4016 -7.3937 -2.6850 -2.6809 -2.4543 -2.4530 -2.3788 -2.3753 3.2620 3.2644 3.6485 3.6534 3.9938 3.9995 5.3892 5.3937 5.5901 5.5966 6.8746 6.8939 6.9097 6.9258 6.9838 6.9883 8.2918 8.2921 12.6873 12.7242 12.8212 12.8460 13.6658 13.6745 14.9711 14.9814 k = 0.0000 0.5000 0.4699 ( 2458 PWs) bands (ev): -46.2560 -46.2560 -23.9349 -23.9340 -21.9274 -21.9261 -21.8403 -21.8387 -18.9467 -18.9467 -8.4288 -8.4265 -7.5298 -7.5228 -7.3904 -7.3848 -2.6850 -2.6819 -2.4551 -2.4542 -2.3781 -2.3755 3.2522 3.2540 3.6356 3.6393 3.9778 3.9821 5.3888 5.3923 5.5815 5.5865 6.8820 6.8999 6.9114 6.9276 6.9762 6.9810 8.2994 8.2996 12.7146 12.7458 12.8248 12.8473 13.6837 13.6902 14.9707 14.9786 k = 0.0000 0.5000 0.4826 ( 2458 PWs) bands (ev): -46.2559 -46.2559 -23.9350 -23.9344 -21.9276 -21.9267 -21.8404 -21.8393 -18.9466 -18.9466 -8.4275 -8.4260 -7.5274 -7.5229 -7.3820 -7.3784 -2.6849 -2.6829 -2.4557 -2.4550 -2.3774 -2.3757 3.2448 3.2460 3.6270 3.6294 3.9667 3.9695 5.3887 5.3912 5.5755 5.5789 6.8888 6.9036 6.9135 6.9277 6.9708 6.9750 8.3048 8.3049 12.7354 12.7582 12.8302 12.8474 13.6969 13.7013 14.9707 14.9760 k = 0.0000 0.5000 0.4953 ( 2456 PWs) bands (ev): -46.2559 -46.2559 -23.9350 -23.9347 -21.9276 -21.9272 -21.8403 -21.8398 -18.9465 -18.9465 -8.4266 -8.4258 -7.5256 -7.5234 -7.3765 -7.3747 -2.6847 -2.6837 -2.4559 -2.4556 -2.3769 -2.3760 3.2402 3.2408 3.6222 3.6234 3.9603 3.9617 5.3890 5.3902 5.5723 5.5740 6.8949 6.9032 6.9176 6.9258 6.9681 6.9706 8.3080 8.3081 12.7501 12.7621 12.8366 12.8459 13.7054 13.7076 14.9712 14.9739 k = 0.0000 0.5000 0.5080 ( 2460 PWs) bands (ev): -46.2560 -46.2560 -23.9349 -23.9349 -21.9275 -21.9275 -21.8401 -21.8401 -18.9465 -18.9465 -8.4260 -8.4260 -7.5243 -7.5243 -7.3741 -7.3741 -2.6843 -2.6843 -2.4559 -2.4559 -2.3764 -2.3764 3.2388 3.2388 3.6210 3.6210 3.9586 3.9586 5.3895 5.3895 5.5718 5.5718 6.8999 6.8999 6.9222 6.9222 6.9682 6.9682 8.3091 8.3091 12.7591 12.7591 12.8422 12.8422 13.7089 13.7089 14.9723 14.9723 k = 0.0000 0.5000 0.5080 ( 2460 PWs) bands (ev): -46.2560 -46.2560 -23.9349 -23.9349 -21.9275 -21.9275 -21.8401 -21.8401 -18.9465 -18.9465 -8.4260 -8.4260 -7.5243 -7.5243 -7.3741 -7.3741 -2.6843 -2.6843 -2.4559 -2.4559 -2.3764 -2.3764 3.2388 3.2388 3.6210 3.6210 3.9586 3.9586 5.3895 5.3895 5.5718 5.5718 6.8999 6.8999 6.9222 6.9222 6.9682 6.9682 8.3091 8.3091 12.7591 12.7591 12.8422 12.8422 13.7089 13.7089 14.9723 14.9723 k = 0.0128 0.5000 0.5080 ( 2460 PWs) bands (ev): -46.2560 -46.2560 -23.9351 -23.9349 -21.9275 -21.9274 -21.8403 -21.8402 -18.9465 -18.9465 -8.4250 -8.4242 -7.5244 -7.5239 -7.3740 -7.3739 -2.6854 -2.6839 -2.4564 -2.4562 -2.3778 -2.3760 3.2388 3.2388 3.6210 3.6210 3.9595 3.9596 5.3862 5.3868 5.5682 5.5683 6.9010 6.9016 6.9255 6.9257 6.9643 6.9650 8.3092 8.3092 12.7585 12.7614 12.8422 12.8434 13.7090 13.7092 14.9783 14.9821 k = 0.0255 0.5000 0.5080 ( 2458 PWs) bands (ev): -46.2559 -46.2559 -23.9353 -23.9349 -21.9276 -21.9274 -21.8408 -21.8405 -18.9464 -18.9464 -8.4211 -8.4196 -7.5243 -7.5233 -7.3737 -7.3735 -2.6873 -2.6842 -2.4576 -2.4572 -2.3803 -2.3765 3.2389 3.2389 3.6209 3.6211 3.9623 3.9625 5.3771 5.3783 5.5579 5.5580 6.8997 6.9011 6.9352 6.9355 6.9588 6.9598 8.3093 8.3093 12.7596 12.7655 12.8435 12.8458 13.7093 13.7098 15.0001 15.0077 k = 0.0383 0.5000 0.5080 ( 2458 PWs) bands (ev): -46.2559 -46.2559 -23.9356 -23.9350 -21.9277 -21.9273 -21.8416 -21.8411 -18.9463 -18.9463 -8.4145 -8.4121 -7.5240 -7.5225 -7.3732 -7.3730 -2.6900 -2.6854 -2.4596 -2.4589 -2.3837 -2.3781 3.2390 3.2391 3.6208 3.6210 3.9670 3.9672 5.3624 5.3642 5.5411 5.5413 6.8812 6.8839 6.9509 6.9509 6.9668 6.9673 8.3096 8.3096 12.7624 12.7714 12.8464 12.8494 13.7099 13.7107 15.0374 15.0484 k = 0.0510 0.5000 0.5080 ( 2458 PWs) bands (ev): -46.2559 -46.2559 -23.9359 -23.9353 -21.9278 -21.9273 -21.8426 -21.8420 -18.9462 -18.9462 -8.4050 -8.4019 -7.5234 -7.5214 -7.3725 -7.3722 -2.6934 -2.6873 -2.4623 -2.4613 -2.3880 -2.3806 3.2391 3.2393 3.6207 3.6210 3.9735 3.9738 5.3426 5.3450 5.5186 5.5189 6.8424 6.8461 6.9728 6.9733 6.9897 6.9898 8.3099 8.3100 12.7670 12.7790 12.8510 12.8543 13.7109 13.7119 15.0893 15.1034 k = 0.0638 0.5000 0.5080 ( 2456 PWs) bands (ev): -46.2558 -46.2558 -23.9364 -23.9355 -21.9279 -21.9272 -21.8439 -21.8431 -18.9460 -18.9460 -8.3929 -8.3890 -7.5226 -7.5201 -7.3716 -7.3712 -2.6975 -2.6899 -2.4657 -2.4645 -2.3933 -2.3841 3.2393 3.2395 3.6205 3.6209 3.9817 3.9822 5.3181 5.3211 5.4911 5.4915 6.7890 6.7936 7.0012 7.0019 7.0213 7.0215 8.3104 8.3104 12.7733 12.7885 12.8576 12.8608 13.7121 13.7134 15.1550 15.1717 k = 0.0766 0.5000 0.5080 ( 2456 PWs) bands (ev): -46.2558 -46.2558 -23.9369 -23.9359 -21.9280 -21.9272 -21.8454 -21.8445 -18.9458 -18.9458 -8.3781 -8.3734 -7.5215 -7.5185 -7.3705 -7.3700 -2.7022 -2.6932 -2.4698 -2.4683 -2.3995 -2.3885 3.2396 3.2398 3.6203 3.6208 3.9917 3.9922 5.2897 5.2931 5.4594 5.4599 6.7238 6.7294 7.0348 7.0357 7.0593 7.0596 8.3109 8.3110 12.7815 12.7997 12.8663 12.8690 13.7136 13.7151 15.2332 15.2521 k = 0.0893 0.5000 0.5080 ( 2456 PWs) bands (ev): -46.2557 -46.2557 -23.9375 -23.9364 -21.9281 -21.9272 -21.8471 -21.8462 -18.9455 -18.9455 -8.3606 -8.3552 -7.5203 -7.5168 -7.3692 -7.3685 -2.7077 -2.6973 -2.4745 -2.4728 -2.4065 -2.3938 3.2399 3.2401 3.6200 3.6205 4.0034 4.0040 5.2577 5.2617 5.4244 5.4249 6.6484 6.6549 7.0727 7.0738 7.1023 7.1026 8.3115 8.3116 12.7915 12.8128 12.8774 12.8792 13.7154 13.7172 15.3226 15.3432 k = 0.1021 0.5000 0.5080 ( 2456 PWs) bands (ev): -46.2557 -46.2557 -23.9382 -23.9369 -21.9283 -21.9272 -21.8491 -21.8480 -18.9452 -18.9452 -8.3407 -8.3345 -7.5188 -7.5148 -7.3677 -7.3670 -2.7137 -2.7020 -2.4799 -2.4779 -2.4143 -2.4000 3.2402 3.2404 3.6196 3.6202 4.0167 4.0173 5.2229 5.2273 5.3868 5.3873 6.5640 6.5714 7.1143 7.1154 7.1493 7.1497 8.3123 8.3124 12.8037 12.8277 12.8908 12.8915 13.7175 13.7195 15.4218 15.4436 k = 0.1148 0.5000 0.5080 ( 2454 PWs) bands (ev): -46.2556 -46.2556 -23.9390 -23.9375 -21.9284 -21.9272 -21.8513 -21.8501 -18.9449 -18.9449 -8.3184 -8.3113 -7.5172 -7.5126 -7.3660 -7.3652 -2.7203 -2.7073 -2.4858 -2.4836 -2.4228 -2.4070 3.2406 3.2408 3.6190 3.6198 4.0314 4.0321 5.1857 5.1906 5.3472 5.3478 6.4718 6.4802 7.1589 7.1600 7.1996 7.1999 8.3131 8.3132 12.8180 12.8444 12.9061 12.9065 13.7198 13.7221 15.5293 15.5518 k = 0.1276 0.5000 0.5080 ( 2452 PWs) bands (ev): -46.2555 -46.2555 -23.9398 -23.9382 -21.9286 -21.9273 -21.8536 -21.8524 -18.9445 -18.9445 -8.2938 -8.2859 -7.5153 -7.5101 -7.3642 -7.3633 -2.7275 -2.7133 -2.4924 -2.4899 -2.4320 -2.4147 3.2410 3.2413 3.6184 3.6192 4.0475 4.0482 5.1465 5.1519 5.3063 5.3069 6.3730 6.3823 7.2059 7.2069 7.2522 7.2526 8.3140 8.3141 12.8345 12.8630 12.9231 12.9247 13.7224 13.7250 15.6435 15.6663 k = 0.1404 0.5000 0.5080 ( 2456 PWs) bands (ev): -46.2555 -46.2555 -23.9407 -23.9390 -21.9289 -21.9273 -21.8561 -21.8548 -18.9441 -18.9441 -8.2670 -8.2584 -7.5133 -7.5075 -7.3622 -7.3612 -2.7351 -2.7198 -2.4994 -2.4967 -2.4418 -2.4230 3.2414 3.2417 3.6175 3.6184 4.0649 4.0657 5.1058 5.1116 5.2645 5.2652 6.2687 6.2788 7.2547 7.2557 7.3067 7.3071 8.3149 8.3151 12.8533 12.8835 12.9424 12.9451 13.7253 13.7281 15.7628 15.7854 k = 0.1531 0.5000 0.5080 ( 2454 PWs) bands (ev): -46.2554 -46.2554 -23.9416 -23.9398 -21.9291 -21.9274 -21.8587 -21.8574 -18.9437 -18.9437 -8.2382 -8.2288 -7.5111 -7.5047 -7.3600 -7.3589 -2.7432 -2.7269 -2.5069 -2.5039 -2.4521 -2.4320 3.2419 3.2422 3.6165 3.6175 4.0834 4.0842 5.0639 5.0701 5.2223 5.2231 6.1600 6.1710 7.3049 7.3058 7.3625 7.3628 8.3160 8.3162 12.8745 12.9059 12.9641 12.9677 13.7284 13.7314 15.8856 15.9075 k = 0.1659 0.5000 0.5080 ( 2454 PWs) bands (ev): -46.2553 -46.2553 -23.9425 -23.9406 -21.9294 -21.9276 -21.8613 -21.8601 -18.9432 -18.9432 -8.2075 -8.1973 -7.5087 -7.5017 -7.3578 -7.3565 -2.7517 -2.7344 -2.5148 -2.5116 -2.4629 -2.4416 3.2424 3.2427 3.6151 3.6162 4.1030 4.1038 5.0209 5.0275 5.1801 5.1809 6.0481 6.0600 7.3559 7.3567 7.4190 7.4194 8.3170 8.3173 12.8979 12.9301 12.9881 12.9924 13.7317 13.7350 16.0101 16.0309 k = 0.1786 0.5000 0.5080 ( 2452 PWs) bands (ev): -46.2552 -46.2552 -23.9435 -23.9416 -21.9298 -21.9278 -21.8641 -21.8629 -18.9427 -18.9427 -8.1752 -8.1642 -7.5062 -7.4985 -7.3554 -7.3541 -2.7605 -2.7424 -2.5231 -2.5196 -2.4740 -2.4517 3.2429 3.2433 3.6135 3.6146 4.1235 4.1243 4.9770 4.9840 5.1382 5.1389 5.9341 5.9468 7.4074 7.4082 7.4758 7.4762 8.3182 8.3185 12.9237 12.9564 13.0142 13.0192 13.7353 13.7389 16.1345 16.1538 k = 0.1914 0.5000 0.5080 ( 2448 PWs) bands (ev): -46.2551 -46.2551 -23.9446 -23.9425 -21.9302 -21.9280 -21.8669 -21.8658 -18.9422 -18.9422 -8.1413 -8.1295 -7.5036 -7.4951 -7.3529 -7.3515 -2.7696 -2.7507 -2.5316 -2.5280 -2.4855 -2.4621 3.2434 3.2438 3.6114 3.6126 4.1447 4.1455 4.9324 4.9398 5.0968 5.0975 5.8192 5.8327 7.4591 7.4598 7.5327 7.5330 8.3194 8.3197 12.9516 12.9844 13.0424 13.0479 13.7391 13.7429 16.2569 16.2743 k = 0.2042 0.5000 0.5080 ( 2446 PWs) bands (ev): -46.2550 -46.2550 -23.9456 -23.9435 -21.9307 -21.9283 -21.8697 -21.8687 -18.9417 -18.9417 -8.1061 -8.0935 -7.5008 -7.4916 -7.3503 -7.3488 -2.7789 -2.7594 -2.5405 -2.5366 -2.4972 -2.4729 3.2440 3.2444 3.6089 3.6102 4.1665 4.1674 4.8869 4.8947 5.0561 5.0569 5.7045 5.7188 7.5106 7.5111 7.5891 7.5895 8.3206 8.3209 12.9817 13.0142 13.0725 13.0783 13.7431 13.7472 16.3752 16.3902 k = 0.2169 0.5000 0.5080 ( 2444 PWs) bands (ev): -46.2549 -46.2549 -23.9467 -23.9446 -21.9313 -21.9287 -21.8725 -21.8716 -18.9412 -18.9412 -8.0699 -8.0564 -7.4979 -7.4879 -7.3476 -7.3460 -2.7883 -2.7683 -2.5495 -2.5454 -2.5090 -2.4840 3.2445 3.2450 3.6058 3.6072 4.1888 4.1896 4.8405 4.8487 5.0164 5.0172 5.5913 5.6063 7.5615 7.5620 7.6449 7.6453 8.3219 8.3222 13.0137 13.0457 13.1044 13.1104 13.7474 13.7517 16.4875 16.4997 k = 0.2297 0.5000 0.5080 ( 2446 PWs) bands (ev): -46.2548 -46.2548 -23.9478 -23.9456 -21.9320 -21.9292 -21.8752 -21.8745 -18.9407 -18.9407 -8.0328 -8.0184 -7.4949 -7.4840 -7.3448 -7.3432 -2.7979 -2.7775 -2.5587 -2.5544 -2.5209 -2.4953 3.2451 3.2456 3.6020 3.6035 4.2113 4.2122 4.7929 4.8014 4.9778 4.9787 5.4809 5.4965 7.6117 7.6120 7.6997 7.7001 8.3232 8.3236 13.0474 13.0787 13.1379 13.1439 13.7519 13.7565 16.5917 16.6005 k = 0.2424 0.5000 0.5080 ( 2444 PWs) bands (ev): -46.2547 -46.2547 -23.9489 -23.9467 -21.9327 -21.9297 -21.8779 -21.8773 -18.9401 -18.9401 -7.9950 -7.9798 -7.4917 -7.4799 -7.3421 -7.3403 -2.8074 -2.7868 -2.5679 -2.5634 -2.5328 -2.5068 3.2457 3.2462 3.5975 3.5990 4.2341 4.2349 4.7439 4.7526 4.9406 4.9414 5.3746 5.3906 7.6608 7.6611 7.7533 7.7537 8.3245 8.3249 13.0827 13.1130 13.1728 13.1787 13.7567 13.7616 16.6858 16.6910 k = 0.2552 0.5000 0.5080 ( 2440 PWs) bands (ev): -46.2545 -46.2545 -23.9500 -23.9478 -21.9335 -21.9304 -21.8804 -21.8800 -18.9396 -18.9396 -7.9569 -7.9408 -7.4885 -7.4757 -7.3393 -7.3374 -2.8170 -2.7962 -2.5772 -2.5725 -2.5446 -2.5182 3.2463 3.2468 3.5920 3.5935 4.2568 4.2576 4.6931 4.7019 4.9047 4.9055 5.2737 5.2900 7.7087 7.7089 7.8054 7.8059 8.3258 8.3263 13.1194 13.1484 13.2088 13.2145 13.7617 13.7669 16.7685 16.7696 k = 0.2680 0.5000 0.5080 ( 2434 PWs) bands (ev): -46.2544 -46.2544 -23.9511 -23.9489 -21.9345 -21.9312 -21.8828 -21.8826 -18.9391 -18.9391 -7.9187 -7.9016 -7.4851 -7.4713 -7.3364 -7.3344 -2.8264 -2.8057 -2.5864 -2.5815 -2.5562 -2.5297 3.2469 3.2474 3.5853 3.5870 4.2794 4.2801 4.6401 4.6488 4.8703 4.8711 5.1797 5.1960 7.7551 7.7552 7.8559 7.8564 8.3271 8.3277 13.1572 13.1847 13.2460 13.2513 13.7671 13.7725 16.8357 16.8387 k = 0.2807 0.5000 0.5080 ( 2436 PWs) bands (ev): -46.2543 -46.2543 -23.9522 -23.9500 -21.9355 -21.9321 -21.8851 -21.8851 -18.9385 -18.9385 -7.8807 -7.8626 -7.4817 -7.4667 -7.3336 -7.3315 -2.8357 -2.8151 -2.5955 -2.5905 -2.5677 -2.5411 3.2474 3.2480 3.5774 3.5791 4.3016 4.3023 4.5848 4.5931 4.8375 4.8384 5.0937 5.1096 7.7998 7.7999 7.9046 7.9051 8.3284 8.3290 13.1957 13.2216 13.2838 13.2886 13.7729 13.7786 16.8893 16.8963 k = 0.2935 0.5000 0.5080 ( 2438 PWs) bands (ev): -46.2543 -46.2543 -23.9533 -23.9511 -21.9366 -21.9331 -21.8873 -21.8872 -18.9380 -18.9380 -7.8432 -7.8241 -7.4780 -7.4619 -7.3308 -7.3286 -2.8447 -2.8245 -2.6045 -2.5992 -2.5788 -2.5524 3.2480 3.2486 3.5679 3.5696 4.3234 4.3240 4.5273 4.5347 4.8065 4.8073 5.0166 5.0317 7.8428 7.8428 7.9512 7.9518 8.3297 8.3304 13.2347 13.2586 13.3222 13.3263 13.7791 13.7850 16.9311 16.9421 k = 0.3062 0.5000 0.5080 ( 2434 PWs) bands (ev): -46.2541 -46.2541 -23.9543 -23.9522 -21.9378 -21.9342 -21.8894 -21.8892 -18.9375 -18.9375 -7.8065 -7.7863 -7.4742 -7.4568 -7.3280 -7.3257 -2.8535 -2.8337 -2.6132 -2.6078 -2.5896 -2.5634 3.2485 3.2491 3.5567 3.5584 4.3444 4.3450 4.4680 4.4745 4.7772 4.7781 4.9485 4.9626 7.8837 7.8838 7.9957 7.9963 8.3309 8.3317 13.2738 13.2956 13.3608 13.3641 13.7858 13.7920 16.9625 16.9771 k = 0.3190 0.5000 0.5080 ( 2432 PWs) bands (ev): -46.2540 -46.2540 -23.9553 -23.9533 -21.9391 -21.9355 -21.8913 -21.8909 -18.9370 -18.9370 -7.7709 -7.7496 -7.4702 -7.4514 -7.3253 -7.3229 -2.8620 -2.8427 -2.6217 -2.6160 -2.5999 -2.5742 3.2490 3.2496 3.5435 3.5452 4.3646 4.3652 4.4081 4.4134 4.7498 4.7507 4.8892 4.9020 7.9226 7.9227 8.0378 8.0385 8.3322 8.3331 13.3126 13.3319 13.3993 13.4016 13.7931 13.7995 16.9851 17.0031 k = 0.3318 0.5000 0.5080 ( 2432 PWs) bands (ev): -46.2539 -46.2539 -23.9562 -23.9543 -21.9404 -21.9368 -21.8930 -21.8925 -18.9365 -18.9365 -7.7369 -7.7145 -7.4658 -7.4457 -7.3226 -7.3201 -2.8700 -2.8514 -2.6298 -2.6240 -2.6098 -2.5846 3.2494 3.2501 3.5281 3.5297 4.3489 4.3528 4.3841 4.3844 4.7245 4.7254 4.8380 4.8494 7.9592 7.9594 8.0775 8.0783 8.3334 8.3344 13.3505 13.3674 13.4375 13.4386 13.8011 13.8076 17.0007 17.0217 k = 0.3445 0.5000 0.5080 ( 2430 PWs) bands (ev): -46.2538 -46.2538 -23.9572 -23.9553 -21.9418 -21.9383 -21.8945 -21.8939 -18.9361 -18.9361 -7.7047 -7.6813 -7.4611 -7.4396 -7.3200 -7.3174 -2.8776 -2.8599 -2.6375 -2.6316 -2.6191 -2.5947 3.2498 3.2505 3.5104 3.5120 4.2920 4.2949 4.4021 4.4023 4.7011 4.7021 4.7937 4.8037 7.9936 7.9938 8.1146 8.1156 8.3346 8.3357 13.3872 13.4014 13.4748 13.4749 13.8098 13.8164 17.0108 17.0345 k = 0.3573 0.5000 0.5080 ( 2436 PWs) bands (ev): -46.2539 -46.2539 -23.9580 -23.9563 -21.9432 -21.9397 -21.8957 -21.8951 -18.9356 -18.9356 -7.6747 -7.6504 -7.4557 -7.4331 -7.3174 -7.3148 -2.8848 -2.8679 -2.6448 -2.6388 -2.6278 -2.6043 3.2501 3.2508 3.4905 3.4919 4.2388 4.2407 4.4187 4.4189 4.6800 4.6810 4.7555 4.7642 8.0255 8.0257 8.1491 8.1502 8.3357 8.3370 13.4221 13.4335 13.5098 13.5112 13.8193 13.8259 17.0168 17.0430 k = 0.3700 0.5000 0.5080 ( 2432 PWs) bands (ev): -46.2537 -46.2537 -23.9588 -23.9572 -21.9445 -21.9412 -21.8968 -21.8962 -18.9352 -18.9352 -7.6472 -7.6223 -7.4496 -7.4261 -7.3149 -7.3123 -2.8913 -2.8756 -2.6516 -2.6455 -2.6358 -2.6133 3.2504 3.2510 3.4685 3.4697 4.1903 4.1915 4.4338 4.4339 4.6612 4.6621 4.7225 4.7300 8.0550 8.0552 8.1808 8.1820 8.3369 8.3382 13.4546 13.4634 13.5435 13.5462 13.8297 13.8362 17.0199 17.0482 k = 0.3828 0.5000 0.5080 ( 2432 PWs) bands (ev): -46.2537 -46.2537 -23.9595 -23.9581 -21.9458 -21.9427 -21.8977 -21.8971 -18.9348 -18.9348 -7.6225 -7.5974 -7.4427 -7.4186 -7.3125 -7.3098 -2.8974 -2.8828 -2.6578 -2.6518 -2.6430 -2.6218 3.2505 3.2512 3.4450 3.4459 4.1473 4.1479 4.4471 4.4471 4.6448 4.6458 4.6939 4.7004 8.0818 8.0820 8.2096 8.2111 8.3379 8.3395 13.4842 13.4906 13.5755 13.5794 13.8409 13.8471 17.0211 17.0512 k = 0.3956 0.5000 0.5080 ( 2436 PWs) bands (ev): -46.2537 -46.2537 -23.9602 -23.9589 -21.9470 -21.9442 -21.8985 -21.8979 -18.9345 -18.9345 -7.6007 -7.5762 -7.4346 -7.4109 -7.3102 -7.3075 -2.9028 -2.8894 -2.6635 -2.6577 -2.6494 -2.6298 3.2504 3.2512 3.4204 3.4212 4.1101 4.1103 4.4583 4.4584 4.6309 4.6319 4.6693 4.6748 8.1061 8.1063 8.2355 8.2371 8.3390 8.3408 13.5106 13.5149 13.6056 13.6105 13.8527 13.8585 17.0212 17.0527 k = 0.4083 0.5000 0.5080 ( 2440 PWs) bands (ev): -46.2537 -46.2537 -23.9608 -23.9596 -21.9481 -21.9456 -21.8991 -21.8985 -18.9342 -18.9342 -7.5820 -7.5588 -7.4256 -7.4029 -7.3079 -7.3053 -2.9075 -2.8956 -2.6686 -2.6632 -2.6549 -2.6370 3.2502 3.2510 3.3958 3.3963 4.0786 4.0786 4.4673 4.4675 4.6196 4.6207 4.6483 4.6529 8.1277 8.1279 8.2583 8.2602 8.3402 8.3422 13.5336 13.5361 13.6336 13.6390 13.8649 13.8702 17.0209 17.0533 k = 0.4211 0.5000 0.5080 ( 2442 PWs) bands (ev): -46.2537 -46.2537 -23.9613 -23.9603 -21.9491 -21.9469 -21.8997 -21.8991 -18.9339 -18.9339 -7.5663 -7.5453 -7.4159 -7.3951 -7.3057 -7.3032 -2.9116 -2.9011 -2.6730 -2.6681 -2.6595 -2.6436 3.2498 3.2505 3.3721 3.3724 4.0524 4.0525 4.4741 4.4744 4.6110 4.6120 4.6306 4.6343 8.1465 8.1467 8.2779 8.2801 8.3414 8.3437 13.5529 13.5542 13.6590 13.6646 13.8770 13.8817 17.0208 17.0533 k = 0.4338 0.5000 0.5080 ( 2446 PWs) bands (ev): -46.2537 -46.2537 -23.9617 -23.9608 -21.9499 -21.9480 -21.9001 -21.8996 -18.9337 -18.9337 -7.5533 -7.5351 -7.4060 -7.3878 -7.3035 -7.3013 -2.9150 -2.9060 -2.6768 -2.6725 -2.6632 -2.6495 3.2490 3.2497 3.3504 3.3504 4.0313 4.0315 4.4789 4.4792 4.6046 4.6057 4.6161 4.6190 8.1626 8.1628 8.2942 8.2967 8.3429 8.3455 13.5687 13.5692 13.6816 13.6870 13.8886 13.8926 17.0212 17.0531 k = 0.4466 0.5000 0.5080 ( 2444 PWs) bands (ev): -46.2536 -46.2536 -23.9621 -23.9613 -21.9506 -21.9490 -21.9004 -21.9000 -18.9335 -18.9335 -7.5429 -7.5279 -7.3966 -7.3815 -7.3015 -7.2996 -2.9176 -2.9102 -2.6799 -2.6763 -2.6659 -2.6546 3.2478 3.2485 3.3315 3.3316 4.0148 4.0150 4.4818 4.4821 4.5992 4.6009 4.6055 4.6072 8.1759 8.1761 8.3070 8.3097 8.3449 8.3476 13.5813 13.5813 13.7010 13.7059 13.8992 13.9025 17.0225 17.0524 k = 0.4594 0.5000 0.5080 ( 2442 PWs) bands (ev): -46.2536 -46.2536 -23.9623 -23.9617 -21.9511 -21.9499 -21.9006 -21.9003 -18.9333 -18.9333 -7.5348 -7.5231 -7.3882 -7.3765 -7.2997 -7.2981 -2.9195 -2.9138 -2.6822 -2.6794 -2.6677 -2.6590 3.2462 3.2469 3.3164 3.3166 4.0024 4.0026 4.4833 4.4836 4.5925 4.5945 4.6007 4.6013 8.1864 8.1865 8.3164 8.3189 8.3474 8.3500 13.5905 13.5908 13.7169 13.7209 13.9083 13.9108 17.0250 17.0512 k = 0.4721 0.5000 0.5080 ( 2442 PWs) bands (ev): -46.2535 -46.2535 -23.9625 -23.9621 -21.9515 -21.9506 -21.9007 -21.9005 -18.9332 -18.9332 -7.5286 -7.5204 -7.3814 -7.3731 -7.2982 -7.2971 -2.9207 -2.9166 -2.6838 -2.6819 -2.6687 -2.6625 3.2445 3.2450 3.3056 3.3059 3.9937 3.9938 4.4840 4.4842 4.5864 4.5878 4.5990 4.5994 8.1941 8.1942 8.3225 8.3245 8.3504 8.3525 13.5971 13.5974 13.7289 13.7319 13.9154 13.9171 17.0286 17.0491 k = 0.4849 0.5000 0.5080 ( 2442 PWs) bands (ev): -46.2535 -46.2535 -23.9626 -23.9623 -21.9516 -21.9511 -21.9008 -21.9007 -18.9331 -18.9331 -7.5242 -7.5195 -7.3763 -7.3715 -7.2971 -7.2964 -2.9211 -2.9188 -2.6847 -2.6835 -2.6688 -2.6652 3.2430 3.2433 3.2991 3.2993 3.9883 3.9884 4.4844 4.4845 4.5825 4.5833 4.5983 4.5985 8.1989 8.1990 8.3260 8.3272 8.3531 8.3543 13.6012 13.6014 13.7368 13.7386 13.9202 13.9212 17.0332 17.0460 k = 0.4976 0.5000 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9514 -21.9008 -21.9008 -18.9331 -18.9331 -7.5214 -7.5202 -7.3732 -7.3719 -7.2965 -7.2963 -2.9208 -2.9201 -2.6848 -2.6845 -2.6681 -2.6671 3.2423 3.2424 3.2967 3.2967 3.9862 3.9862 4.4846 4.4846 4.5810 4.5813 4.5981 4.5981 8.2009 8.2009 8.3276 8.3279 8.3547 8.3550 13.6029 13.6029 13.7404 13.7409 13.9224 13.9227 17.0384 17.0420 k = 0.4976 0.5000 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9514 -21.9008 -21.9008 -18.9331 -18.9331 -7.5214 -7.5202 -7.3732 -7.3719 -7.2965 -7.2963 -2.9208 -2.9201 -2.6848 -2.6845 -2.6681 -2.6671 3.2423 3.2424 3.2967 3.2967 3.9862 3.9862 4.4846 4.4846 4.5810 4.5813 4.5981 4.5981 8.2009 8.2009 8.3276 8.3279 8.3547 8.3550 13.6029 13.6029 13.7404 13.7409 13.9224 13.9227 17.0384 17.0420 k = 0.4886 0.4909 0.5080 ( 2446 PWs) bands (ev): -46.2536 -46.2536 -23.9626 -23.9623 -21.9517 -21.9510 -21.9008 -21.9006 -18.9332 -18.9332 -7.5250 -7.5188 -7.3772 -7.3710 -7.2973 -7.2964 -2.9214 -2.9183 -2.6848 -2.6833 -2.6694 -2.6646 3.2431 3.2436 3.2990 3.2993 3.9887 3.9888 4.4838 4.4840 4.5828 4.5839 4.5988 4.5991 8.1987 8.1987 8.3259 8.3275 8.3525 8.3542 13.6011 13.6014 13.7361 13.7384 13.9196 13.9209 17.0298 17.0463 k = 0.4795 0.4818 0.5080 ( 2442 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9620 -21.9516 -21.9504 -21.9007 -21.9004 -18.9332 -18.9332 -7.5300 -7.5190 -7.3832 -7.3721 -7.2986 -7.2971 -2.9213 -2.9158 -2.6840 -2.6812 -2.6699 -2.6613 3.2452 3.2461 3.3045 3.3050 3.9945 3.9947 4.4822 4.4824 4.5875 4.5893 4.6008 4.6013 8.1936 8.1937 8.3229 8.3259 8.3484 8.3515 13.5972 13.5976 13.7274 13.7315 13.9137 13.9162 17.0207 17.0467 k = 0.4705 0.4727 0.5080 ( 2438 PWs) bands (ev): -46.2535 -46.2535 -23.9624 -23.9616 -21.9513 -21.9496 -21.9006 -21.9002 -18.9333 -18.9333 -7.5365 -7.5207 -7.3912 -7.3754 -7.3005 -7.2983 -2.9204 -2.9125 -2.6824 -2.6782 -2.6698 -2.6572 3.2485 3.2497 3.3132 3.3140 4.0037 4.0040 4.4797 4.4801 4.5948 4.5974 4.6041 4.6049 8.1857 8.1859 8.3184 8.3231 8.3423 8.3471 13.5911 13.5915 13.7145 13.7201 13.9050 13.9085 17.0124 17.0445 k = 0.4615 0.4636 0.5080 ( 2442 PWs) bands (ev): -46.2536 -46.2536 -23.9622 -23.9611 -21.9509 -21.9486 -21.9004 -21.8999 -18.9335 -18.9335 -7.5444 -7.5240 -7.4011 -7.3808 -7.3027 -7.3001 -2.9188 -2.9085 -2.6802 -2.6743 -2.6689 -2.6523 3.2528 3.2545 3.3251 3.3263 4.0163 4.0165 4.4765 4.4769 4.6037 4.6060 4.6099 4.6119 8.1751 8.1753 8.3123 8.3189 8.3344 8.3411 13.5828 13.5828 13.6975 13.7043 13.8934 13.8981 17.0059 17.0413 k = 0.4524 0.4546 0.5080 ( 2442 PWs) bands (ev): -46.2536 -46.2536 -23.9619 -23.9606 -21.9502 -21.9475 -21.9002 -21.8995 -18.9337 -18.9337 -7.5537 -7.5290 -7.4128 -7.3884 -7.3053 -7.3023 -2.9165 -2.9039 -2.6774 -2.6699 -2.6671 -2.6465 3.2580 3.2601 3.3402 3.3419 4.0321 4.0323 4.4726 4.4731 4.6107 4.6123 4.6218 4.6255 8.1617 8.1620 8.3044 8.3133 8.3247 8.3337 13.5715 13.5723 13.6768 13.6842 13.8791 13.8851 17.0019 17.0388 k = 0.4434 0.4455 0.5080 ( 2446 PWs) bands (ev): -46.2537 -46.2537 -23.9615 -23.9600 -21.9494 -21.9461 -21.8998 -21.8990 -18.9340 -18.9340 -7.5645 -7.5357 -7.4261 -7.3981 -7.3081 -7.3049 -2.9135 -2.8987 -2.6739 -2.6662 -2.6629 -2.6398 3.2639 3.2664 3.3586 3.3609 4.0513 4.0513 4.4681 4.4687 4.6171 4.6186 4.6385 4.6432 8.1457 8.1461 8.2946 8.3056 8.3139 8.3251 13.5570 13.5594 13.6530 13.6601 13.8622 13.8695 17.0005 17.0378 k = 0.4343 0.4364 0.5080 ( 2438 PWs) bands (ev): -46.2537 -46.2537 -23.9610 -23.9592 -21.9483 -21.9446 -21.8994 -21.8985 -18.9342 -18.9342 -7.5767 -7.5443 -7.4408 -7.4099 -7.3111 -7.3079 -2.9098 -2.8928 -2.6699 -2.6633 -2.6565 -2.6323 3.2703 3.2733 3.3803 3.3832 4.0734 4.0736 4.4633 4.4638 4.6242 4.6257 4.6589 4.6643 8.1272 8.1277 8.2826 8.2945 8.3036 8.3156 13.5387 13.5441 13.6269 13.6323 13.8431 13.8518 17.0019 17.0390 k = 0.4253 0.4273 0.5080 ( 2436 PWs) bands (ev): -46.2537 -46.2537 -23.9604 -23.9584 -21.9471 -21.9430 -21.8989 -21.8980 -18.9345 -18.9345 -7.5903 -7.5550 -7.4569 -7.4237 -7.3142 -7.3111 -2.9055 -2.8865 -2.6653 -2.6600 -2.6490 -2.6240 3.2771 3.2805 3.4053 3.4090 4.0986 4.0990 4.4581 4.4586 4.6321 4.6337 4.6829 4.6888 8.1062 8.1068 8.2685 8.2797 8.2937 8.3052 13.5154 13.5257 13.5998 13.6013 13.8218 13.8320 17.0061 17.0425 k = 0.4162 0.4182 0.5080 ( 2432 PWs) bands (ev): -46.2537 -46.2537 -23.9597 -23.9575 -21.9457 -21.9411 -21.8983 -21.8973 -18.9349 -18.9349 -7.6054 -7.5678 -7.4739 -7.4394 -7.3175 -7.3146 -2.9006 -2.8796 -2.6603 -2.6562 -2.6407 -2.6149 3.2841 3.2878 3.4337 3.4382 4.1267 4.1274 4.4527 4.4532 4.6409 4.6426 4.7105 4.7168 8.0830 8.0836 8.2523 8.2626 8.2834 8.2938 13.4859 13.5035 13.5683 13.5729 13.7985 13.8103 17.0130 17.0483 k = 0.4072 0.4091 0.5080 ( 2428 PWs) bands (ev): -46.2537 -46.2537 -23.9590 -23.9566 -21.9441 -21.9392 -21.8977 -21.8966 -18.9353 -18.9353 -7.6219 -7.5831 -7.4917 -7.4568 -7.3208 -7.3182 -2.8951 -2.8724 -2.6548 -2.6519 -2.6316 -2.6051 3.2911 3.2952 3.4653 3.4707 4.1577 4.1586 4.4472 4.4478 4.6506 4.6525 4.7418 4.7485 8.0575 8.0583 8.2342 8.2435 8.2721 8.2816 13.4497 13.4757 13.5351 13.5471 13.7736 13.7871 17.0223 17.0564 k = 0.3981 0.4000 0.5080 ( 2432 PWs) bands (ev): -46.2538 -46.2538 -23.9581 -23.9556 -21.9423 -21.9371 -21.8970 -21.8959 -18.9357 -18.9357 -7.6397 -7.6008 -7.5100 -7.4759 -7.3241 -7.3219 -2.8892 -2.8647 -2.6489 -2.6471 -2.6217 -2.5946 3.2981 3.3024 3.5002 3.5066 4.1913 4.1924 4.4419 4.4424 4.6613 4.6633 4.7771 4.7838 8.0301 8.0310 8.2141 8.2226 8.2596 8.2683 13.4072 13.4404 13.5039 13.5223 13.7471 13.7624 17.0337 17.0664 k = 0.3891 0.3909 0.5080 ( 2428 PWs) bands (ev): -46.2538 -46.2538 -23.9572 -23.9545 -21.9404 -21.9349 -21.8962 -21.8950 -18.9362 -18.9362 -7.6590 -7.6211 -7.5285 -7.4965 -7.3275 -7.3256 -2.8828 -2.8567 -2.6425 -2.6419 -2.6112 -2.5836 3.3049 3.3094 3.5383 3.5457 4.2274 4.2286 4.4368 4.4373 4.6730 4.6750 4.8163 4.8230 8.0008 8.0018 8.1923 8.2002 8.2460 8.2540 13.3591 13.3974 13.4751 13.4979 13.7194 13.7365 17.0468 17.0780 k = 0.3800 0.3818 0.5080 ( 2432 PWs) bands (ev): -46.2540 -46.2540 -23.9562 -23.9533 -21.9384 -21.9325 -21.8953 -21.8942 -18.9367 -18.9366 -7.6796 -7.6438 -7.5473 -7.5184 -7.3308 -7.3294 -2.8760 -2.8485 -2.6361 -2.6357 -2.6001 -2.5721 3.3114 3.3161 3.5796 3.5880 4.2658 4.2669 4.4321 4.4326 4.6856 4.6877 4.8596 4.8659 7.9697 7.9710 8.1689 8.1762 8.2310 8.2386 13.3062 13.3481 13.4476 13.4733 13.6906 13.7096 17.0611 17.0906 k = 0.3710 0.3727 0.5080 ( 2434 PWs) bands (ev): -46.2541 -46.2541 -23.9552 -23.9521 -21.9362 -21.9301 -21.8943 -21.8932 -18.9372 -18.9372 -7.7015 -7.6690 -7.5663 -7.5414 -7.3341 -7.3330 -2.8688 -2.8400 -2.6300 -2.6285 -2.5886 -2.5602 3.3176 3.3225 3.6240 3.6334 4.3063 4.3072 4.4280 4.4285 4.6992 4.7014 4.9070 4.9128 7.9371 7.9386 8.1439 8.1508 8.2148 8.2219 13.2493 13.2940 13.4202 13.4482 13.6608 13.6819 17.0760 17.1037 k = 0.3619 0.3636 0.5080 ( 2438 PWs) bands (ev): -46.2542 -46.2542 -23.9541 -23.9508 -21.9339 -21.9276 -21.8932 -21.8922 -18.9377 -18.9377 -7.7248 -7.6962 -7.5855 -7.5655 -7.3373 -7.3366 -2.8613 -2.8313 -2.6235 -2.6210 -2.5766 -2.5481 3.3235 3.3285 3.6715 3.6818 4.3488 4.3493 4.4247 4.4251 4.7138 4.7161 4.9585 4.9635 7.9032 7.9049 8.1174 8.1240 8.1973 8.2040 13.1886 13.2358 13.3925 13.4224 13.6305 13.6535 17.0906 17.1163 k = 0.3529 0.3545 0.5080 ( 2438 PWs) bands (ev): -46.2543 -46.2543 -23.9529 -23.9495 -21.9314 -21.9251 -21.8920 -21.8911 -18.9383 -18.9383 -7.7494 -7.7253 -7.6050 -7.5904 -7.3404 -7.3401 -2.8535 -2.8225 -2.6165 -2.6132 -2.5644 -2.5357 3.3290 3.3340 3.7220 3.7332 4.3925 4.3927 4.4227 4.4231 4.7294 4.7318 5.0142 5.0180 7.8681 7.8699 8.0896 8.0959 8.1784 8.1849 13.1246 13.1741 13.3642 13.3959 13.5996 13.6245 17.1039 17.1276 k = 0.3438 0.3455 0.5080 ( 2432 PWs) bands (ev): -46.2544 -46.2544 -23.9516 -23.9481 -21.9289 -21.9225 -21.8906 -21.8900 -18.9388 -18.9388 -7.7753 -7.7560 -7.6250 -7.6160 -7.3434 -7.3434 -2.8455 -2.8135 -2.6092 -2.6050 -2.5519 -2.5232 3.3342 3.3392 3.7753 3.7873 4.4193 4.4196 4.4397 4.4410 4.7460 4.7485 5.0739 5.0763 7.8319 7.8341 8.0605 8.0666 8.1582 8.1644 13.0576 13.1093 13.3353 13.3687 13.5683 13.5952 17.1148 17.1362 k = 0.3348 0.3364 0.5080 ( 2428 PWs) bands (ev): -46.2544 -46.2544 -23.9503 -23.9466 -21.9262 -21.9199 -21.8892 -21.8888 -18.9394 -18.9394 -7.8023 -7.7880 -7.6453 -7.6421 -7.3465 -7.3463 -2.8372 -2.8044 -2.6016 -2.5965 -2.5394 -2.5106 3.3390 3.3439 3.8314 3.8441 4.4199 4.4204 4.4854 4.4880 4.7636 4.7662 5.1374 5.1381 7.7950 7.7974 8.0301 8.0360 8.1366 8.1426 12.9878 13.0416 13.3057 13.3407 13.5369 13.5656 17.1216 17.1404 k = 0.3257 0.3273 0.5080 ( 2418 PWs) bands (ev): -46.2544 -46.2544 -23.9489 -23.9451 -21.9235 -21.9173 -21.8876 -21.8875 -18.9400 -18.9400 -7.8306 -7.8212 -7.6685 -7.6662 -7.3495 -7.3490 -2.8288 -2.7953 -2.5937 -2.5878 -2.5269 -2.4982 3.3434 3.3483 3.8902 3.9034 4.4213 4.4218 4.5331 4.5374 4.7823 4.7850 5.2032 5.2046 7.7574 7.7601 7.9985 8.0042 8.1137 8.1194 12.9155 12.9715 13.2756 13.3121 13.5055 13.5359 17.1225 17.1385 k = 0.3167 0.3182 0.5080 ( 2418 PWs) bands (ev): -46.2545 -46.2545 -23.9475 -23.9436 -21.9207 -21.9147 -21.8861 -21.8858 -18.9406 -18.9406 -7.8599 -7.8554 -7.6951 -7.6874 -7.3522 -7.3515 -2.8203 -2.7862 -2.5855 -2.5789 -2.5145 -2.4861 3.3475 3.3523 3.9515 3.9650 4.4243 4.4247 4.5821 4.5885 4.8020 4.8048 5.2715 5.2751 7.7194 7.7223 7.9657 7.9714 8.0892 8.0949 12.8410 12.8990 13.2450 13.2829 13.4742 13.5061 17.1152 17.1279 k = 0.3076 0.3091 0.5080 ( 2422 PWs) bands (ev): -46.2547 -46.2546 -23.9461 -23.9421 -21.9179 -21.9122 -21.8846 -21.8839 -18.9412 -18.9412 -7.8903 -7.8902 -7.7218 -7.7091 -7.3547 -7.3539 -2.8117 -2.7772 -2.5772 -2.5698 -2.5024 -2.4742 3.3512 3.3559 4.0153 4.0289 4.4289 4.4294 4.6322 4.6411 4.8228 4.8257 5.3425 5.3486 7.6811 7.6844 7.9317 7.9373 8.0634 8.0689 12.7643 12.8243 13.2142 13.2533 13.4430 13.4764 17.0973 17.1064 k = 0.2986 0.3000 0.5080 ( 2426 PWs) bands (ev): -46.2548 -46.2548 -23.9446 -23.9406 -21.9151 -21.9098 -21.8831 -21.8819 -18.9419 -18.9419 -7.9257 -7.9215 -7.7484 -7.7311 -7.3570 -7.3560 -2.8031 -2.7681 -2.5686 -2.5605 -2.4906 -2.4627 3.3546 3.3593 4.0813 4.0948 4.4355 4.4360 4.6836 4.6953 4.8447 4.8476 5.4161 5.4249 7.6428 7.6465 7.8967 7.9022 8.0361 8.0415 12.6859 12.7479 13.1832 13.2234 13.4122 13.4468 17.0666 17.0719 k = 0.2895 0.2909 0.5080 ( 2430 PWs) bands (ev): -46.2550 -46.2550 -23.9431 -23.9390 -21.9123 -21.9074 -21.8814 -21.8797 -18.9425 -18.9425 -7.9616 -7.9536 -7.7750 -7.7534 -7.3591 -7.3580 -2.7945 -2.7592 -2.5599 -2.5511 -2.4792 -2.4517 3.3578 3.3623 4.1495 4.1627 4.4442 4.4447 4.7361 4.7510 4.8677 4.8706 5.4918 5.5035 7.6047 7.6087 7.8605 7.8661 8.0074 8.0127 12.6059 12.6697 13.1522 13.1932 13.3819 13.4175 17.0216 17.0229 k = 0.2805 0.2818 0.5080 ( 2438 PWs) bands (ev): -46.2552 -46.2552 -23.9415 -23.9374 -21.9095 -21.9052 -21.8796 -21.8773 -18.9432 -18.9432 -7.9978 -7.9863 -7.8013 -7.7760 -7.3609 -7.3597 -2.7859 -2.7504 -2.5511 -2.5416 -2.4683 -2.4413 3.3607 3.3650 4.2197 4.2323 4.4550 4.4556 4.7897 4.8081 4.8918 4.8948 5.5692 5.5840 7.5670 7.5714 7.8233 7.8288 7.9773 7.9825 12.5245 12.5902 13.1213 13.1630 13.3520 13.3885 16.9594 16.9619 k = 0.2714 0.2727 0.5080 ( 2442 PWs) bands (ev): -46.2554 -46.2554 -23.9400 -23.9358 -21.9068 -21.9031 -21.8777 -21.8747 -18.9438 -18.9438 -8.0341 -8.0196 -7.8273 -7.7988 -7.3624 -7.3612 -2.7773 -2.7417 -2.5422 -2.5320 -2.4579 -2.4315 3.3634 3.3675 4.2917 4.3034 4.4683 4.4689 4.8442 4.8667 4.9173 4.9201 5.6479 5.6659 7.5300 7.5347 7.7850 7.7905 7.9456 7.9508 12.4420 12.5095 13.0906 13.1329 13.3228 13.3599 16.8824 16.8885 k = 0.2624 0.2636 0.5080 ( 2446 PWs) bands (ev): -46.2556 -46.2556 -23.9384 -23.9342 -21.9042 -21.9011 -21.8757 -21.8720 -18.9445 -18.9445 -8.0704 -8.0533 -7.8530 -7.8217 -7.3637 -7.3624 -2.7689 -2.7331 -2.5333 -2.5224 -2.4481 -2.4223 3.3658 3.3698 4.3655 4.3759 4.4840 4.4847 4.8992 4.9259 4.9444 4.9473 5.7274 5.7488 7.4938 7.4990 7.7455 7.7510 7.9126 7.9177 12.3587 12.4279 13.0603 13.1029 13.2943 13.3319 16.7936 16.8029 k = 0.2533 0.2545 0.5080 ( 2446 PWs) bands (ev): -46.2557 -46.2557 -23.9368 -23.9326 -21.9016 -21.8992 -21.8735 -21.8691 -18.9451 -18.9451 -8.1066 -8.0873 -7.8783 -7.8446 -7.3647 -7.3634 -2.7605 -2.7248 -2.5244 -2.5128 -2.4389 -2.4139 3.3681 3.3719 4.4406 4.4492 4.5028 4.5033 4.9520 4.9711 4.9759 4.9911 5.8073 5.8320 7.4587 7.4644 7.7050 7.7106 7.8782 7.8832 12.2748 12.3457 13.0305 13.0733 13.2665 13.3044 16.6952 16.7073 k = 0.2443 0.2455 0.5080 ( 2446 PWs) bands (ev): -46.2559 -46.2559 -23.9352 -23.9310 -21.8992 -21.8974 -21.8711 -21.8662 -18.9457 -18.9457 -8.1426 -8.1214 -7.9031 -7.8675 -7.3655 -7.3642 -2.7523 -2.7167 -2.5155 -2.5032 -2.4304 -2.4063 3.3701 3.3738 4.5127 4.5152 4.5291 4.5328 4.9920 5.0005 5.0223 5.0530 5.8868 5.9150 7.4251 7.4312 7.6634 7.6690 7.8423 7.8473 12.1907 12.2631 13.0013 13.0440 13.2396 13.2776 16.5893 16.6038 k = 0.2353 0.2364 0.5080 ( 2454 PWs) bands (ev): -46.2561 -46.2561 -23.9335 -23.9294 -21.8969 -21.8957 -21.8687 -21.8632 -18.9463 -18.9463 -8.1782 -8.1555 -7.9275 -7.8903 -7.3661 -7.3648 -2.7443 -2.7088 -2.5068 -2.4937 -2.4226 -2.3994 3.3721 3.3756 4.5441 4.5453 4.5983 4.6034 5.0235 5.0301 5.0791 5.1170 5.9655 5.9972 7.3932 7.3999 7.6207 7.6263 7.8051 7.8101 12.1065 12.1804 12.9728 13.0153 13.2136 13.2515 16.4776 16.4941 k = 0.2262 0.2273 0.5080 ( 2458 PWs) bands (ev): -46.2563 -46.2563 -23.9319 -23.9278 -21.8948 -21.8941 -21.8660 -21.8601 -18.9469 -18.9469 -8.2133 -8.1894 -7.9512 -7.9130 -7.3664 -7.3651 -2.7365 -2.7012 -2.4983 -2.4843 -2.4154 -2.3933 3.3739 3.3772 4.5707 4.5720 4.6774 4.6800 5.0544 5.0606 5.1383 5.1823 6.0427 6.0779 7.3634 7.3707 7.5768 7.5825 7.7666 7.7715 12.0226 12.0978 12.9450 12.9872 13.1886 13.2262 16.3615 16.3798 k = 0.2172 0.2182 0.5080 ( 2454 PWs) bands (ev): -46.2563 -46.2563 -23.9303 -23.9263 -21.8928 -21.8926 -21.8633 -21.8569 -18.9475 -18.9475 -8.2479 -8.2231 -7.9745 -7.9354 -7.3664 -7.3652 -2.7289 -2.6939 -2.4899 -2.4750 -2.4089 -2.3880 3.3755 3.3787 4.5996 4.6011 4.7578 4.7580 5.0859 5.0920 5.1987 5.2486 6.1177 6.1562 7.3361 7.3442 7.5319 7.5376 7.7268 7.7318 11.9394 12.0159 12.9182 12.9598 13.1646 13.2018 16.2423 16.2621 k = 0.2081 0.2091 0.5080 ( 2450 PWs) bands (ev): -46.2564 -46.2564 -23.9287 -23.9247 -21.8912 -21.8909 -21.8605 -21.8538 -18.9481 -18.9481 -8.2818 -8.2564 -7.9970 -7.9576 -7.3663 -7.3650 -2.7215 -2.6870 -2.4818 -2.4659 -2.4030 -2.3835 3.3771 3.3801 4.6311 4.6328 4.8363 4.8396 5.1183 5.1244 5.2598 5.3158 6.1896 6.2313 7.3117 7.3207 7.4858 7.4916 7.6858 7.6908 11.8573 11.9349 12.8923 12.9333 13.1416 13.1783 16.1210 16.1420 k = 0.1991 0.2000 0.5080 ( 2450 PWs) bands (ev): -46.2565 -46.2565 -23.9271 -23.9232 -21.8898 -21.8892 -21.8575 -21.8506 -18.9487 -18.9487 -8.3149 -8.2891 -8.0189 -7.9793 -7.3659 -7.3647 -2.7145 -2.6804 -2.4739 -2.4570 -2.3977 -2.3797 3.3785 3.3814 4.6653 4.6672 4.9154 4.9221 5.1514 5.1577 5.3214 5.3835 6.2577 6.3024 7.2906 7.3008 7.4386 7.4445 7.6437 7.6487 11.7766 11.8551 12.8674 12.9076 13.1198 13.1557 15.9982 16.0203 k = 0.1900 0.1909 0.5080 ( 2450 PWs) bands (ev): -46.2566 -46.2566 -23.9256 -23.9218 -21.8885 -21.8876 -21.8545 -21.8475 -18.9492 -18.9492 -8.3472 -8.3212 -8.0401 -8.0006 -7.3654 -7.3642 -2.7077 -2.6742 -2.4665 -2.4484 -2.3928 -2.3766 3.3799 3.3826 4.7021 4.7042 4.9948 5.0052 5.1854 5.1919 5.3832 5.4516 6.3209 6.3682 7.2734 7.2851 7.3903 7.3963 7.6005 7.6055 11.6978 11.7771 12.8435 12.8829 13.0991 13.1342 15.8748 15.8978 k = 0.1810 0.1818 0.5080 ( 2450 PWs) bands (ev): -46.2567 -46.2567 -23.9241 -23.9204 -21.8872 -21.8861 -21.8515 -21.8444 -18.9497 -18.9497 -8.3785 -8.3526 -8.0606 -8.0215 -7.3646 -7.3635 -2.7013 -2.6684 -2.4595 -2.4401 -2.3885 -2.3742 3.3812 3.3838 4.7415 4.7438 5.0746 5.0889 5.2203 5.2270 5.4450 5.5198 6.3786 6.4279 7.2603 7.2742 7.3411 7.3469 7.5564 7.5614 11.6212 11.7011 12.8208 12.8591 13.0795 13.1136 15.7514 15.7752 k = 0.1719 0.1727 0.5080 ( 2454 PWs) bands (ev): -46.2569 -46.2569 -23.9226 -23.9190 -21.8860 -21.8848 -21.8485 -21.8414 -18.9502 -18.9502 -8.4087 -8.3831 -8.0802 -8.0417 -7.3637 -7.3627 -2.6952 -2.6630 -2.4529 -2.4321 -2.3845 -2.3724 3.3824 3.3848 4.7834 4.7860 5.1545 5.1729 5.2559 5.2629 5.5065 5.5878 6.4299 6.4806 7.2513 7.2684 7.2914 7.2965 7.5113 7.5164 11.5474 11.6276 12.7993 12.8364 13.0611 13.0941 15.6286 15.6528 k = 0.1629 0.1636 0.5080 ( 2452 PWs) bands (ev): -46.2570 -46.2570 -23.9211 -23.9176 -21.8849 -21.8835 -21.8455 -21.8384 -18.9507 -18.9507 -8.4378 -8.4127 -8.0990 -8.0614 -7.3627 -7.3617 -2.6895 -2.6581 -2.4468 -2.4245 -2.3807 -2.3710 3.3836 3.3858 4.8277 4.8306 5.2343 5.2567 5.2925 5.2995 5.5676 5.6553 6.4743 6.5254 7.2336 7.2449 7.2541 7.2681 7.4656 7.4706 11.4769 11.5571 12.7789 12.8147 13.0439 13.0757 15.5068 15.5314 k = 0.1538 0.1545 0.5080 ( 2452 PWs) bands (ev): -46.2571 -46.2571 -23.9197 -23.9164 -21.8838 -21.8823 -21.8425 -21.8356 -18.9512 -18.9512 -8.4658 -8.4412 -8.1169 -8.0804 -7.3616 -7.3606 -2.6841 -2.6537 -2.4413 -2.4173 -2.3772 -2.3701 3.3847 3.3868 4.8742 4.8775 5.3138 5.3270 5.3368 5.3432 5.6280 5.7219 6.5115 6.5621 7.1840 7.1924 7.2522 7.2730 7.4192 7.4243 11.4100 11.4899 12.7597 12.7942 13.0279 13.0584 15.3866 15.4115 k = 0.1448 0.1455 0.5080 ( 2444 PWs) bands (ev): -46.2571 -46.2571 -23.9183 -23.9151 -21.8827 -21.8812 -21.8396 -21.8328 -18.9516 -18.9516 -8.4924 -8.4686 -8.1340 -8.0987 -7.3603 -7.3594 -2.6791 -2.6497 -2.4363 -2.4107 -2.3737 -2.3694 3.3857 3.3877 4.9230 4.9267 5.3656 5.3745 5.3931 5.4258 5.6873 5.7872 6.5418 6.5909 7.1308 7.1389 7.2570 7.2825 7.3723 7.3775 11.3472 11.4265 12.7418 12.7748 13.0131 13.0423 15.2685 15.2934 k = 0.1357 0.1364 0.5080 ( 2452 PWs) bands (ev): -46.2573 -46.2573 -23.9170 -23.9140 -21.8818 -21.8802 -21.8367 -21.8302 -18.9520 -18.9520 -8.5177 -8.4948 -8.1501 -8.1162 -7.3590 -7.3581 -2.6745 -2.6463 -2.4319 -2.4048 -2.3704 -2.3688 3.3867 3.3885 4.9737 4.9778 5.4034 5.4128 5.4714 5.5089 5.7454 5.8509 6.5659 6.6125 7.0763 7.0844 7.2652 7.2953 7.3251 7.3304 11.2890 11.3673 12.7251 12.7565 12.9994 13.0271 15.1530 15.1777 k = 0.1267 0.1273 0.5080 ( 2456 PWs) bands (ev): -46.2574 -46.2574 -23.9158 -23.9129 -21.8808 -21.8793 -21.8340 -21.8277 -18.9524 -18.9524 -8.5417 -8.5198 -8.1652 -8.1329 -7.3576 -7.3568 -2.6702 -2.6433 -2.4281 -2.3997 -2.3681 -2.3671 3.3876 3.3893 5.0263 5.0309 5.4413 5.4513 5.5487 5.5910 5.8020 5.9123 6.5848 6.6280 7.0209 7.0292 7.2752 7.2779 7.2831 7.3099 11.2359 11.3127 12.7095 12.7393 12.9869 13.0131 15.0406 15.0650 k = 0.1176 0.1182 0.5080 ( 2452 PWs) bands (ev): -46.2574 -46.2574 -23.9146 -23.9119 -21.8799 -21.8784 -21.8313 -21.8253 -18.9528 -18.9528 -8.5641 -8.5434 -8.1793 -8.1488 -7.3562 -7.3554 -2.6663 -2.6408 -2.4248 -2.3956 -2.3671 -2.3639 3.3884 3.3900 5.0804 5.0856 5.4792 5.4899 5.6246 5.6715 5.8571 5.9711 6.6000 6.6389 6.9648 6.9733 7.2307 7.2360 7.2855 7.3246 11.1881 11.2630 12.6953 12.7233 12.9756 13.0002 14.9319 14.9558 k = 0.1086 0.1091 0.5080 ( 2456 PWs) bands (ev): -46.2576 -46.2576 -23.9135 -23.9109 -21.8791 -21.8777 -21.8288 -21.8231 -18.9531 -18.9531 -8.5851 -8.5655 -8.1924 -8.1637 -7.3547 -7.3541 -2.6628 -2.6388 -2.4219 -2.3928 -2.3654 -2.3607 3.3893 3.3907 5.1360 5.1417 5.5168 5.5284 5.6988 5.7498 5.9104 6.0265 6.6130 6.6464 6.9081 6.9169 7.1839 7.1892 7.2946 7.3378 11.1458 11.2182 12.6823 12.7085 12.9654 12.9883 14.8274 14.8506 k = 0.0995 0.1000 0.5080 ( 2456 PWs) bands (ev): -46.2576 -46.2576 -23.9124 -23.9100 -21.8783 -21.8769 -21.8264 -21.8211 -18.9534 -18.9534 -8.6044 -8.5862 -8.2044 -8.1777 -7.3533 -7.3527 -2.6596 -2.6372 -2.4195 -2.3911 -2.3631 -2.3575 3.3900 3.3913 5.1926 5.1991 5.5539 5.5665 5.7706 5.8249 5.9622 6.0779 6.6253 6.6521 6.8513 6.8602 7.1377 7.1431 7.3012 7.3480 11.1094 11.1787 12.6705 12.6948 12.9563 12.9774 14.7277 14.7500 k = 0.0905 0.0909 0.5080 ( 2452 PWs) bands (ev): -46.2577 -46.2577 -23.9114 -23.9092 -21.8776 -21.8763 -21.8241 -21.8192 -18.9537 -18.9537 -8.6222 -8.6054 -8.2153 -8.1907 -7.3519 -7.3514 -2.6568 -2.6361 -2.4173 -2.3905 -2.3602 -2.3545 3.3907 3.3919 5.2500 5.2573 5.5901 5.6038 5.8396 5.8953 6.0127 6.1245 6.6384 6.6572 6.7945 6.8034 7.0925 7.0978 7.3043 7.3542 11.0787 11.1444 12.6599 12.6822 12.9483 12.9676 14.6335 14.6547 k = 0.0814 0.0818 0.5080 ( 2452 PWs) bands (ev): -46.2577 -46.2577 -23.9105 -23.9085 -21.8770 -21.8757 -21.8220 -21.8175 -18.9540 -18.9540 -8.6383 -8.6230 -8.2251 -8.2027 -7.3506 -7.3501 -2.6542 -2.6353 -2.4154 -2.3907 -2.3572 -2.3516 3.3914 3.3924 5.3079 5.3161 5.6250 5.6399 5.9053 5.9595 6.0626 6.1655 6.6533 6.6630 6.7385 6.7470 7.0487 7.0540 7.3031 7.3555 11.0537 11.1150 12.6505 12.6708 12.9413 12.9587 14.5454 14.5654 k = 0.0724 0.0727 0.5080 ( 2450 PWs) bands (ev): -46.2577 -46.2577 -23.9096 -23.9079 -21.8764 -21.8752 -21.8201 -21.8160 -18.9542 -18.9542 -8.6527 -8.6389 -8.2338 -8.2137 -7.3494 -7.3489 -2.6519 -2.6349 -2.4137 -2.3915 -2.3540 -2.3490 3.3920 3.3929 5.3657 5.3751 5.6580 5.6744 5.9668 6.0156 6.1120 6.2005 6.6646 6.6705 6.6902 6.6914 7.0067 7.0118 7.2973 7.3516 11.0340 11.0905 12.6423 12.6604 12.9352 12.9507 14.4641 14.4826 k = 0.0633 0.0636 0.5080 ( 2450 PWs) bands (ev): -46.2578 -46.2578 -23.9089 -23.9073 -21.8758 -21.8748 -21.8183 -21.8147 -18.9544 -18.9544 -8.6654 -8.6532 -8.2414 -8.2236 -7.3482 -7.3478 -2.6498 -2.6348 -2.4122 -2.3925 -2.3510 -2.3466 3.3925 3.3933 5.4231 5.4337 5.6884 5.7064 6.0236 6.0631 6.1602 6.2290 6.6241 6.6368 6.6814 6.6989 6.9670 6.9720 7.2869 7.3422 11.0193 11.0703 12.6352 12.6512 12.9301 12.9437 14.3903 14.4070 k = 0.0543 0.0545 0.5080 ( 2446 PWs) bands (ev): -46.2578 -46.2578 -23.9082 -23.9068 -21.8753 -21.8744 -21.8167 -21.8136 -18.9546 -18.9546 -8.6763 -8.6658 -8.2478 -8.2324 -7.3472 -7.3468 -2.6480 -2.6350 -2.4107 -2.3938 -2.3482 -2.3444 3.3930 3.3937 5.4793 5.4914 5.7154 5.7351 6.0748 6.1026 6.2049 6.2512 6.5729 6.5846 6.6961 6.7241 6.9304 6.9351 7.2724 7.3277 11.0090 11.0539 12.6293 12.6431 12.9259 12.9376 14.3248 14.3395 k = 0.0452 0.0455 0.5080 ( 2442 PWs) bands (ev): -46.2577 -46.2577 -23.9076 -23.9064 -21.8749 -21.8741 -21.8153 -21.8127 -18.9547 -18.9547 -8.6855 -8.6766 -8.2530 -8.2401 -7.3463 -7.3460 -2.6463 -2.6354 -2.4093 -2.3951 -2.3458 -2.3426 3.3934 3.3940 5.5337 5.5474 5.7380 5.7596 6.1196 6.1352 6.2434 6.2679 6.5245 6.5356 6.7154 6.7523 6.8974 6.9017 7.2546 7.3086 11.0025 11.0408 12.6245 12.6360 12.9226 12.9323 14.2681 14.2808 k = 0.0362 0.0364 0.5080 ( 2438 PWs) bands (ev): -46.2577 -46.2577 -23.9070 -23.9061 -21.8745 -21.8739 -21.8141 -21.8120 -18.9548 -18.9548 -8.6928 -8.6857 -8.2571 -8.2467 -7.3455 -7.3453 -2.6447 -2.6360 -2.4079 -2.3965 -2.3436 -2.3411 3.3937 3.3942 5.5851 5.6007 5.7551 5.7783 6.1572 6.1620 6.2737 6.2803 6.4808 6.4911 6.7392 6.7810 6.8689 6.8728 7.2353 7.2860 10.9992 11.0304 12.6208 12.6301 12.9201 12.9279 14.2209 14.2313 k = 0.0271 0.0273 0.5080 ( 2442 PWs) bands (ev): -46.2578 -46.2578 -23.9066 -23.9059 -21.8742 -21.8738 -21.8131 -21.8116 -18.9549 -18.9549 -8.6984 -8.6930 -8.2599 -8.2521 -7.3449 -7.3447 -2.6433 -2.6368 -2.4065 -2.3980 -2.3419 -2.3401 3.3940 3.3944 5.6323 5.6499 5.7655 5.7899 6.1835 6.1862 6.2899 6.2950 6.4440 6.4527 6.7661 6.8069 6.8457 6.8491 7.2169 7.2614 10.9983 11.0221 12.6181 12.6251 12.9184 12.9242 14.1838 14.1918 k = 0.0181 0.0182 0.5080 ( 2436 PWs) bands (ev): -46.2577 -46.2577 -23.9063 -23.9058 -21.8740 -21.8737 -21.8123 -21.8113 -18.9550 -18.9550 -8.7021 -8.6985 -8.2616 -8.2564 -7.3444 -7.3443 -2.6420 -2.6376 -2.4051 -2.3994 -2.3406 -2.3393 3.3943 3.3945 5.6738 5.6928 5.7686 5.7929 6.2000 6.2058 6.2981 6.3074 6.4161 6.4226 6.7933 6.8241 6.8286 6.8335 7.2030 7.2371 10.9994 11.0154 12.6166 12.6213 12.9175 12.9214 14.1574 14.1628 k = 0.0090 0.0091 0.5080 ( 2440 PWs) bands (ev): -46.2578 -46.2578 -23.9060 -23.9058 -21.8738 -21.8736 -21.8117 -21.8112 -18.9550 -18.9550 -8.7039 -8.7021 -8.2621 -8.2595 -7.3441 -7.3441 -2.6408 -2.6386 -2.4038 -2.4009 -2.3396 -2.3390 3.3944 3.3945 5.7076 5.7247 5.7665 5.7865 6.2113 6.2157 6.3055 6.3122 6.3992 6.4026 6.8158 6.8185 6.8193 6.8369 7.1971 7.2160 11.0018 11.0099 12.6162 12.6186 12.9174 12.9193 14.1419 14.1446 k = 0.0000 0.0000 0.5080 ( 2436 PWs) bands (ev): -46.2577 -46.2577 -23.9059 -23.9059 -21.8737 -21.8737 -21.8114 -21.8114 -18.9550 -18.9550 -8.7039 -8.7039 -8.2614 -8.2614 -7.3440 -7.3440 -2.6397 -2.6397 -2.4023 -2.4023 -2.3391 -2.3391 3.3945 3.3945 5.7294 5.7294 5.7730 5.7730 6.2170 6.2170 6.3109 6.3109 6.3946 6.3946 6.8146 6.8146 6.8328 6.8328 7.2016 7.2016 11.0054 11.0054 12.6169 12.6169 12.9180 12.9180 14.1376 14.1376 k = 0.0000 0.0000 0.5080 ( 2436 PWs) bands (ev): -46.2577 -46.2577 -23.9059 -23.9059 -21.8737 -21.8737 -21.8114 -21.8114 -18.9550 -18.9550 -8.7039 -8.7039 -8.2614 -8.2614 -7.3440 -7.3440 -2.6397 -2.6397 -2.4023 -2.4023 -2.3391 -2.3391 3.3945 3.3945 5.7294 5.7294 5.7730 5.7730 6.2170 6.2170 6.3109 6.3109 6.3946 6.3946 6.8146 6.8146 6.8328 6.8328 7.2016 7.2016 11.0054 11.0054 12.6169 12.6169 12.9180 12.9180 14.1376 14.1376 k = 0.0000 0.0000 0.4953 ( 2434 PWs) bands (ev): -46.2577 -46.2577 -23.9060 -23.9057 -21.8737 -21.8734 -21.8115 -21.8113 -18.9551 -18.9551 -8.7040 -8.7036 -8.2614 -8.2614 -7.3466 -7.3451 -2.6400 -2.6396 -2.4024 -2.4024 -2.3396 -2.3390 3.3977 3.3994 5.7296 5.7311 5.7734 5.7748 6.2143 6.2200 6.3092 6.3116 6.3952 6.3985 6.8152 6.8156 6.8333 6.8334 7.2016 7.2019 11.0047 11.0056 12.6112 12.6149 12.9126 12.9156 14.1368 14.1391 k = 0.0000 0.0000 0.4826 ( 2446 PWs) bands (ev): -46.2579 -46.2579 -23.9060 -23.9054 -21.8733 -21.8728 -21.8116 -21.8112 -18.9553 -18.9552 -8.7039 -8.7031 -8.2616 -8.2615 -7.3530 -7.3500 -2.6405 -2.6397 -2.4026 -2.4026 -2.3403 -2.3392 3.4090 3.4123 5.7316 5.7347 5.7757 5.7786 6.2120 6.2234 6.3070 6.3112 6.4005 6.4065 6.8172 6.8180 6.8347 6.8350 7.2019 7.2024 11.0036 11.0054 12.5979 12.6052 12.8996 12.9055 14.1366 14.1411 k = 0.0000 0.0000 0.4699 ( 2450 PWs) bands (ev): -46.2580 -46.2580 -23.9058 -23.9049 -21.8727 -21.8719 -21.8117 -21.8111 -18.9555 -18.9554 -8.7035 -8.7023 -8.2618 -8.2617 -7.3630 -7.3585 -2.6411 -2.6399 -2.4030 -2.4029 -2.3414 -2.3398 3.4282 3.4332 5.7353 5.7401 5.7801 5.7844 6.2102 6.2273 6.3050 6.3101 6.4100 6.4178 6.8206 6.8219 6.8372 6.8376 7.2024 7.2033 11.0021 11.0048 12.5772 12.5880 12.8791 12.8877 14.1370 14.1437 k = 0.0000 0.0000 0.4572 ( 2450 PWs) bands (ev): -46.2580 -46.2580 -23.9056 -23.9044 -21.8718 -21.8708 -21.8118 -21.8109 -18.9558 -18.9557 -8.7029 -8.7013 -8.2620 -8.2619 -7.3766 -7.3707 -2.6419 -2.6403 -2.4034 -2.4033 -2.3428 -2.3406 3.4554 3.4620 5.7409 5.7473 5.7865 5.7922 6.2089 6.2315 6.3037 6.3089 6.4229 6.4317 6.8255 6.8271 6.8409 6.8413 7.2033 7.2044 11.0000 11.0037 12.5492 12.5634 12.8513 12.8626 14.1382 14.1468 k = 0.0000 0.0000 0.4445 ( 2452 PWs) bands (ev): -46.2581 -46.2581 -23.9053 -23.9038 -21.8705 -21.8693 -21.8119 -21.8108 -18.9562 -18.9561 -8.7021 -8.7001 -8.2624 -8.2623 -7.3937 -7.3863 -2.6429 -2.6410 -2.4040 -2.4039 -2.3444 -2.3417 3.4903 3.4984 5.7481 5.7563 5.7949 5.8019 6.2083 6.2362 6.3033 6.3082 6.4387 6.4479 6.8319 6.8336 6.8458 6.8463 7.2044 7.2058 10.9975 11.0022 12.5143 12.5316 12.8165 12.8301 14.1398 14.1502 k = 0.0000 0.0000 0.4318 ( 2452 PWs) bands (ev): -46.2581 -46.2581 -23.9048 -23.9031 -21.8690 -21.8676 -21.8120 -21.8107 -18.9567 -18.9565 -8.7011 -8.6987 -8.2628 -8.2627 -7.4140 -7.4053 -2.6440 -2.6417 -2.4047 -2.4045 -2.3463 -2.3432 3.5326 3.5423 5.7569 5.7670 5.8053 5.8134 6.2083 6.2415 6.3041 6.3083 6.4568 6.4660 6.8396 6.8414 6.8521 6.8526 7.2058 7.2075 10.9946 11.0002 12.4727 12.4931 12.7751 12.7908 14.1419 14.1538 k = 0.0000 0.0000 0.4191 ( 2440 PWs) bands (ev): -46.2580 -46.2580 -23.9042 -23.9022 -21.8671 -21.8656 -21.8121 -21.8105 -18.9573 -18.9570 -8.7000 -8.6972 -8.2633 -8.2631 -7.4374 -7.4274 -2.6453 -2.6426 -2.4055 -2.4053 -2.3485 -2.3449 3.5823 3.5934 5.7671 5.7794 5.8174 5.8266 6.2092 6.2473 6.3061 6.3096 6.4767 6.4856 6.8487 6.8503 6.8601 6.8606 7.2075 7.2095 10.9912 10.9979 12.4249 12.4482 12.7274 12.7449 14.1444 14.1575 k = 0.0000 0.0000 0.4064 ( 2440 PWs) bands (ev): -46.2581 -46.2581 -23.9036 -23.9013 -21.8650 -21.8634 -21.8122 -21.8103 -18.9579 -18.9576 -8.6987 -8.6955 -8.2639 -8.2636 -7.4637 -7.4524 -2.6468 -2.6437 -2.4064 -2.4062 -2.3509 -2.3468 3.6389 3.6514 5.7787 5.7932 5.8313 5.8415 6.2111 6.2538 6.3093 6.3121 6.4980 6.5064 6.8591 6.8604 6.8698 6.8703 7.2094 7.2118 10.9873 10.9952 12.3713 12.3972 12.6737 12.6928 14.1471 14.1612 k = 0.0000 0.0000 0.3937 ( 2444 PWs) bands (ev): -46.2582 -46.2582 -23.9028 -23.9003 -21.8627 -21.8609 -21.8122 -21.8101 -18.9586 -18.9583 -8.6972 -8.6936 -8.2645 -8.2642 -7.4927 -7.4802 -2.6484 -2.6450 -2.4074 -2.4072 -2.3536 -2.3491 3.7021 3.7159 5.7916 5.8084 5.8469 5.8579 6.2140 6.2611 6.3139 6.3160 6.5202 6.5282 6.8707 6.8718 6.8813 6.8821 7.2117 7.2144 10.9830 10.9921 12.3124 12.3406 12.6145 12.6349 14.1499 14.1649 k = 0.0000 0.0000 0.3810 ( 2448 PWs) bands (ev): -46.2583 -46.2583 -23.9020 -23.8993 -21.8601 -21.8584 -21.8123 -21.8098 -18.9594 -18.9590 -8.6957 -8.6917 -8.2651 -8.2649 -7.5241 -7.5104 -2.6501 -2.6464 -2.4085 -2.4083 -2.3565 -2.3516 3.7717 3.7866 5.8055 5.8248 5.8639 5.8756 6.2181 6.2691 6.3198 6.3215 6.5430 6.5505 6.8835 6.8848 6.8946 6.8964 7.2143 7.2173 10.9782 10.9887 12.2486 12.2789 12.5501 12.5716 14.1529 14.1684 k = 0.0000 0.0000 0.3683 ( 2448 PWs) bands (ev): -46.2584 -46.2584 -23.9011 -23.8981 -21.8573 -21.8556 -21.8123 -21.8094 -18.9602 -18.9598 -8.6941 -8.6897 -8.2659 -8.2656 -7.5575 -7.5429 -2.6519 -2.6480 -2.4097 -2.4095 -2.3596 -2.3543 3.8470 3.8630 5.8202 5.8422 5.8823 5.8944 6.2236 6.2781 6.3270 6.3285 6.5658 6.5729 6.8974 6.8995 6.9098 6.9135 7.2172 7.2206 10.9730 10.9849 12.1807 12.2128 12.4810 12.5034 14.1559 14.1718 k = 0.0000 0.0000 0.3556 ( 2452 PWs) bands (ev): -46.2585 -46.2585 -23.9001 -23.8970 -21.8543 -21.8527 -21.8123 -21.8090 -18.9611 -18.9607 -8.6924 -8.6876 -8.2667 -8.2663 -7.5928 -7.5772 -2.6539 -2.6497 -2.4110 -2.4108 -2.3628 -2.3573 3.9279 3.9449 5.8357 5.8604 5.9018 5.9142 6.2305 6.2879 6.3358 6.3372 6.5881 6.5950 6.9122 6.9156 6.9274 6.9338 7.2204 7.2243 10.9673 10.9808 12.1091 12.1427 12.4076 12.4308 14.1588 14.1750 k = 0.0000 0.0000 0.3429 ( 2448 PWs) bands (ev): -46.2586 -46.2586 -23.8990 -23.8957 -21.8511 -21.8498 -21.8123 -21.8084 -18.9620 -18.9616 -8.6908 -8.6856 -8.2675 -8.2671 -7.6296 -7.6132 -2.6559 -2.6515 -2.4123 -2.4121 -2.3662 -2.3604 4.0138 4.0316 5.8517 5.8791 5.9223 5.9347 6.2389 6.2988 6.3461 6.3478 6.6095 6.6164 6.9279 6.9326 6.9482 6.9577 7.2240 7.2284 10.9610 10.9763 12.0345 12.0693 12.3304 12.3541 14.1617 14.1780 k = 0.0000 0.0000 0.3302 ( 2444 PWs) bands (ev): -46.2586 -46.2586 -23.8979 -23.8944 -21.8478 -21.8468 -21.8121 -21.8078 -18.9630 -18.9626 -8.6892 -8.6836 -8.2684 -8.2680 -7.6677 -7.6505 -2.6580 -2.6534 -2.4137 -2.4135 -2.3697 -2.3636 4.1042 4.1227 5.8679 5.8982 5.9435 5.9557 6.2492 6.3108 6.3580 6.3603 6.6297 6.6367 6.9444 6.9502 6.9727 6.9853 7.2279 7.2330 10.9542 10.9716 11.9575 11.9931 12.2497 12.2739 14.1645 14.1806 k = 0.0000 0.0000 0.3175 ( 2444 PWs) bands (ev): -46.2587 -46.2587 -23.8967 -23.8931 -21.8445 -21.8439 -21.8119 -21.8069 -18.9641 -18.9636 -8.6877 -8.6816 -8.2693 -8.2688 -7.7067 -7.6887 -2.6602 -2.6554 -2.4151 -2.4149 -2.3734 -2.3670 4.1986 4.2177 5.8843 5.9171 5.9651 5.9769 6.2612 6.3238 6.3718 6.3748 6.6483 6.6556 6.9616 6.9681 7.0010 7.0167 7.2323 7.2380 10.9469 10.9665 11.8787 11.9148 12.1659 12.1905 14.1671 14.1831 k = 0.0000 0.0000 0.3048 ( 2444 PWs) bands (ev): -46.2588 -46.2588 -23.8954 -23.8918 -21.8411 -21.8410 -21.8115 -21.8058 -18.9651 -18.9647 -8.6863 -8.6799 -8.2702 -8.2697 -7.7463 -7.7277 -2.6625 -2.6575 -2.4166 -2.4164 -2.3771 -2.3706 4.2967 4.3162 5.9006 5.9358 5.9869 5.9981 6.2753 6.3381 6.3874 6.3916 6.6653 6.6730 6.9792 6.9863 7.0329 7.0520 7.2371 7.2437 10.9388 10.9611 11.7989 11.8350 12.0796 12.1046 14.1696 14.1853 k = 0.0000 0.0000 0.2921 ( 2444 PWs) bands (ev): -46.2589 -46.2589 -23.8941 -23.8904 -21.8384 -21.8378 -21.8109 -21.8045 -18.9662 -18.9657 -8.6852 -8.6783 -8.2712 -8.2706 -7.7862 -7.7671 -2.6648 -2.6597 -2.4181 -2.4179 -2.3809 -2.3742 4.3978 4.4176 5.9167 5.9539 6.0086 6.0189 6.2914 6.3535 6.4051 6.4106 6.6808 6.6888 6.9973 7.0047 7.0681 7.0906 7.2424 7.2502 10.9301 10.9554 11.7188 11.7544 11.9911 12.0164 14.1720 14.1873 k = 0.0000 0.0000 0.2794 ( 2448 PWs) bands (ev): -46.2590 -46.2590 -23.8928 -23.8890 -21.8359 -21.8347 -21.8101 -21.8029 -18.9673 -18.9668 -8.6842 -8.6770 -8.2721 -8.2716 -7.8260 -7.8066 -2.6672 -2.6619 -2.4196 -2.4195 -2.3847 -2.3780 4.5013 4.5213 5.9324 5.9712 6.0299 6.0392 6.3095 6.3704 6.4250 6.4319 6.6947 6.7033 7.0155 7.0232 7.1059 7.1323 7.2484 7.2577 10.9204 10.9494 11.6392 11.6737 11.9009 11.9266 14.1741 14.1890 k = 0.0000 0.0000 0.2667 ( 2445 PWs) bands (ev): -46.2591 -46.2591 -23.8915 -23.8876 -21.8337 -21.8318 -21.8089 -21.8010 -18.9684 -18.9679 -8.6836 -8.6761 -8.2731 -8.2725 -7.8656 -7.8459 -2.6696 -2.6642 -2.4212 -2.4210 -2.3885 -2.3817 4.6069 4.6268 5.9475 5.9875 6.0505 6.0587 6.3297 6.3886 6.4471 6.4554 6.7073 6.7164 7.0337 7.0416 7.1456 7.1765 7.2550 7.2666 10.9098 10.9429 11.5608 11.5938 11.8094 11.8356 14.1761 14.1905 k = 0.0000 0.0000 0.2540 ( 2445 PWs) bands (ev): -46.2592 -46.2592 -23.8901 -23.8863 -21.8318 -21.8293 -21.8072 -21.7987 -18.9696 -18.9691 -8.6833 -8.6755 -8.2741 -8.2734 -7.9046 -7.8847 -2.6719 -2.6666 -2.4227 -2.4226 -2.3923 -2.3855 4.7139 4.7335 5.9620 6.0027 6.0702 6.0773 6.3519 6.4083 6.4714 6.4811 6.7188 6.7285 7.0518 7.0597 7.1856 7.2224 7.2625 7.2778 10.8979 10.9361 11.4847 11.5152 11.7171 11.7439 14.1780 14.1918 k = 0.0000 0.0000 0.2413 ( 2445 PWs) bands (ev): -46.2593 -46.2593 -23.8888 -23.8849 -21.8302 -21.8274 -21.8050 -21.7962 -18.9707 -18.9702 -8.6834 -8.6753 -8.2752 -8.2744 -7.9426 -7.9227 -2.6743 -2.6689 -2.4242 -2.4241 -2.3961 -2.3893 4.8217 4.8409 5.9758 6.0168 6.0888 6.0947 6.3759 6.4296 6.4979 6.5089 6.7293 6.7397 7.0695 7.0773 7.2235 7.2661 7.2742 7.2933 10.8847 10.9288 11.4115 11.4390 11.6244 11.6522 14.1796 14.1929 k = 0.0000 0.0000 0.2286 ( 2449 PWs) bands (ev): -46.2595 -46.2595 -23.8874 -23.8836 -21.8289 -21.8258 -21.8024 -21.7934 -18.9718 -18.9713 -8.6840 -8.6757 -8.2762 -8.2753 -7.9794 -7.9596 -2.6767 -2.6713 -2.4258 -2.4257 -2.3998 -2.3931 4.9298 4.9484 5.9889 6.0298 6.1062 6.1110 6.4016 6.4523 6.5263 6.5384 6.7391 6.7502 7.0864 7.0941 7.2550 7.2791 7.3167 7.3179 10.8697 10.9208 11.3423 11.3659 11.5317 11.5609 14.1811 14.1938 k = 0.0000 0.0000 0.2159 ( 2457 PWs) bands (ev): -46.2597 -46.2597 -23.8861 -23.8823 -21.8278 -21.8248 -21.7993 -21.7904 -18.9729 -18.9725 -8.6851 -8.6766 -8.2772 -8.2762 -8.0148 -7.9952 -2.6790 -2.6737 -2.4273 -2.4272 -2.4034 -2.3969 5.0375 5.0553 6.0012 6.0419 6.1223 6.1260 6.4289 6.4766 6.5566 6.5696 6.7482 6.7601 7.1025 7.1099 7.2779 7.2897 7.3495 7.3647 10.8529 10.9121 11.2775 11.2970 11.4395 11.4710 14.1825 14.1945 k = 0.0000 0.0000 0.2032 ( 2453 PWs) bands (ev): -46.2597 -46.2597 -23.8847 -23.8810 -21.8270 -21.8240 -21.7959 -21.7872 -18.9740 -18.9736 -8.6868 -8.6781 -8.2782 -8.2771 -8.0485 -8.0292 -2.6813 -2.6761 -2.4287 -2.4287 -2.4069 -2.4005 5.1443 5.1609 6.0129 6.0530 6.1370 6.1398 6.4576 6.5023 6.5883 6.6020 6.7569 6.7698 7.1175 7.1246 7.2959 7.3014 7.3871 7.4102 10.8343 10.9024 11.2176 11.2331 11.3485 11.3836 14.1838 14.1951 k = 0.0000 0.0000 0.1905 ( 2453 PWs) bands (ev): -46.2598 -46.2598 -23.8834 -23.8798 -21.8263 -21.8235 -21.7924 -21.7840 -18.9751 -18.9746 -8.6890 -8.6803 -8.2792 -8.2780 -8.0803 -8.0615 -2.6835 -2.6784 -2.4302 -2.4301 -2.4103 -2.4041 5.2494 5.2647 6.0240 6.0634 6.1505 6.1524 6.4876 6.5294 6.6211 6.6353 6.7653 6.7793 7.1312 7.1378 7.3124 7.3144 7.4252 7.4531 10.8140 10.8916 11.1615 11.1752 11.2590 11.3008 14.1849 14.1955 k = 0.0000 0.0000 0.1778 ( 2453 PWs) bands (ev): -46.2599 -46.2599 -23.8821 -23.8787 -21.8257 -21.8232 -21.7888 -21.7808 -18.9761 -18.9757 -8.6918 -8.6832 -8.2802 -8.2789 -8.1099 -8.0918 -2.6856 -2.6807 -2.4315 -2.4315 -2.4136 -2.4076 5.3522 5.3657 6.0345 6.0732 6.1626 6.1638 6.5185 6.5577 6.6546 6.6692 6.7736 6.7889 7.1434 7.1496 7.3287 7.3288 7.4613 7.4925 10.7926 10.8794 11.1064 11.1239 11.1719 11.2259 14.1859 14.1959 k = 0.0000 0.0000 0.1651 ( 2453 PWs) bands (ev): -46.2600 -46.2600 -23.8809 -23.8776 -21.8253 -21.8230 -21.7851 -21.7776 -18.9771 -18.9767 -8.6952 -8.6868 -8.2811 -8.2797 -8.1372 -8.1200 -2.6876 -2.6829 -2.4328 -2.4328 -2.4166 -2.4109 5.4518 5.4632 6.0445 6.0828 6.1736 6.1741 6.5504 6.5872 6.6883 6.7031 6.7821 6.7989 7.1542 7.1600 7.3442 7.3458 7.4938 7.5274 10.7713 10.8658 11.0476 11.0771 11.0908 11.1642 14.1868 14.1961 k = 0.0000 0.0000 0.1524 ( 2461 PWs) bands (ev): -46.2602 -46.2602 -23.8797 -23.8766 -21.8250 -21.8229 -21.7816 -21.7745 -18.9780 -18.9776 -8.6991 -8.6910 -8.2821 -8.2804 -8.1621 -8.1459 -2.6895 -2.6851 -2.4341 -2.4341 -2.4196 -2.4142 5.5473 5.5561 6.0544 6.0923 6.1834 6.1834 6.5829 6.6175 6.7217 6.7368 6.7911 6.8099 7.1635 7.1689 7.3608 7.3633 7.5212 7.5565 10.7512 10.8507 10.9822 11.0049 11.0466 11.1183 14.1876 14.1961 k = 0.0000 0.0000 0.1397 ( 2465 PWs) bands (ev): -46.2603 -46.2603 -23.8786 -23.8756 -21.8247 -21.8228 -21.7781 -21.7716 -18.9789 -18.9786 -8.7036 -8.6958 -8.2830 -8.2812 -8.1845 -8.1695 -2.6913 -2.6871 -2.4353 -2.4353 -2.4223 -2.4172 5.6377 5.6436 6.0643 6.1020 6.1918 6.1922 6.6155 6.6482 6.7544 6.7697 6.8014 6.8224 7.1715 7.1765 7.3782 7.3812 7.5427 7.5790 10.7337 10.8332 10.9131 10.9311 11.0173 11.0850 14.1883 14.1962 k = 0.0000 0.0000 0.1270 ( 2467 PWs) bands (ev): -46.2604 -46.2604 -23.8775 -23.8748 -21.8245 -21.8228 -21.7748 -21.7688 -18.9798 -18.9794 -8.7084 -8.7011 -8.2839 -8.2818 -8.2044 -8.1908 -2.6930 -2.6891 -2.4364 -2.4363 -2.4248 -2.4201 5.7218 5.7242 6.0746 6.1125 6.1992 6.2001 6.6476 6.6784 6.7860 6.8013 6.8140 6.8376 7.1782 7.1828 7.3961 7.3992 7.5574 7.5941 10.7193 10.8065 10.8448 10.8717 10.9943 11.0601 14.1890 14.1961 k = 0.0000 0.0000 0.1143 ( 2471 PWs) bands (ev): -46.2605 -46.2605 -23.8765 -23.8740 -21.8243 -21.8228 -21.7717 -21.7662 -18.9805 -18.9802 -8.7134 -8.7067 -8.2849 -8.2825 -8.2218 -8.2098 -2.6945 -2.6909 -2.4374 -2.4373 -2.4271 -2.4228 5.7966 5.7981 6.0860 6.1242 6.2058 6.2070 6.6778 6.7065 6.8161 6.8294 6.8328 6.8566 7.1838 7.1880 7.4143 7.4169 7.5646 7.6011 10.7068 10.7580 10.7821 10.8417 10.9762 11.0406 14.1896 14.1960 k = 0.0000 0.0000 0.1016 ( 2477 PWs) bands (ev): -46.2607 -46.2607 -23.8756 -23.8733 -21.8242 -21.8229 -21.7688 -21.7639 -18.9812 -18.9809 -8.7186 -8.7125 -8.2858 -8.2831 -8.2366 -8.2264 -2.6959 -2.6926 -2.4383 -2.4383 -2.4292 -2.4253 5.8594 5.8648 6.0995 6.1378 6.2116 6.2132 6.7048 6.7303 6.8451 6.8536 6.8602 6.8808 7.1883 7.1922 7.4322 7.4339 7.5642 7.5997 10.6847 10.6992 10.7383 10.8306 10.9616 11.0247 14.1901 14.1958 k = 0.0000 0.0000 0.0889 ( 2477 PWs) bands (ev): -46.2607 -46.2607 -23.8747 -23.8727 -21.8241 -21.8229 -21.7661 -21.7618 -18.9819 -18.9816 -8.7237 -8.7183 -8.2869 -8.2836 -8.2491 -8.2408 -2.6971 -2.6942 -2.4391 -2.4391 -2.4310 -2.4275 5.9113 5.9200 6.1161 6.1538 6.2166 6.2185 6.7270 6.7483 6.8726 6.8843 6.8867 6.9112 7.1920 7.1955 7.4495 7.4496 7.5564 7.5897 10.6399 10.6424 10.7278 10.8273 10.9496 11.0113 14.1906 14.1956 k = 0.0000 0.0000 0.0762 ( 2477 PWs) bands (ev): -46.2608 -46.2608 -23.8739 -23.8722 -21.8240 -21.8230 -21.7637 -21.7600 -18.9824 -18.9822 -8.7285 -8.7238 -8.2880 -8.2841 -8.2591 -8.2530 -2.6981 -2.6956 -2.4398 -2.4397 -2.4325 -2.4295 5.9519 5.9621 6.1367 6.1722 6.2208 6.2232 6.7441 6.7609 6.8978 6.9086 6.9246 6.9488 7.1949 7.1980 7.4626 7.4659 7.5421 7.5715 10.5906 10.5910 10.7321 10.8284 10.9399 10.9997 14.1911 14.1953 k = 0.0000 0.0000 0.0635 ( 2477 PWs) bands (ev): -46.2608 -46.2608 -23.8732 -23.8718 -21.8239 -21.8231 -21.7616 -21.7585 -18.9829 -18.9827 -8.7329 -8.7290 -8.2893 -8.2847 -8.2669 -8.2632 -2.6990 -2.6968 -2.4404 -2.4403 -2.4339 -2.4313 5.9819 5.9916 6.1604 6.1919 6.2244 6.2272 6.7567 6.7694 6.9196 6.9285 6.9696 6.9929 7.1972 7.1997 7.4698 7.4809 7.5249 7.5457 10.5453 10.5465 10.7426 10.8321 10.9322 10.9893 14.1915 14.1950 k = 0.0000 0.0000 0.0508 ( 2473 PWs) bands (ev): -46.2608 -46.2608 -23.8726 -23.8715 -21.8238 -21.8232 -21.7597 -21.7573 -18.9832 -18.9831 -8.7367 -8.7336 -8.2907 -8.2854 -8.2726 -8.2711 -2.6996 -2.6979 -2.4408 -2.4408 -2.4349 -2.4328 6.0029 6.0108 6.1845 6.2110 6.2272 6.2309 6.7659 6.7752 6.9379 6.9451 7.0183 7.0414 7.1990 7.2009 7.4621 7.4940 7.5133 7.5146 10.5074 10.5087 10.7566 10.8361 10.9271 10.9795 14.1919 14.1946 k = 0.0000 0.0000 0.0381 ( 2473 PWs) bands (ev): -46.2609 -46.2609 -23.8721 -23.8712 -21.8237 -21.8232 -21.7583 -21.7564 -18.9835 -18.9834 -8.7398 -8.7374 -8.2921 -8.2867 -8.2767 -8.2764 -2.7001 -2.6988 -2.4412 -2.4412 -2.4356 -2.4341 6.0171 6.0228 6.2056 6.2273 6.2294 6.2345 6.7725 6.7790 6.9525 6.9580 7.0684 7.0914 7.2005 7.2016 7.4367 7.4756 7.5050 7.5155 10.4772 10.4785 10.7724 10.8380 10.9254 10.9700 14.1922 14.1940 k = 0.0000 0.0000 0.0254 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8717 -23.8711 -21.8236 -21.8233 -21.7571 -21.7558 -18.9837 -18.9836 -8.7419 -8.7404 -8.2931 -8.2887 -8.2798 -8.2788 -2.7003 -2.6995 -2.4414 -2.4414 -2.4361 -2.4351 6.0262 6.0299 6.2204 6.2305 6.2392 6.2399 6.7771 6.7812 6.9634 6.9671 7.1167 7.1381 7.2018 7.2019 7.4053 7.4358 7.5134 7.5192 10.4555 10.4564 10.7888 10.8358 10.9279 10.9606 14.1921 14.1927 k = 0.0000 0.0000 0.0127 ( 2465 PWs) bands (ev): -46.2608 -46.2608 -23.8714 -23.8711 -21.8236 -21.8234 -21.7562 -21.7556 -18.9838 -18.9838 -8.7431 -8.7423 -8.2933 -8.2910 -8.2808 -8.2802 -2.7004 -2.7000 -2.4416 -2.4416 -2.4363 -2.4357 6.0316 6.0334 6.2277 6.2310 6.2449 6.2469 6.7801 6.7821 6.9704 6.9722 7.1574 7.1725 7.2028 7.2032 7.3799 7.3988 7.5190 7.5217 10.4424 10.4429 10.8044 10.8290 10.9338 10.9511 14.1849 14.1877 k = 0.0000 0.0000 0.0000 ( 2477 PWs) bands (ev): -46.2610 -46.2610 -23.8712 -23.8712 -21.8235 -21.8235 -21.7558 -21.7558 -18.9839 -18.9839 -8.7433 -8.7433 -8.2927 -8.2927 -8.2809 -8.2809 -2.7003 -2.7003 -2.4416 -2.4416 -2.4362 -2.4362 6.0339 6.0339 6.2303 6.2303 6.2484 6.2484 6.7817 6.7817 6.9733 6.9733 7.1795 7.1795 7.2044 7.2044 7.3758 7.3758 7.5218 7.5218 10.4381 10.4381 10.8181 10.8181 10.9420 10.9420 14.1801 14.1801 k = 0.0000 0.0000 0.0000 ( 2477 PWs) bands (ev): -46.2610 -46.2610 -23.8712 -23.8712 -21.8235 -21.8235 -21.7558 -21.7558 -18.9839 -18.9839 -8.7433 -8.7433 -8.2927 -8.2927 -8.2809 -8.2809 -2.7003 -2.7003 -2.4416 -2.4416 -2.4362 -2.4362 6.0339 6.0339 6.2303 6.2303 6.2484 6.2484 6.7817 6.7817 6.9733 6.9733 7.1795 7.1795 7.2044 7.2044 7.3758 7.3758 7.5218 7.5218 10.4381 10.4381 10.8181 10.8181 10.9420 10.9420 14.1801 14.1801 k =-0.0091 0.0090 0.0000 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8713 -23.8713 -21.8236 -21.8236 -21.7558 -21.7558 -18.9838 -18.9838 -8.7428 -8.7428 -8.2923 -8.2923 -8.2804 -8.2804 -2.7002 -2.7002 -2.4415 -2.4415 -2.4361 -2.4361 6.0322 6.0322 6.2281 6.2281 6.2473 6.2473 6.7786 6.7786 6.9715 6.9715 7.1793 7.1793 7.2042 7.2042 7.3747 7.3747 7.5202 7.5202 10.4407 10.4407 10.8198 10.8198 10.9443 10.9443 14.1824 14.1824 k =-0.0182 0.0181 0.0000 ( 2465 PWs) bands (ev): -46.2608 -46.2608 -23.8714 -23.8714 -21.8239 -21.8239 -21.7559 -21.7559 -18.9837 -18.9837 -8.7414 -8.7414 -8.2913 -8.2913 -8.2789 -8.2789 -2.6999 -2.6999 -2.4411 -2.4411 -2.4358 -2.4358 6.0272 6.0272 6.2213 6.2213 6.2441 6.2441 6.7692 6.7692 6.9658 6.9658 7.1789 7.1789 7.2038 7.2038 7.3712 7.3712 7.5153 7.5153 10.4482 10.4482 10.8249 10.8249 10.9511 10.9511 14.1888 14.1888 k =-0.0273 0.0271 0.0000 ( 2469 PWs) bands (ev): -46.2608 -46.2608 -23.8717 -23.8717 -21.8245 -21.8245 -21.7561 -21.7561 -18.9835 -18.9835 -8.7390 -8.7390 -8.2897 -8.2897 -8.2765 -8.2765 -2.6993 -2.6993 -2.4406 -2.4406 -2.4354 -2.4354 6.0186 6.0187 6.2101 6.2101 6.2387 6.2387 6.7536 6.7536 6.9565 6.9565 7.1781 7.1781 7.2031 7.2031 7.3654 7.3654 7.5075 7.5075 10.4607 10.4607 10.8334 10.8334 10.9625 10.9625 14.1991 14.1991 k =-0.0364 0.0362 0.0000 ( 2465 PWs) bands (ev): -46.2607 -46.2607 -23.8720 -23.8720 -21.8252 -21.8252 -21.7563 -21.7563 -18.9832 -18.9832 -8.7358 -8.7358 -8.2876 -8.2876 -8.2728 -8.2728 -2.6986 -2.6986 -2.4399 -2.4399 -2.4346 -2.4346 6.0064 6.0064 6.1946 6.1946 6.2312 6.2312 6.7323 6.7323 6.9436 6.9436 7.1771 7.1771 7.2021 7.2021 7.3573 7.3573 7.4971 7.4971 10.4781 10.4781 10.8451 10.8451 10.9785 10.9785 14.2131 14.2131 k =-0.0455 0.0452 0.0000 ( 2466 PWs) bands (ev): -46.2607 -46.2607 -23.8725 -23.8725 -21.8262 -21.8262 -21.7567 -21.7567 -18.9828 -18.9828 -8.7317 -8.7317 -8.2850 -8.2850 -8.2680 -8.2680 -2.6977 -2.6977 -2.4392 -2.4392 -2.4334 -2.4334 5.9902 5.9902 6.1748 6.1748 6.2217 6.2217 6.7053 6.7053 6.9273 6.9273 7.1758 7.1758 7.2009 7.2009 7.3467 7.3467 7.4845 7.4845 10.5001 10.5001 10.8600 10.8600 10.9990 10.9990 14.2307 14.2307 k =-0.0545 0.0543-0.0000 ( 2466 PWs) bands (ev): -46.2607 -46.2607 -23.8730 -23.8730 -21.8274 -21.8274 -21.7571 -21.7571 -18.9824 -18.9824 -8.7267 -8.7267 -8.2820 -8.2820 -8.2620 -8.2620 -2.6966 -2.6966 -2.4386 -2.4386 -2.4318 -2.4318 5.9698 5.9698 6.1508 6.1508 6.2104 6.2104 6.6731 6.6731 6.9077 6.9077 7.1742 7.1742 7.1995 7.1995 7.3337 7.3337 7.4702 7.4702 10.5266 10.5266 10.8781 10.8781 11.0239 11.0239 14.2516 14.2516 k =-0.0636 0.0633-0.0000 ( 2470 PWs) bands (ev): -46.2607 -46.2607 -23.8737 -23.8737 -21.8289 -21.8289 -21.7575 -21.7575 -18.9818 -18.9818 -8.7210 -8.7210 -8.2784 -8.2784 -8.2548 -8.2548 -2.6954 -2.6954 -2.4380 -2.4380 -2.4299 -2.4299 5.9448 5.9448 6.1227 6.1227 6.1975 6.1975 6.6359 6.6359 6.8850 6.8850 7.1724 7.1724 7.1979 7.1979 7.3183 7.3183 7.4549 7.4549 10.5574 10.5574 10.8991 10.8991 11.0533 11.0533 14.2755 14.2755 k =-0.0727 0.0724 0.0000 ( 2470 PWs) bands (ev): -46.2606 -46.2606 -23.8744 -23.8744 -21.8305 -21.8305 -21.7580 -21.7580 -18.9812 -18.9812 -8.7145 -8.7145 -8.2743 -8.2743 -8.2464 -8.2464 -2.6940 -2.6940 -2.4375 -2.4375 -2.4275 -2.4275 5.9152 5.9152 6.0904 6.0904 6.1832 6.1832 6.5942 6.5942 6.8595 6.8595 7.1704 7.1704 7.1961 7.1961 7.3007 7.3007 7.4392 7.4392 10.5923 10.5923 10.9231 10.9231 11.0868 11.0868 14.3023 14.3023 k =-0.0818 0.0814-0.0000 ( 2470 PWs) bands (ev): -46.2606 -46.2606 -23.8752 -23.8752 -21.8323 -21.8323 -21.7586 -21.7586 -18.9806 -18.9806 -8.7074 -8.7074 -8.2696 -8.2696 -8.2368 -8.2368 -2.6925 -2.6925 -2.4370 -2.4370 -2.4248 -2.4248 5.8808 5.8808 6.0538 6.0538 6.1678 6.1678 6.5482 6.5482 6.8314 6.8314 7.1681 7.1681 7.1940 7.1940 7.2810 7.2810 7.4238 7.4238 10.6309 10.6309 10.9498 10.9498 11.1245 11.1245 14.3315 14.3315 k =-0.0909 0.0905-0.0000 ( 2460 PWs) bands (ev): -46.2604 -46.2604 -23.8761 -23.8761 -21.8343 -21.8343 -21.7592 -21.7592 -18.9798 -18.9798 -8.6997 -8.6997 -8.2641 -8.2641 -8.2261 -8.2261 -2.6908 -2.6908 -2.4365 -2.4365 -2.4217 -2.4217 5.8418 5.8418 6.0127 6.0127 6.1514 6.1514 6.4982 6.4982 6.8009 6.8009 7.1655 7.1655 7.1918 7.1918 7.2596 7.2596 7.4094 7.4094 10.6730 10.6730 10.9793 10.9793 11.1662 11.1662 14.3630 14.3630 k =-0.1000 0.0995-0.0000 ( 2462 PWs) bands (ev): -46.2603 -46.2603 -23.8771 -23.8771 -21.8365 -21.8365 -21.7599 -21.7599 -18.9790 -18.9790 -8.6915 -8.6915 -8.2579 -8.2579 -8.2144 -8.2144 -2.6891 -2.6891 -2.4359 -2.4359 -2.4185 -2.4185 5.7983 5.7983 5.9670 5.9670 6.1343 6.1343 6.4445 6.4445 6.7683 6.7683 7.1624 7.1624 7.1892 7.1892 7.2369 7.2369 7.3966 7.3966 10.7184 10.7184 11.0113 11.0113 11.2116 11.2116 14.3964 14.3964 k =-0.1091 0.1086-0.0000 ( 2452 PWs) bands (ev): -46.2601 -46.2601 -23.8782 -23.8782 -21.8389 -21.8389 -21.7606 -21.7606 -18.9782 -18.9782 -8.6828 -8.6828 -8.2509 -8.2509 -8.2016 -8.2016 -2.6874 -2.6874 -2.4353 -2.4353 -2.4151 -2.4151 5.7506 5.7506 5.9166 5.9166 6.1164 6.1164 6.3873 6.3873 6.7338 6.7338 7.1584 7.1584 7.1861 7.1861 7.2139 7.2139 7.3860 7.3860 10.7667 10.7667 11.0459 11.0459 11.2606 11.2606 14.4313 14.4313 k =-0.1182 0.1176-0.0000 ( 2452 PWs) bands (ev): -46.2600 -46.2600 -23.8793 -23.8793 -21.8414 -21.8414 -21.7614 -21.7614 -18.9773 -18.9773 -8.6738 -8.6738 -8.2430 -8.2430 -8.1878 -8.1878 -2.6856 -2.6856 -2.4347 -2.4347 -2.4116 -2.4116 5.6992 5.6992 5.8616 5.8616 6.0979 6.0979 6.3270 6.3270 6.6976 6.6976 7.1519 7.1519 7.1810 7.1810 7.1936 7.1936 7.3779 7.3779 10.8177 10.8177 11.0829 11.0829 11.3128 11.3128 14.4676 14.4676 k =-0.1273 0.1267-0.0000 ( 2446 PWs) bands (ev): -46.2599 -46.2599 -23.8805 -23.8805 -21.8441 -21.8441 -21.7623 -21.7623 -18.9763 -18.9763 -8.6646 -8.6646 -8.2341 -8.2341 -8.1731 -8.1731 -2.6838 -2.6838 -2.4341 -2.4341 -2.4080 -2.4080 5.6443 5.6443 5.8021 5.8021 6.0787 6.0787 6.2638 6.2638 6.6601 6.6601 7.1391 7.1391 7.1708 7.1708 7.1835 7.1835 7.3729 7.3729 10.8711 10.8711 11.1222 11.1222 11.3682 11.3682 14.5049 14.5049 k =-0.1364 0.1357-0.0000 ( 2446 PWs) bands (ev): -46.2598 -46.2598 -23.8818 -23.8818 -21.8470 -21.8470 -21.7631 -21.7631 -18.9753 -18.9753 -8.6552 -8.6552 -8.2242 -8.2242 -8.1574 -8.1574 -2.6820 -2.6820 -2.4334 -2.4334 -2.4043 -2.4043 5.5864 5.5864 5.7383 5.7383 6.0587 6.0587 6.1981 6.1981 6.6213 6.6213 7.1181 7.1181 7.1629 7.1629 7.1784 7.1784 7.3712 7.3712 10.9265 10.9265 11.1637 11.1637 11.4263 11.4263 14.5430 14.5430 k =-0.1455 0.1448 0.0000 ( 2448 PWs) bands (ev): -46.2597 -46.2597 -23.8832 -23.8832 -21.8500 -21.8500 -21.7640 -21.7640 -18.9743 -18.9743 -8.6457 -8.6457 -8.2132 -8.2132 -8.1409 -8.1409 -2.6802 -2.6802 -2.4327 -2.4327 -2.4007 -2.4007 5.5258 5.5259 5.6705 5.6706 6.0374 6.0374 6.1304 6.1305 6.5816 6.5816 7.0930 7.0930 7.1579 7.1579 7.1736 7.1736 7.3728 7.3728 10.9839 10.9839 11.2073 11.2073 11.4870 11.4870 14.5816 14.5816 k =-0.1545 0.1538-0.0000 ( 2448 PWs) bands (ev): -46.2596 -46.2596 -23.8846 -23.8846 -21.8531 -21.8531 -21.7650 -21.7650 -18.9733 -18.9733 -8.6363 -8.6363 -8.2010 -8.2010 -8.1235 -8.1235 -2.6784 -2.6784 -2.4319 -2.4319 -2.3971 -2.3971 5.4629 5.4630 5.5992 5.5992 6.0127 6.0127 6.0634 6.0634 6.5411 6.5411 7.0668 7.0668 7.1540 7.1540 7.1686 7.1686 7.3777 7.3777 11.0428 11.0428 11.2528 11.2528 11.5502 11.5502 14.6207 14.6207 k =-0.1636 0.1629-0.0000 ( 2448 PWs) bands (ev): -46.2595 -46.2595 -23.8861 -23.8861 -21.8564 -21.8564 -21.7659 -21.7659 -18.9722 -18.9722 -8.6269 -8.6269 -8.1878 -8.1878 -8.1053 -8.1053 -2.6766 -2.6766 -2.4311 -2.4311 -2.3936 -2.3936 5.3980 5.3980 5.5249 5.5249 5.9700 5.9700 6.0117 6.0117 6.5001 6.5001 7.0406 7.0406 7.1506 7.1506 7.1633 7.1633 7.3858 7.3858 11.1031 11.1031 11.3002 11.3002 11.6154 11.6154 14.6599 14.6599 k =-0.1727 0.1719-0.0000 ( 2456 PWs) bands (ev): -46.2595 -46.2595 -23.8877 -23.8877 -21.8598 -21.8598 -21.7669 -21.7669 -18.9712 -18.9712 -8.6177 -8.6177 -8.1733 -8.1733 -8.0863 -8.0863 -2.6750 -2.6750 -2.4302 -2.4302 -2.3903 -2.3903 5.3312 5.3312 5.4479 5.4479 5.9017 5.9018 5.9832 5.9832 6.4586 6.4586 7.0149 7.0149 7.1473 7.1473 7.1577 7.1577 7.3969 7.3969 11.1644 11.1644 11.3493 11.3493 11.6824 11.6824 14.6991 14.6991 k =-0.1818 0.1810-0.0000 ( 2454 PWs) bands (ev): -46.2594 -46.2594 -23.8892 -23.8892 -21.8632 -21.8632 -21.7679 -21.7679 -18.9701 -18.9701 -8.6087 -8.6087 -8.1577 -8.1577 -8.0666 -8.0666 -2.6733 -2.6733 -2.4293 -2.4293 -2.3871 -2.3871 5.2627 5.2628 5.3690 5.3691 5.8267 5.8267 5.9595 5.9595 6.4170 6.4170 6.9901 6.9901 7.1440 7.1440 7.1521 7.1521 7.4107 7.4107 11.2267 11.2267 11.4000 11.4000 11.7512 11.7512 14.7381 14.7381 k =-0.1909 0.1900-0.0000 ( 2458 PWs) bands (ev): -46.2593 -46.2593 -23.8908 -23.8908 -21.8668 -21.8668 -21.7689 -21.7689 -18.9690 -18.9690 -8.5999 -8.5999 -8.1410 -8.1410 -8.0463 -8.0463 -2.6718 -2.6718 -2.4283 -2.4283 -2.3842 -2.3842 5.1926 5.1926 5.2889 5.2889 5.7491 5.7491 5.9364 5.9364 6.3752 6.3752 6.9666 6.9666 7.1404 7.1404 7.1467 7.1467 7.4271 7.4271 11.2896 11.2896 11.4521 11.4521 11.8214 11.8214 14.7768 14.7768 k =-0.2000 0.1991-0.0000 ( 2458 PWs) bands (ev): -46.2592 -46.2592 -23.8925 -23.8925 -21.8704 -21.8704 -21.7700 -21.7700 -18.9679 -18.9679 -8.5914 -8.5914 -8.1231 -8.1231 -8.0254 -8.0254 -2.6703 -2.6703 -2.4273 -2.4273 -2.3815 -2.3815 5.1208 5.1208 5.2083 5.2083 5.6702 5.6702 5.9132 5.9132 6.3335 6.3335 6.9446 6.9446 7.1362 7.1362 7.1420 7.1420 7.4457 7.4457 11.3530 11.3530 11.5055 11.5055 11.8929 11.8929 14.8149 14.8149 k =-0.2091 0.2081-0.0000 ( 2456 PWs) bands (ev): -46.2591 -46.2591 -23.8942 -23.8942 -21.8741 -21.8741 -21.7710 -21.7710 -18.9669 -18.9669 -8.5831 -8.5831 -8.1043 -8.1043 -8.0039 -8.0039 -2.6688 -2.6688 -2.4263 -2.4263 -2.3792 -2.3792 5.0469 5.0469 5.1280 5.1281 5.5902 5.5902 5.8900 5.8900 6.2920 6.2920 6.9241 6.9241 7.1311 7.1311 7.1383 7.1383 7.4664 7.4664 11.4167 11.4167 11.5600 11.5600 11.9654 11.9654 14.8525 14.8525 k =-0.2182 0.2172-0.0000 ( 2458 PWs) bands (ev): -46.2590 -46.2590 -23.8959 -23.8959 -21.8778 -21.8778 -21.7721 -21.7721 -18.9658 -18.9658 -8.5752 -8.5752 -8.0844 -8.0844 -7.9819 -7.9819 -2.6675 -2.6675 -2.4252 -2.4252 -2.3771 -2.3771 4.9707 4.9707 5.0492 5.0492 5.5096 5.5096 5.8665 5.8665 6.2509 6.2509 6.9055 6.9055 7.1255 7.1255 7.1352 7.1352 7.4888 7.4888 11.4804 11.4804 11.6155 11.6155 12.0388 12.0388 14.8893 14.8893 k =-0.2273 0.2262-0.0000 ( 2452 PWs) bands (ev): -46.2588 -46.2588 -23.8976 -23.8976 -21.8815 -21.8815 -21.7731 -21.7731 -18.9647 -18.9647 -8.5675 -8.5675 -8.0636 -8.0636 -7.9595 -7.9595 -2.6663 -2.6663 -2.4241 -2.4241 -2.3754 -2.3754 4.8921 4.8921 4.9723 4.9723 5.4288 5.4288 5.8428 5.8428 6.2102 6.2102 6.8888 6.8888 7.1198 7.1198 7.1324 7.1324 7.5129 7.5129 11.5440 11.5440 11.6718 11.6718 12.1128 12.1128 14.9253 14.9253 k =-0.2364 0.2352-0.0000 ( 2452 PWs) bands (ev): -46.2587 -46.2587 -23.8993 -23.8993 -21.8853 -21.8853 -21.7742 -21.7742 -18.9637 -18.9637 -8.5601 -8.5601 -8.0421 -8.0421 -7.9367 -7.9367 -2.6651 -2.6651 -2.4230 -2.4230 -2.3740 -2.3740 4.8113 4.8113 4.8978 4.8978 5.3479 5.3479 5.8191 5.8191 6.1700 6.1700 6.8740 6.8740 7.1141 7.1141 7.1298 7.1298 7.5383 7.5383 11.6073 11.6073 11.7287 11.7287 12.1873 12.1873 14.9603 14.9603 k =-0.2455 0.2443-0.0000 ( 2452 PWs) bands (ev): -46.2586 -46.2586 -23.9011 -23.9011 -21.8891 -21.8891 -21.7752 -21.7752 -18.9627 -18.9627 -8.5530 -8.5530 -8.0198 -8.0198 -7.9136 -7.9136 -2.6641 -2.6641 -2.4219 -2.4219 -2.3730 -2.3730 4.7289 4.7289 4.8254 4.8254 5.2674 5.2674 5.7952 5.7952 6.1305 6.1305 6.8613 6.8613 7.1085 7.1085 7.1274 7.1274 7.5649 7.5649 11.6702 11.6702 11.7861 11.7861 12.2620 12.2620 14.9943 14.9943 k =-0.2545 0.2533-0.0000 ( 2454 PWs) bands (ev): -46.2585 -46.2585 -23.9028 -23.9028 -21.8929 -21.8929 -21.7762 -21.7762 -18.9617 -18.9617 -8.5461 -8.5461 -7.9970 -7.9970 -7.8902 -7.8902 -2.6631 -2.6631 -2.4209 -2.4209 -2.3723 -2.3723 4.6456 4.6456 4.7550 4.7550 5.1874 5.1874 5.7714 5.7714 6.0918 6.0918 6.8507 6.8507 7.1030 7.1030 7.1251 7.1251 7.5926 7.5926 11.7325 11.7325 11.8437 11.8437 12.3367 12.3367 15.0271 15.0271 k =-0.2636 0.2624-0.0000 ( 2446 PWs) bands (ev): -46.2582 -46.2582 -23.9045 -23.9045 -21.8967 -21.8967 -21.7773 -21.7773 -18.9607 -18.9607 -8.5395 -8.5395 -7.9737 -7.9737 -7.8667 -7.8667 -2.6623 -2.6623 -2.4198 -2.4198 -2.3719 -2.3719 4.5622 4.5622 4.6863 4.6863 5.1083 5.1083 5.7476 5.7476 6.0538 6.0538 6.8421 6.8421 7.0977 7.0977 7.1230 7.1230 7.6211 7.6211 11.7940 11.7940 11.9014 11.9014 12.4114 12.4114 15.0587 15.0587 k =-0.2727 0.2714-0.0000 ( 2446 PWs) bands (ev): -46.2581 -46.2581 -23.9063 -23.9063 -21.9004 -21.9004 -21.7783 -21.7783 -18.9598 -18.9598 -8.5331 -8.5331 -7.9500 -7.9500 -7.8430 -7.8430 -2.6616 -2.6616 -2.4188 -2.4188 -2.3718 -2.3718 4.4792 4.4792 4.6190 4.6190 5.0303 5.0303 5.7239 5.7239 6.0168 6.0168 6.8355 6.8355 7.0926 7.0926 7.1209 7.1209 7.6502 7.6502 11.8546 11.8546 11.9589 11.9589 12.4858 12.4858 15.0890 15.0890 k =-0.2818 0.2805-0.0000 ( 2450 PWs) bands (ev): -46.2581 -46.2581 -23.9080 -23.9080 -21.9041 -21.9041 -21.7793 -21.7793 -18.9589 -18.9589 -8.5268 -8.5268 -7.9262 -7.9262 -7.8193 -7.8193 -2.6610 -2.6610 -2.4180 -2.4180 -2.3719 -2.3719 4.3970 4.3970 4.5532 4.5532 4.9538 4.9538 5.7005 5.7005 5.9808 5.9808 6.8309 6.8309 7.0876 7.0876 7.1190 7.1190 7.6799 7.6799 11.9143 11.9143 12.0161 12.0161 12.5596 12.5596 15.1179 15.1179 k =-0.2909 0.2895 0.0000 ( 2454 PWs) bands (ev): -46.2580 -46.2580 -23.9097 -23.9097 -21.9077 -21.9077 -21.7803 -21.7803 -18.9581 -18.9581 -8.5208 -8.5208 -7.9022 -7.9022 -7.7957 -7.7957 -2.6605 -2.6605 -2.4172 -2.4172 -2.3723 -2.3723 4.3161 4.3161 4.4888 4.4888 4.8790 4.8790 5.6773 5.6773 5.9458 5.9458 6.8282 6.8282 7.0829 7.0829 7.1171 7.1171 7.7099 7.7099 11.9727 11.9727 12.0728 12.0728 12.6328 12.6328 15.1454 15.1454 k =-0.3000 0.2986 0.0000 ( 2454 PWs) bands (ev): -46.2579 -46.2579 -23.9114 -23.9114 -21.9113 -21.9113 -21.7812 -21.7812 -18.9572 -18.9572 -8.5149 -8.5149 -7.8783 -7.8783 -7.7721 -7.7721 -2.6601 -2.6601 -2.4166 -2.4166 -2.3728 -2.3728 4.2368 4.2368 4.4258 4.4258 4.8062 4.8062 5.6545 5.6545 5.9119 5.9119 6.8273 6.8273 7.0784 7.0784 7.1154 7.1154 7.7401 7.7401 12.0299 12.0299 12.1288 12.1288 12.7050 12.7050 15.1716 15.1716 k =-0.3091 0.3076-0.0000 ( 2458 PWs) bands (ev): -46.2578 -46.2578 -23.9130 -23.9130 -21.9148 -21.9148 -21.7822 -21.7822 -18.9565 -18.9565 -8.5092 -8.5092 -7.8546 -7.8546 -7.7487 -7.7487 -2.6598 -2.6598 -2.4162 -2.4162 -2.3734 -2.3734 4.1592 4.1592 4.3643 4.3643 4.7355 4.7355 5.6320 5.6320 5.8792 5.8792 6.8282 6.8282 7.0741 7.0741 7.1138 7.1138 7.7703 7.7703 12.0856 12.0856 12.1839 12.1839 12.7762 12.7762 15.1962 15.1962 k =-0.3182 0.3167-0.0000 ( 2452 PWs) bands (ev): -46.2576 -46.2576 -23.9146 -23.9146 -21.9183 -21.9183 -21.7831 -21.7831 -18.9557 -18.9557 -8.5037 -8.5037 -7.8311 -7.8311 -7.7255 -7.7255 -2.6597 -2.6597 -2.4160 -2.4160 -2.3740 -2.3740 4.0838 4.0838 4.3043 4.3043 4.6673 4.6673 5.6101 5.6101 5.8477 5.8477 6.8306 6.8306 7.0700 7.0700 7.1122 7.1122 7.8003 7.8003 12.1397 12.1397 12.2379 12.2379 12.8460 12.8460 15.2194 15.2194 k =-0.3273 0.3257-0.0000 ( 2448 PWs) bands (ev): -46.2575 -46.2575 -23.9161 -23.9161 -21.9216 -21.9216 -21.7839 -21.7839 -18.9550 -18.9550 -8.4983 -8.4983 -7.8081 -7.8081 -7.7027 -7.7027 -2.6597 -2.6597 -2.4161 -2.4161 -2.3745 -2.3745 4.0107 4.0107 4.2458 4.2458 4.6017 4.6017 5.5887 5.5887 5.8175 5.8175 6.8345 6.8345 7.0661 7.0661 7.1108 7.1108 7.8301 7.8301 12.1922 12.1922 12.2906 12.2906 12.9143 12.9143 15.2411 15.2411 k =-0.3364 0.3348 0.0000 ( 2456 PWs) bands (ev): -46.2575 -46.2575 -23.9177 -23.9177 -21.9248 -21.9248 -21.7848 -21.7848 -18.9544 -18.9544 -8.4931 -8.4931 -7.7855 -7.7855 -7.6803 -7.6803 -2.6598 -2.6598 -2.4165 -2.4165 -2.3750 -2.3750 3.9401 3.9401 4.1891 4.1891 4.5389 4.5389 5.5680 5.5680 5.7886 5.7886 6.8397 6.8397 7.0625 7.0625 7.1094 7.1094 7.8595 7.8595 12.2428 12.2428 12.3419 12.3419 12.9809 12.9809 15.2613 15.2613 k =-0.3455 0.3438-0.0000 ( 2452 PWs) bands (ev): -46.2573 -46.2573 -23.9191 -23.9191 -21.9279 -21.9279 -21.7856 -21.7856 -18.9538 -18.9538 -8.4880 -8.4880 -7.7636 -7.7636 -7.6585 -7.6585 -2.6600 -2.6600 -2.4172 -2.4172 -2.3752 -2.3752 3.8722 3.8722 4.1341 4.1341 4.4791 4.4791 5.5479 5.5479 5.7610 5.7610 6.8460 6.8460 7.0590 7.0590 7.1082 7.1082 7.8882 7.8882 12.2915 12.2915 12.3915 12.3915 13.0456 13.0456 15.2800 15.2800 k =-0.3545 0.3529-0.0000 ( 2448 PWs) bands (ev): -46.2571 -46.2571 -23.9205 -23.9205 -21.9309 -21.9309 -21.7864 -21.7864 -18.9532 -18.9532 -8.4832 -8.4832 -7.7423 -7.7423 -7.6372 -7.6372 -2.6603 -2.6603 -2.4182 -2.4182 -2.3753 -2.3753 3.8073 3.8073 4.0811 4.0811 4.4225 4.4225 5.5286 5.5286 5.7348 5.7348 6.8533 6.8533 7.0558 7.0558 7.1070 7.1070 7.9163 7.9163 12.3381 12.3381 12.4394 12.4394 13.1080 13.1080 15.2972 15.2972 k =-0.3636 0.3619-0.0000 ( 2456 PWs) bands (ev): -46.2572 -46.2572 -23.9219 -23.9219 -21.9337 -21.9337 -21.7871 -21.7871 -18.9527 -18.9527 -8.4785 -8.4785 -7.7219 -7.7219 -7.6166 -7.6166 -2.6607 -2.6607 -2.4195 -2.4195 -2.3753 -2.3753 3.7454 3.7454 4.0301 4.0301 4.3691 4.3691 5.5101 5.5101 5.7101 5.7101 6.8614 6.8614 7.0529 7.0529 7.1060 7.1060 7.9435 7.9435 12.3825 12.3825 12.4852 12.4852 13.1681 13.1681 15.3130 15.3130 k =-0.3727 0.3710 0.0000 ( 2452 PWs) bands (ev): -46.2570 -46.2570 -23.9231 -23.9231 -21.9364 -21.9364 -21.7878 -21.7878 -18.9522 -18.9522 -8.4740 -8.4740 -7.7024 -7.7024 -7.5967 -7.5967 -2.6612 -2.6612 -2.4209 -2.4209 -2.3750 -2.3750 3.6867 3.6867 3.9813 3.9813 4.3191 4.3191 5.4925 5.4925 5.6868 5.6868 6.8701 6.8701 7.0501 7.0501 7.1050 7.1050 7.9696 7.9696 12.4246 12.4246 12.5290 12.5290 13.2255 13.2255 15.3274 15.3274 k =-0.3818 0.3800-0.0000 ( 2450 PWs) bands (ev): -46.2569 -46.2569 -23.9243 -23.9243 -21.9389 -21.9389 -21.7885 -21.7885 -18.9517 -18.9517 -8.4698 -8.4698 -7.6839 -7.6839 -7.5778 -7.5778 -2.6618 -2.6618 -2.4225 -2.4225 -2.3746 -2.3746 3.6314 3.6314 3.9349 3.9349 4.2724 4.2724 5.4758 5.4758 5.6650 5.6650 6.8792 6.8792 7.0476 7.0476 7.1041 7.1041 7.9947 7.9947 12.4643 12.4643 12.5705 12.5705 13.2802 13.2802 15.3404 15.3404 k =-0.3909 0.3891-0.0000 ( 2456 PWs) bands (ev): -46.2569 -46.2569 -23.9255 -23.9255 -21.9413 -21.9413 -21.7891 -21.7891 -18.9513 -18.9513 -8.4657 -8.4657 -7.6664 -7.6664 -7.5598 -7.5598 -2.6625 -2.6625 -2.4243 -2.4243 -2.3741 -2.3741 3.5796 3.5796 3.8910 3.8910 4.2292 4.2292 5.4602 5.4602 5.6447 5.6447 6.8885 6.8885 7.0453 7.0453 7.1032 7.1032 8.0184 8.0184 12.5014 12.5014 12.6096 12.6096 13.3317 13.3317 15.3521 15.3521 k =-0.4000 0.3981-0.0000 ( 2454 PWs) bands (ev): -46.2568 -46.2568 -23.9265 -23.9265 -21.9436 -21.9436 -21.7897 -21.7897 -18.9509 -18.9509 -8.4620 -8.4620 -7.6501 -7.6501 -7.5429 -7.5429 -2.6632 -2.6632 -2.4261 -2.4261 -2.3735 -2.3735 3.5315 3.5315 3.8498 3.8498 4.1895 4.1895 5.4456 5.4456 5.6260 5.6260 6.8980 6.8980 7.0432 7.0432 7.1025 7.1025 8.0408 8.0408 12.5360 12.5360 12.6461 12.6461 13.3801 13.3801 15.3625 15.3625 k =-0.4091 0.4072-0.0000 ( 2450 PWs) bands (ev): -46.2567 -46.2567 -23.9275 -23.9275 -21.9456 -21.9456 -21.7902 -21.7902 -18.9506 -18.9506 -8.4584 -8.4584 -7.6350 -7.6350 -7.5271 -7.5271 -2.6639 -2.6639 -2.4278 -2.4278 -2.3729 -2.3729 3.4871 3.4871 3.8115 3.8115 4.1533 4.1533 5.4321 5.4321 5.6088 5.6088 6.9072 6.9072 7.0413 7.0413 7.1018 7.1018 8.0616 8.0616 12.5678 12.5678 12.6800 12.6800 13.4249 13.4249 15.3718 15.3718 k =-0.4182 0.4162-0.0000 ( 2450 PWs) bands (ev): -46.2566 -46.2566 -23.9284 -23.9284 -21.9475 -21.9475 -21.7907 -21.7907 -18.9503 -18.9503 -8.4552 -8.4552 -7.6212 -7.6212 -7.5125 -7.5125 -2.6647 -2.6647 -2.4296 -2.4296 -2.3722 -2.3722 3.4466 3.4466 3.7763 3.7763 4.1205 4.1205 5.4197 5.4197 5.5932 5.5932 6.9162 6.9162 7.0397 7.0397 7.1012 7.1012 8.0808 8.0808 12.5969 12.5969 12.7110 12.7110 13.4662 13.4662 15.3799 15.3799 k =-0.4273 0.4253-0.0000 ( 2450 PWs) bands (ev): -46.2566 -46.2566 -23.9292 -23.9292 -21.9492 -21.9492 -21.7911 -21.7911 -18.9500 -18.9500 -8.4522 -8.4522 -7.6086 -7.6086 -7.4993 -7.4993 -2.6654 -2.6654 -2.4312 -2.4312 -2.3715 -2.3715 3.4101 3.4101 3.7443 3.7443 4.0913 4.0913 5.4085 5.4085 5.5792 5.5792 6.9247 6.9247 7.0382 7.0382 7.1007 7.1007 8.0983 8.0983 12.6230 12.6230 12.7391 12.7391 13.5036 13.5036 15.3869 15.3869 k =-0.4364 0.4343-0.0000 ( 2454 PWs) bands (ev): -46.2566 -46.2566 -23.9299 -23.9299 -21.9507 -21.9507 -21.7915 -21.7915 -18.9498 -18.9498 -8.4496 -8.4496 -7.5974 -7.5974 -7.4874 -7.4874 -2.6662 -2.6662 -2.4327 -2.4327 -2.3709 -2.3709 3.3777 3.3777 3.7157 3.7157 4.0655 4.0655 5.3985 5.3985 5.5668 5.5668 6.9326 6.9326 7.0370 7.0370 7.1003 7.1003 8.1140 8.1140 12.6463 12.6463 12.7641 12.7641 13.5370 13.5370 15.3929 15.3929 k =-0.4455 0.4434 0.0000 ( 2452 PWs) bands (ev): -46.2565 -46.2565 -23.9305 -23.9305 -21.9520 -21.9520 -21.7918 -21.7918 -18.9496 -18.9496 -8.4473 -8.4473 -7.5877 -7.5877 -7.4769 -7.4769 -2.6668 -2.6668 -2.4340 -2.4340 -2.3703 -2.3703 3.3494 3.3494 3.6906 3.6906 4.0432 4.0432 5.3898 5.3898 5.5560 5.5560 6.9397 6.9397 7.0359 7.0359 7.0999 7.0999 8.1278 8.1278 12.6666 12.6666 12.7860 12.7860 13.5662 13.5662 15.3980 15.3980 k =-0.4545 0.4524-0.0000 ( 2450 PWs) bands (ev): -46.2565 -46.2565 -23.9311 -23.9311 -21.9531 -21.9531 -21.7921 -21.7921 -18.9494 -18.9494 -8.4453 -8.4453 -7.5793 -7.5793 -7.4680 -7.4680 -2.6674 -2.6674 -2.4352 -2.4352 -2.3698 -2.3698 3.3254 3.3254 3.6692 3.6692 4.0243 4.0243 5.3824 5.3824 5.5469 5.5469 6.9459 6.9459 7.0350 7.0350 7.0995 7.0995 8.1396 8.1396 12.6838 12.6838 12.8047 12.8047 13.5912 13.5912 15.4022 15.4022 k =-0.4636 0.4614-0.0000 ( 2442 PWs) bands (ev): -46.2563 -46.2563 -23.9315 -23.9315 -21.9540 -21.9540 -21.7923 -21.7923 -18.9493 -18.9493 -8.4436 -8.4436 -7.5725 -7.5725 -7.4606 -7.4606 -2.6679 -2.6679 -2.4362 -2.4362 -2.3693 -2.3693 3.3056 3.3056 3.6515 3.6515 4.0089 4.0089 5.3763 5.3763 5.5394 5.5394 6.9511 6.9511 7.0344 7.0344 7.0993 7.0993 8.1493 8.1493 12.6980 12.6980 12.8202 12.8202 13.6118 13.6118 15.4056 15.4056 k =-0.4727 0.4705-0.0000 ( 2446 PWs) bands (ev): -46.2563 -46.2563 -23.9318 -23.9318 -21.9547 -21.9547 -21.7925 -21.7925 -18.9492 -18.9492 -8.4423 -8.4423 -7.5671 -7.5671 -7.4548 -7.4548 -2.6684 -2.6684 -2.4370 -2.4370 -2.3690 -2.3690 3.2902 3.2902 3.6376 3.6376 3.9970 3.9970 5.3716 5.3716 5.5336 5.5336 6.9552 6.9552 7.0339 7.0339 7.0991 7.0991 8.1569 8.1569 12.7091 12.7091 12.8322 12.8322 13.6279 13.6279 15.4082 15.4082 k =-0.4818 0.4795-0.0000 ( 2452 PWs) bands (ev): -46.2564 -46.2564 -23.9321 -23.9321 -21.9552 -21.9552 -21.7926 -21.7926 -18.9491 -18.9491 -8.4414 -8.4414 -7.5633 -7.5633 -7.4506 -7.4506 -2.6687 -2.6687 -2.4375 -2.4375 -2.3687 -2.3687 3.2791 3.2791 3.6277 3.6277 3.9884 3.9884 5.3682 5.3682 5.5294 5.5294 6.9582 6.9582 7.0335 7.0335 7.0989 7.0989 8.1624 8.1624 12.7170 12.7170 12.8408 12.8408 13.6395 13.6395 15.4100 15.4100 k =-0.4909 0.4886-0.0000 ( 2452 PWs) bands (ev): -46.2564 -46.2564 -23.9322 -23.9322 -21.9555 -21.9555 -21.7927 -21.7927 -18.9491 -18.9491 -8.4408 -8.4408 -7.5610 -7.5610 -7.4481 -7.4481 -2.6689 -2.6689 -2.4379 -2.4379 -2.3686 -2.3686 3.2725 3.2725 3.6217 3.6217 3.9833 3.9833 5.3661 5.3661 5.5269 5.5269 6.9601 6.9601 7.0333 7.0333 7.0989 7.0989 8.1657 8.1657 12.7217 12.7217 12.8460 12.8460 13.6465 13.6465 15.4110 15.4110 k =-0.5000 0.4976-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9323 -21.9556 -21.9556 -21.7927 -21.7927 -18.9491 -18.9491 -8.4406 -8.4406 -7.5602 -7.5602 -7.4473 -7.4473 -2.6690 -2.6690 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2703 3.6197 3.6197 3.9816 3.9816 5.3654 5.3654 5.5260 5.5260 6.9607 6.9607 7.0332 7.0332 7.0988 7.0988 8.1668 8.1668 12.7233 12.7233 12.8477 12.8477 13.6488 13.6488 15.4114 15.4114 k =-0.5000 0.4976-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9323 -21.9556 -21.9556 -21.7927 -21.7927 -18.9491 -18.9491 -8.4406 -8.4406 -7.5602 -7.5602 -7.4473 -7.4473 -2.6690 -2.6690 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2703 3.6197 3.6197 3.9816 3.9816 5.3654 5.3654 5.5260 5.5260 6.9607 6.9607 7.0332 7.0332 7.0988 7.0988 8.1668 8.1668 12.7233 12.7233 12.8477 12.8477 13.6488 13.6488 15.4114 15.4114 k =-0.4976 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9322 -21.9557 -21.9556 -21.7928 -21.7927 -18.9491 -18.9491 -8.4407 -8.4406 -7.5604 -7.5601 -7.4475 -7.4472 -2.6690 -2.6689 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2704 3.6198 3.6198 3.9816 3.9820 5.3652 5.3657 5.5259 5.5263 6.9605 6.9609 7.0330 7.0334 7.0988 7.0988 8.1667 8.1667 12.7230 12.7234 12.8474 12.8479 13.6483 13.6490 15.4113 15.4114 k =-0.4976 0.5000-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9322 -21.9557 -21.9556 -21.7928 -21.7927 -18.9491 -18.9491 -8.4407 -8.4406 -7.5604 -7.5601 -7.4475 -7.4472 -2.6690 -2.6689 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2704 3.6198 3.6198 3.9816 3.9820 5.3652 5.3657 5.5259 5.5263 6.9605 6.9609 7.0330 7.0334 7.0988 7.0988 8.1667 8.1667 12.7230 12.7234 12.8474 12.8479 13.6483 13.6490 15.4113 15.4114 k =-0.4976 0.5000 0.0127 ( 2444 PWs) bands (ev): -46.2563 -46.2563 -23.9325 -23.9321 -21.9557 -21.9555 -21.7932 -21.7926 -18.9490 -18.9490 -8.4399 -8.4384 -7.5606 -7.5597 -7.4474 -7.4471 -2.6703 -2.6683 -2.4384 -2.4383 -2.3700 -2.3680 3.2703 3.2705 3.6197 3.6199 3.9825 3.9829 5.3614 5.3627 5.5227 5.5232 6.9638 6.9651 7.0364 7.0369 7.0929 7.0939 8.1668 8.1668 12.7233 12.7253 12.8448 12.8494 13.6483 13.6494 15.4168 15.4216 k =-0.4976 0.5000 0.0254 ( 2446 PWs) bands (ev): -46.2563 -46.2563 -23.9328 -23.9321 -21.9557 -21.9555 -21.7941 -21.7929 -18.9490 -18.9490 -8.4361 -8.4332 -7.5606 -7.5589 -7.4470 -7.4467 -2.6725 -2.6685 -2.4395 -2.4394 -2.3725 -2.3686 3.2704 3.2706 3.6197 3.6201 3.9852 3.9856 5.3506 5.3531 5.5134 5.5138 6.9741 6.9770 7.0458 7.0464 7.0771 7.0788 8.1669 8.1669 12.7254 12.7295 12.8413 12.8501 13.6484 13.6503 15.4378 15.4472 k =-0.4976 0.5000 0.0381 ( 2452 PWs) bands (ev): -46.2563 -46.2563 -23.9331 -23.9322 -21.9557 -21.9554 -21.7952 -21.7935 -18.9488 -18.9488 -8.4294 -8.4250 -7.5604 -7.5578 -7.4465 -7.4461 -2.6754 -2.6695 -2.4414 -2.4413 -2.3761 -2.3702 3.2706 3.2708 3.6197 3.6203 3.9896 3.9901 5.3334 5.3372 5.4981 5.4985 6.9896 6.9958 7.0435 7.0440 7.0709 7.0713 8.1672 8.1672 12.7294 12.7360 12.8376 12.8500 13.6489 13.6516 15.4738 15.4874 k =-0.4976 0.5000 0.0508 ( 2448 PWs) bands (ev): -46.2563 -46.2562 -23.9336 -23.9324 -21.9557 -21.9553 -21.7968 -21.7944 -18.9487 -18.9487 -8.4197 -8.4139 -7.5600 -7.5565 -7.4456 -7.4453 -2.6790 -2.6712 -2.4440 -2.4438 -2.3806 -2.3728 3.2708 3.2711 3.6198 3.6206 3.9959 3.9964 5.3104 5.3152 5.4775 5.4779 6.9902 7.0052 7.0241 7.0307 7.0925 7.0929 8.1675 8.1676 12.7350 12.7447 12.8347 12.8495 13.6497 13.6533 15.5241 15.5415 k =-0.4976 0.5000 0.0635 ( 2448 PWs) bands (ev): -46.2562 -46.2562 -23.9341 -23.9326 -21.9556 -21.9552 -21.7986 -21.7957 -18.9485 -18.9484 -8.4071 -8.3999 -7.5593 -7.5550 -7.4446 -7.4442 -2.6834 -2.6737 -2.4474 -2.4471 -2.3860 -2.3763 3.2711 3.2714 3.6199 3.6208 4.0038 4.0044 5.2822 5.2880 5.4520 5.4524 6.9469 6.9579 7.0542 7.0550 7.1219 7.1226 8.1680 8.1681 12.7418 12.7555 12.8333 12.8490 13.6509 13.6553 15.5875 15.6082 k =-0.4976 0.5000 0.0762 ( 2446 PWs) bands (ev): -46.2561 -46.2561 -23.9348 -23.9329 -21.9555 -21.9551 -21.8007 -21.7973 -18.9482 -18.9482 -8.3917 -8.3830 -7.5584 -7.5532 -7.4434 -7.4430 -2.6885 -2.6769 -2.4515 -2.4510 -2.3923 -2.3808 3.2715 3.2718 3.6199 3.6210 4.0134 4.0140 5.2494 5.2561 5.4225 5.4229 6.8878 6.8991 7.0902 7.0911 7.1568 7.1576 8.1686 8.1687 12.7491 12.7683 12.8347 12.8495 13.6524 13.6576 15.6627 15.6860 k =-0.4976 0.5000 0.0889 ( 2441 PWs) bands (ev): -46.2560 -46.2560 -23.9355 -23.9334 -21.9555 -21.9549 -21.8032 -21.7992 -18.9479 -18.9479 -8.3735 -8.3634 -7.5573 -7.5511 -7.4419 -7.4415 -2.6942 -2.6808 -2.4562 -2.4557 -2.3995 -2.3863 3.2719 3.2723 3.6199 3.6212 4.0246 4.0253 5.2127 5.2203 5.3895 5.3899 6.8187 6.8310 7.1308 7.1325 7.1962 7.1971 8.1692 8.1694 12.7564 12.7826 12.8400 12.8517 13.6543 13.6603 15.7483 15.7735 k =-0.4976 0.5000 0.1016 ( 2435 PWs) bands (ev): -46.2559 -46.2559 -23.9362 -23.9339 -21.9554 -21.9547 -21.8059 -21.8014 -18.9475 -18.9475 -8.3527 -8.3411 -7.5560 -7.5488 -7.4403 -7.4398 -2.7005 -2.6854 -2.4616 -2.4609 -2.4074 -2.3926 3.2724 3.2728 3.6198 3.6213 4.0374 4.0381 5.1729 5.1812 5.3537 5.3541 6.7410 6.7545 7.1755 7.1776 7.2392 7.2402 8.1700 8.1702 12.7635 12.7979 12.8499 12.8568 13.6565 13.6632 15.8426 15.8691 k =-0.4976 0.5000 0.1143 ( 2430 PWs) bands (ev): -46.2557 -46.2557 -23.9370 -23.9344 -21.9553 -21.9546 -21.8089 -21.8039 -18.9471 -18.9471 -8.3293 -8.3162 -7.5544 -7.5463 -7.4384 -7.4379 -2.7074 -2.6907 -2.4676 -2.4668 -2.4161 -2.3997 3.2730 3.2735 3.6196 3.6213 4.0516 4.0524 5.1304 5.1394 5.3158 5.3162 6.6558 6.6704 7.2234 7.2257 7.2851 7.2862 8.1709 8.1711 12.7707 12.8131 12.8642 12.8665 13.6590 13.6664 15.9440 15.9711 k =-0.4976 0.5000 0.1270 ( 2434 PWs) bands (ev): -46.2557 -46.2557 -23.9379 -23.9351 -21.9551 -21.9544 -21.8122 -21.8067 -18.9467 -18.9467 -8.3034 -8.2889 -7.5527 -7.5435 -7.4364 -7.4358 -2.7149 -2.6966 -2.4742 -2.4732 -2.4254 -2.4077 3.2736 3.2741 3.6193 3.6211 4.0672 4.0681 5.0859 5.0954 5.2762 5.2766 6.5639 6.5798 7.2738 7.2762 7.3334 7.3346 8.1718 8.1720 12.7786 12.8274 12.8806 12.8838 13.6617 13.6698 16.0507 16.0777 k =-0.4976 0.5000 0.1397 ( 2426 PWs) bands (ev): -46.2555 -46.2555 -23.9389 -23.9358 -21.9550 -21.9542 -21.8156 -21.8097 -18.9462 -18.9462 -8.2753 -8.2593 -7.5508 -7.5405 -7.4342 -7.4335 -2.7229 -2.7031 -2.4813 -2.4801 -2.4353 -2.4163 3.2743 3.2748 3.6187 3.6207 4.0840 4.0850 5.0397 5.0497 5.2355 5.2359 6.4665 6.4836 7.3260 7.3285 7.3835 7.3847 8.1728 8.1731 12.7881 12.8411 12.9011 12.9063 13.6647 13.6735 16.1611 16.1874 k =-0.4976 0.5000 0.1524 ( 2430 PWs) bands (ev): -46.2555 -46.2555 -23.9399 -23.9366 -21.9549 -21.9540 -21.8193 -21.8130 -18.9458 -18.9458 -8.2449 -8.2274 -7.5487 -7.5372 -7.4318 -7.4311 -2.7314 -2.7102 -2.4890 -2.4876 -2.4457 -2.4256 3.2751 3.2756 3.6179 3.6201 4.1020 4.1030 4.9922 5.0026 5.1941 5.1945 6.3644 6.3826 7.3796 7.3820 7.4348 7.4361 8.1739 8.1742 12.7998 12.8552 12.9261 12.9322 13.6679 13.6774 16.2732 16.2981 k =-0.4976 0.5000 0.1651 ( 2434 PWs) bands (ev): -46.2555 -46.2555 -23.9410 -23.9375 -21.9547 -21.9538 -21.8232 -21.8165 -18.9452 -18.9452 -8.2126 -8.1935 -7.5465 -7.5338 -7.4293 -7.4285 -2.7402 -2.7178 -2.4972 -2.4954 -2.4566 -2.4354 3.2758 3.2764 3.6168 3.6191 4.1210 4.1220 4.9439 4.9546 5.1523 5.1528 6.2587 6.2780 7.4339 7.4363 7.4869 7.4882 8.1750 8.1754 12.8139 12.8708 12.9547 12.9610 13.6713 13.6816 16.3851 16.4080 k =-0.4976 0.5000 0.1778 ( 2440 PWs) bands (ev): -46.2555 -46.2555 -23.9421 -23.9385 -21.9546 -21.9535 -21.8272 -21.8202 -18.9447 -18.9447 -8.1785 -8.1578 -7.5441 -7.5301 -7.4267 -7.4258 -2.7494 -2.7259 -2.5058 -2.5037 -2.4678 -2.4458 3.2767 3.2773 3.6152 3.6178 4.1409 4.1419 4.8949 4.9059 5.1105 5.1110 6.1504 6.1707 7.4887 7.4908 7.5393 7.5408 8.1763 8.1767 12.8308 12.8885 12.9862 12.9924 13.6749 13.6859 16.4949 16.5151 k =-0.4976 0.5000 0.1905 ( 2440 PWs) bands (ev): -46.2554 -46.2554 -23.9432 -23.9395 -21.9544 -21.9533 -21.8313 -21.8240 -18.9441 -18.9441 -8.1427 -8.1204 -7.5416 -7.5261 -7.4240 -7.4230 -2.7589 -2.7344 -2.5147 -2.5123 -2.4792 -2.4567 3.2776 3.2782 3.6132 3.6159 4.1614 4.1625 4.8454 4.8567 5.0689 5.0695 6.0405 6.0617 7.5434 7.5454 7.5918 7.5933 8.1775 8.1780 12.8506 12.9087 13.0203 13.0262 13.6786 13.6904 16.6003 16.6171 k =-0.4976 0.5000 0.2032 ( 2440 PWs) bands (ev): -46.2553 -46.2553 -23.9443 -23.9405 -21.9543 -21.9531 -21.8355 -21.8280 -18.9436 -18.9436 -8.1055 -8.0814 -7.5390 -7.5219 -7.4211 -7.4201 -2.7686 -2.7432 -2.5240 -2.5211 -2.4908 -2.4679 3.2785 3.2791 3.6107 3.6135 4.1826 4.1837 4.7957 4.8071 5.0279 5.0285 5.9301 5.9520 7.5977 7.5995 7.6439 7.6455 8.1788 8.1794 12.8732 12.9315 13.0566 13.0622 13.6825 13.6950 16.6992 16.7120 k =-0.4976 0.5000 0.2159 ( 2438 PWs) bands (ev): -46.2551 -46.2551 -23.9455 -23.9416 -21.9541 -21.9528 -21.8398 -21.8320 -18.9429 -18.9429 -8.0671 -8.0413 -7.5362 -7.5175 -7.4182 -7.4170 -2.7785 -2.7524 -2.5336 -2.5302 -2.5025 -2.4793 3.2794 3.2801 3.6074 3.6105 4.2041 4.2051 4.7459 4.7573 4.9876 4.9882 5.8200 5.8425 7.6514 7.6529 7.6954 7.6970 8.1802 8.1808 12.8985 12.9568 13.0950 13.1002 13.6864 13.6998 16.7893 16.7976 k =-0.4976 0.5000 0.2286 ( 2432 PWs) bands (ev): -46.2549 -46.2549 -23.9467 -23.9427 -21.9539 -21.9526 -21.8441 -21.8362 -18.9423 -18.9423 -8.0277 -8.0000 -7.5334 -7.5128 -7.4152 -7.4139 -2.7884 -2.7618 -2.5434 -2.5395 -2.5142 -2.4910 3.2804 3.2811 3.6034 3.6066 4.2257 4.2268 4.6962 4.7075 4.9481 4.9488 5.7113 5.7342 7.7040 7.7053 7.7460 7.7477 8.1816 8.1823 12.9266 12.9847 13.1352 13.1401 13.6904 13.7046 16.8689 16.8722 k =-0.4976 0.5000 0.2413 ( 2440 PWs) bands (ev): -46.2549 -46.2549 -23.9479 -23.9439 -21.9538 -21.9524 -21.8484 -21.8404 -18.9417 -18.9417 -7.9877 -7.9580 -7.5304 -7.5078 -7.4122 -7.4107 -2.7985 -2.7715 -2.5534 -2.5489 -2.5259 -2.5029 3.2814 3.2821 3.5985 3.6018 4.2471 4.2482 4.6467 4.6579 4.9097 4.9104 5.6049 5.6281 7.7555 7.7565 7.7955 7.7972 8.1830 8.1838 12.9571 13.0148 13.1770 13.1815 13.6945 13.7095 16.9346 16.9364 k =-0.4976 0.5000 0.2540 ( 2432 PWs) bands (ev): -46.2547 -46.2547 -23.9491 -23.9450 -21.9536 -21.9521 -21.8527 -21.8446 -18.9411 -18.9411 -7.9473 -7.9153 -7.5274 -7.5025 -7.4092 -7.4075 -2.8084 -2.7813 -2.5634 -2.5583 -2.5373 -2.5148 3.2824 3.2831 3.5924 3.5960 4.2680 4.2690 4.5979 4.6087 4.8725 4.8732 5.5019 5.5252 7.8055 7.8063 7.8437 7.8455 8.1844 8.1853 12.9899 13.0472 13.2202 13.2243 13.6985 13.7145 16.9846 16.9914 k =-0.4976 0.5000 0.2667 ( 2436 PWs) bands (ev): -46.2547 -46.2547 -23.9503 -23.9462 -21.9534 -21.9519 -21.8570 -21.8489 -18.9405 -18.9405 -7.9068 -7.8725 -7.5242 -7.4968 -7.4061 -7.4043 -2.8183 -2.7911 -2.5735 -2.5678 -2.5486 -2.5267 3.2834 3.2842 3.5851 3.5888 4.2876 4.2886 4.5503 4.5607 4.8366 4.8373 5.4030 5.4261 7.8539 7.8544 7.8903 7.8921 8.1858 8.1869 13.0247 13.0814 13.2646 13.2682 13.7026 13.7196 17.0229 17.0343 k =-0.4976 0.5000 0.2794 ( 2436 PWs) bands (ev): -46.2546 -46.2546 -23.9514 -23.9474 -21.9533 -21.9517 -21.8612 -21.8531 -18.9398 -18.9398 -7.8666 -7.8296 -7.5210 -7.4906 -7.4031 -7.4010 -2.8281 -2.8010 -2.5836 -2.5772 -2.5596 -2.5386 3.2845 3.2852 3.5763 3.5801 4.3046 4.3055 4.5054 4.5151 4.8021 4.8028 5.3091 5.3318 7.9004 7.9007 7.9351 7.9371 8.1872 8.1885 13.0613 13.1173 13.3099 13.3130 13.7067 13.7247 17.0508 17.0663 k =-0.4976 0.5000 0.2921 ( 2438 PWs) bands (ev): -46.2545 -46.2545 -23.9526 -23.9486 -21.9531 -21.9515 -21.8653 -21.8573 -18.9392 -18.9392 -7.8270 -7.7871 -7.5175 -7.4839 -7.4001 -7.3978 -2.8376 -2.8109 -2.5935 -2.5864 -2.5703 -2.5502 3.2855 3.2862 3.5657 3.5697 4.3159 4.3169 4.4662 4.4750 4.7690 4.7698 5.2209 5.2429 7.9450 7.9451 7.9781 7.9803 8.1886 8.1902 13.0992 13.1545 13.3557 13.3584 13.7109 13.7299 17.0701 17.0893 k =-0.4976 0.5000 0.3048 ( 2442 PWs) bands (ev): -46.2545 -46.2545 -23.9537 -23.9499 -21.9530 -21.9514 -21.8693 -21.8614 -18.9386 -18.9386 -7.7886 -7.7454 -7.5139 -7.4765 -7.3971 -7.3945 -2.8469 -2.8207 -2.6032 -2.5956 -2.5806 -2.5617 3.2865 3.2872 3.5533 3.5573 4.3147 4.3164 4.4398 4.4469 4.7376 4.7383 5.1389 5.1600 7.9873 7.9875 8.0191 8.0214 8.1901 8.1920 13.1383 13.1927 13.4019 13.4041 13.7150 13.7352 17.0826 17.1049 k =-0.4976 0.5000 0.3175 ( 2446 PWs) bands (ev): -46.2544 -46.2544 -23.9548 -23.9510 -21.9529 -21.9512 -21.8731 -21.8654 -18.9381 -18.9381 -7.7517 -7.7048 -7.5098 -7.4683 -7.3942 -7.3913 -2.8558 -2.8303 -2.6127 -2.6045 -2.5905 -2.5729 3.2875 3.2882 3.5386 3.5427 4.2952 4.2978 4.4324 4.4375 4.7078 4.7085 5.0634 5.0834 8.0273 8.0278 8.0578 8.0604 8.1915 8.1939 13.1781 13.2316 13.4480 13.4496 13.7192 13.7406 17.0900 17.1152 k =-0.4976 0.5000 0.3302 ( 2448 PWs) bands (ev): -46.2544 -46.2544 -23.9558 -23.9522 -21.9527 -21.9511 -21.8768 -21.8692 -18.9375 -18.9375 -7.7168 -7.6660 -7.5052 -7.4590 -7.3914 -7.3881 -2.8644 -2.8397 -2.6218 -2.6131 -2.5999 -2.5837 3.2885 3.2892 3.5216 3.5257 4.2626 4.2654 4.4391 4.4429 4.6796 4.6804 4.9947 5.0134 8.0649 8.0657 8.0941 8.0972 8.1929 8.1960 13.2183 13.2708 13.4935 13.4945 13.7235 13.7462 17.0940 17.1216 k =-0.4976 0.5000 0.3429 ( 2448 PWs) bands (ev): -46.2543 -46.2543 -23.9568 -23.9533 -21.9526 -21.9510 -21.8802 -21.8729 -18.9369 -18.9369 -7.6845 -7.6297 -7.4994 -7.4485 -7.3888 -7.3849 -2.8725 -2.8488 -2.6305 -2.6214 -2.6089 -2.5941 3.2895 3.2901 3.5021 3.5061 4.2254 4.2277 4.4520 4.4551 4.6532 4.6540 4.9327 4.9499 8.1000 8.1012 8.1276 8.1315 8.1945 8.1988 13.2585 13.3098 13.5378 13.5384 13.7282 13.7522 17.0956 17.1256 k =-0.4976 0.5000 0.3556 ( 2448 PWs) bands (ev): -46.2542 -46.2542 -23.9577 -23.9544 -21.9525 -21.9509 -21.8835 -21.8765 -18.9364 -18.9364 -7.6552 -7.5972 -7.4917 -7.4365 -7.3862 -7.3817 -2.8801 -2.8576 -2.6388 -2.6294 -2.6173 -2.6040 3.2904 3.2911 3.4803 3.4841 4.1881 4.1898 4.4671 4.4697 4.6287 4.6294 4.8772 4.8929 8.1324 8.1343 8.1574 8.1630 8.1967 8.2032 13.2982 13.3483 13.5800 13.5809 13.7335 13.7588 17.0960 17.1282 k =-0.4976 0.5000 0.3683 ( 2450 PWs) bands (ev): -46.2541 -46.2541 -23.9586 -23.9555 -21.9524 -21.9508 -21.8865 -21.8799 -18.9359 -18.9359 -7.6294 -7.5703 -7.4806 -7.4231 -7.3837 -7.3784 -2.8872 -2.8660 -2.6464 -2.6370 -2.6253 -2.6134 3.2913 3.2919 3.4562 3.4598 4.1529 4.1540 4.4826 4.4849 4.6059 4.6066 4.8279 4.8421 8.1611 8.1646 8.1811 8.1880 8.2030 8.2124 13.3371 13.3858 13.6192 13.6206 13.7402 13.7665 17.0959 17.1303 k =-0.4976 0.5000 0.3810 ( 2448 PWs) bands (ev): -46.2540 -46.2540 -23.9594 -23.9565 -21.9523 -21.9508 -21.8892 -21.8830 -18.9355 -18.9355 -7.6072 -7.5504 -7.4650 -7.4082 -7.3814 -7.3749 -2.8937 -2.8739 -2.6535 -2.6441 -2.6326 -2.6221 3.2921 3.2927 3.4304 3.4336 4.1208 4.1213 4.4977 4.4999 4.5851 4.5857 4.7844 4.7971 8.1817 8.1897 8.1980 8.1996 8.2242 8.2299 13.3747 13.4219 13.6544 13.6557 13.7497 13.7762 17.0960 17.1326 k =-0.4976 0.5000 0.3937 ( 2443 PWs) bands (ev): -46.2539 -46.2539 -23.9601 -23.9574 -21.9522 -21.9508 -21.8917 -21.8860 -18.9350 -18.9350 -7.5885 -7.5374 -7.4457 -7.3925 -7.3790 -7.3710 -2.8995 -2.8814 -2.6599 -2.6507 -2.6393 -2.6302 3.2929 3.2935 3.4034 3.4063 4.0924 4.0925 4.5121 4.5141 4.5661 4.5667 4.7463 4.7576 8.1902 8.1957 8.2194 8.2211 8.2482 8.2512 13.4107 13.4561 13.6831 13.6840 13.7643 13.7890 17.0965 17.1358 k =-0.4976 0.5000 0.4064 ( 2438 PWs) bands (ev): -46.2537 -46.2537 -23.9607 -23.9583 -21.9521 -21.9508 -21.8939 -21.8887 -18.9346 -18.9346 -7.5732 -7.5293 -7.4254 -7.3799 -7.3732 -7.3661 -2.9048 -2.8883 -2.6657 -2.6569 -2.6453 -2.6376 3.2936 3.2941 3.3760 3.3785 4.0676 4.0679 4.5253 4.5273 4.5492 4.5497 4.7132 4.7232 8.1937 8.1972 8.2418 8.2427 8.2702 8.2721 13.4445 13.4879 13.7014 13.7065 13.7854 13.8060 17.0976 17.1402 k =-0.4976 0.5000 0.4191 ( 2438 PWs) bands (ev): -46.2537 -46.2537 -23.9612 -23.9591 -21.9521 -21.9508 -21.8958 -21.8911 -18.9343 -18.9343 -7.5608 -7.5242 -7.4073 -7.3767 -7.3595 -7.3582 -2.9093 -2.8947 -2.6707 -2.6625 -2.6507 -2.6442 3.2943 3.2947 3.3491 3.3512 4.0466 4.0470 4.5334 4.5342 4.5380 4.5398 4.6849 4.6936 8.1958 8.1983 8.2619 8.2624 8.2898 8.2912 13.4760 13.5168 13.7123 13.7219 13.8107 13.8264 17.0984 17.1459 k =-0.4976 0.5000 0.4318 ( 2432 PWs) bands (ev): -46.2535 -46.2535 -23.9617 -23.9599 -21.9520 -21.9509 -21.8974 -21.8933 -18.9340 -18.9340 -7.5507 -7.5210 -7.3937 -7.3751 -7.3498 -7.3428 -2.9132 -2.9004 -2.6750 -2.6676 -2.6554 -2.6500 3.2949 3.2953 3.3237 3.3254 4.0293 4.0298 4.5208 4.5213 4.5483 4.5502 4.6609 4.6685 8.1973 8.1991 8.2793 8.2796 8.3070 8.3079 13.5047 13.5424 13.7191 13.7318 13.8366 13.8483 17.0963 17.1403 k =-0.4976 0.5000 0.4445 ( 2432 PWs) bands (ev): -46.2535 -46.2535 -23.9621 -23.9605 -21.9519 -21.9510 -21.8988 -21.8953 -18.9337 -18.9337 -7.5426 -7.5190 -7.3851 -7.3739 -7.3376 -7.3288 -2.9163 -2.9055 -2.6786 -2.6721 -2.6594 -2.6550 3.2954 3.2956 3.3006 3.3019 4.0153 4.0158 4.5098 4.5102 4.5575 4.5594 4.6410 4.6475 8.1984 8.1997 8.2940 8.2943 8.3215 8.3222 13.5302 13.5641 13.7239 13.7380 13.8607 13.8694 17.0872 17.1118 k =-0.4976 0.5000 0.4572 ( 2428 PWs) bands (ev): -46.2534 -46.2534 -23.9623 -23.9611 -21.9518 -21.9510 -21.8998 -21.8969 -18.9335 -18.9335 -7.5360 -7.5179 -7.3800 -7.3729 -7.3250 -7.3168 -2.9186 -2.9100 -2.6813 -2.6759 -2.6626 -2.6592 3.2804 3.2814 3.2959 3.2962 4.0044 4.0048 4.5007 4.5010 4.5652 4.5672 4.6250 4.6306 8.1992 8.2002 8.3061 8.3064 8.3334 8.3340 13.5524 13.5816 13.7279 13.7417 13.8817 13.8881 17.0727 17.0875 k =-0.4976 0.5000 0.4699 ( 2428 PWs) bands (ev): -46.2534 -46.2534 -23.9625 -23.9616 -21.9518 -21.9511 -21.9005 -21.8983 -18.9333 -18.9333 -7.5307 -7.5176 -7.3769 -7.3723 -7.3138 -7.3073 -2.9202 -2.9137 -2.6833 -2.6791 -2.6651 -2.6625 3.2641 3.2648 3.2962 3.2964 3.9962 3.9966 4.4936 4.4939 4.5714 4.5734 4.6127 4.6173 8.1999 8.2006 8.3155 8.3158 8.3427 8.3432 13.5710 13.5943 13.7314 13.7434 13.8988 13.9033 17.0585 17.0681 k =-0.4976 0.5000 0.4826 ( 2434 PWs) bands (ev): -46.2534 -46.2534 -23.9626 -23.9620 -21.9517 -21.9512 -21.9009 -21.8994 -18.9332 -18.9332 -7.5266 -7.5180 -7.3749 -7.3719 -7.3050 -7.3006 -2.9211 -2.9167 -2.6845 -2.6817 -2.6668 -2.6650 3.2521 3.2525 3.2965 3.2966 3.9905 3.9908 4.4886 4.4887 4.5762 4.5780 4.6040 4.6076 8.2004 8.2008 8.3222 8.3225 8.3493 8.3497 13.5857 13.6020 13.7348 13.7437 13.9114 13.9143 17.0474 17.0538 k =-0.4976 0.5000 0.4953 ( 2436 PWs) bands (ev): -46.2534 -46.2534 -23.9626 -23.9623 -21.9516 -21.9513 -21.9010 -21.9003 -18.9331 -18.9331 -7.5234 -7.5190 -7.3736 -7.3718 -7.2991 -7.2969 -2.9212 -2.9189 -2.6850 -2.6835 -2.6678 -2.6665 3.2448 3.2450 3.2966 3.2967 3.9873 3.9874 4.4856 4.4856 4.5794 4.5807 4.5990 4.6011 8.2007 8.2009 8.3262 8.3265 8.3533 8.3537 13.5965 13.6049 13.7379 13.7427 13.9194 13.9208 17.0406 17.0450 k =-0.4976 0.5000 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9514 -21.9008 -21.9008 -18.9331 -18.9331 -7.5214 -7.5202 -7.3732 -7.3719 -7.2965 -7.2963 -2.9208 -2.9201 -2.6848 -2.6845 -2.6681 -2.6671 3.2423 3.2424 3.2967 3.2967 3.9862 3.9862 4.4846 4.4846 4.5810 4.5813 4.5981 4.5981 8.2009 8.2009 8.3276 8.3279 8.3547 8.3550 13.6029 13.6029 13.7404 13.7409 13.9224 13.9227 17.0384 17.0420 k =-0.4976 0.5000 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9514 -21.9008 -21.9008 -18.9331 -18.9331 -7.5214 -7.5202 -7.3732 -7.3719 -7.2965 -7.2963 -2.9208 -2.9201 -2.6848 -2.6845 -2.6681 -2.6671 3.2423 3.2424 3.2967 3.2967 3.9862 3.9862 4.4846 4.4846 4.5810 4.5813 4.5981 4.5981 8.2009 8.2009 8.3276 8.3279 8.3547 8.3550 13.6029 13.6029 13.7404 13.7409 13.9224 13.9227 17.0384 17.0420 k =-0.5000 0.4976 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9515 -21.9008 -21.9008 -18.9331 -18.9331 -7.5208 -7.5208 -7.3725 -7.3725 -7.2964 -7.2964 -2.9205 -2.9205 -2.6847 -2.6847 -2.6676 -2.6676 3.2423 3.2423 3.2966 3.2966 3.9861 3.9861 4.4846 4.4846 4.5811 4.5811 4.5981 4.5981 8.2010 8.2010 8.3278 8.3278 8.3549 8.3549 13.6030 13.6030 13.7408 13.7408 13.9226 13.9226 17.0403 17.0403 k =-0.5000 0.4976 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9515 -21.9008 -21.9008 -18.9331 -18.9331 -7.5208 -7.5208 -7.3725 -7.3725 -7.2964 -7.2964 -2.9205 -2.9205 -2.6847 -2.6847 -2.6676 -2.6676 3.2423 3.2423 3.2966 3.2966 3.9861 3.9861 4.4846 4.4846 4.5811 4.5811 4.5981 4.5981 8.2010 8.2010 8.3278 8.3278 8.3549 8.3549 13.6030 13.6030 13.7408 13.7408 13.9226 13.9226 17.0403 17.0403 k =-0.5000 0.4976 0.4953 ( 2436 PWs) bands (ev): -46.2534 -46.2534 -23.9626 -23.9623 -21.9516 -21.9514 -21.9010 -21.9003 -18.9331 -18.9331 -7.5232 -7.5190 -7.3733 -7.3721 -7.2991 -7.2969 -2.9212 -2.9190 -2.6850 -2.6835 -2.6676 -2.6668 3.2447 3.2449 3.2965 3.2966 3.9871 3.9873 4.4856 4.4857 4.5793 4.5806 4.5989 4.6011 8.2008 8.2010 8.3264 8.3264 8.3535 8.3536 13.5965 13.6049 13.7381 13.7428 13.9195 13.9209 17.0417 17.0441 k =-0.5000 0.4976 0.4826 ( 2436 PWs) bands (ev): -46.2534 -46.2534 -23.9626 -23.9620 -21.9517 -21.9513 -21.9009 -21.8994 -18.9332 -18.9332 -7.5265 -7.5180 -7.3746 -7.3720 -7.3050 -7.3006 -2.9211 -2.9167 -2.6846 -2.6817 -2.6667 -2.6652 3.2520 3.2525 3.2964 3.2965 3.9904 3.9907 4.4886 4.4888 4.5761 4.5779 4.6039 4.6075 8.2005 8.2009 8.3224 8.3224 8.3495 8.3497 13.5858 13.6021 13.7349 13.7438 13.9115 13.9144 17.0481 17.0533 k =-0.5000 0.4976 0.4699 ( 2428 PWs) bands (ev): -46.2534 -46.2534 -23.9625 -23.9616 -21.9518 -21.9512 -21.9005 -21.8983 -18.9333 -18.9333 -7.5307 -7.5176 -7.3767 -7.3723 -7.3138 -7.3073 -2.9203 -2.9137 -2.6833 -2.6792 -2.6650 -2.6627 3.2641 3.2648 3.2961 3.2963 3.9961 3.9965 4.4936 4.4939 4.5713 4.5733 4.6127 4.6173 8.2000 8.2007 8.3157 8.3157 8.3428 8.3432 13.5710 13.5943 13.7316 13.7436 13.8989 13.9034 17.0591 17.0677 k =-0.5000 0.4976 0.4572 ( 2424 PWs) bands (ev): -46.2533 -46.2533 -23.9623 -23.9611 -21.9518 -21.9510 -21.8998 -21.8969 -18.9335 -18.9335 -7.5359 -7.5179 -7.3799 -7.3729 -7.3250 -7.3168 -2.9186 -2.9100 -2.6813 -2.6759 -2.6625 -2.6593 3.2804 3.2814 3.2958 3.2960 4.0043 4.0047 4.5007 4.5010 4.5651 4.5671 4.6250 4.6305 8.1993 8.2003 8.3063 8.3063 8.3335 8.3340 13.5525 13.5817 13.7281 13.7418 13.8818 13.8882 17.0733 17.0872 k =-0.5000 0.4976 0.4445 ( 2432 PWs) bands (ev): -46.2535 -46.2535 -23.9621 -23.9605 -21.9519 -21.9510 -21.8988 -21.8953 -18.9337 -18.9337 -7.5425 -7.5190 -7.3850 -7.3739 -7.3376 -7.3288 -2.9163 -2.9056 -2.6786 -2.6721 -2.6593 -2.6551 3.2953 3.2955 3.3006 3.3018 4.0152 4.0157 4.5098 4.5102 4.5574 4.5593 4.6410 4.6475 8.1985 8.1998 8.2942 8.2943 8.3216 8.3222 13.5303 13.5642 13.7241 13.7381 13.8608 13.8695 17.0876 17.1116 k =-0.5000 0.4976 0.4318 ( 2432 PWs) bands (ev): -46.2535 -46.2535 -23.9617 -23.9599 -21.9520 -21.9509 -21.8974 -21.8933 -18.9340 -18.9340 -7.5506 -7.5210 -7.3936 -7.3751 -7.3497 -7.3428 -2.9132 -2.9005 -2.6750 -2.6676 -2.6554 -2.6501 3.2948 3.2952 3.3236 3.3253 4.0292 4.0297 4.5209 4.5214 4.5481 4.5500 4.6609 4.6684 8.1974 8.1992 8.2794 8.2796 8.3071 8.3080 13.5047 13.5425 13.7193 13.7319 13.8367 13.8484 17.0966 17.1399 k =-0.5000 0.4976 0.4191 ( 2438 PWs) bands (ev): -46.2537 -46.2537 -23.9612 -23.9591 -21.9521 -21.9508 -21.8958 -21.8911 -18.9343 -18.9343 -7.5607 -7.5242 -7.4072 -7.3767 -7.3594 -7.3582 -2.9093 -2.8947 -2.6707 -2.6626 -2.6507 -2.6443 3.2942 3.2946 3.3491 3.3512 4.0465 4.0470 4.5339 4.5345 4.5376 4.5394 4.6848 4.6936 8.1959 8.1984 8.2619 8.2624 8.2899 8.2912 13.4761 13.5169 13.7124 13.7220 13.8108 13.8265 17.0985 17.1459 k =-0.5000 0.4976 0.4064 ( 2438 PWs) bands (ev): -46.2537 -46.2537 -23.9607 -23.9583 -21.9521 -21.9508 -21.8939 -21.8887 -18.9346 -18.9346 -7.5732 -7.5292 -7.4254 -7.3798 -7.3732 -7.3661 -2.9048 -2.8884 -2.6657 -2.6569 -2.6453 -2.6376 3.2935 3.2940 3.3759 3.3784 4.0675 4.0678 4.5253 4.5273 4.5491 4.5497 4.7132 4.7232 8.1938 8.1974 8.2419 8.2427 8.2703 8.2722 13.4446 13.4880 13.7015 13.7066 13.7855 13.8061 17.0976 17.1401 k =-0.5000 0.4976 0.3937 ( 2444 PWs) bands (ev): -46.2539 -46.2539 -23.9601 -23.9574 -21.9522 -21.9508 -21.8917 -21.8860 -18.9350 -18.9350 -7.5885 -7.5373 -7.4457 -7.3925 -7.3789 -7.3709 -2.8996 -2.8814 -2.6599 -2.6508 -2.6392 -2.6303 3.2928 3.2933 3.4033 3.4062 4.0924 4.0924 4.5120 4.5141 4.5661 4.5667 4.7462 4.7575 8.1903 8.1958 8.2194 8.2210 8.2482 8.2513 13.4107 13.4562 13.6832 13.6841 13.7644 13.7892 17.0965 17.1357 k =-0.5000 0.4976 0.3810 ( 2444 PWs) bands (ev): -46.2540 -46.2540 -23.9594 -23.9565 -21.9523 -21.9508 -21.8892 -21.8830 -18.9355 -18.9355 -7.6071 -7.5503 -7.4650 -7.4082 -7.3813 -7.3748 -2.8937 -2.8739 -2.6535 -2.6441 -2.6325 -2.6222 3.2920 3.2926 3.4303 3.4336 4.1208 4.1213 4.4976 4.4998 4.5851 4.5857 4.7843 4.7970 8.1818 8.1898 8.1981 8.1995 8.2243 8.2299 13.3748 13.4220 13.6546 13.6557 13.7498 13.7764 17.0959 17.1325 k =-0.5000 0.4976 0.3683 ( 2452 PWs) bands (ev): -46.2542 -46.2542 -23.9586 -23.9555 -21.9524 -21.9508 -21.8865 -21.8799 -18.9359 -18.9359 -7.6293 -7.5702 -7.4805 -7.4230 -7.3837 -7.3783 -2.8872 -2.8660 -2.6464 -2.6370 -2.6252 -2.6134 3.2912 3.2918 3.4561 3.4597 4.1528 4.1539 4.4825 4.4848 4.6059 4.6066 4.8278 4.8420 8.1612 8.1646 8.1812 8.1880 8.2030 8.2124 13.3371 13.3859 13.6194 13.6207 13.7403 13.7667 17.0958 17.1302 k =-0.5000 0.4976 0.3556 ( 2452 PWs) bands (ev): -46.2542 -46.2542 -23.9577 -23.9544 -21.9525 -21.9509 -21.8835 -21.8765 -18.9364 -18.9364 -7.6552 -7.5972 -7.4916 -7.4365 -7.3861 -7.3816 -2.8801 -2.8576 -2.6388 -2.6295 -2.6173 -2.6041 3.2903 3.2909 3.4802 3.4840 4.1880 4.1898 4.4670 4.4696 4.6286 4.6294 4.8772 4.8929 8.1324 8.1343 8.1574 8.1630 8.1967 8.2033 13.2983 13.3484 13.5802 13.5809 13.7336 13.7589 17.0959 17.1281 k =-0.5000 0.4976 0.3429 ( 2448 PWs) bands (ev): -46.2543 -46.2543 -23.9568 -23.9533 -21.9526 -21.9510 -21.8802 -21.8729 -18.9369 -18.9369 -7.6844 -7.6297 -7.4994 -7.4484 -7.3887 -7.3848 -2.8725 -2.8488 -2.6305 -2.6215 -2.6089 -2.5942 3.2894 3.2900 3.5020 3.5060 4.2253 4.2277 4.4519 4.4549 4.6532 4.6540 4.9327 4.9499 8.1001 8.1013 8.1276 8.1316 8.1946 8.1989 13.2585 13.3099 13.5382 13.5382 13.7283 13.7523 17.0955 17.1255 k =-0.5000 0.4976 0.3302 ( 2448 PWs) bands (ev): -46.2544 -46.2544 -23.9558 -23.9522 -21.9527 -21.9511 -21.8768 -21.8692 -18.9375 -18.9375 -7.7168 -7.6659 -7.5051 -7.4590 -7.3914 -7.3880 -2.8644 -2.8397 -2.6218 -2.6132 -2.5999 -2.5838 3.2884 3.2891 3.5215 3.5255 4.2626 4.2654 4.4390 4.4427 4.6796 4.6803 4.9947 5.0134 8.0649 8.0657 8.0941 8.0972 8.1930 8.1961 13.2184 13.2709 13.4937 13.4945 13.7237 13.7463 17.0938 17.1215 k =-0.5000 0.4976 0.3175 ( 2446 PWs) bands (ev): -46.2544 -46.2544 -23.9548 -23.9510 -21.9529 -21.9512 -21.8731 -21.8654 -18.9381 -18.9381 -7.7516 -7.7048 -7.5098 -7.4682 -7.3941 -7.3913 -2.8558 -2.8303 -2.6127 -2.6045 -2.5905 -2.5729 3.2874 3.2881 3.5385 3.5426 4.2952 4.2977 4.4322 4.4374 4.7077 4.7085 5.0634 5.0834 8.0273 8.0278 8.0578 8.0605 8.1916 8.1940 13.1782 13.2317 13.4482 13.4496 13.7194 13.7407 17.0899 17.1151 k =-0.5000 0.4976 0.3048 ( 2444 PWs) bands (ev): -46.2545 -46.2545 -23.9537 -23.9499 -21.9530 -21.9514 -21.8693 -21.8614 -18.9386 -18.9386 -7.7886 -7.7453 -7.5138 -7.4765 -7.3970 -7.3945 -2.8469 -2.8207 -2.6032 -2.5956 -2.5806 -2.5618 3.2864 3.2871 3.5531 3.5572 4.3147 4.3163 4.4397 4.4468 4.7376 4.7383 5.1389 5.1599 7.9873 7.9875 8.0191 8.0214 8.1901 8.1921 13.1384 13.1928 13.4021 13.4041 13.7152 13.7353 17.0825 17.1048 k =-0.5000 0.4976 0.2921 ( 2436 PWs) bands (ev): -46.2545 -46.2545 -23.9526 -23.9486 -21.9531 -21.9515 -21.8653 -21.8573 -18.9392 -18.9392 -7.8270 -7.7871 -7.5175 -7.4839 -7.4000 -7.3977 -2.8376 -2.8109 -2.5935 -2.5865 -2.5703 -2.5503 3.2854 3.2861 3.5656 3.5696 4.3158 4.3168 4.4662 4.4749 4.7690 4.7698 5.2209 5.2429 7.9450 7.9451 7.9782 7.9803 8.1887 8.1903 13.0993 13.1546 13.3559 13.3585 13.7110 13.7300 17.0700 17.0892 k =-0.5000 0.4976 0.2794 ( 2436 PWs) bands (ev): -46.2546 -46.2546 -23.9514 -23.9474 -21.9533 -21.9517 -21.8612 -21.8531 -18.9398 -18.9398 -7.8666 -7.8296 -7.5209 -7.4906 -7.4030 -7.4010 -2.8281 -2.8010 -2.5835 -2.5772 -2.5596 -2.5386 3.2844 3.2851 3.5761 3.5800 4.3046 4.3054 4.5053 4.5150 4.8021 4.8028 5.3091 5.3318 7.9004 7.9007 7.9352 7.9372 8.1873 8.1886 13.0614 13.1174 13.3100 13.3131 13.7069 13.7248 17.0507 17.0662 k =-0.5000 0.4976 0.2667 ( 2436 PWs) bands (ev): -46.2547 -46.2547 -23.9503 -23.9462 -21.9534 -21.9519 -21.8570 -21.8489 -18.9405 -18.9405 -7.9068 -7.8725 -7.5242 -7.4967 -7.4060 -7.4043 -2.8184 -2.7911 -2.5735 -2.5678 -2.5486 -2.5268 3.2833 3.2841 3.5849 3.5887 4.2876 4.2884 4.5503 4.5607 4.8366 4.8373 5.4030 5.4261 7.8539 7.8544 7.8903 7.8922 8.1859 8.1870 13.0248 13.0815 13.2647 13.2683 13.7028 13.7197 17.0228 17.0342 k =-0.5000 0.4976 0.2540 ( 2432 PWs) bands (ev): -46.2547 -46.2547 -23.9491 -23.9450 -21.9536 -21.9522 -21.8527 -21.8446 -18.9411 -18.9411 -7.9473 -7.9153 -7.5273 -7.5024 -7.4091 -7.4075 -2.8085 -2.7813 -2.5634 -2.5584 -2.5373 -2.5148 3.2823 3.2831 3.5923 3.5958 4.2679 4.2689 4.5979 4.6087 4.8725 4.8732 5.5019 5.5251 7.8055 7.8063 7.8437 7.8455 8.1845 8.1854 12.9900 13.0473 13.2204 13.2244 13.6987 13.7147 16.9846 16.9913 k =-0.5000 0.4976 0.2413 ( 2440 PWs) bands (ev): -46.2549 -46.2549 -23.9479 -23.9439 -21.9538 -21.9524 -21.8484 -21.8404 -18.9417 -18.9417 -7.9877 -7.9579 -7.5304 -7.5078 -7.4121 -7.4107 -2.7985 -2.7715 -2.5533 -2.5489 -2.5259 -2.5029 3.2813 3.2820 3.5983 3.6017 4.2471 4.2480 4.6467 4.6578 4.9097 4.9104 5.6049 5.6281 7.7555 7.7566 7.7956 7.7973 8.1830 8.1839 12.9572 13.0149 13.1772 13.1816 13.6946 13.7096 16.9345 16.9363 k =-0.5000 0.4976 0.2286 ( 2436 PWs) bands (ev): -46.2550 -46.2550 -23.9467 -23.9427 -21.9539 -21.9526 -21.8441 -21.8362 -18.9423 -18.9423 -8.0277 -8.0000 -7.5333 -7.5127 -7.4151 -7.4139 -2.7885 -2.7619 -2.5433 -2.5396 -2.5142 -2.4911 3.2803 3.2810 3.6033 3.6065 4.2256 4.2266 4.6962 4.7075 4.9481 4.9487 5.7112 5.7342 7.7041 7.7053 7.7461 7.7477 8.1816 8.1824 12.9267 12.9847 13.1354 13.1401 13.6906 13.7048 16.8688 16.8721 k =-0.5000 0.4976 0.2159 ( 2436 PWs) bands (ev): -46.2551 -46.2551 -23.9455 -23.9416 -21.9541 -21.9528 -21.8398 -21.8320 -18.9429 -18.9429 -8.0670 -8.0412 -7.5362 -7.5174 -7.4181 -7.4170 -2.7785 -2.7524 -2.5335 -2.5303 -2.5025 -2.4794 3.2793 3.2800 3.6073 3.6103 4.2040 4.2050 4.7459 4.7573 4.9876 4.9881 5.8200 5.8425 7.6514 7.6529 7.6955 7.6971 8.1803 8.1809 12.8987 12.9569 13.0952 13.1003 13.6866 13.6999 16.7893 16.7976 k =-0.5000 0.4976 0.2032 ( 2440 PWs) bands (ev): -46.2553 -46.2553 -23.9443 -23.9405 -21.9543 -21.9531 -21.8355 -21.8280 -18.9436 -18.9436 -8.1055 -8.0814 -7.5389 -7.5219 -7.4210 -7.4200 -2.7686 -2.7433 -2.5240 -2.5212 -2.4909 -2.4679 3.2784 3.2791 3.6105 3.6134 4.1825 4.1835 4.7957 4.8070 5.0279 5.0284 5.9300 5.9519 7.5977 7.5995 7.6440 7.6455 8.1789 8.1795 12.8733 12.9316 13.0568 13.0623 13.6826 13.6952 16.6992 16.7120 k =-0.5000 0.4976 0.1905 ( 2440 PWs) bands (ev): -46.2554 -46.2554 -23.9432 -23.9395 -21.9544 -21.9533 -21.8313 -21.8240 -18.9441 -18.9441 -8.1427 -8.1203 -7.5415 -7.5261 -7.4239 -7.4230 -2.7589 -2.7344 -2.5147 -2.5123 -2.4792 -2.4567 3.2775 3.2781 3.6131 3.6158 4.1613 4.1623 4.8454 4.8566 5.0689 5.0694 6.0405 6.0617 7.5434 7.5454 7.5918 7.5933 8.1776 8.1781 12.8507 12.9088 13.0204 13.0262 13.6788 13.6905 16.6003 16.6171 k =-0.5000 0.4976 0.1778 ( 2442 PWs) bands (ev): -46.2555 -46.2555 -23.9421 -23.9385 -21.9546 -21.9535 -21.8272 -21.8202 -18.9447 -18.9447 -8.1785 -8.1578 -7.5441 -7.5300 -7.4266 -7.4258 -2.7495 -2.7259 -2.5057 -2.5037 -2.4678 -2.4459 3.2766 3.2772 3.6151 3.6176 4.1407 4.1417 4.8949 4.9059 5.1105 5.1109 6.1504 6.1707 7.4887 7.4908 7.5394 7.5408 8.1763 8.1768 12.8309 12.8886 12.9864 12.9924 13.6750 13.6860 16.4949 16.5151 k =-0.5000 0.4976 0.1651 ( 2434 PWs) bands (ev): -46.2555 -46.2555 -23.9410 -23.9375 -21.9547 -21.9538 -21.8232 -21.8165 -18.9452 -18.9452 -8.2126 -8.1935 -7.5464 -7.5337 -7.4292 -7.4285 -2.7403 -2.7178 -2.4972 -2.4955 -2.4566 -2.4354 3.2758 3.2763 3.6166 3.6190 4.1209 4.1218 4.9439 4.9546 5.1523 5.1527 6.2587 6.2780 7.4339 7.4363 7.4869 7.4883 8.1751 8.1755 12.8140 12.8709 12.9549 12.9610 13.6715 13.6817 16.3851 16.4081 k =-0.5000 0.4976 0.1524 ( 2430 PWs) bands (ev): -46.2555 -46.2555 -23.9399 -23.9366 -21.9549 -21.9540 -21.8193 -21.8130 -18.9458 -18.9458 -8.2449 -8.2274 -7.5487 -7.5372 -7.4317 -7.4311 -2.7314 -2.7102 -2.4890 -2.4876 -2.4457 -2.4256 3.2750 3.2755 3.6178 3.6199 4.1019 4.1028 4.9922 5.0026 5.1940 5.1944 6.3644 6.3826 7.3796 7.3820 7.4348 7.4361 8.1740 8.1743 12.7999 12.8553 12.9263 12.9322 13.6681 13.6776 16.2732 16.2981 k =-0.5000 0.4976 0.1397 ( 2426 PWs) bands (ev): -46.2555 -46.2555 -23.9389 -23.9358 -21.9550 -21.9542 -21.8156 -21.8097 -18.9462 -18.9462 -8.2752 -8.2592 -7.5507 -7.5404 -7.4341 -7.4335 -2.7229 -2.7031 -2.4813 -2.4802 -2.4353 -2.4163 3.2743 3.2748 3.6186 3.6206 4.0839 4.0848 5.0397 5.0496 5.2355 5.2358 6.4665 6.4836 7.3260 7.3285 7.3835 7.3847 8.1729 8.1732 12.7882 12.8412 12.9014 12.9063 13.6649 13.6737 16.1611 16.1874 k =-0.5000 0.4976 0.1270 ( 2434 PWs) bands (ev): -46.2557 -46.2557 -23.9379 -23.9351 -21.9551 -21.9544 -21.8122 -21.8067 -18.9467 -18.9467 -8.3034 -8.2889 -7.5526 -7.5434 -7.4363 -7.4358 -2.7149 -2.6966 -2.4742 -2.4732 -2.4254 -2.4077 3.2736 3.2740 3.6191 3.6210 4.0671 4.0678 5.0858 5.0953 5.2762 5.2765 6.5639 6.5798 7.2738 7.2762 7.3335 7.3346 8.1719 8.1721 12.7787 12.8275 12.8810 12.8836 13.6619 13.6700 16.0507 16.0778 k =-0.5000 0.4976 0.1143 ( 2430 PWs) bands (ev): -46.2557 -46.2557 -23.9370 -23.9344 -21.9553 -21.9546 -21.8089 -21.8039 -18.9471 -18.9471 -8.3292 -8.3162 -7.5544 -7.5462 -7.4383 -7.4379 -2.7074 -2.6907 -2.4676 -2.4668 -2.4161 -2.3997 3.2729 3.2734 3.6195 3.6212 4.0515 4.0522 5.1304 5.1393 5.3158 5.3160 6.6558 6.6704 7.2234 7.2257 7.2852 7.2862 8.1709 8.1711 12.7708 12.8132 12.8647 12.8662 13.6591 13.6665 15.9441 15.9711 k =-0.5000 0.4976 0.1016 ( 2434 PWs) bands (ev): -46.2559 -46.2559 -23.9362 -23.9339 -21.9554 -21.9548 -21.8059 -21.8014 -18.9475 -18.9475 -8.3526 -8.3411 -7.5559 -7.5488 -7.4401 -7.4398 -2.7005 -2.6854 -2.4615 -2.4609 -2.4074 -2.3926 3.2724 3.2728 3.6197 3.6212 4.0373 4.0379 5.1729 5.1812 5.3538 5.3540 6.7410 6.7545 7.1755 7.1776 7.2392 7.2402 8.1701 8.1703 12.7636 12.7980 12.8501 12.8568 13.6567 13.6633 15.8426 15.8691 k =-0.5000 0.4976 0.0889 ( 2440 PWs) bands (ev): -46.2560 -46.2560 -23.9355 -23.9334 -21.9555 -21.9549 -21.8032 -21.7992 -18.9479 -18.9479 -8.3735 -8.3634 -7.5572 -7.5511 -7.4418 -7.4415 -2.6942 -2.6808 -2.4562 -2.4557 -2.3995 -2.3863 3.2719 3.2722 3.6198 3.6211 4.0245 4.0251 5.2127 5.2203 5.3896 5.3897 6.8187 6.8310 7.1308 7.1324 7.1962 7.1970 8.1693 8.1695 12.7565 12.7827 12.8402 12.8517 13.6545 13.6604 15.7483 15.7735 k =-0.5000 0.4976 0.0762 ( 2444 PWs) bands (ev): -46.2561 -46.2561 -23.9348 -23.9329 -21.9555 -21.9551 -21.8007 -21.7973 -18.9482 -18.9482 -8.3917 -8.3830 -7.5583 -7.5531 -7.4432 -7.4430 -2.6885 -2.6769 -2.4514 -2.4511 -2.3923 -2.3808 3.2714 3.2717 3.6198 3.6209 4.0133 4.0138 5.2494 5.2561 5.4226 5.4227 6.8878 6.8991 7.0902 7.0911 7.1569 7.1576 8.1687 8.1688 12.7492 12.7684 12.8348 12.8495 13.6526 13.6578 15.6628 15.6860 k =-0.5000 0.4976 0.0635 ( 2448 PWs) bands (ev): -46.2562 -46.2562 -23.9341 -23.9326 -21.9556 -21.9552 -21.7986 -21.7957 -18.9485 -18.9485 -8.4071 -8.3999 -7.5592 -7.5549 -7.4445 -7.4443 -2.6834 -2.6737 -2.4474 -2.4471 -2.3860 -2.3763 3.2711 3.2713 3.6197 3.6207 4.0037 4.0041 5.2821 5.2880 5.4521 5.4522 6.9469 6.9579 7.0543 7.0550 7.1220 7.1226 8.1681 8.1682 12.7419 12.7557 12.8334 12.8491 13.6511 13.6554 15.5875 15.6082 k =-0.5000 0.4976 0.0508 ( 2448 PWs) bands (ev): -46.2563 -46.2562 -23.9336 -23.9324 -21.9556 -21.9553 -21.7968 -21.7944 -18.9487 -18.9487 -8.4197 -8.4139 -7.5599 -7.5565 -7.4455 -7.4453 -2.6790 -2.6712 -2.4440 -2.4438 -2.3806 -2.3728 3.2708 3.2710 3.6196 3.6204 3.9958 3.9961 5.3104 5.3152 5.4776 5.4776 6.9902 7.0052 7.0241 7.0307 7.0925 7.0929 8.1676 8.1677 12.7352 12.7448 12.8348 12.8496 13.6499 13.6534 15.5241 15.5416 k =-0.5000 0.4976 0.0381 ( 2452 PWs) bands (ev): -46.2563 -46.2563 -23.9331 -23.9322 -21.9557 -21.9554 -21.7952 -21.7935 -18.9488 -18.9488 -8.4293 -8.4250 -7.5604 -7.5578 -7.4463 -7.4462 -2.6754 -2.6695 -2.4414 -2.4413 -2.3761 -2.3702 3.2705 3.2707 3.6196 3.6202 3.9896 3.9898 5.3334 5.3371 5.4982 5.4983 6.9896 6.9958 7.0436 7.0440 7.0709 7.0713 8.1672 8.1673 12.7296 12.7361 12.8377 12.8501 13.6491 13.6518 15.4738 15.4875 k =-0.5000 0.4976 0.0254 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9328 -23.9321 -21.9557 -21.9555 -21.7941 -21.7929 -18.9490 -18.9490 -8.4361 -8.4332 -7.5605 -7.5588 -7.4468 -7.4468 -2.6725 -2.6685 -2.4395 -2.4394 -2.3725 -2.3686 3.2704 3.2705 3.6196 3.6200 3.9851 3.9853 5.3506 5.3531 5.5135 5.5135 6.9741 6.9769 7.0459 7.0464 7.0771 7.0788 8.1670 8.1670 12.7256 12.7296 12.8414 12.8502 13.6486 13.6504 15.4378 15.4472 k =-0.5000 0.4976 0.0127 ( 2444 PWs) bands (ev): -46.2563 -46.2563 -23.9325 -23.9322 -21.9557 -21.9556 -21.7932 -21.7926 -18.9490 -18.9490 -8.4399 -8.4384 -7.5605 -7.5596 -7.4472 -7.4471 -2.6703 -2.6683 -2.4384 -2.4383 -2.3700 -2.3680 3.2703 3.2703 3.6196 3.6198 3.9824 3.9825 5.3614 5.3626 5.5229 5.5229 6.9638 6.9651 7.0366 7.0368 7.0929 7.0939 8.1668 8.1669 12.7234 12.7254 12.8449 12.8495 13.6485 13.6494 15.4169 15.4216 k =-0.5000 0.4976-0.0000 ( 2448 PWs) bands (ev): -46.2563 -46.2563 -23.9323 -23.9323 -21.9556 -21.9556 -21.7927 -21.7927 -18.9491 -18.9491 -8.4406 -8.4406 -7.5602 -7.5602 -7.4473 -7.4473 -2.6690 -2.6690 -2.4380 -2.4380 -2.3685 -2.3685 3.2703 3.2703 3.6197 3.6197 3.9816 3.9816 5.3654 5.3654 5.5260 5.5260 6.9607 6.9607 7.0332 7.0332 7.0988 7.0988 8.1668 8.1668 12.7233 12.7233 12.8477 12.8477 13.6488 13.6488 15.4114 15.4114 k = 0.0000 0.0000 0.5080 ( 2436 PWs) bands (ev): -46.2577 -46.2577 -23.9059 -23.9059 -21.8737 -21.8737 -21.8114 -21.8114 -18.9550 -18.9550 -8.7039 -8.7039 -8.2614 -8.2614 -7.3440 -7.3440 -2.6397 -2.6397 -2.4023 -2.4023 -2.3391 -2.3391 3.3945 3.3945 5.7294 5.7294 5.7730 5.7730 6.2170 6.2170 6.3109 6.3109 6.3946 6.3946 6.8146 6.8146 6.8328 6.8328 7.2016 7.2016 11.0054 11.0054 12.6169 12.6169 12.9180 12.9180 14.1376 14.1376 k =-0.0091 0.0090 0.5080 ( 2434 PWs) bands (ev): -46.2577 -46.2577 -23.9059 -23.9059 -21.8737 -21.8737 -21.8115 -21.8115 -18.9550 -18.9550 -8.7030 -8.7030 -8.2608 -8.2608 -7.3441 -7.3441 -2.6397 -2.6397 -2.4023 -2.4023 -2.3393 -2.3393 3.3944 3.3944 5.7258 5.7258 5.7659 5.7659 6.2152 6.2152 6.3082 6.3082 6.4021 6.4021 6.8179 6.8179 6.8315 6.8315 7.1998 7.1998 11.0079 11.0079 12.6173 12.6173 12.9185 12.9185 14.1424 14.1424 k =-0.0182 0.0181 0.5080 ( 2426 PWs) bands (ev): -46.2576 -46.2576 -23.9060 -23.9060 -21.8738 -21.8738 -21.8118 -21.8118 -18.9550 -18.9550 -8.7003 -8.7003 -8.2589 -8.2589 -7.3443 -7.3443 -2.6399 -2.6399 -2.4023 -2.4023 -2.3399 -2.3399 3.3943 3.3943 5.7143 5.7143 5.7464 5.7464 6.2097 6.2097 6.3003 6.3003 6.4235 6.4235 6.8241 6.8241 6.8309 6.8309 7.1943 7.1943 11.0156 11.0156 12.6187 12.6187 12.9200 12.9200 14.1570 14.1570 k =-0.0273 0.0271 0.5080 ( 2434 PWs) bands (ev): -46.2577 -46.2577 -23.9063 -23.9063 -21.8740 -21.8740 -21.8123 -21.8123 -18.9549 -18.9549 -8.6958 -8.6958 -8.2558 -8.2558 -7.3447 -7.3447 -2.6402 -2.6402 -2.4024 -2.4024 -2.3408 -2.3408 3.3940 3.3940 5.6925 5.6925 5.7199 5.7199 6.2000 6.2000 6.2876 6.2876 6.4565 6.4565 6.8176 6.8176 6.8462 6.8462 7.1854 7.1854 11.0281 11.0281 12.6210 12.6210 12.9225 12.9225 14.1809 14.1809 k =-0.0364 0.0362 0.5080 ( 2442 PWs) bands (ev): -46.2578 -46.2578 -23.9066 -23.9066 -21.8742 -21.8742 -21.8131 -21.8131 -18.9548 -18.9548 -8.6896 -8.6896 -8.2515 -8.2515 -7.3452 -7.3452 -2.6406 -2.6406 -2.4025 -2.4025 -2.3421 -2.3421 3.3937 3.3937 5.6570 5.6570 5.6934 5.6934 6.1854 6.1854 6.2708 6.2708 6.4979 6.4979 6.8063 6.8063 6.8687 6.8687 7.1738 7.1738 11.0457 11.0457 12.6241 12.6241 12.9261 12.9261 14.2142 14.2142 k =-0.0455 0.0452 0.5080 ( 2446 PWs) bands (ev): -46.2578 -46.2578 -23.9070 -23.9070 -21.8745 -21.8745 -21.8141 -21.8141 -18.9547 -18.9547 -8.6815 -8.6815 -8.2460 -8.2460 -7.3459 -7.3459 -2.6412 -2.6412 -2.4026 -2.4026 -2.3437 -2.3437 3.3932 3.3932 5.6115 5.6115 5.6665 5.6665 6.1651 6.1651 6.2507 6.2507 6.5453 6.5453 6.7911 6.7911 6.8966 6.8966 7.1600 7.1600 11.0681 11.0681 12.6283 12.6283 12.9307 12.9307 14.2564 14.2564 k =-0.0545 0.0543 0.5080 ( 2448 PWs) bands (ev): -46.2578 -46.2578 -23.9075 -23.9075 -21.8749 -21.8749 -21.8152 -21.8152 -18.9546 -18.9546 -8.6717 -8.6717 -8.2393 -8.2393 -7.3467 -7.3467 -2.6420 -2.6420 -2.4029 -2.4029 -2.3456 -2.3456 3.3927 3.3927 5.5606 5.5606 5.6372 5.6372 6.1387 6.1387 6.2278 6.2278 6.5968 6.5968 6.7719 6.7719 6.9290 6.9290 7.1449 7.1449 11.0953 11.0953 12.6334 12.6334 12.9364 12.9364 14.3073 14.3073 k =-0.0636 0.0633 0.5080 ( 2448 PWs) bands (ev): -46.2578 -46.2578 -23.9081 -23.9081 -21.8753 -21.8753 -21.8166 -21.8166 -18.9544 -18.9544 -8.6602 -8.6602 -8.2314 -8.2314 -7.3476 -7.3476 -2.6430 -2.6430 -2.4032 -2.4032 -2.3479 -2.3479 3.3921 3.3921 5.5066 5.5066 5.6054 5.6054 6.1062 6.1062 6.2019 6.2019 6.6507 6.6507 6.7486 6.7486 6.9652 6.9652 7.1293 7.1293 11.1271 11.1271 12.6395 12.6395 12.9431 12.9431 14.3664 14.3664 k =-0.0727 0.0724 0.5080 ( 2448 PWs) bands (ev): -46.2577 -46.2577 -23.9088 -23.9088 -21.8757 -21.8757 -21.8182 -21.8182 -18.9542 -18.9542 -8.6470 -8.6470 -8.2224 -8.2224 -7.3486 -7.3486 -2.6442 -2.6442 -2.4037 -2.4037 -2.3503 -2.3503 3.3914 3.3914 5.4510 5.4510 5.5714 5.5714 6.0683 6.0683 6.1724 6.1724 6.7046 6.7046 6.7227 6.7227 7.0046 7.0046 7.1144 7.1144 11.1633 11.1633 12.6466 12.6466 12.9510 12.9510 14.4334 14.4334 k =-0.0818 0.0814 0.5080 ( 2452 PWs) bands (ev): -46.2577 -46.2577 -23.9095 -23.9095 -21.8763 -21.8763 -21.8199 -21.8199 -18.9539 -18.9539 -8.6321 -8.6321 -8.2122 -8.2122 -7.3497 -7.3497 -2.6457 -2.6457 -2.4045 -2.4045 -2.3530 -2.3530 3.3906 3.3906 5.3946 5.3946 5.5356 5.5356 6.0257 6.0257 6.1386 6.1386 6.6878 6.6878 6.7638 6.7638 7.0464 7.0464 7.1010 7.1010 11.2038 11.2038 12.6547 12.6547 12.9599 12.9599 14.5077 14.5077 k =-0.0909 0.0905 0.5080 ( 2456 PWs) bands (ev): -46.2577 -46.2577 -23.9103 -23.9103 -21.8769 -21.8769 -21.8218 -21.8218 -18.9537 -18.9537 -8.6156 -8.6156 -8.2008 -8.2008 -7.3509 -7.3509 -2.6475 -2.6475 -2.4055 -2.4055 -2.3558 -2.3558 3.3897 3.3897 5.3380 5.3380 5.4984 5.4984 5.9792 5.9792 6.0997 6.0998 6.6514 6.6514 6.8205 6.8205 7.0890 7.0890 7.0913 7.0913 11.2484 11.2484 12.6640 12.6640 12.9699 12.9699 14.5887 14.5887 k =-0.1000 0.0995 0.5080 ( 2452 PWs) bands (ev): -46.2576 -46.2576 -23.9112 -23.9112 -21.8776 -21.8776 -21.8239 -21.8239 -18.9534 -18.9534 -8.5975 -8.5975 -8.1884 -8.1884 -7.3521 -7.3521 -2.6497 -2.6497 -2.4070 -2.4070 -2.3587 -2.3587 3.3887 3.3887 5.2818 5.2818 5.4603 5.4603 5.9294 5.9294 6.0554 6.0554 6.6104 6.6104 6.8773 6.8773 7.0822 7.0822 7.1357 7.1357 11.2969 11.2969 12.6743 12.6743 12.9811 12.9811 14.6761 14.6761 k =-0.1091 0.1086 0.5080 ( 2460 PWs) bands (ev): -46.2576 -46.2576 -23.9122 -23.9122 -21.8783 -21.8783 -21.8262 -21.8262 -18.9531 -18.9531 -8.5778 -8.5778 -8.1750 -8.1750 -7.3533 -7.3533 -2.6522 -2.6522 -2.4089 -2.4089 -2.3616 -2.3616 3.3877 3.3877 5.2264 5.2264 5.4216 5.4216 5.8769 5.8769 6.0053 6.0053 6.5651 6.5651 6.9337 6.9337 7.0782 7.0782 7.1822 7.1822 11.3489 11.3489 12.6858 12.6858 12.9934 12.9934 14.7691 14.7691 k =-0.1182 0.1176 0.5080 ( 2460 PWs) bands (ev): -46.2575 -46.2575 -23.9133 -23.9133 -21.8791 -21.8791 -21.8286 -21.8286 -18.9528 -18.9528 -8.5567 -8.5567 -8.1605 -8.1605 -7.3546 -7.3546 -2.6551 -2.6551 -2.4114 -2.4114 -2.3645 -2.3645 3.3866 3.3866 5.1721 5.1721 5.3826 5.3826 5.8221 5.8221 5.9495 5.9495 6.5156 6.5156 6.9895 6.9895 7.0783 7.0783 7.2295 7.2295 11.4043 11.4043 12.6983 12.6983 13.0068 13.0068 14.8674 14.8674 k =-0.1273 0.1267 0.5080 ( 2456 PWs) bands (ev): -46.2574 -46.2574 -23.9144 -23.9144 -21.8799 -21.8799 -21.8312 -21.8312 -18.9524 -18.9524 -8.5341 -8.5341 -8.1450 -8.1450 -7.3558 -7.3558 -2.6584 -2.6584 -2.4146 -2.4146 -2.3673 -2.3673 3.3854 3.3854 5.1192 5.1192 5.3434 5.3434 5.7654 5.7655 5.8884 5.8884 6.4623 6.4623 7.0436 7.0436 7.0834 7.0834 7.2772 7.2772 11.4627 11.4627 12.7121 12.7121 13.0215 13.0215 14.9704 14.9704 k =-0.1364 0.1357 0.5080 ( 2460 PWs) bands (ev): -46.2574 -46.2574 -23.9156 -23.9156 -21.8808 -21.8808 -21.8339 -21.8339 -18.9520 -18.9520 -8.5101 -8.5101 -8.1285 -8.1285 -7.3570 -7.3570 -2.6621 -2.6621 -2.4184 -2.4184 -2.3701 -2.3701 3.3842 3.3842 5.0679 5.0679 5.3044 5.3044 5.7071 5.7072 5.8223 5.8224 6.4053 6.4053 7.0836 7.0836 7.1058 7.1058 7.3252 7.3252 11.5238 11.5238 12.7270 12.7270 13.0373 13.0373 15.0773 15.0773 k =-0.1455 0.1448 0.5080 ( 2466 PWs) bands (ev): -46.2573 -46.2573 -23.9168 -23.9168 -21.8818 -21.8818 -21.8367 -21.8367 -18.9516 -18.9516 -8.4847 -8.4847 -8.1111 -8.1111 -7.3582 -7.3582 -2.6662 -2.6662 -2.4229 -2.4229 -2.3729 -2.3729 3.3829 3.3829 5.0185 5.0185 5.2656 5.2656 5.6473 5.6474 5.7521 5.7521 6.3450 6.3450 7.0988 7.0988 7.1560 7.1560 7.3731 7.3731 11.5875 11.5875 12.7431 12.7431 13.0543 13.0543 15.1878 15.1878 k =-0.1545 0.1538 0.5080 ( 2462 PWs) bands (ev): -46.2572 -46.2572 -23.9181 -23.9181 -21.8828 -21.8828 -21.8396 -21.8396 -18.9511 -18.9511 -8.4582 -8.4582 -8.0929 -8.0929 -7.3592 -7.3592 -2.6707 -2.6707 -2.4281 -2.4281 -2.3757 -2.3757 3.3815 3.3815 4.9710 4.9710 5.2272 5.2272 5.5860 5.5860 5.6786 5.6786 6.2818 6.2818 7.1146 7.1146 7.2082 7.2082 7.4209 7.4209 11.6534 11.6534 12.7604 12.7604 13.0724 13.0724 15.3013 15.3013 k =-0.1636 0.1629 0.5080 ( 2454 PWs) bands (ev): -46.2570 -46.2570 -23.9195 -23.9195 -21.8839 -21.8839 -21.8425 -21.8425 -18.9507 -18.9507 -8.4304 -8.4304 -8.0738 -8.0738 -7.3602 -7.3602 -2.6757 -2.6757 -2.4340 -2.4340 -2.3786 -2.3786 3.3801 3.3801 4.9257 4.9257 5.1894 5.1894 5.5227 5.5227 5.6029 5.6029 6.2160 6.2160 7.1333 7.1333 7.2597 7.2597 7.4682 7.4682 11.7213 11.7213 12.7789 12.7789 13.0918 13.0918 15.4172 15.4172 k =-0.1727 0.1719 0.5080 ( 2454 PWs) bands (ev): -46.2569 -46.2569 -23.9209 -23.9209 -21.8851 -21.8851 -21.8456 -21.8456 -18.9502 -18.9502 -8.4015 -8.4015 -8.0539 -8.0539 -7.3611 -7.3611 -2.6810 -2.6810 -2.4404 -2.4404 -2.3817 -2.3817 3.3786 3.3786 4.8827 4.8827 5.1522 5.1522 5.4565 5.4565 5.5268 5.5269 6.1480 6.1480 7.1550 7.1550 7.3102 7.3102 7.5149 7.5149 11.7909 11.7909 12.7985 12.7985 13.1122 13.1122 15.5350 15.5350 k =-0.1818 0.1810 0.5080 ( 2454 PWs) bands (ev): -46.2568 -46.2568 -23.9223 -23.9223 -21.8863 -21.8863 -21.8487 -21.8487 -18.9497 -18.9497 -8.3716 -8.3716 -8.0333 -8.0333 -7.3618 -7.3618 -2.6867 -2.6867 -2.4473 -2.4473 -2.3852 -2.3852 3.3771 3.3771 4.8421 4.8421 5.1157 5.1157 5.3857 5.3857 5.4528 5.4528 6.0781 6.0781 7.1793 7.1793 7.3596 7.3596 7.5609 7.5609 11.8619 11.8619 12.8193 12.8193 13.1338 13.1338 15.6541 15.6541 k =-0.1909 0.1900 0.5080 ( 2454 PWs) bands (ev): -46.2566 -46.2566 -23.9238 -23.9238 -21.8876 -21.8876 -21.8518 -21.8518 -18.9491 -18.9491 -8.3407 -8.3407 -8.0121 -8.0121 -7.3624 -7.3624 -2.6928 -2.6928 -2.4547 -2.4547 -2.3891 -2.3891 3.3755 3.3755 4.8040 4.8040 5.0801 5.0801 5.3090 5.3091 5.3826 5.3827 6.0068 6.0068 7.2061 7.2061 7.4080 7.4080 7.6061 7.6061 11.9340 11.9340 12.8413 12.8413 13.1565 13.1565 15.7740 15.7740 k =-0.2000 0.1991 0.5080 ( 2450 PWs) bands (ev): -46.2564 -46.2564 -23.9253 -23.9253 -21.8890 -21.8890 -21.8549 -21.8549 -18.9486 -18.9486 -8.3089 -8.3089 -7.9902 -7.9902 -7.3628 -7.3628 -2.6993 -2.6993 -2.4624 -2.4624 -2.3935 -2.3935 3.3738 3.3738 4.7685 4.7685 5.0453 5.0453 5.2271 5.2271 5.3165 5.3165 5.9344 5.9344 7.2351 7.2351 7.4552 7.4552 7.6503 7.6503 12.0071 12.0071 12.8643 12.8643 13.1803 13.1803 15.8940 15.8940 k =-0.2091 0.2081 0.5080 ( 2454 PWs) bands (ev): -46.2564 -46.2564 -23.9269 -23.9269 -21.8905 -21.8905 -21.8581 -21.8581 -18.9480 -18.9480 -8.2764 -8.2764 -7.9678 -7.9677 -7.3630 -7.3630 -2.7061 -2.7061 -2.4706 -2.4706 -2.3984 -2.3984 3.3720 3.3720 4.7355 4.7355 5.0114 5.0114 5.1417 5.1417 5.2530 5.2530 5.8614 5.8614 7.2662 7.2662 7.5013 7.5013 7.6934 7.6934 12.0809 12.0809 12.8883 12.8883 13.2051 13.2051 16.0135 16.0135 k =-0.2182 0.2172 0.5080 ( 2454 PWs) bands (ev): -46.2563 -46.2563 -23.9285 -23.9285 -21.8921 -21.8921 -21.8611 -21.8611 -18.9475 -18.9475 -8.2432 -8.2432 -7.9448 -7.9448 -7.3630 -7.3630 -2.7132 -2.7132 -2.4790 -2.4790 -2.4040 -2.4040 3.3702 3.3702 4.7053 4.7053 4.9784 4.9784 5.0542 5.0542 5.1914 5.1914 5.7881 5.7881 7.2989 7.2989 7.5462 7.5462 7.7354 7.7354 12.1551 12.1551 12.9133 12.9133 13.2308 13.2308 16.1320 16.1320 k =-0.2273 0.2262 0.5080 ( 2458 PWs) bands (ev): -46.2562 -46.2562 -23.9301 -23.9301 -21.8939 -21.8939 -21.8642 -21.8642 -18.9469 -18.9469 -8.2094 -8.2094 -7.9214 -7.9214 -7.3628 -7.3628 -2.7206 -2.7206 -2.4877 -2.4877 -2.4102 -2.4102 3.3682 3.3682 4.6776 4.6776 4.9458 4.9458 4.9663 4.9663 5.1309 5.1309 5.7149 5.7149 7.3332 7.3332 7.5901 7.5901 7.7762 7.7762 12.2296 12.2296 12.9393 12.9393 13.2574 13.2574 16.2486 16.2486 k =-0.2364 0.2352 0.5080 ( 2450 PWs) bands (ev): -46.2560 -46.2560 -23.9316 -23.9316 -21.8957 -21.8957 -21.8671 -21.8671 -18.9463 -18.9463 -8.1752 -8.1752 -7.8977 -7.8977 -7.3625 -7.3625 -2.7283 -2.7283 -2.4966 -2.4966 -2.4171 -2.4171 3.3662 3.3662 4.6526 4.6526 4.8760 4.8760 4.9162 4.9162 5.0714 5.0714 5.6422 5.6422 7.3689 7.3689 7.6328 7.6328 7.8157 7.8157 12.3042 12.3042 12.9662 12.9662 13.2849 13.2849 16.3626 16.3626 k =-0.2455 0.2443 0.5080 ( 2450 PWs) bands (ev): -46.2558 -46.2558 -23.9333 -23.9333 -21.8976 -21.8976 -21.8699 -21.8699 -18.9456 -18.9456 -8.1406 -8.1406 -7.8736 -7.8736 -7.3618 -7.3618 -2.7362 -2.7362 -2.5057 -2.5057 -2.4246 -2.4246 3.3640 3.3640 4.6300 4.6300 4.7876 4.7876 4.8861 4.8861 5.0127 5.0127 5.5704 5.5704 7.4057 7.4057 7.6743 7.6743 7.8539 7.8539 12.3786 12.3786 12.9938 12.9938 13.3131 13.3131 16.4733 16.4733 k =-0.2545 0.2533 0.5080 ( 2446 PWs) bands (ev): -46.2557 -46.2557 -23.9349 -23.9349 -21.8997 -21.8997 -21.8726 -21.8726 -18.9450 -18.9450 -8.1058 -8.1058 -7.8493 -7.8493 -7.3610 -7.3610 -2.7443 -2.7443 -2.5149 -2.5149 -2.4328 -2.4328 3.3617 3.3617 4.6094 4.6094 4.7002 4.7002 4.8572 4.8572 4.9546 4.9546 5.4998 5.4998 7.4435 7.4435 7.7148 7.7148 7.8907 7.8907 12.4527 12.4527 13.0222 13.0222 13.3419 13.3419 16.5796 16.5796 k =-0.2636 0.2624 0.5080 ( 2446 PWs) bands (ev): -46.2555 -46.2555 -23.9365 -23.9365 -21.9020 -21.9020 -21.8751 -21.8751 -18.9444 -18.9444 -8.0708 -8.0708 -7.8248 -7.8248 -7.3599 -7.3599 -2.7526 -2.7526 -2.5242 -2.5242 -2.4417 -2.4417 3.3593 3.3593 4.5864 4.5864 4.6185 4.6185 4.8295 4.8295 4.8971 4.8971 5.4309 5.4309 7.4821 7.4821 7.7542 7.7542 7.9260 7.9260 12.5263 12.5263 13.0513 13.0513 13.3712 13.3712 16.6805 16.6805 k =-0.2727 0.2714 0.5080 ( 2438 PWs) bands (ev): -46.2553 -46.2553 -23.9381 -23.9381 -21.9043 -21.9043 -21.8774 -21.8774 -18.9437 -18.9437 -8.0359 -8.0359 -7.8002 -7.8002 -7.3586 -7.3586 -2.7611 -2.7611 -2.5335 -2.5335 -2.4511 -2.4511 3.3567 3.3567 4.5206 4.5206 4.5833 4.5833 4.8028 4.8028 4.8404 4.8404 5.3638 5.3638 7.5213 7.5213 7.7925 7.7925 7.9600 7.9600 12.5993 12.5993 13.0809 13.0809 13.4010 13.4010 16.7751 16.7751 k =-0.2818 0.2805 0.5080 ( 2430 PWs) bands (ev): -46.2551 -46.2551 -23.9397 -23.9397 -21.9068 -21.9068 -21.8796 -21.8796 -18.9431 -18.9431 -8.0011 -8.0011 -7.7755 -7.7755 -7.3571 -7.3571 -2.7697 -2.7697 -2.5428 -2.5428 -2.4612 -2.4612 3.3538 3.3538 4.4374 4.4374 4.5693 4.5693 4.7769 4.7769 4.7845 4.7845 5.2990 5.2990 7.5610 7.5610 7.8298 7.8298 7.9924 7.9924 12.6713 12.6713 13.1110 13.1110 13.4311 13.4311 16.8622 16.8622 k =-0.2909 0.2895 0.5080 ( 2430 PWs) bands (ev): -46.2550 -46.2550 -23.9412 -23.9412 -21.9094 -21.9094 -21.8816 -21.8816 -18.9424 -18.9424 -7.9666 -7.9666 -7.7509 -7.7509 -7.3553 -7.3553 -2.7784 -2.7784 -2.5521 -2.5521 -2.4718 -2.4718 3.3508 3.3508 4.3546 4.3546 4.5587 4.5587 4.7284 4.7284 4.7531 4.7531 5.2366 5.2366 7.6009 7.6009 7.8659 7.8659 8.0234 8.0234 12.7424 12.7424 13.1414 13.1414 13.4615 13.4615 16.9405 16.9405 k =-0.3000 0.2986 0.5080 ( 2426 PWs) bands (ev): -46.2548 -46.2548 -23.9428 -23.9428 -21.9120 -21.9120 -21.8835 -21.8835 -18.9418 -18.9418 -7.9325 -7.9325 -7.7264 -7.7264 -7.3534 -7.3534 -2.7872 -2.7872 -2.5614 -2.5614 -2.4828 -2.4828 3.3475 3.3475 4.2734 4.2734 4.5506 4.5506 4.6737 4.6737 4.7297 4.7297 5.1769 5.1769 7.6408 7.6408 7.9010 7.9010 8.0529 8.0529 12.8122 12.8122 13.1721 13.1721 13.4918 13.4918 17.0091 17.0091 k =-0.3091 0.3076 0.5080 ( 2422 PWs) bands (ev): -46.2546 -46.2546 -23.9443 -23.9443 -21.9148 -21.9148 -21.8852 -21.8852 -18.9411 -18.9411 -7.8989 -7.8989 -7.7020 -7.7020 -7.3512 -7.3512 -2.7960 -2.7960 -2.5705 -2.5705 -2.4943 -2.4943 3.3439 3.3439 4.1943 4.1943 4.5445 4.5445 4.6199 4.6199 4.7074 4.7074 5.1201 5.1201 7.6807 7.6807 7.9350 7.9350 8.0809 8.0809 12.8807 12.8807 13.2030 13.2030 13.5222 13.5222 17.0672 17.0672 k =-0.3182 0.3167 0.5080 ( 2428 PWs) bands (ev): -46.2546 -46.2546 -23.9458 -23.9458 -21.9175 -21.9175 -21.8868 -21.8868 -18.9405 -18.9405 -7.8661 -7.8661 -7.6779 -7.6779 -7.3488 -7.3488 -2.8049 -2.8049 -2.5795 -2.5795 -2.5061 -2.5061 3.3401 3.3401 4.1175 4.1175 4.5398 4.5398 4.5674 4.5674 4.6863 4.6863 5.0664 5.0664 7.7203 7.7203 7.9679 7.9679 8.1075 8.1075 12.9476 12.9476 13.2338 13.2338 13.5523 13.5523 17.1142 17.1142 k =-0.3273 0.3257 0.5080 ( 2430 PWs) bands (ev): -46.2545 -46.2545 -23.9473 -23.9473 -21.9203 -21.9203 -21.8883 -21.8883 -18.9399 -18.9399 -7.8341 -7.8341 -7.6541 -7.6541 -7.3462 -7.3462 -2.8137 -2.8137 -2.5883 -2.5883 -2.5181 -2.5181 3.3359 3.3359 4.0431 4.0431 4.5138 4.5138 4.5392 4.5392 4.6663 4.6663 5.0157 5.0157 7.7594 7.7594 7.9996 7.9996 8.1325 8.1325 13.0127 13.0127 13.2647 13.2647 13.5821 13.5821 17.1504 17.1504 k =-0.3364 0.3348 0.5080 ( 2430 PWs) bands (ev): -46.2544 -46.2544 -23.9487 -23.9487 -21.9230 -21.9230 -21.8897 -21.8897 -18.9393 -18.9393 -7.8031 -7.8031 -7.6306 -7.6306 -7.3434 -7.3434 -2.8224 -2.8224 -2.5969 -2.5969 -2.5302 -2.5302 3.3314 3.3314 3.9715 3.9715 4.4640 4.4640 4.5378 4.5378 4.6473 4.6473 4.9681 4.9681 7.7979 7.7979 8.0303 8.0303 8.1562 8.1562 13.0759 13.0759 13.2955 13.2955 13.6115 13.6115 17.1760 17.1760 k =-0.3455 0.3438 0.5080 ( 2426 PWs) bands (ev): -46.2543 -46.2543 -23.9501 -23.9501 -21.9257 -21.9257 -21.8909 -21.8909 -18.9387 -18.9387 -7.7732 -7.7732 -7.6076 -7.6076 -7.3405 -7.3405 -2.8311 -2.8311 -2.6053 -2.6053 -2.5423 -2.5423 3.3266 3.3266 3.9027 3.9027 4.4152 4.4152 4.5382 4.5382 4.6294 4.6294 4.9236 4.9236 7.8356 7.8356 8.0597 8.0597 8.1783 8.1783 13.1369 13.1369 13.3262 13.3262 13.6403 13.6403 17.1920 17.1920 k =-0.3545 0.3529 0.5080 ( 2430 PWs) bands (ev): -46.2542 -46.2542 -23.9514 -23.9514 -21.9283 -21.9283 -21.8921 -21.8921 -18.9381 -18.9381 -7.7447 -7.7447 -7.5850 -7.5850 -7.3374 -7.3374 -2.8396 -2.8396 -2.6134 -2.6134 -2.5544 -2.5544 3.3214 3.3214 3.8369 3.8369 4.3682 4.3682 4.5398 4.5398 4.6127 4.6127 4.8822 4.8822 7.8724 7.8724 8.0880 8.0880 8.1991 8.1991 13.1953 13.1953 13.3567 13.3567 13.6683 13.6683 17.1996 17.1996 k =-0.3636 0.3619 0.5080 ( 2430 PWs) bands (ev): -46.2541 -46.2541 -23.9526 -23.9526 -21.9309 -21.9309 -21.8932 -21.8932 -18.9376 -18.9376 -7.7175 -7.7175 -7.5630 -7.5630 -7.3341 -7.3341 -2.8479 -2.8479 -2.6211 -2.6211 -2.5663 -2.5663 3.3159 3.3159 3.7744 3.7744 4.3232 4.3232 4.5425 4.5425 4.5970 4.5970 4.8438 4.8438 7.9080 7.9080 8.1150 8.1150 8.2184 8.2184 13.2509 13.2509 13.3870 13.3870 13.6955 13.6955 17.2003 17.2003 k =-0.3727 0.3710 0.5080 ( 2430 PWs) bands (ev): -46.2540 -46.2540 -23.9538 -23.9538 -21.9333 -21.9333 -21.8942 -21.8942 -18.9371 -18.9371 -7.6919 -7.6919 -7.5417 -7.5417 -7.3308 -7.3308 -2.8560 -2.8560 -2.6285 -2.6285 -2.5779 -2.5779 3.3101 3.3101 3.7151 3.7151 4.2804 4.2804 4.5460 4.5460 4.5823 4.5823 4.8084 4.8084 7.9422 7.9422 8.1407 8.1407 8.2364 8.2364 13.3031 13.3031 13.4173 13.4173 13.7217 13.7217 17.1953 17.1953 k =-0.3818 0.3800 0.5080 ( 2430 PWs) bands (ev): -46.2539 -46.2539 -23.9550 -23.9550 -21.9357 -21.9357 -21.8951 -21.8951 -18.9365 -18.9365 -7.6680 -7.6680 -7.5212 -7.5212 -7.3274 -7.3274 -2.8638 -2.8638 -2.6356 -2.6356 -2.5892 -2.5892 3.3040 3.3040 3.6594 3.6594 4.2402 4.2402 4.5501 4.5501 4.5688 4.5688 4.7759 4.7759 7.9750 7.9750 8.1650 8.1650 8.2530 8.2530 13.3514 13.3514 13.4479 13.4479 13.7468 13.7468 17.1861 17.1861 k =-0.3909 0.3891 0.5080 ( 2426 PWs) bands (ev): -46.2538 -46.2538 -23.9560 -23.9560 -21.9379 -21.9379 -21.8959 -21.8959 -18.9361 -18.9361 -7.6457 -7.6457 -7.5015 -7.5015 -7.3240 -7.3240 -2.8713 -2.8713 -2.6422 -2.6422 -2.5999 -2.5999 3.2976 3.2976 3.6072 3.6072 4.2026 4.2026 4.5540 4.5540 4.5571 4.5571 4.7461 4.7461 8.0062 8.0062 8.1879 8.1879 8.2683 8.2683 13.3950 13.3950 13.4791 13.4791 13.7707 13.7707 17.1737 17.1737 k =-0.4000 0.3981 0.5080 ( 2432 PWs) bands (ev): -46.2538 -46.2538 -23.9570 -23.9570 -21.9400 -21.9400 -21.8967 -21.8967 -18.9356 -18.9356 -7.6253 -7.6253 -7.4827 -7.4827 -7.3205 -7.3205 -2.8785 -2.8785 -2.6485 -2.6485 -2.6102 -2.6102 3.2911 3.2911 3.5588 3.5588 4.1678 4.1678 4.5445 4.5445 4.5600 4.5600 4.7190 4.7190 8.0355 8.0355 8.2093 8.2093 8.2823 8.2823 13.4332 13.4332 13.5114 13.5114 13.7932 13.7932 17.1593 17.1593 k =-0.4091 0.4072 0.5080 ( 2444 PWs) bands (ev): -46.2539 -46.2539 -23.9580 -23.9580 -21.9419 -21.9419 -21.8974 -21.8974 -18.9352 -18.9352 -7.6068 -7.6068 -7.4650 -7.4650 -7.3171 -7.3171 -2.8853 -2.8853 -2.6543 -2.6543 -2.6198 -2.6198 3.2846 3.2846 3.5142 3.5142 4.1360 4.1360 4.5341 4.5341 4.5651 4.5651 4.6946 4.6946 8.0628 8.0628 8.2291 8.2291 8.2950 8.2950 13.4660 13.4660 13.5443 13.5443 13.8143 13.8143 17.1436 17.1436 k =-0.4182 0.4162 0.5080 ( 2448 PWs) bands (ev): -46.2539 -46.2539 -23.9588 -23.9588 -21.9437 -21.9437 -21.8981 -21.8981 -18.9348 -18.9348 -7.5900 -7.5900 -7.4485 -7.4485 -7.3138 -7.3138 -2.8916 -2.8916 -2.6597 -2.6597 -2.6287 -2.6287 3.2780 3.2780 3.4735 3.4735 4.1072 4.1072 4.5246 4.5246 4.5702 4.5702 4.6727 4.6727 8.0880 8.0880 8.2474 8.2474 8.3064 8.3064 13.4939 13.4939 13.5771 13.5771 13.8338 13.8338 17.1276 17.1276 k =-0.4273 0.4253 0.5080 ( 2448 PWs) bands (ev): -46.2538 -46.2538 -23.9596 -23.9596 -21.9453 -21.9453 -21.8986 -21.8986 -18.9345 -18.9345 -7.5752 -7.5752 -7.4334 -7.4334 -7.3106 -7.3106 -2.8973 -2.8973 -2.6646 -2.6646 -2.6368 -2.6368 3.2717 3.2717 3.4368 3.4368 4.0815 4.0815 4.5162 4.5162 4.5751 4.5751 4.6533 4.6533 8.1110 8.1110 8.2639 8.2639 8.3166 8.3166 13.5177 13.5177 13.6087 13.6087 13.8516 13.8516 17.1118 17.1118 k =-0.4364 0.4343 0.5080 ( 2448 PWs) bands (ev): -46.2538 -46.2538 -23.9603 -23.9603 -21.9467 -21.9467 -21.8991 -21.8991 -18.9342 -18.9342 -7.5622 -7.5622 -7.4196 -7.4196 -7.3076 -7.3076 -2.9026 -2.9026 -2.6690 -2.6690 -2.6440 -2.6440 3.2656 3.2656 3.4043 3.4043 4.0589 4.0589 4.5088 4.5088 4.5798 4.5798 4.6363 4.6363 8.1316 8.1316 8.2786 8.2786 8.3256 8.3256 13.5380 13.5380 13.6380 13.6380 13.8676 13.8676 17.0967 17.0967 k =-0.4455 0.4434 0.5080 ( 2448 PWs) bands (ev): -46.2537 -46.2537 -23.9609 -23.9609 -21.9480 -21.9480 -21.8996 -21.8996 -18.9339 -18.9339 -7.5511 -7.5511 -7.4075 -7.4075 -7.3049 -7.3049 -2.9072 -2.9072 -2.6730 -2.6730 -2.6503 -2.6503 3.2600 3.2600 3.3759 3.3759 4.0394 4.0394 4.5023 4.5023 4.5841 4.5841 4.6217 4.6217 8.1497 8.1497 8.2915 8.2915 8.3333 8.3333 13.5554 13.5554 13.6644 13.6644 13.8818 13.8818 17.0828 17.0828 k =-0.4545 0.4524 0.5080 ( 2442 PWs) bands (ev): -46.2536 -46.2536 -23.9613 -23.9613 -21.9490 -21.9490 -21.8999 -21.8999 -18.9337 -18.9337 -7.5417 -7.5417 -7.3970 -7.3970 -7.3024 -7.3024 -2.9112 -2.9112 -2.6764 -2.6764 -2.6556 -2.6556 3.2549 3.2549 3.3518 3.3518 4.0230 4.0230 4.4969 4.4969 4.5878 4.5878 4.6096 4.6096 8.1651 8.1651 8.3025 8.3025 8.3399 8.3399 13.5699 13.5699 13.6872 13.6872 13.8941 13.8941 17.0704 17.0704 k =-0.4636 0.4614 0.5080 ( 2442 PWs) bands (ev): -46.2536 -46.2536 -23.9618 -23.9618 -21.9499 -21.9499 -21.9002 -21.9002 -18.9335 -18.9335 -7.5341 -7.5341 -7.3883 -7.3883 -7.3003 -7.3003 -2.9145 -2.9145 -2.6793 -2.6793 -2.6600 -2.6600 3.2506 3.2506 3.3320 3.3320 4.0097 4.0097 4.4925 4.4925 4.5905 4.5905 4.6001 4.6001 8.1779 8.1779 8.3116 8.3116 8.3453 8.3453 13.5818 13.5818 13.7063 13.7063 13.9042 13.9042 17.0599 17.0599 k =-0.4727 0.4705 0.5080 ( 2442 PWs) bands (ev): -46.2535 -46.2535 -23.9621 -23.9621 -21.9506 -21.9506 -21.9005 -21.9005 -18.9333 -18.9333 -7.5282 -7.5282 -7.3814 -7.3814 -7.2986 -7.2986 -2.9171 -2.9171 -2.6816 -2.6816 -2.6633 -2.6633 3.2470 3.2470 3.3165 3.3165 3.9993 3.9993 4.4890 4.4890 4.5897 4.5897 4.5959 4.5959 8.1880 8.1880 8.3186 8.3186 8.3495 8.3495 13.5911 13.5911 13.7213 13.7213 13.9122 13.9122 17.0515 17.0515 k =-0.4818 0.4795 0.5080 ( 2434 PWs) bands (ev): -46.2534 -46.2534 -23.9623 -23.9623 -21.9511 -21.9511 -21.9006 -21.9006 -18.9332 -18.9332 -7.5241 -7.5241 -7.3764 -7.3764 -7.2974 -7.2974 -2.9189 -2.9189 -2.6833 -2.6833 -2.6657 -2.6657 3.2444 3.2444 3.3055 3.3055 3.9920 3.9920 4.4866 4.4866 4.5852 4.5852 4.5968 4.5968 8.1952 8.1952 8.3237 8.3237 8.3525 8.3525 13.5977 13.5977 13.7321 13.7321 13.9180 13.9180 17.0453 17.0453 k =-0.4909 0.4886 0.5080 ( 2444 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9514 -21.9514 -21.9007 -21.9007 -18.9331 -18.9331 -7.5216 -7.5216 -7.3735 -7.3735 -7.2966 -7.2966 -2.9201 -2.9201 -2.6843 -2.6843 -2.6671 -2.6671 3.2428 3.2428 3.2988 3.2988 3.9876 3.9876 4.4851 4.4851 4.5821 4.5821 4.5977 4.5977 8.1995 8.1995 8.3268 8.3268 8.3543 8.3543 13.6017 13.6017 13.7387 13.7387 13.9215 13.9215 17.0416 17.0416 k =-0.5000 0.4976 0.5080 ( 2448 PWs) bands (ev): -46.2536 -46.2536 -23.9625 -23.9625 -21.9515 -21.9515 -21.9008 -21.9008 -18.9331 -18.9331 -7.5208 -7.5208 -7.3725 -7.3725 -7.2964 -7.2964 -2.9205 -2.9205 -2.6847 -2.6847 -2.6676 -2.6676 3.2423 3.2423 3.2966 3.2966 3.9861 3.9861 4.4846 4.4846 4.5811 4.5811 4.5981 4.5981 8.2010 8.2010 8.3278 8.3278 8.3549 8.3549 13.6030 13.6030 13.7408 13.7408 13.9226 13.9226 17.0403 17.0403 Writing output data file KNbO3.save init_run : 2.88s CPU 13.04s WALL ( 1 calls) electrons : 611.26s CPU 618.55s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.34s CPU 1.46s WALL ( 1 calls) Called by electrons: c_bands : 611.11s CPU 618.16s WALL ( 1 calls) v_of_rho : 0.04s CPU 0.78s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.04s CPU 0.52s WALL ( 1 calls) newd : 0.34s CPU 0.45s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.08s WALL ( 472 calls) cegterg : 574.77s CPU 579.25s WALL ( 913 calls) Called by sum_band: Called by *egterg: h_psi : 214.80s CPU 223.64s WALL ( 16315 calls) s_psi : 22.38s CPU 22.94s WALL ( 16315 calls) g_psi : 0.45s CPU 0.46s WALL ( 14930 calls) cdiaghg : 260.78s CPU 257.24s WALL ( 15402 calls) cegterg:over : 51.52s CPU 48.50s WALL ( 14930 calls) cegterg:upda : 5.98s CPU 9.21s WALL ( 14930 calls) cegterg:last : 5.86s CPU 6.84s WALL ( 2517 calls) Called by h_psi: h_psi:vloc : 167.25s CPU 175.03s WALL ( 16315 calls) h_psi:vnl : 47.40s CPU 48.06s WALL ( 16315 calls) add_vuspsi : 13.08s CPU 16.97s WALL ( 16315 calls) General routines calbec : 34.27s CPU 30.94s WALL ( 16315 calls) fft : 0.34s CPU 1.30s WALL ( 19 calls) ffts : 0.02s CPU 0.06s WALL ( 4 calls) fftw : 158.36s CPU 166.97s WALL ( 1510460 calls) interpolate : 0.19s CPU 0.24s WALL ( 4 calls) davcio : 0.06s CPU 1.22s WALL ( 944 calls) Parallel routines fft_scatter : 107.51s CPU 119.38s WALL ( 1510483 calls) PWSCF : 11m11.40s CPU 12m29.56s WALL This run was terminated on: 23:27:10 11Oct2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=